smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)C1 ZINC000532226716 1032105783 /nfs/dbraw/zinc/10/57/83/1032105783.db2.gz PIFNCDIYBBQZQN-SWLSCSKDSA-N 2 1 343.298 4.139 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)C1 ZINC000532226716 1032105797 /nfs/dbraw/zinc/10/57/97/1032105797.db2.gz PIFNCDIYBBQZQN-SWLSCSKDSA-N 2 1 343.298 4.139 20 0 EIADMP CCc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)s1 ZINC000237141921 1032224476 /nfs/dbraw/zinc/22/44/76/1032224476.db2.gz FUGUNHOIMWTFJE-UHFFFAOYSA-N 2 1 328.525 4.107 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2cccc3[nH]ccc32)cc1F ZINC000237650665 1032234695 /nfs/dbraw/zinc/23/46/95/1032234695.db2.gz HBVUHZFQBVAMHC-UHFFFAOYSA-N 2 1 334.398 4.091 20 0 EIADMP Cn1ccnc1C[C@@H]1CCC[N@@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000508621030 1032245049 /nfs/dbraw/zinc/24/50/49/1032245049.db2.gz KWPPXLXQZIZSFX-HNNXBMFYSA-N 2 1 331.529 4.234 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)C1 ZINC000760161696 1032484775 /nfs/dbraw/zinc/48/47/75/1032484775.db2.gz ZDVFOMBJNWWUQH-STQMWFEESA-N 2 1 344.330 4.347 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](CCOC(C)C)CC1)c1ccc(Cl)cc1 ZINC000177488853 1032499452 /nfs/dbraw/zinc/49/94/52/1032499452.db2.gz XIRJEPNMGJRJPN-IBGZPJMESA-N 2 1 338.923 4.270 20 0 EIADMP CC[N@@H+](C)C[C@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475822 1032521526 /nfs/dbraw/zinc/52/15/26/1032521526.db2.gz ZYOYMCQNFCPKTR-GDBMZVCRSA-N 2 1 328.422 4.126 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475822 1032521538 /nfs/dbraw/zinc/52/15/38/1032521538.db2.gz ZYOYMCQNFCPKTR-GDBMZVCRSA-N 2 1 328.422 4.126 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475822 1032521552 /nfs/dbraw/zinc/52/15/52/1032521552.db2.gz ZYOYMCQNFCPKTR-GDBMZVCRSA-N 2 1 328.422 4.126 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475822 1032521562 /nfs/dbraw/zinc/52/15/62/1032521562.db2.gz ZYOYMCQNFCPKTR-GDBMZVCRSA-N 2 1 328.422 4.126 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475822 1032521572 /nfs/dbraw/zinc/52/15/72/1032521572.db2.gz ZYOYMCQNFCPKTR-GDBMZVCRSA-N 2 1 328.422 4.126 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)CC1CC[NH2+]CC1 ZINC000178981794 1032546102 /nfs/dbraw/zinc/54/61/02/1032546102.db2.gz DCFKTOJDCHSTLB-HNNXBMFYSA-N 2 1 329.513 4.111 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000760174785 1032570689 /nfs/dbraw/zinc/57/06/89/1032570689.db2.gz ZCJCNBODKRODBJ-WMZOPIPTSA-N 2 1 343.902 4.298 20 0 EIADMP CCC1(C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CCOCC1 ZINC000512396971 1032665552 /nfs/dbraw/zinc/66/55/52/1032665552.db2.gz XVRRFJOWCCLKSY-FPOVZHCZSA-N 2 1 344.543 4.084 20 0 EIADMP CCC[C@@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619759 1032725496 /nfs/dbraw/zinc/72/54/96/1032725496.db2.gz UQRIWIGODPXZCC-UYAOXDASSA-N 2 1 325.500 4.423 20 0 EIADMP CCC[C@@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619759 1032725513 /nfs/dbraw/zinc/72/55/13/1032725513.db2.gz UQRIWIGODPXZCC-UYAOXDASSA-N 2 1 325.500 4.423 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCCO2 ZINC000643545991 1018898338 /nfs/dbraw/zinc/89/83/38/1018898338.db2.gz GTQXRXWZMPNLSA-YOEHRIQHSA-N 2 1 334.891 4.126 20 0 EIADMP c1cc(C[NH+]2CCOCC2)ccc1C[N@@H+]1CCC[C@H]1C1CCCCC1 ZINC001167078271 1019574271 /nfs/dbraw/zinc/57/42/71/1019574271.db2.gz PREWCXNIGAVATR-QFIPXVFZSA-N 2 1 342.527 4.064 20 0 EIADMP c1cc(C[NH+]2CCOCC2)ccc1C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC001167078271 1019574288 /nfs/dbraw/zinc/57/42/88/1019574288.db2.gz PREWCXNIGAVATR-QFIPXVFZSA-N 2 1 342.527 4.064 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000432814816 1032860058 /nfs/dbraw/zinc/86/00/58/1032860058.db2.gz BIRCCNUGZUCPAJ-FQEVSTJZSA-N 2 1 338.495 4.278 20 0 EIADMP CC(C)(C)[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccccc1 ZINC000655688117 1020894899 /nfs/dbraw/zinc/89/48/99/1020894899.db2.gz LVFIJAYAPWEPIB-UXHICEINSA-N 2 1 330.516 4.007 20 0 EIADMP Cc1ccccc1[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)C(C)(C)C ZINC000655721287 1020915914 /nfs/dbraw/zinc/91/59/14/1020915914.db2.gz MMAVLFAZDVXCCT-PZJWPPBQSA-N 2 1 344.543 4.315 20 0 EIADMP COCCCC1(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)CCC1 ZINC001204496331 1020976543 /nfs/dbraw/zinc/97/65/43/1020976543.db2.gz FWDKMAUAYGNQNF-FQEVSTJZSA-N 2 1 336.564 4.027 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000538116109 1021003880 /nfs/dbraw/zinc/00/38/80/1021003880.db2.gz DZHWNKNFWBEJFP-HKUYNNGSSA-N 2 1 328.525 4.099 20 0 EIADMP CC[NH+](CC)CCC[N@@H+](Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC001167318395 1021071149 /nfs/dbraw/zinc/07/11/49/1021071149.db2.gz KKUXICWUPGXOAC-UHFFFAOYSA-N 2 1 330.516 4.098 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ccc(O)cc32)c1 ZINC000340519542 1021186427 /nfs/dbraw/zinc/18/64/27/1021186427.db2.gz MLMXSXZAJOOEDF-JOCHJYFZSA-N 2 1 338.495 4.400 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1cc(F)ccc1F ZINC000163474465 1021374512 /nfs/dbraw/zinc/37/45/12/1021374512.db2.gz HXVDSJJVLOBYGD-IBGZPJMESA-N 2 1 345.437 4.378 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc3cnccc3c2)C1 ZINC000683827224 1021723377 /nfs/dbraw/zinc/72/33/77/1021723377.db2.gz ADAVNNOGCLNGDG-AZUAARDMSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc3cnccc3c2)C1 ZINC000683827224 1021723394 /nfs/dbraw/zinc/72/33/94/1021723394.db2.gz ADAVNNOGCLNGDG-AZUAARDMSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc3cnccc3c2)C1 ZINC000683827224 1021723411 /nfs/dbraw/zinc/72/34/11/1021723411.db2.gz ADAVNNOGCLNGDG-AZUAARDMSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc3cnccc3c2)C1 ZINC000683827224 1021723431 /nfs/dbraw/zinc/72/34/31/1021723431.db2.gz ADAVNNOGCLNGDG-AZUAARDMSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc3cnccc3c2)C1 ZINC000683827224 1021723446 /nfs/dbraw/zinc/72/34/46/1021723446.db2.gz ADAVNNOGCLNGDG-AZUAARDMSA-N 2 1 337.511 4.321 20 0 EIADMP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179092 1021743232 /nfs/dbraw/zinc/74/32/32/1021743232.db2.gz CKWMODOIKKCNBH-SJLPKXTDSA-N 2 1 333.545 4.107 20 0 EIADMP C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179092 1021743246 /nfs/dbraw/zinc/74/32/46/1021743246.db2.gz CKWMODOIKKCNBH-SJLPKXTDSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179092 1021743256 /nfs/dbraw/zinc/74/32/56/1021743256.db2.gz CKWMODOIKKCNBH-SJLPKXTDSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179092 1021743276 /nfs/dbraw/zinc/74/32/76/1021743276.db2.gz CKWMODOIKKCNBH-SJLPKXTDSA-N 2 1 333.545 4.107 20 0 EIADMP FC(F)(F)c1cccc(C2([NH2+]C3CC[NH+](C4CC4)CC3)CCC2)c1 ZINC000414093285 1021839607 /nfs/dbraw/zinc/83/96/07/1021839607.db2.gz HCUSDVQUMOUESF-UHFFFAOYSA-N 2 1 338.417 4.301 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1csc(-c2ccccc2)n1 ZINC000414147439 1021966628 /nfs/dbraw/zinc/96/66/28/1021966628.db2.gz MGIWSMGSQIOFBC-HNNXBMFYSA-N 2 1 329.513 4.335 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]CC[C@H]3CCC[N@@H+](C)C3)c(C)c2c1 ZINC000414169291 1022017544 /nfs/dbraw/zinc/01/75/44/1022017544.db2.gz BAVQPIYAIUVMGJ-JKSUJKDBSA-N 2 1 330.472 4.132 20 0 EIADMP C[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)CC(F)(F)F ZINC000414278997 1022389791 /nfs/dbraw/zinc/38/97/91/1022389791.db2.gz IPGHZFJQVORJMU-LEUOFYLZSA-N 2 1 340.433 4.360 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(OC(C)C)c(Cl)c1 ZINC000188103803 1022440215 /nfs/dbraw/zinc/44/02/15/1022440215.db2.gz BTMYXATVYLAHCO-UHFFFAOYSA-N 2 1 335.879 4.154 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(OC(C)C)c(Cl)c1 ZINC000188103803 1022440229 /nfs/dbraw/zinc/44/02/29/1022440229.db2.gz BTMYXATVYLAHCO-UHFFFAOYSA-N 2 1 335.879 4.154 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1F ZINC000162263555 1022659789 /nfs/dbraw/zinc/65/97/89/1022659789.db2.gz RKNVWYOEFLVYPP-OAHLLOKOSA-N 2 1 334.479 4.282 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548153699 1022828690 /nfs/dbraw/zinc/82/86/90/1022828690.db2.gz DGZUSAJFZAPPRF-WIYYLYMNSA-N 2 1 338.495 4.004 20 0 EIADMP C[C@H]1CCC[N@H+]1C1CC[NH+](CC2CCC(C(F)(F)F)CC2)CC1 ZINC000376498999 1022846935 /nfs/dbraw/zinc/84/69/35/1022846935.db2.gz CIRUGPXFRVZHJM-FHERZECASA-N 2 1 332.454 4.304 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CCCC34CC[NH+](C)CC4)s2)cc1 ZINC000472611649 1022867583 /nfs/dbraw/zinc/86/75/83/1022867583.db2.gz OIVKLDKWWUXGCW-UHFFFAOYSA-N 2 1 341.524 4.179 20 0 EIADMP CC(C)[NH2+]C1CC[NH+](CCCOc2cccc(C(C)(C)C)c2)CC1 ZINC000511569867 1022901795 /nfs/dbraw/zinc/90/17/95/1022901795.db2.gz GJWPXISNGQLYIJ-UHFFFAOYSA-N 2 1 332.532 4.215 20 0 EIADMP COc1c(Cl)cc(Cl)cc1C[N@H+](C)CCCn1cc[nH+]c1C ZINC000349411421 1023172922 /nfs/dbraw/zinc/17/29/22/1023172922.db2.gz WXBIYWLUXLVTAB-UHFFFAOYSA-N 2 1 342.270 4.029 20 0 EIADMP COc1c(Cl)cc(Cl)cc1C[N@@H+](C)CCCn1cc[nH+]c1C ZINC000349411421 1023172928 /nfs/dbraw/zinc/17/29/28/1023172928.db2.gz WXBIYWLUXLVTAB-UHFFFAOYSA-N 2 1 342.270 4.029 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000376672599 1023255400 /nfs/dbraw/zinc/25/54/00/1023255400.db2.gz OJELGPNBPZUIOD-UGKGYDQZSA-N 2 1 335.495 4.035 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cscc2C(F)(F)F)C1 ZINC000581576967 1023375366 /nfs/dbraw/zinc/37/53/66/1023375366.db2.gz FLBBBLHZWQFQSI-ZDUSSCGKSA-N 2 1 334.451 4.225 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2cscc2C(F)(F)F)C1 ZINC000581576967 1023375376 /nfs/dbraw/zinc/37/53/76/1023375376.db2.gz FLBBBLHZWQFQSI-ZDUSSCGKSA-N 2 1 334.451 4.225 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc3c2CCCN3)CC[N@H+]1Cc1ccccc1 ZINC000415046491 1023409028 /nfs/dbraw/zinc/40/90/28/1023409028.db2.gz ZTYLDQFIAXMZEM-RXVVDRJESA-N 2 1 349.522 4.187 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000415078511 1023422281 /nfs/dbraw/zinc/42/22/81/1023422281.db2.gz GMVOBEPCFYCGHG-WEYGHZABSA-N 2 1 346.478 4.016 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000415078516 1023423085 /nfs/dbraw/zinc/42/30/85/1023423085.db2.gz GMVOBEPCFYCGHG-XJABCFGWSA-N 2 1 346.478 4.016 20 0 EIADMP CCC[C@@H](C[NH2+]C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1)c1ccccc1 ZINC000377300319 1023458490 /nfs/dbraw/zinc/45/84/90/1023458490.db2.gz UFIRXWVCWYVACA-BVSLBCMMSA-N 2 1 337.511 4.248 20 0 EIADMP CCC[C@@H](C[NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)c1ccccc1 ZINC000377300319 1023458495 /nfs/dbraw/zinc/45/84/95/1023458495.db2.gz UFIRXWVCWYVACA-BVSLBCMMSA-N 2 1 337.511 4.248 20 0 EIADMP Clc1ccc(C[N@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c2ncccc12 ZINC000656786259 1023526932 /nfs/dbraw/zinc/52/69/32/1023526932.db2.gz QZGBFCIHRSXHGD-MRXNPFEDSA-N 2 1 343.902 4.100 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CCC[C@H](C[NH3+])C3)s2)cc1 ZINC000430633896 1023538714 /nfs/dbraw/zinc/53/87/14/1023538714.db2.gz CJLKDBBSGNGMEJ-OAHLLOKOSA-N 2 1 329.513 4.104 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CCC[C@H](C[NH3+])C3)s2)cc1 ZINC000430633896 1023538721 /nfs/dbraw/zinc/53/87/21/1023538721.db2.gz CJLKDBBSGNGMEJ-OAHLLOKOSA-N 2 1 329.513 4.104 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)c(C(F)(F)F)c1)C[C@H]1CCC[NH+](C)C1 ZINC001167477555 1023567292 /nfs/dbraw/zinc/56/72/92/1023567292.db2.gz GGWJWSVDWAFPHM-ZDUSSCGKSA-N 2 1 334.813 4.132 20 0 EIADMP C[N@H+](Cc1ccc(Cl)c(C(F)(F)F)c1)C[C@H]1CCC[NH+](C)C1 ZINC001167477555 1023567300 /nfs/dbraw/zinc/56/73/00/1023567300.db2.gz GGWJWSVDWAFPHM-ZDUSSCGKSA-N 2 1 334.813 4.132 20 0 EIADMP C[NH+](Cc1ccc(Cl)c(C(F)(F)F)c1)C[C@H]1CCC[N@H+](C)C1 ZINC001167477555 1023567308 /nfs/dbraw/zinc/56/73/08/1023567308.db2.gz GGWJWSVDWAFPHM-ZDUSSCGKSA-N 2 1 334.813 4.132 20 0 EIADMP C[NH+](Cc1ccc(Cl)c(C(F)(F)F)c1)C[C@H]1CCC[N@@H+](C)C1 ZINC001167477555 1023567317 /nfs/dbraw/zinc/56/73/17/1023567317.db2.gz GGWJWSVDWAFPHM-ZDUSSCGKSA-N 2 1 334.813 4.132 20 0 EIADMP CCc1ccc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)cn1 ZINC000581693911 1023616494 /nfs/dbraw/zinc/61/64/94/1023616494.db2.gz VAGZZFNXVJSKFU-SFHVURJKSA-N 2 1 329.532 4.121 20 0 EIADMP CC(C)C1=[NH+]CCc2ccc(NCCC[N@H+]3CCCC[C@H]3C)cc21 ZINC001167754790 1023641805 /nfs/dbraw/zinc/64/18/05/1023641805.db2.gz VLEZLPFNGYFEBZ-QGZVFWFLSA-N 2 1 327.516 4.364 20 0 EIADMP Cc1ccn(C2CC[NH+]([C@@H](C)c3ccc(-n4cc[nH+]c4C)cc3)CC2)n1 ZINC000377632327 1023643173 /nfs/dbraw/zinc/64/31/73/1023643173.db2.gz UPOBDHMEFCGDAR-KRWDZBQOSA-N 2 1 349.482 4.084 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC000390540734 1023657897 /nfs/dbraw/zinc/65/78/97/1023657897.db2.gz HHPKEWDPRFIHQZ-QFIPXVFZSA-N 2 1 334.507 4.044 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1Cc2ccccc2C1 ZINC000390540734 1023657901 /nfs/dbraw/zinc/65/79/01/1023657901.db2.gz HHPKEWDPRFIHQZ-QFIPXVFZSA-N 2 1 334.507 4.044 20 0 EIADMP CCc1nc2cc(C[NH2+][C@H]3C[C@@H]([NH3+])c4ccccc43)ccc2n1C1CC1 ZINC000581800383 1023723372 /nfs/dbraw/zinc/72/33/72/1023723372.db2.gz GNXNFYUHOAQDOJ-MOPGFXCFSA-N 2 1 346.478 4.168 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000581847178 1023763282 /nfs/dbraw/zinc/76/32/82/1023763282.db2.gz XUMGTXUDNDRSLE-MBSJSRAVSA-N 2 1 326.406 4.040 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1cccc(O)c1 ZINC000390676020 1023768711 /nfs/dbraw/zinc/76/87/11/1023768711.db2.gz UHQVIHYVWRMCSU-UTKZUKDTSA-N 2 1 338.495 4.344 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1cccc(O)c1 ZINC000390676020 1023768713 /nfs/dbraw/zinc/76/87/13/1023768713.db2.gz UHQVIHYVWRMCSU-UTKZUKDTSA-N 2 1 338.495 4.344 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@@H](c4cccnc4)C3)C2)cc1 ZINC000500382548 1023769778 /nfs/dbraw/zinc/76/97/78/1023769778.db2.gz HQVZFYDPXTVPIL-XPNTWCBSSA-N 2 1 349.522 4.220 20 0 EIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390744205 1023819688 /nfs/dbraw/zinc/81/96/88/1023819688.db2.gz OMYRZDVLVWTWEV-RDJZCZTQSA-N 2 1 328.422 4.219 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](Cc1ccccc1Cl)c1ccccc1 ZINC000471777095 1023834016 /nfs/dbraw/zinc/83/40/16/1023834016.db2.gz YWGWHZHTFSJUMP-FQEVSTJZSA-N 2 1 339.870 4.190 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000511741926 1023854608 /nfs/dbraw/zinc/85/46/08/1023854608.db2.gz XSRDEEXCKRQMCP-RQRMZWKBSA-N 2 1 344.543 4.194 20 0 EIADMP CSC[C@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(C(F)(F)F)cc1 ZINC000581903436 1023856718 /nfs/dbraw/zinc/85/67/18/1023856718.db2.gz BLUJUVRUFXTDBG-HNNXBMFYSA-N 2 1 348.478 4.287 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccccc1OCc1ccccc1 ZINC000341591935 1023901801 /nfs/dbraw/zinc/90/18/01/1023901801.db2.gz WPMIHGIBIPPMMN-KRWDZBQOSA-N 2 1 335.451 4.121 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+]CCCn3cc[nH+]c3C)cc2)cs1 ZINC000341599142 1023922543 /nfs/dbraw/zinc/92/25/43/1023922543.db2.gz TWROGEGDEGHOOO-AWEZNQCLSA-N 2 1 340.496 4.364 20 0 EIADMP CC[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccccc1OC(F)F ZINC000341626505 1023963991 /nfs/dbraw/zinc/96/39/91/1023963991.db2.gz MRFQITXWHDRONF-HOCLYGCPSA-N 2 1 326.431 4.203 20 0 EIADMP CC[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccccc1OC(F)F ZINC000341626505 1023964012 /nfs/dbraw/zinc/96/40/12/1023964012.db2.gz MRFQITXWHDRONF-HOCLYGCPSA-N 2 1 326.431 4.203 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C2CCN(C3CC3)CC2)c2cccc(F)c2)c1 ZINC000510698930 1024250159 /nfs/dbraw/zinc/25/01/59/1024250159.db2.gz ADIANPLCNCZDCB-JOCHJYFZSA-N 2 1 338.470 4.440 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](c2cccnc2)C2CCCCC2)C1 ZINC000652149879 1024331317 /nfs/dbraw/zinc/33/13/17/1024331317.db2.gz DOYMMLURCRGZMQ-WIYYLYMNSA-N 2 1 329.532 4.413 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000510737090 1024379313 /nfs/dbraw/zinc/37/93/13/1024379313.db2.gz RVTIFRMEUHRMFC-CPUCHLNUSA-N 2 1 328.422 4.099 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000510737090 1024379329 /nfs/dbraw/zinc/37/93/29/1024379329.db2.gz RVTIFRMEUHRMFC-CPUCHLNUSA-N 2 1 328.422 4.099 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCC[C@@H]2CCCF)CC1 ZINC000510756709 1024401603 /nfs/dbraw/zinc/40/16/03/1024401603.db2.gz SGXWXNMYNUTMPD-WIYYLYMNSA-N 2 1 332.507 4.467 20 0 EIADMP Cc1nc(C[N@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])oc1-c1ccc(Cl)cc1 ZINC000652356049 1024727440 /nfs/dbraw/zinc/72/74/40/1024727440.db2.gz RAGBAXZXFGEKGV-GUYCJALGSA-N 2 1 347.890 4.253 20 0 EIADMP Cc1nc(C[N@@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])oc1-c1ccc(Cl)cc1 ZINC000652356049 1024727466 /nfs/dbraw/zinc/72/74/66/1024727466.db2.gz RAGBAXZXFGEKGV-GUYCJALGSA-N 2 1 347.890 4.253 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(F)cc1OC(F)F ZINC000164699354 1024809466 /nfs/dbraw/zinc/80/94/66/1024809466.db2.gz SAXOQPPFLFWOCL-GFCCVEGCSA-N 2 1 341.377 4.063 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](COCc1ccccc1)c1ccccc1 ZINC000341855463 1024826198 /nfs/dbraw/zinc/82/61/98/1024826198.db2.gz WISLMOIQYMHMDK-JOCHJYFZSA-N 2 1 349.478 4.129 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cccc(-c2ccncc2)c1 ZINC000164713960 1024828036 /nfs/dbraw/zinc/82/80/36/1024828036.db2.gz VHEAHHBPIQAFIX-QGZVFWFLSA-N 2 1 334.467 4.385 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000548483980 1024831593 /nfs/dbraw/zinc/83/15/93/1024831593.db2.gz RGRSLFXTVNAJIW-OJAHFUOMSA-N 2 1 332.557 4.161 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCc2c3ccccc3sc21 ZINC000510944634 1024859019 /nfs/dbraw/zinc/85/90/19/1024859019.db2.gz KFNCZCFTFUQPHC-QGZVFWFLSA-N 2 1 325.481 4.464 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](CCc1ccc(Cl)cc1)C(C)C ZINC000510948529 1024863328 /nfs/dbraw/zinc/86/33/28/1024863328.db2.gz TVCXBBJGGAGXBC-IBGZPJMESA-N 2 1 333.907 4.482 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295872 1025049309 /nfs/dbraw/zinc/04/93/09/1025049309.db2.gz IIEDUBYJKJMPJO-YOEHRIQHSA-N 2 1 338.442 4.061 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000684611406 1025057596 /nfs/dbraw/zinc/05/75/96/1025057596.db2.gz GLMNPPYBBXFDNC-NFBKMPQASA-N 2 1 349.522 4.425 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2coc(-c3cccc(Cl)c3)n2)[C@@H]1CCC[NH3+] ZINC000662314617 1025066524 /nfs/dbraw/zinc/06/65/24/1025066524.db2.gz OWKCTBZCASOZES-RDTXWAMCSA-N 2 1 347.890 4.334 20 0 EIADMP COCC[C@@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(Cl)c(Cl)c1 ZINC000342056374 1025079662 /nfs/dbraw/zinc/07/96/62/1025079662.db2.gz HOIVARJXZMWINM-RHSMWYFYSA-N 2 1 345.314 4.145 20 0 EIADMP CC[N@@H+](Cc1scnc1C1CC1)Cc1ccc(C[NH+](C)C)cc1 ZINC000348970802 1025152858 /nfs/dbraw/zinc/15/28/58/1025152858.db2.gz XCIISBOJTOFPBR-UHFFFAOYSA-N 2 1 329.513 4.104 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]Cc3cccc4[nH]ccc43)C2)c1 ZINC000236592253 1025248311 /nfs/dbraw/zinc/24/83/11/1025248311.db2.gz CZYKEGIOFLKMJU-MRXNPFEDSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]Cc3cccc4[nH]ccc43)C2)c1 ZINC000236592253 1025248323 /nfs/dbraw/zinc/24/83/23/1025248323.db2.gz CZYKEGIOFLKMJU-MRXNPFEDSA-N 2 1 339.508 4.231 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2occc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511985604 1025396521 /nfs/dbraw/zinc/39/65/21/1025396521.db2.gz AQDRCOCJWSSLRC-UTKZUKDTSA-N 2 1 334.463 4.433 20 0 EIADMP Fc1ccc2c(c1)[C@@H](NC[C@@H]1CCC[N@@H+](CC3CC3)C1)CCS2 ZINC000663467766 1025407725 /nfs/dbraw/zinc/40/77/25/1025407725.db2.gz HZBSOABAFSPTNQ-YJBOKZPZSA-N 2 1 334.504 4.074 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC3CC3)C1)CCS2 ZINC000663467766 1025407739 /nfs/dbraw/zinc/40/77/39/1025407739.db2.gz HZBSOABAFSPTNQ-YJBOKZPZSA-N 2 1 334.504 4.074 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC3CC3)C1)CCS2 ZINC000663467766 1025407757 /nfs/dbraw/zinc/40/77/57/1025407757.db2.gz HZBSOABAFSPTNQ-YJBOKZPZSA-N 2 1 334.504 4.074 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2ncc(Cl)s2)C[N@H+]1Cc1ccccc1 ZINC000472037149 1025461449 /nfs/dbraw/zinc/46/14/49/1025461449.db2.gz HQRSXQKRRPEMEJ-GDBMZVCRSA-N 2 1 349.931 4.187 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2cc(O)cc(F)c2)cc1 ZINC000472040313 1025475123 /nfs/dbraw/zinc/47/51/23/1025475123.db2.gz BUNXJUUZQJURKL-MRXNPFEDSA-N 2 1 342.458 4.196 20 0 EIADMP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000563135544 1025515440 /nfs/dbraw/zinc/51/54/40/1025515440.db2.gz QKRSOJGTBDAWRS-NXEZZACHSA-N 2 1 344.311 4.332 20 0 EIADMP CC(C)Sc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)cc1 ZINC000925784402 1025655284 /nfs/dbraw/zinc/65/52/84/1025655284.db2.gz RBRQMJJUQXUZRZ-ZFWWWQNUSA-N 2 1 328.472 4.083 20 0 EIADMP COc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)cc1 ZINC001167967034 1025862818 /nfs/dbraw/zinc/86/28/18/1025862818.db2.gz AGYCZDFQRQWZMC-RKKYOWQMSA-N 2 1 340.511 4.141 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+]CC(C)(C)CCCc2ccccc2)s1 ZINC000512061549 1025864157 /nfs/dbraw/zinc/86/41/57/1025864157.db2.gz YTKOBMLZFOSGJA-UHFFFAOYSA-N 2 1 345.556 4.343 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000431328328 1025874511 /nfs/dbraw/zinc/87/45/11/1025874511.db2.gz MLXYJIGVUBRWJJ-IBGZPJMESA-N 2 1 348.918 4.326 20 0 EIADMP COc1cccc([C@H]2C[C@@H](C)C[N@H+]2CCCCn2ccnc2C)c1 ZINC000344034479 1025889121 /nfs/dbraw/zinc/88/91/21/1025889121.db2.gz FASLQLGNNBFDKQ-OXQOHEQNSA-N 2 1 327.472 4.063 20 0 EIADMP COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2CCCCn2cc[nH+]c2C)c1 ZINC000344034479 1025889122 /nfs/dbraw/zinc/88/91/22/1025889122.db2.gz FASLQLGNNBFDKQ-OXQOHEQNSA-N 2 1 327.472 4.063 20 0 EIADMP COc1cccc([C@H]2C[C@@H](C)C[N@H+]2CCCCn2cc[nH+]c2C)c1 ZINC000344034479 1025889123 /nfs/dbraw/zinc/88/91/23/1025889123.db2.gz FASLQLGNNBFDKQ-OXQOHEQNSA-N 2 1 327.472 4.063 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1cc2ccccc2o1 ZINC000432424945 1025912790 /nfs/dbraw/zinc/91/27/90/1025912790.db2.gz KODMTGGKFFCYTP-DYESRHJHSA-N 2 1 344.499 4.220 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1cc2ccccc2o1 ZINC000432424945 1025912816 /nfs/dbraw/zinc/91/28/16/1025912816.db2.gz KODMTGGKFFCYTP-DYESRHJHSA-N 2 1 344.499 4.220 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1cc2ccccc2o1 ZINC000432424951 1025913703 /nfs/dbraw/zinc/91/37/03/1025913703.db2.gz KODMTGGKFFCYTP-UWJYYQICSA-N 2 1 344.499 4.220 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1cc2ccccc2o1 ZINC000432424951 1025913725 /nfs/dbraw/zinc/91/37/25/1025913725.db2.gz KODMTGGKFFCYTP-UWJYYQICSA-N 2 1 344.499 4.220 20 0 EIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@H]2CCc3[nH+]ccn3C2)cc1 ZINC000279035243 1025992754 /nfs/dbraw/zinc/99/27/54/1025992754.db2.gz WRFGCTUBCYUBOV-HZPDHXFCSA-N 2 1 329.513 4.297 20 0 EIADMP CC(C)Sc1ccc([C@H](C)[NH2+]C[C@H]2CCc3[nH+]ccn3C2)cc1 ZINC000279035246 1025993745 /nfs/dbraw/zinc/99/37/45/1025993745.db2.gz WRFGCTUBCYUBOV-JKSUJKDBSA-N 2 1 329.513 4.297 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cccc(OC)c1 ZINC001167969447 1025994978 /nfs/dbraw/zinc/99/49/78/1025994978.db2.gz CGUXOUCJOVBNMZ-SMLSOGCJSA-N 2 1 328.500 4.141 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2COc3c(C)cccc3C2)cc1 ZINC000582032708 1025998356 /nfs/dbraw/zinc/99/83/56/1025998356.db2.gz VQMNPBUJEPHDGB-OXJNMPFZSA-N 2 1 347.462 4.143 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)s1 ZINC000512105007 1026005334 /nfs/dbraw/zinc/00/53/34/1026005334.db2.gz KPBARWIQPLWGMJ-ZWKOTPCHSA-N 2 1 329.513 4.021 20 0 EIADMP Cc1nc(-c2cc([C@H](C)[NH2+]C3CC[NH+](C4CC4)CC3)cs2)cs1 ZINC000119681582 1026074594 /nfs/dbraw/zinc/07/45/94/1026074594.db2.gz YIAPCZZJLFJBCW-LBPRGKRZSA-N 2 1 347.553 4.457 20 0 EIADMP CCC1(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCOCC1 ZINC000582091755 1026129428 /nfs/dbraw/zinc/12/94/28/1026129428.db2.gz ISXLCEUWOQUPCI-NRFANRHFSA-N 2 1 344.543 4.085 20 0 EIADMP COc1cccc(CCC[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC000303950945 1026297290 /nfs/dbraw/zinc/29/72/90/1026297290.db2.gz VRMRGZNYEFNSAA-CTNGQTDRSA-N 2 1 344.543 4.214 20 0 EIADMP COc1cccc(CCC[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC000303950945 1026297302 /nfs/dbraw/zinc/29/73/02/1026297302.db2.gz VRMRGZNYEFNSAA-CTNGQTDRSA-N 2 1 344.543 4.214 20 0 EIADMP COc1cccc(CCC[NH+]2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)c1 ZINC000303950945 1026297318 /nfs/dbraw/zinc/29/73/18/1026297318.db2.gz VRMRGZNYEFNSAA-CTNGQTDRSA-N 2 1 344.543 4.214 20 0 EIADMP CCC[C@@H](C)[C@H](CC)[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000162759639 1026298459 /nfs/dbraw/zinc/29/84/59/1026298459.db2.gz LERHUGIPMOODAB-BEFAXECRSA-N 2 1 335.536 4.308 20 0 EIADMP Clc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)nc1 ZINC001167977519 1026332780 /nfs/dbraw/zinc/33/27/80/1026332780.db2.gz DDWJPQOJTZVYJV-DLZDZTESSA-N 2 1 345.918 4.181 20 0 EIADMP Clc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)nc1 ZINC001167977519 1026332793 /nfs/dbraw/zinc/33/27/93/1026332793.db2.gz DDWJPQOJTZVYJV-DLZDZTESSA-N 2 1 345.918 4.181 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167978555 1026344856 /nfs/dbraw/zinc/34/48/56/1026344856.db2.gz OZCBFWYQCNKDKA-MIJOPJBOSA-N 2 1 328.500 4.141 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1cccc(OC)c1 ZINC000163464773 1026372608 /nfs/dbraw/zinc/37/26/08/1026372608.db2.gz LMBCVWJHHZFTME-FQEVSTJZSA-N 2 1 339.483 4.108 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccccc1OC ZINC000163528634 1026379133 /nfs/dbraw/zinc/37/91/33/1026379133.db2.gz YHTOIARNCJWKFO-LJQANCHMSA-N 2 1 339.483 4.108 20 0 EIADMP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CS1 ZINC000709726463 1026425977 /nfs/dbraw/zinc/42/59/77/1026425977.db2.gz MGPVRDJLBULYDN-NEWSRXKRSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CS1 ZINC000709726463 1026425984 /nfs/dbraw/zinc/42/59/84/1026425984.db2.gz MGPVRDJLBULYDN-NEWSRXKRSA-N 2 1 332.557 4.161 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(-c3ccccc3)n[nH]2)CC1 ZINC000506888802 1026490384 /nfs/dbraw/zinc/49/03/84/1026490384.db2.gz BAJXKODGKHDOOZ-UHFFFAOYSA-N 2 1 340.515 4.021 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cnc(CC(C)C)s2)CC1 ZINC000506891362 1026507249 /nfs/dbraw/zinc/50/72/49/1026507249.db2.gz ODHDTEVAYBVLLT-UHFFFAOYSA-N 2 1 337.577 4.286 20 0 EIADMP CO[C@H](CC(C)C)C[N@@H+](C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC001167571829 1026585508 /nfs/dbraw/zinc/58/55/08/1026585508.db2.gz BAVWZTYANQEMTE-SESVDKBCSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001167571829 1026585517 /nfs/dbraw/zinc/58/55/17/1026585517.db2.gz BAVWZTYANQEMTE-SESVDKBCSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001167571829 1026585527 /nfs/dbraw/zinc/58/55/27/1026585527.db2.gz BAVWZTYANQEMTE-SESVDKBCSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001167571829 1026585535 /nfs/dbraw/zinc/58/55/35/1026585535.db2.gz BAVWZTYANQEMTE-SESVDKBCSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001167571829 1026585540 /nfs/dbraw/zinc/58/55/40/1026585540.db2.gz BAVWZTYANQEMTE-SESVDKBCSA-N 2 1 332.532 4.032 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512330907 1026711054 /nfs/dbraw/zinc/71/10/54/1026711054.db2.gz VVLQVQPPLDAPRY-SQNIBIBYSA-N 2 1 330.516 4.389 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512330907 1026711065 /nfs/dbraw/zinc/71/10/65/1026711065.db2.gz VVLQVQPPLDAPRY-SQNIBIBYSA-N 2 1 330.516 4.389 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000657456919 1026778472 /nfs/dbraw/zinc/77/84/72/1026778472.db2.gz BLXXRXNXTHXSBW-UHFFFAOYSA-N 2 1 341.524 4.225 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000507498289 1026812639 /nfs/dbraw/zinc/81/26/39/1026812639.db2.gz UXBRHBDLRBXQHR-CZEIZJIKSA-N 2 1 349.522 4.205 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)[C@H]1CCCOC1 ZINC000507511132 1026822895 /nfs/dbraw/zinc/82/28/95/1026822895.db2.gz NXBRGJSJWCKNGF-RXVVDRJESA-N 2 1 344.543 4.356 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](CCc2ccncc2)CC1)c1ccc(C)cc1 ZINC000152819860 1026853056 /nfs/dbraw/zinc/85/30/56/1026853056.db2.gz TZQXXMBZCZWGJC-JOCHJYFZSA-N 2 1 337.511 4.138 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@H]3CCCc4cccnc43)cc2)C1 ZINC000684954075 1026889141 /nfs/dbraw/zinc/88/91/41/1026889141.db2.gz PJDFCSLTKCFGES-GCJKJVERSA-N 2 1 349.522 4.481 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCCc3cccnc32)cc1 ZINC000684957074 1026891757 /nfs/dbraw/zinc/89/17/57/1026891757.db2.gz GMXLGSURGLUMEO-QRWLVFNGSA-N 2 1 332.451 4.304 20 0 EIADMP C[C@@H](Cc1cccs1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582665306 1026914740 /nfs/dbraw/zinc/91/47/40/1026914740.db2.gz ZWWILIKGKPKDMH-HKUYNNGSSA-N 2 1 340.536 4.466 20 0 EIADMP C[C@@H](Cc1cccs1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582665306 1026914750 /nfs/dbraw/zinc/91/47/50/1026914750.db2.gz ZWWILIKGKPKDMH-HKUYNNGSSA-N 2 1 340.536 4.466 20 0 EIADMP CC[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1ccncc1 ZINC000582664249 1026914992 /nfs/dbraw/zinc/91/49/92/1026914992.db2.gz CKYKUFOZCXIROC-LEWJYISDSA-N 2 1 335.495 4.320 20 0 EIADMP CC[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1ccncc1 ZINC000582664249 1026914999 /nfs/dbraw/zinc/91/49/99/1026914999.db2.gz CKYKUFOZCXIROC-LEWJYISDSA-N 2 1 335.495 4.320 20 0 EIADMP C[C@H]([NH2+]CC1([NH3+])C2CC3CC(C2)CC1C3)c1cnc2ccsc2c1 ZINC000519641816 1026937693 /nfs/dbraw/zinc/93/76/93/1026937693.db2.gz VMNXBIOMQCDYSL-PJIQEZCUSA-N 2 1 341.524 4.101 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1cccc(OC(F)F)c1)C1CCCCC1 ZINC000060946768 1026991820 /nfs/dbraw/zinc/99/18/20/1026991820.db2.gz DHGBWWVDPVJIJP-UHFFFAOYSA-N 2 1 326.431 4.032 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1cccc(OC(F)F)c1)C1CCCCC1 ZINC000060946768 1026991828 /nfs/dbraw/zinc/99/18/28/1026991828.db2.gz DHGBWWVDPVJIJP-UHFFFAOYSA-N 2 1 326.431 4.032 20 0 EIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc2ccccc2c1OC(F)F ZINC000519855757 1027021010 /nfs/dbraw/zinc/02/10/10/1027021010.db2.gz BEEJFSJNUMJNSZ-CYBMUJFWSA-N 2 1 345.393 4.068 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCOc2cc(C)c(C)cc21 ZINC000164649142 1027071786 /nfs/dbraw/zinc/07/17/86/1027071786.db2.gz GNQFMKCLGGVOAA-IBGZPJMESA-N 2 1 327.472 4.092 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cc1OC ZINC000474476299 1027106773 /nfs/dbraw/zinc/10/67/73/1027106773.db2.gz WXGBPMYDZGKMPK-RCCFBDPRSA-N 2 1 348.531 4.050 20 0 EIADMP Cc1ccncc1C[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000474597014 1027261575 /nfs/dbraw/zinc/26/15/75/1027261575.db2.gz IPGNDHAUZXSQIW-UHFFFAOYSA-N 2 1 337.511 4.444 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000474628558 1027337795 /nfs/dbraw/zinc/33/77/95/1027337795.db2.gz LBXKIXAXRKKFOX-CBBWQLFWSA-N 2 1 326.937 4.215 20 0 EIADMP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c(F)c1 ZINC000520238420 1027342109 /nfs/dbraw/zinc/34/21/09/1027342109.db2.gz IONOEQAHQIQFGQ-KXBFYZLASA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c(F)c1 ZINC000520238420 1027342128 /nfs/dbraw/zinc/34/21/28/1027342128.db2.gz IONOEQAHQIQFGQ-KXBFYZLASA-N 2 1 348.487 4.069 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1OC ZINC000119718309 1027372589 /nfs/dbraw/zinc/37/25/89/1027372589.db2.gz ISUXTVYVLFODMU-INIZCTEOSA-N 2 1 346.515 4.152 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCC[C@H](C(C)C)C3)CC2)oc1C ZINC000474717136 1027436391 /nfs/dbraw/zinc/43/63/91/1027436391.db2.gz AZYVLLBXUWWEFR-PMACEKPBSA-N 2 1 347.547 4.308 20 0 EIADMP Cc1[nH+]c2ccc(N3C(C)(C)CC([NH3+])CC3(C)C)cc2n1C(C)C ZINC001167624683 1027451668 /nfs/dbraw/zinc/45/16/68/1027451668.db2.gz DZAQFWJKPSGOJN-UHFFFAOYSA-N 2 1 328.504 4.410 20 0 EIADMP C[C@]1(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1(F)F ZINC000657669285 1027481646 /nfs/dbraw/zinc/48/16/46/1027481646.db2.gz CMKFETUZMODAON-ROUUACIJSA-N 2 1 334.454 4.209 20 0 EIADMP C[C@]1(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1(F)F ZINC000657669285 1027481659 /nfs/dbraw/zinc/48/16/59/1027481659.db2.gz CMKFETUZMODAON-ROUUACIJSA-N 2 1 334.454 4.209 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000474818036 1027540190 /nfs/dbraw/zinc/54/01/90/1027540190.db2.gz RJOIYUWTFAWKDB-WMLDXEAASA-N 2 1 328.422 4.100 20 0 EIADMP CCCCCOc1ccc(C[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000475548286 1027582539 /nfs/dbraw/zinc/58/25/39/1027582539.db2.gz JBJIWZYWYCWWHD-UHFFFAOYSA-N 2 1 330.516 4.362 20 0 EIADMP CC(C)OC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000090771943 1027584016 /nfs/dbraw/zinc/58/40/16/1027584016.db2.gz BGLCSXKHDHRJOE-DWOCFRCJSA-N 2 1 344.543 4.365 20 0 EIADMP CC(C)OC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000090771943 1027584039 /nfs/dbraw/zinc/58/40/39/1027584039.db2.gz BGLCSXKHDHRJOE-DWOCFRCJSA-N 2 1 344.543 4.365 20 0 EIADMP Fc1ccccc1CCC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000475553875 1027601529 /nfs/dbraw/zinc/60/15/29/1027601529.db2.gz LKZXDSNNHSKEFQ-UHFFFAOYSA-N 2 1 326.459 4.013 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1OC ZINC000161644998 1027661340 /nfs/dbraw/zinc/66/13/40/1027661340.db2.gz OOXBZTWUIMARJD-NZSAHSFTSA-N 2 1 346.515 4.152 20 0 EIADMP FC(F)(F)c1ccc2c(NC3CC[NH+](C4CC4)CC3)cc[nH+]c2c1 ZINC000123385493 1027717240 /nfs/dbraw/zinc/71/72/40/1027717240.db2.gz HDFVFBCOHBFMKI-UHFFFAOYSA-N 2 1 335.373 4.292 20 0 EIADMP Fc1cccc([C@@H]2CC[N@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)c1 ZINC001167995010 1027735053 /nfs/dbraw/zinc/73/50/53/1027735053.db2.gz TYMFMBCQCZUTSG-OKCRPCIYSA-N 2 1 328.475 4.020 20 0 EIADMP Fc1cccc([C@@H]2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)C2)c1 ZINC001167995010 1027735080 /nfs/dbraw/zinc/73/50/80/1027735080.db2.gz TYMFMBCQCZUTSG-OKCRPCIYSA-N 2 1 328.475 4.020 20 0 EIADMP Fc1cccc([C@@H]2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)C2)c1 ZINC001167995010 1027735108 /nfs/dbraw/zinc/73/51/08/1027735108.db2.gz TYMFMBCQCZUTSG-OKCRPCIYSA-N 2 1 328.475 4.020 20 0 EIADMP C[N@@H+]1CC[C@H]2CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000474924700 1027804178 /nfs/dbraw/zinc/80/41/78/1027804178.db2.gz IRVJRCALAQBJGG-MAUKXSAKSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@H]2CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000474924700 1027804183 /nfs/dbraw/zinc/80/41/83/1027804183.db2.gz IRVJRCALAQBJGG-MAUKXSAKSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@H+](CCCCc3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000474924700 1027804184 /nfs/dbraw/zinc/80/41/84/1027804184.db2.gz IRVJRCALAQBJGG-MAUKXSAKSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@@H+](CCCCc3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000474924700 1027804186 /nfs/dbraw/zinc/80/41/86/1027804186.db2.gz IRVJRCALAQBJGG-MAUKXSAKSA-N 2 1 341.326 4.342 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)c(C)s1 ZINC000162232030 1027836072 /nfs/dbraw/zinc/83/60/72/1027836072.db2.gz SUYYHIMZIPCQEL-CQSZACIVSA-N 2 1 344.528 4.091 20 0 EIADMP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)C2)c1 ZINC000280803820 1027895881 /nfs/dbraw/zinc/89/58/81/1027895881.db2.gz LBRWSLUVFNRDMD-DKIMLUQUSA-N 2 1 338.417 4.168 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1ccccc1)CC(C)C ZINC000346145573 1028283889 /nfs/dbraw/zinc/28/38/89/1028283889.db2.gz SZJGRXGQRCVFOM-UHFFFAOYSA-N 2 1 334.467 4.234 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H]1Cc1ccc(C)cc1 ZINC000346159695 1028295254 /nfs/dbraw/zinc/29/52/54/1028295254.db2.gz CXDCMTNESVSHPL-JOCHJYFZSA-N 2 1 346.478 4.091 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000346167432 1028299762 /nfs/dbraw/zinc/29/97/62/1028299762.db2.gz KIIBVDIJZRESEY-DNVCBOLYSA-N 2 1 336.439 4.142 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](CCOC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000154833098 1028304617 /nfs/dbraw/zinc/30/46/17/1028304617.db2.gz ACCXPEINIQJORA-QGZVFWFLSA-N 2 1 345.314 4.145 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H]1c1ccccc1C ZINC000346174511 1028305818 /nfs/dbraw/zinc/30/58/18/1028305818.db2.gz MKHOEAHRPZOMIO-OAQYLSRUSA-N 2 1 332.451 4.221 20 0 EIADMP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000280963620 1028312043 /nfs/dbraw/zinc/31/20/43/1028312043.db2.gz ZGTUYTMNSFGFMK-LEUOFYLZSA-N 2 1 338.417 4.168 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2cc(C)c(C)cc2C)cn1 ZINC000126494121 1028621986 /nfs/dbraw/zinc/62/19/86/1028621986.db2.gz IXYFXNFZQIVVJQ-KRWDZBQOSA-N 2 1 334.467 4.352 20 0 EIADMP C[C@@H](c1cccnc1)[NH+](C)CCCCC[N@H+](C)[C@@H](C)c1cccnc1 ZINC000093234347 1028726849 /nfs/dbraw/zinc/72/68/49/1028726849.db2.gz MICZDEPOUZNDIT-OALUTQOASA-N 2 1 340.515 4.333 20 0 EIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000526119004 1028859977 /nfs/dbraw/zinc/85/99/77/1028859977.db2.gz KUWMGCVVUFQNNA-DLBZAZTESA-N 2 1 346.515 4.493 20 0 EIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000526119004 1028859984 /nfs/dbraw/zinc/85/99/84/1028859984.db2.gz KUWMGCVVUFQNNA-DLBZAZTESA-N 2 1 346.515 4.493 20 0 EIADMP COCC[C@@H]1CCCC[N@@H+]1C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168050433 1028875318 /nfs/dbraw/zinc/87/53/18/1028875318.db2.gz ANHHGSXHRHIYOX-SBHAEUEKSA-N 2 1 344.543 4.319 20 0 EIADMP COCC[C@@H]1CCCC[N@H+]1C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168050433 1028875322 /nfs/dbraw/zinc/87/53/22/1028875322.db2.gz ANHHGSXHRHIYOX-SBHAEUEKSA-N 2 1 344.543 4.319 20 0 EIADMP CC(C)C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000647302038 1028992147 /nfs/dbraw/zinc/99/21/47/1028992147.db2.gz PKUBGQGLNVZYJC-RBBKRZOGSA-N 2 1 337.511 4.281 20 0 EIADMP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)c1 ZINC000650752360 1029138222 /nfs/dbraw/zinc/13/82/22/1029138222.db2.gz PRLNVUQKTFPXJW-GFCCVEGCSA-N 2 1 338.373 4.045 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+]Cc1cc(Br)cs1 ZINC000524680543 1029153079 /nfs/dbraw/zinc/15/30/79/1029153079.db2.gz DTFIRGSQHNKXHC-UHFFFAOYSA-N 2 1 333.339 4.112 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000157882468 1029261040 /nfs/dbraw/zinc/26/10/40/1029261040.db2.gz RFTIWVPMOVTUCU-OALUTQOASA-N 2 1 340.515 4.178 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(Oc3ccccc3)o2)CC1 ZINC000475115988 1029273987 /nfs/dbraw/zinc/27/39/87/1029273987.db2.gz DKDABGLVZAEPCO-UHFFFAOYSA-N 2 1 326.440 4.132 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[N@H+](C)CCC[NH+]1CCCC1 ZINC000583903651 1029349059 /nfs/dbraw/zinc/34/90/59/1029349059.db2.gz DZCRQPYMOXEXGJ-PEZBUJJGSA-N 2 1 338.442 4.109 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[N@@H+](C)CCC[NH+]1CCCC1 ZINC000583903651 1029349073 /nfs/dbraw/zinc/34/90/73/1029349073.db2.gz DZCRQPYMOXEXGJ-PEZBUJJGSA-N 2 1 338.442 4.109 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)CCS2 ZINC000343493593 1029355782 /nfs/dbraw/zinc/35/57/82/1029355782.db2.gz DCBDPCXJCHHLIS-LPHOPBHVSA-N 2 1 348.556 4.476 20 0 EIADMP CC(C)CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccoc1 ZINC000428448244 1029465850 /nfs/dbraw/zinc/46/58/50/1029465850.db2.gz OQJSHWHYOLOXAM-PCCBWWKXSA-N 2 1 348.531 4.114 20 0 EIADMP Cc1ncccc1C[N@@H+](C)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168060242 1029469246 /nfs/dbraw/zinc/46/92/46/1029469246.db2.gz VZWIIVAXJCIOAN-QZTJIDSGSA-N 2 1 337.511 4.263 20 0 EIADMP Cc1ncccc1C[N@H+](C)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168060242 1029469251 /nfs/dbraw/zinc/46/92/51/1029469251.db2.gz VZWIIVAXJCIOAN-QZTJIDSGSA-N 2 1 337.511 4.263 20 0 EIADMP C[C@@H]1[C@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000475278834 1029485176 /nfs/dbraw/zinc/48/51/76/1029485176.db2.gz XFRGCHVCJFGVPL-NEKRIBJYSA-N 2 1 334.507 4.290 20 0 EIADMP Fc1ccc(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c(Cl)c1 ZINC000566828141 1029546938 /nfs/dbraw/zinc/54/69/38/1029546938.db2.gz MSGPSVZEEIDRBM-UHFFFAOYSA-N 2 1 346.877 4.276 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccc(C(F)F)nc1 ZINC000657827542 1029606748 /nfs/dbraw/zinc/60/67/48/1029606748.db2.gz NEOIFDVFSOGQLE-OAHLLOKOSA-N 2 1 345.437 4.118 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccc(C(F)F)nc1 ZINC000657827542 1029606749 /nfs/dbraw/zinc/60/67/49/1029606749.db2.gz NEOIFDVFSOGQLE-OAHLLOKOSA-N 2 1 345.437 4.118 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@H](C(F)F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168064287 1029626605 /nfs/dbraw/zinc/62/66/05/1029626605.db2.gz PSUSMUZAAHPBMS-NBMJBFSESA-N 2 1 336.470 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@H](C(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168064287 1029626612 /nfs/dbraw/zinc/62/66/12/1029626612.db2.gz PSUSMUZAAHPBMS-NBMJBFSESA-N 2 1 336.470 4.405 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C3CC(C)(C)[NH2+]C(C)(C)C3)oc21 ZINC000192935189 1029650679 /nfs/dbraw/zinc/65/06/79/1029650679.db2.gz RKGISWXNUXIJKO-ZDUSSCGKSA-N 2 1 330.472 4.401 20 0 EIADMP Cc1cnccc1OC1CCN(Cc2ccc([C@H]3C[C@H]3C)o2)CC1 ZINC000447099344 1029694197 /nfs/dbraw/zinc/69/41/97/1029694197.db2.gz RANBUOBLXUGPIG-KDOFPFPSSA-N 2 1 326.440 4.150 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838282 1029724274 /nfs/dbraw/zinc/72/42/74/1029724274.db2.gz PYOBGHVSNFTFBW-GJZGRUSLSA-N 2 1 325.447 4.182 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc2ccncc2s1 ZINC000657837989 1029732651 /nfs/dbraw/zinc/73/26/51/1029732651.db2.gz LTXXPTONJRQIOW-HOTGVXAUSA-N 2 1 331.529 4.459 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000708525632 1029812896 /nfs/dbraw/zinc/81/28/96/1029812896.db2.gz WTWGNUQRWUBCHO-MAUKXSAKSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000708525634 1029813350 /nfs/dbraw/zinc/81/33/50/1029813350.db2.gz WTWGNUQRWUBCHO-QAPCUYQASA-N 2 1 346.877 4.337 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000091287733 1029882457 /nfs/dbraw/zinc/88/24/57/1029882457.db2.gz QKFXDEDQGIWJGV-CXAGYDPISA-N 2 1 326.406 4.088 20 0 EIADMP c1cc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc(-c2ccncc2)c1 ZINC000092066689 1029899970 /nfs/dbraw/zinc/89/99/70/1029899970.db2.gz YOXZFEVMKODDEY-GGAORHGYSA-N 2 1 347.506 4.197 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000092808963 1029950675 /nfs/dbraw/zinc/95/06/75/1029950675.db2.gz QBAHYLRYVHMWOJ-UHFFFAOYSA-N 2 1 341.405 4.239 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000525786791 1030004816 /nfs/dbraw/zinc/00/48/16/1030004816.db2.gz OGDVIPIGJGNITI-GJZGRUSLSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000525786791 1030004838 /nfs/dbraw/zinc/00/48/38/1030004838.db2.gz OGDVIPIGJGNITI-GJZGRUSLSA-N 2 1 342.405 4.064 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)c(C)c2c1 ZINC000623408060 1030025005 /nfs/dbraw/zinc/02/50/05/1030025005.db2.gz GPCNHOPDADLOEI-CABCVRRESA-N 2 1 330.472 4.273 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+][C@H]3CC[N@@H+](C)C(C)(C)C3)c(C)c2c1 ZINC000623408060 1030025022 /nfs/dbraw/zinc/02/50/22/1030025022.db2.gz GPCNHOPDADLOEI-CABCVRRESA-N 2 1 330.472 4.273 20 0 EIADMP C[C@H](C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874926 1030091525 /nfs/dbraw/zinc/09/15/25/1030091525.db2.gz RSMXODSGCRGHPK-OXFYSEKESA-N 2 1 332.919 4.392 20 0 EIADMP C[C@H](C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874926 1030091544 /nfs/dbraw/zinc/09/15/44/1030091544.db2.gz RSMXODSGCRGHPK-OXFYSEKESA-N 2 1 332.919 4.392 20 0 EIADMP C[C@H](C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874926 1030091563 /nfs/dbraw/zinc/09/15/63/1030091563.db2.gz RSMXODSGCRGHPK-OXFYSEKESA-N 2 1 332.919 4.392 20 0 EIADMP CC[C@H]([NH3+])C[NH2+][C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000219493033 1030137765 /nfs/dbraw/zinc/13/77/65/1030137765.db2.gz RQAXWBBKZCRCEN-UFBFGSQYSA-N 2 1 328.300 4.112 20 0 EIADMP Fc1ccc(C[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000447560906 1030168391 /nfs/dbraw/zinc/16/83/91/1030168391.db2.gz GDIRCYTUHRQVBV-JOCHJYFZSA-N 2 1 338.470 4.326 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H](c2cccnc2)C2CC2)C3)cc1 ZINC000447588806 1030188815 /nfs/dbraw/zinc/18/88/15/1030188815.db2.gz VNTDPFGVYHXBDI-GPJHCHHRSA-N 2 1 347.506 4.318 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2CCCCS2)C3)cc1 ZINC000447601365 1030224445 /nfs/dbraw/zinc/22/44/45/1030224445.db2.gz PKMPQMPGHGZDEZ-YRPNKDGESA-N 2 1 330.541 4.057 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2c(F)cccc2Cl)C[C@H]1C ZINC000447723516 1030310771 /nfs/dbraw/zinc/31/07/71/1030310771.db2.gz PQHSWZYRNMKCGF-CABCVRRESA-N 2 1 326.887 4.216 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2c(F)cccc2Cl)C[C@H]1C ZINC000447723516 1030310779 /nfs/dbraw/zinc/31/07/79/1030310779.db2.gz PQHSWZYRNMKCGF-CABCVRRESA-N 2 1 326.887 4.216 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2c(F)cccc2Cl)C[C@H]1C ZINC000447723516 1030310799 /nfs/dbraw/zinc/31/07/99/1030310799.db2.gz PQHSWZYRNMKCGF-CABCVRRESA-N 2 1 326.887 4.216 20 0 EIADMP C[C@H](CC[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000447735315 1030312848 /nfs/dbraw/zinc/31/28/48/1030312848.db2.gz CVXCFBZANCNWSL-AQNXPRMDSA-N 2 1 344.543 4.001 20 0 EIADMP Cc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c(C)n1 ZINC000186931832 1030314988 /nfs/dbraw/zinc/31/49/88/1030314988.db2.gz UTTZITYCGZJEQH-UHFFFAOYSA-N 2 1 337.511 4.042 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1nccc2ccccc21 ZINC000685456748 1030334532 /nfs/dbraw/zinc/33/45/32/1030334532.db2.gz WTVBMEVGYJEZBD-UHFFFAOYSA-N 2 1 333.479 4.319 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358418 1030336911 /nfs/dbraw/zinc/33/69/11/1030336911.db2.gz ZQKPMSQORVLIAF-AABGKKOBSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358418 1030336928 /nfs/dbraw/zinc/33/69/28/1030336928.db2.gz ZQKPMSQORVLIAF-AABGKKOBSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358418 1030336943 /nfs/dbraw/zinc/33/69/43/1030336943.db2.gz ZQKPMSQORVLIAF-AABGKKOBSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358418 1030336963 /nfs/dbraw/zinc/33/69/63/1030336963.db2.gz ZQKPMSQORVLIAF-AABGKKOBSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358418 1030336979 /nfs/dbraw/zinc/33/69/79/1030336979.db2.gz ZQKPMSQORVLIAF-AABGKKOBSA-N 2 1 334.548 4.065 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cc(F)cc(C(F)(F)F)c3)C2)CC1 ZINC000685463175 1030340660 /nfs/dbraw/zinc/34/06/60/1030340660.db2.gz XDZAADOWVRDWDS-OAHLLOKOSA-N 2 1 344.396 4.008 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(Oc4ccccc4)o3)C2)CC1 ZINC000685462861 1030341089 /nfs/dbraw/zinc/34/10/89/1030341089.db2.gz VFXUMRJATBYWMD-SFHVURJKSA-N 2 1 340.467 4.236 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)C2CCSCC2)cc1 ZINC000187290827 1030355935 /nfs/dbraw/zinc/35/59/35/1030355935.db2.gz AFGRMYUCRKCMQS-GJZGRUSLSA-N 2 1 329.513 4.363 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000657892737 1030377504 /nfs/dbraw/zinc/37/75/04/1030377504.db2.gz XSQDDSYCGVBMMO-KBRIMQKVSA-N 2 1 328.422 4.099 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000657892737 1030377516 /nfs/dbraw/zinc/37/75/16/1030377516.db2.gz XSQDDSYCGVBMMO-KBRIMQKVSA-N 2 1 328.422 4.099 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1cccc2cccnc21 ZINC000708571139 1030390843 /nfs/dbraw/zinc/39/08/43/1030390843.db2.gz QRYGAPPCCUQJCV-XMSQKQJNSA-N 2 1 345.490 4.093 20 0 EIADMP C[C@H]([NH2+]CCc1ccc(F)c(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527041846 1030422479 /nfs/dbraw/zinc/42/24/79/1030422479.db2.gz BSTWTEHIJUHSFI-LPHOPBHVSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@@H](CCSc1ccccc1)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000431607622 1030474570 /nfs/dbraw/zinc/47/45/70/1030474570.db2.gz IIYDPFJVKASULJ-PKOBYXMFSA-N 2 1 332.557 4.221 20 0 EIADMP C[C@@H](CCSc1ccccc1)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000431607622 1030474581 /nfs/dbraw/zinc/47/45/81/1030474581.db2.gz IIYDPFJVKASULJ-PKOBYXMFSA-N 2 1 332.557 4.221 20 0 EIADMP C[C@@H](CCSc1ccccc1)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000431607622 1030474601 /nfs/dbraw/zinc/47/46/01/1030474601.db2.gz IIYDPFJVKASULJ-PKOBYXMFSA-N 2 1 332.557 4.221 20 0 EIADMP Cc1ccc2c(CC[NH2+]C3CC[NH+](Cc4ccccc4)CC3)c[nH]c2c1 ZINC000527120461 1030507541 /nfs/dbraw/zinc/50/75/41/1030507541.db2.gz ROYNFLZTSVADFD-UHFFFAOYSA-N 2 1 347.506 4.273 20 0 EIADMP C[C@@H](C[NH2+][C@@H](C)c1ccccc1OC(F)F)C[NH+]1CCCCC1 ZINC000321694073 1030519558 /nfs/dbraw/zinc/51/95/58/1030519558.db2.gz YUZDMJCHFQLNFL-GJZGRUSLSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@H](CC1CCOCC1)[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000685665254 1030663554 /nfs/dbraw/zinc/66/35/54/1030663554.db2.gz ZWTBYODIVNWVFH-KNQAVFIVSA-N 2 1 344.543 4.084 20 0 EIADMP Cc1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc(C)c1O ZINC000398182637 1030735374 /nfs/dbraw/zinc/73/53/74/1030735374.db2.gz KKMMTTGOQHOVJI-NQIIRXRSSA-N 2 1 338.495 4.009 20 0 EIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000657982951 1030738235 /nfs/dbraw/zinc/73/82/35/1030738235.db2.gz PCPDHLYGPYKHJB-ROUUACIJSA-N 2 1 349.478 4.453 20 0 EIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000657982947 1030741693 /nfs/dbraw/zinc/74/16/93/1030741693.db2.gz PCPDHLYGPYKHJB-MSOLQXFVSA-N 2 1 349.478 4.453 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCCSCC1 ZINC000658004257 1030767436 /nfs/dbraw/zinc/76/74/36/1030767436.db2.gz PBXLDHLCXHURNF-OALUTQOASA-N 2 1 332.557 4.162 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCCSCC1 ZINC000658004257 1030767464 /nfs/dbraw/zinc/76/74/64/1030767464.db2.gz PBXLDHLCXHURNF-OALUTQOASA-N 2 1 332.557 4.162 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]Cc3ccc4cc[nH]c4c3)C2)c1 ZINC000527650545 1030800617 /nfs/dbraw/zinc/80/06/17/1030800617.db2.gz QBZYKCCRALMURZ-QGZVFWFLSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]Cc3ccc4cc[nH]c4c3)C2)c1 ZINC000527650545 1030800619 /nfs/dbraw/zinc/80/06/19/1030800619.db2.gz QBZYKCCRALMURZ-QGZVFWFLSA-N 2 1 339.508 4.231 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(F)cc1F ZINC000122351054 1030808278 /nfs/dbraw/zinc/80/82/78/1030808278.db2.gz ZESAIWNUNVULLP-IBGZPJMESA-N 2 1 348.437 4.146 20 0 EIADMP c1nc([C@H]2CCC[N@H+](Cc3ccnc4ccccc34)C2)n2c1CCCC2 ZINC000548859327 1030835990 /nfs/dbraw/zinc/83/59/90/1030835990.db2.gz ZJIIAKOYXPMNLV-SFHVURJKSA-N 2 1 346.478 4.147 20 0 EIADMP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH+]2CCC(F)CC2)CC1 ZINC001168188325 1030891214 /nfs/dbraw/zinc/89/12/14/1030891214.db2.gz JHIUORDVQFEKPN-OAHLLOKOSA-N 2 1 338.898 4.169 20 0 EIADMP Cc1ccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000658293426 1030959774 /nfs/dbraw/zinc/95/97/74/1030959774.db2.gz HBENFHXERQMNHM-FGZHOGPDSA-N 2 1 342.527 4.069 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCOc2ccc3ccccc3c2)CC[N@@H+]1C ZINC000531381780 1031175563 /nfs/dbraw/zinc/17/55/63/1031175563.db2.gz IKENAGHTTQFRTO-PXNSSMCTSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCOc2ccc3ccccc3c2)CC[N@H+]1C ZINC000531381780 1031175573 /nfs/dbraw/zinc/17/55/73/1031175573.db2.gz IKENAGHTTQFRTO-PXNSSMCTSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)CCCOc2ccc3ccccc3c2)CC[NH+]1C ZINC000531381780 1031175580 /nfs/dbraw/zinc/17/55/80/1031175580.db2.gz IKENAGHTTQFRTO-PXNSSMCTSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCOc2ccc3ccccc3c2)CC[NH+]1C ZINC000531381780 1031175588 /nfs/dbraw/zinc/17/55/88/1031175588.db2.gz IKENAGHTTQFRTO-PXNSSMCTSA-N 2 1 326.484 4.023 20 0 EIADMP CC(C)c1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@H](C)c1nc2ccccc2o1 ZINC000375825402 1031310305 /nfs/dbraw/zinc/31/03/05/1031310305.db2.gz RMIXFEJOHQUTMQ-HZPDHXFCSA-N 2 1 338.455 4.373 20 0 EIADMP CC(C)c1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@H](C)c1nc2ccccc2o1 ZINC000375825402 1031310319 /nfs/dbraw/zinc/31/03/19/1031310319.db2.gz RMIXFEJOHQUTMQ-HZPDHXFCSA-N 2 1 338.455 4.373 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@@H]1C ZINC000532589647 1031321092 /nfs/dbraw/zinc/32/10/92/1031321092.db2.gz ROVIOMMRJWFCJD-LPHOPBHVSA-N 2 1 330.516 4.119 20 0 EIADMP CCN1CC[C@H]([N@H+](C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@@H]1C ZINC000532589647 1031321109 /nfs/dbraw/zinc/32/11/09/1031321109.db2.gz ROVIOMMRJWFCJD-LPHOPBHVSA-N 2 1 330.516 4.119 20 0 EIADMP CCN1CC[C@H]([N@@H+](C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@@H]1C ZINC000532589647 1031321121 /nfs/dbraw/zinc/32/11/21/1031321121.db2.gz ROVIOMMRJWFCJD-LPHOPBHVSA-N 2 1 330.516 4.119 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@@H]2CCOC3(CCC3)C2)cc1 ZINC000449080389 1031435361 /nfs/dbraw/zinc/43/53/61/1031435361.db2.gz VTTAYHOTQNXRDC-GHTZIAJQSA-N 2 1 342.527 4.252 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000532626163 1031442105 /nfs/dbraw/zinc/44/21/05/1031442105.db2.gz MCVBXDINYMBSLK-DLBZAZTESA-N 2 1 343.540 4.350 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000532626163 1031442113 /nfs/dbraw/zinc/44/21/13/1031442113.db2.gz MCVBXDINYMBSLK-DLBZAZTESA-N 2 1 343.540 4.350 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000532626163 1031442119 /nfs/dbraw/zinc/44/21/19/1031442119.db2.gz MCVBXDINYMBSLK-DLBZAZTESA-N 2 1 343.540 4.350 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccnn2C2CCCC2)c1 ZINC000449098617 1031442737 /nfs/dbraw/zinc/44/27/37/1031442737.db2.gz KHCZAWASMILXBI-UHFFFAOYSA-N 2 1 340.515 4.128 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H](C)[C@@H]3CCCC[C@H]3C)CC2)oc1C ZINC000449123520 1031460352 /nfs/dbraw/zinc/46/03/52/1031460352.db2.gz NIJAEHUGBAJREP-WRWLIDTKSA-N 2 1 347.547 4.308 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2c[nH]c3ccccc23)CC[N@@H+]1Cc1ccccc1 ZINC000531677765 1031470419 /nfs/dbraw/zinc/47/04/19/1031470419.db2.gz ZTALYEMLJCXDEL-GHTZIAJQSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2c[nH]c3ccccc23)CC[N@H+]1Cc1ccccc1 ZINC000531677765 1031470425 /nfs/dbraw/zinc/47/04/25/1031470425.db2.gz ZTALYEMLJCXDEL-GHTZIAJQSA-N 2 1 347.506 4.353 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCCC34CCC4)CC2)cs1 ZINC000449149867 1031484360 /nfs/dbraw/zinc/48/43/60/1031484360.db2.gz PAHXSIJKUGYPNW-SFHVURJKSA-N 2 1 347.572 4.230 20 0 EIADMP C[C@H]([NH2+]C1(C[NH2+][C@H]2CCOC3(CCC3)C2)CCCC1)c1ccccc1 ZINC000449154731 1031484562 /nfs/dbraw/zinc/48/45/62/1031484562.db2.gz JJLDQHRMQUNESO-ICSRJNTNSA-N 2 1 342.527 4.341 20 0 EIADMP COc1ccc2c(c1)C[C@@H]([N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168251736 1031524071 /nfs/dbraw/zinc/52/40/71/1031524071.db2.gz KYUAERVMTHGZJO-JBACZVJFSA-N 2 1 342.527 4.067 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2cc3cccnc3o2)C[N@H+]1Cc1ccccc1 ZINC000449217117 1031552358 /nfs/dbraw/zinc/55/23/58/1031552358.db2.gz WZNDHCAMSUOETM-IEBWSBKVSA-N 2 1 349.478 4.218 20 0 EIADMP C[C@H]([NH2+]C1CCC(OC2CCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000449231324 1031560111 /nfs/dbraw/zinc/56/01/11/1031560111.db2.gz DGUQYEXVNBSWJX-BXRCABCMSA-N 2 1 348.575 4.499 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H](C)c1cc(F)cc(F)c1 ZINC000449324590 1031622409 /nfs/dbraw/zinc/62/24/09/1031622409.db2.gz GHYDGHBWFRKUQY-HNNXBMFYSA-N 2 1 335.442 4.239 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H](C)c1cc(F)cc(F)c1 ZINC000449324590 1031622417 /nfs/dbraw/zinc/62/24/17/1031622417.db2.gz GHYDGHBWFRKUQY-HNNXBMFYSA-N 2 1 335.442 4.239 20 0 EIADMP Cc1nccn1CCCC[N@H+](CC(C)C)[C@H]1CCCc2cccnc21 ZINC000126885678 1031665362 /nfs/dbraw/zinc/66/53/62/1031665362.db2.gz UGXUTARUDQSHHL-FQEVSTJZSA-N 2 1 340.515 4.402 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](CC(C)C)[C@H]1CCCc2cccnc21 ZINC000126885678 1031665369 /nfs/dbraw/zinc/66/53/69/1031665369.db2.gz UGXUTARUDQSHHL-FQEVSTJZSA-N 2 1 340.515 4.402 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](CC(C)C)[C@H]1CCCc2cccnc21 ZINC000126885678 1031665378 /nfs/dbraw/zinc/66/53/78/1031665378.db2.gz UGXUTARUDQSHHL-FQEVSTJZSA-N 2 1 340.515 4.402 20 0 EIADMP CC(C)OCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453194484 1031700815 /nfs/dbraw/zinc/70/08/15/1031700815.db2.gz NNTVXDIWILJMOG-YPAWHYETSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@H]21)C(F)(F)F ZINC000453207617 1031719007 /nfs/dbraw/zinc/71/90/07/1031719007.db2.gz WMJQURBRAGWVNG-SPUZQDLCSA-N 2 1 340.433 4.218 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453256130 1031779257 /nfs/dbraw/zinc/77/92/57/1031779257.db2.gz QQBARDLRMJOYEQ-IFMALSPDSA-N 2 1 337.511 4.425 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)cc1 ZINC000449481587 1031779987 /nfs/dbraw/zinc/77/99/87/1031779987.db2.gz ULGWEGZTEHLURS-SJLPKXTDSA-N 2 1 339.483 4.181 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCO[C@@H](C(C)C)C2)cc1 ZINC000449494201 1031803840 /nfs/dbraw/zinc/80/38/40/1031803840.db2.gz MYYCQYRZLNEFBW-YRISNDGFSA-N 2 1 341.499 4.283 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528796220 1031858076 /nfs/dbraw/zinc/85/80/76/1031858076.db2.gz YTOPGCSQAAJEMA-UHFFFAOYSA-N 2 1 337.389 4.049 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528796220 1031858082 /nfs/dbraw/zinc/85/80/82/1031858082.db2.gz YTOPGCSQAAJEMA-UHFFFAOYSA-N 2 1 337.389 4.049 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3C)CCCO2 ZINC000453346732 1031873043 /nfs/dbraw/zinc/87/30/43/1031873043.db2.gz KOEVFAOSTMYOOY-KRWWSPQJSA-N 2 1 334.891 4.077 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCCO2 ZINC000453346732 1031873048 /nfs/dbraw/zinc/87/30/48/1031873048.db2.gz KOEVFAOSTMYOOY-KRWWSPQJSA-N 2 1 334.891 4.077 20 0 EIADMP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1F ZINC000453359693 1031889127 /nfs/dbraw/zinc/88/91/27/1031889127.db2.gz QFNHWAAPNACHMS-RLFDKKOZSA-N 2 1 346.490 4.075 20 0 EIADMP CC[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000531967859 1031889472 /nfs/dbraw/zinc/88/94/72/1031889472.db2.gz ZJNNTKHMSBGNEZ-QRTARXTBSA-N 2 1 328.422 4.476 20 0 EIADMP CC[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000531967859 1031889479 /nfs/dbraw/zinc/88/94/79/1031889479.db2.gz ZJNNTKHMSBGNEZ-QRTARXTBSA-N 2 1 328.422 4.476 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc(Br)cs1 ZINC000453387217 1031896253 /nfs/dbraw/zinc/89/62/53/1031896253.db2.gz BALBBVUZLGNSDB-LLVKDONJSA-N 2 1 331.323 4.036 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000531972415 1031908959 /nfs/dbraw/zinc/90/89/59/1031908959.db2.gz RIVLNIKSUXKXEW-UWJYYQICSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453405340 1031940607 /nfs/dbraw/zinc/94/06/07/1031940607.db2.gz QJHQZFUBZBBNID-AWEZNQCLSA-N 2 1 328.422 4.100 20 0 EIADMP Cc1cc([C@@H]([NH2+]CCCC[N@H+](C)C2CC2)c2cccnc2)ccc1F ZINC000453405920 1031941052 /nfs/dbraw/zinc/94/10/52/1031941052.db2.gz QVPWEBAUPKUTRR-OAQYLSRUSA-N 2 1 341.474 4.083 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)c2ccccc12 ZINC000453405873 1031941877 /nfs/dbraw/zinc/94/18/77/1031941877.db2.gz QQFKQWVOVBKQRH-INIZCTEOSA-N 2 1 326.484 4.373 20 0 EIADMP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453406476 1031942124 /nfs/dbraw/zinc/94/21/24/1031942124.db2.gz RBDFDHLBHDIIKK-AWEZNQCLSA-N 2 1 328.422 4.100 20 0 EIADMP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000449763796 1032009092 /nfs/dbraw/zinc/00/90/92/1032009092.db2.gz VOSJVWIUXNDXSR-CWFSZBLJSA-N 2 1 327.472 4.179 20 0 EIADMP CCc1ccc(C[N@@H+](C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)nc1 ZINC000549866453 1033490166 /nfs/dbraw/zinc/49/01/66/1033490166.db2.gz XNIPHBHOTAENEA-AVRDEDQJSA-N 2 1 337.511 4.129 20 0 EIADMP FC1(F)CCC([NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000512632314 1033555752 /nfs/dbraw/zinc/55/57/52/1033555752.db2.gz YZSBOIQZBGAPKD-YZGWKJHDSA-N 2 1 348.481 4.455 20 0 EIADMP Cc1cnc([C@H](C)[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)o1 ZINC000433048675 1033725042 /nfs/dbraw/zinc/72/50/42/1033725042.db2.gz YCHJZLPQAAVRTO-SFHVURJKSA-N 2 1 339.483 4.032 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCCc2cccc(C(F)(F)F)c2)CCN1C ZINC000429846702 1033767516 /nfs/dbraw/zinc/76/75/16/1033767516.db2.gz DLVVMNASUPBZMS-QAPCUYQASA-N 2 1 342.449 4.443 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCCc2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000429846702 1033767528 /nfs/dbraw/zinc/76/75/28/1033767528.db2.gz DLVVMNASUPBZMS-QAPCUYQASA-N 2 1 342.449 4.443 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCCc2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000429846702 1033767542 /nfs/dbraw/zinc/76/75/42/1033767542.db2.gz DLVVMNASUPBZMS-QAPCUYQASA-N 2 1 342.449 4.443 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCCc2cccc(C(F)(F)F)c2)CC[NH+]1C ZINC000429846702 1033767559 /nfs/dbraw/zinc/76/75/59/1033767559.db2.gz DLVVMNASUPBZMS-QAPCUYQASA-N 2 1 342.449 4.443 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCCc2cccc(C(F)(F)F)c2)CC[NH+]1C ZINC000429846702 1033767576 /nfs/dbraw/zinc/76/75/76/1033767576.db2.gz DLVVMNASUPBZMS-QAPCUYQASA-N 2 1 342.449 4.443 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000512772673 1033904642 /nfs/dbraw/zinc/90/46/42/1033904642.db2.gz CWTVGMGTGQYLTH-FQEVSTJZSA-N 2 1 347.462 4.465 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000512800245 1033981618 /nfs/dbraw/zinc/98/16/18/1033981618.db2.gz YYCAAYSOQRXQIB-AWEZNQCLSA-N 2 1 334.916 4.500 20 0 EIADMP c1ccc(Oc2cccc(C[NH2+]C3CC[NH+](CC4CC4)CC3)c2)cc1 ZINC000513082569 1034504759 /nfs/dbraw/zinc/50/47/59/1034504759.db2.gz XWJUPESEEYOGBW-UHFFFAOYSA-N 2 1 336.479 4.443 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[N@H+](C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000576438251 1034562844 /nfs/dbraw/zinc/56/28/44/1034562844.db2.gz LPHROHNRFAPWES-SBALYVHTSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[NH+](C)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000576438251 1034562861 /nfs/dbraw/zinc/56/28/61/1034562861.db2.gz LPHROHNRFAPWES-SBALYVHTSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000576438251 1034562868 /nfs/dbraw/zinc/56/28/68/1034562868.db2.gz LPHROHNRFAPWES-SBALYVHTSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC000576438251 1034562886 /nfs/dbraw/zinc/56/28/86/1034562886.db2.gz LPHROHNRFAPWES-SBALYVHTSA-N 2 1 338.442 4.106 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CSc4ccccc43)CC2)C1 ZINC000513207724 1034836235 /nfs/dbraw/zinc/83/62/35/1034836235.db2.gz FEGAYTNUNOSWSB-SZVBFZGTSA-N 2 1 330.541 4.466 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc(Cl)ccc1OCC1CC1 ZINC000430015301 1034847298 /nfs/dbraw/zinc/84/72/98/1034847298.db2.gz JRVTUGKDZNNSFD-UHFFFAOYSA-N 2 1 347.890 4.204 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000509927395 1035012110 /nfs/dbraw/zinc/01/21/10/1035012110.db2.gz PEMNIHHGUWXXOG-AZGFIHASSA-N 2 1 344.543 4.338 20 0 EIADMP Clc1ccc2[nH+]ccc(NC[C@H](c3ccco3)[NH+]3CCCC3)c2c1 ZINC000513602901 1035056730 /nfs/dbraw/zinc/05/67/30/1035056730.db2.gz KPJILEOLYACCSK-GOSISDBHSA-N 2 1 341.842 4.152 20 0 EIADMP C[NH+](C)[C@@H](CNc1cc[nH+]c2ccc(Cl)cc12)c1cccs1 ZINC000513651977 1035079440 /nfs/dbraw/zinc/07/94/40/1035079440.db2.gz HGLPTSUNSJGKLA-INIZCTEOSA-N 2 1 331.872 4.086 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]C4CCSCC4)[C@H]3C2)cc1 ZINC000513683637 1035101015 /nfs/dbraw/zinc/10/10/15/1035101015.db2.gz LUBPYKMVIWMFOB-JBACZVJFSA-N 2 1 344.568 4.162 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+][C@H](c3cccnc3)C3CCC3)CC2)cc1 ZINC000280285667 1035221067 /nfs/dbraw/zinc/22/10/67/1035221067.db2.gz MCYLPFQNONIXSW-QFIPXVFZSA-N 2 1 335.495 4.177 20 0 EIADMP Cc1ccccc1CCC[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501081998 1035374534 /nfs/dbraw/zinc/37/45/34/1035374534.db2.gz QHWCLNCHZZNOQJ-UHFFFAOYSA-N 2 1 337.511 4.171 20 0 EIADMP C[C@@H](C[NH+]1CCC([NH+]2CCCC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501130441 1035380183 /nfs/dbraw/zinc/38/01/83/1035380183.db2.gz OABSFAWEKDSSBI-HNNXBMFYSA-N 2 1 340.433 4.369 20 0 EIADMP c1csc([C@H]2c3ccsc3CC[N@@H+]2CC[C@@H]2CCC[NH2+]C2)c1 ZINC000420320512 1035511956 /nfs/dbraw/zinc/51/19/56/1035511956.db2.gz QKXLOIGOHNMZMQ-KBXCAEBGSA-N 2 1 332.538 4.147 20 0 EIADMP c1csc(C[N@H+](CCCC2CCCC2)[C@H]2CC23CC[NH2+]CC3)n1 ZINC000420319149 1035515793 /nfs/dbraw/zinc/51/57/93/1035515793.db2.gz XESXRUHOFXCLRU-KRWDZBQOSA-N 2 1 333.545 4.058 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420326852 1035531290 /nfs/dbraw/zinc/53/12/90/1035531290.db2.gz XSWMONHUSDQKKZ-DLBZAZTESA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420328279 1035533754 /nfs/dbraw/zinc/53/37/54/1035533754.db2.gz ZVTDIVMAVVLURT-HZPDHXFCSA-N 2 1 329.513 4.111 20 0 EIADMP CSCC1(CC[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000595067426 1035548666 /nfs/dbraw/zinc/54/86/66/1035548666.db2.gz ILNPRTXKAGURLZ-PKOBYXMFSA-N 2 1 332.557 4.020 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc3sccc3c2)[C@H](C)C1 ZINC000575222286 1035729135 /nfs/dbraw/zinc/72/91/35/1035729135.db2.gz ZMWVFJIJQRIMIX-APWZRJJASA-N 2 1 346.540 4.128 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCCC[C@H]3CC)CC2)cs1 ZINC000502035697 1035813537 /nfs/dbraw/zinc/81/35/37/1035813537.db2.gz QZBHHYZFBKJSAX-MJGOQNOKSA-N 2 1 349.588 4.476 20 0 EIADMP Cc1cccc(N2CCC([NH2+]Cc3ccc(C)c(Cl)c3)CC2)[nH+]1 ZINC000195443681 1035851844 /nfs/dbraw/zinc/85/18/44/1035851844.db2.gz FLCFBWLVVZULQL-UHFFFAOYSA-N 2 1 329.875 4.110 20 0 EIADMP Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000571380352 1036037868 /nfs/dbraw/zinc/03/78/68/1036037868.db2.gz IPAXKICDKUKXEN-YMPZKCBVSA-N 2 1 349.522 4.170 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cnn(C2CCCC2)c1 ZINC000502429100 1036211527 /nfs/dbraw/zinc/21/15/27/1036211527.db2.gz GMOXSSKWADZOJA-INIZCTEOSA-N 2 1 330.520 4.056 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]CC1([NH2+][C@H](C)c2ccccc2)CCCC1 ZINC000502452270 1036223071 /nfs/dbraw/zinc/22/30/71/1036223071.db2.gz MJPVPWYTKLPIJQ-GIVPXCGWSA-N 2 1 344.543 4.445 20 0 EIADMP C[N@H+](Cc1cc(C(F)(F)F)ccc1Cl)CC1CC[NH+](C)CC1 ZINC000513746411 1036247002 /nfs/dbraw/zinc/24/70/02/1036247002.db2.gz WBVIAIKWWNMVMT-UHFFFAOYSA-N 2 1 334.813 4.132 20 0 EIADMP Cc1ccc2[nH+]ccc(N(C)C[C@@H]3CC[N@@H+](C)[C@H]3c3cccnc3)c2c1 ZINC000486002062 1036417014 /nfs/dbraw/zinc/41/70/14/1036417014.db2.gz IHIFOUCSFHFYLU-AVRDEDQJSA-N 2 1 346.478 4.067 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000572243018 1036471071 /nfs/dbraw/zinc/47/10/71/1036471071.db2.gz HHUBFJPLNPPRPW-DLBZAZTESA-N 2 1 333.545 4.012 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(CCc2ccccc2)CC1 ZINC000502720875 1036561936 /nfs/dbraw/zinc/56/19/36/1036561936.db2.gz HCDGHQQVGXVOMO-UHFFFAOYSA-N 2 1 325.500 4.317 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCCC[C@@H]1CCc1ccccc1 ZINC000502763161 1036633816 /nfs/dbraw/zinc/63/38/16/1036633816.db2.gz PTIMLSJCQJZWDU-OAQYLSRUSA-N 2 1 325.500 4.459 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCC[C@@H]1CCc1ccccc1 ZINC000502763161 1036633823 /nfs/dbraw/zinc/63/38/23/1036633823.db2.gz PTIMLSJCQJZWDU-OAQYLSRUSA-N 2 1 325.500 4.459 20 0 EIADMP CC[C@@H](C[NH2+]CC1([NH+]2CCC(OC)CC2)CCCC1)c1ccccc1 ZINC000502985806 1036850987 /nfs/dbraw/zinc/85/09/87/1036850987.db2.gz FGJUDLAVSADRLW-IBGZPJMESA-N 2 1 344.543 4.193 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3[nH]nc4ccccc43)cc2)C1 ZINC000589641197 1036857950 /nfs/dbraw/zinc/85/79/50/1036857950.db2.gz XAORUCVHJSJQRE-QGZVFWFLSA-N 2 1 348.494 4.085 20 0 EIADMP CC(C)C[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043719 1036883422 /nfs/dbraw/zinc/88/34/22/1036883422.db2.gz HDLPTYWMRGXHNR-WBVHZDCISA-N 2 1 328.422 4.334 20 0 EIADMP CC(C)C[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043719 1036883425 /nfs/dbraw/zinc/88/34/25/1036883425.db2.gz HDLPTYWMRGXHNR-WBVHZDCISA-N 2 1 328.422 4.334 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]C[C@H]3C[C@H]3c3ccccc3)C2)c1 ZINC000503046895 1036885864 /nfs/dbraw/zinc/88/58/64/1036885864.db2.gz SMMJDHSDZHQSOO-QFUCXCTJSA-N 2 1 340.536 4.353 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]C[C@H]3C[C@H]3c3ccccc3)C2)c1 ZINC000503046895 1036885865 /nfs/dbraw/zinc/88/58/65/1036885865.db2.gz SMMJDHSDZHQSOO-QFUCXCTJSA-N 2 1 340.536 4.353 20 0 EIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000503071941 1036889952 /nfs/dbraw/zinc/88/99/52/1036889952.db2.gz JJSBXVVCUGNNPO-MRXNPFEDSA-N 2 1 338.417 4.279 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000503071941 1036889953 /nfs/dbraw/zinc/88/99/53/1036889953.db2.gz JJSBXVVCUGNNPO-MRXNPFEDSA-N 2 1 338.417 4.279 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000503071941 1036889958 /nfs/dbraw/zinc/88/99/58/1036889958.db2.gz JJSBXVVCUGNNPO-MRXNPFEDSA-N 2 1 338.417 4.279 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000503071941 1036889963 /nfs/dbraw/zinc/88/99/63/1036889963.db2.gz JJSBXVVCUGNNPO-MRXNPFEDSA-N 2 1 338.417 4.279 20 0 EIADMP Clc1sccc1CN1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000710907979 1036892284 /nfs/dbraw/zinc/89/22/84/1036892284.db2.gz QQWMFBLTBZFNAQ-AEFFLSMTSA-N 2 1 346.927 4.355 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)oc1C ZINC000669699101 1037019571 /nfs/dbraw/zinc/01/95/71/1037019571.db2.gz HKBRCQWTEDSGDM-FXAWDEMLSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000669699101 1037019590 /nfs/dbraw/zinc/01/95/90/1037019590.db2.gz HKBRCQWTEDSGDM-FXAWDEMLSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1noc(C)c1CCC[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000166172343 1037109947 /nfs/dbraw/zinc/10/99/47/1037109947.db2.gz FYBMAYIYFVWEDR-CQSZACIVSA-N 2 1 338.455 4.069 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000272298750 1037153278 /nfs/dbraw/zinc/15/32/78/1037153278.db2.gz GNLATBODLQRPQL-BJLQDIEVSA-N 2 1 340.515 4.025 20 0 EIADMP Cc1oc(-c2ccccc2)nc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000590786527 1037165484 /nfs/dbraw/zinc/16/54/84/1037165484.db2.gz DCVWXUMMPMKORE-UHFFFAOYSA-N 2 1 341.499 4.202 20 0 EIADMP Cc1csc([C@H](C)C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000273470309 1037473665 /nfs/dbraw/zinc/47/36/65/1037473665.db2.gz RXDDCUHYKATPNV-GPMSIDNRSA-N 2 1 343.540 4.055 20 0 EIADMP C[C@@H]1C[C@@H]1C[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415369 1037583844 /nfs/dbraw/zinc/58/38/44/1037583844.db2.gz AMULRZHPYCSPRT-VUNQQRPYSA-N 2 1 340.433 4.334 20 0 EIADMP C[C@@H]1C[C@@H]1C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415369 1037583860 /nfs/dbraw/zinc/58/38/60/1037583860.db2.gz AMULRZHPYCSPRT-VUNQQRPYSA-N 2 1 340.433 4.334 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000488436643 1037593027 /nfs/dbraw/zinc/59/30/27/1037593027.db2.gz YAGQONXUJIIPBB-YVZSJOIWSA-N 2 1 344.568 4.302 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000488547752 1037658404 /nfs/dbraw/zinc/65/84/04/1037658404.db2.gz SWQCUERTPJFSGT-LMCOJAPRSA-N 2 1 332.557 4.017 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000513788217 1037743371 /nfs/dbraw/zinc/74/33/71/1037743371.db2.gz MZURTVNXXXMGTR-PKOBYXMFSA-N 2 1 328.500 4.145 20 0 EIADMP COCCSc1ccc([C@H](C)[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422709439 1037804178 /nfs/dbraw/zinc/80/41/78/1037804178.db2.gz DISJIJVJKZJDCL-KPOBHBOGSA-N 2 1 342.508 4.221 20 0 EIADMP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000422727199 1037817855 /nfs/dbraw/zinc/81/78/55/1037817855.db2.gz BOUTVQFYNKJAIE-SFHVURJKSA-N 3 1 331.548 4.058 20 0 EIADMP COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422758370 1037819053 /nfs/dbraw/zinc/81/90/53/1037819053.db2.gz IXNYKFHPIGXIJY-IXEWLPCDSA-N 2 1 336.907 4.308 20 0 EIADMP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000422818963 1037845688 /nfs/dbraw/zinc/84/56/88/1037845688.db2.gz LULDDIQZPKLGMM-TVFCKZIOSA-N 2 1 340.433 4.438 20 0 EIADMP Clc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000422937840 1037876614 /nfs/dbraw/zinc/87/66/14/1037876614.db2.gz CUYJBJOIXGCIRF-IHPCNDPISA-N 2 1 326.871 4.410 20 0 EIADMP COc1ccc([C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])c2ccccc2Cl)cc1 ZINC000422920424 1037880042 /nfs/dbraw/zinc/88/00/42/1037880042.db2.gz LYSLNFKLKZVEED-NJSLBKSFSA-N 2 1 332.875 4.153 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1c[nH+]ccc1N ZINC000423101943 1037964766 /nfs/dbraw/zinc/96/47/66/1037964766.db2.gz WPJIPUXKPBYPHE-UXIGCNINSA-N 2 1 335.373 4.110 20 0 EIADMP c1ccc(C[N@@H+](Cc2ccc(C3CC3)cc2)[C@@H]2CCC[NH2+]CC2)nc1 ZINC000414720751 1038030478 /nfs/dbraw/zinc/03/04/78/1038030478.db2.gz ZQZVJARZCVLTHE-JOCHJYFZSA-N 2 1 335.495 4.103 20 0 EIADMP c1ccc(C[N@H+](Cc2ccc(C3CC3)cc2)[C@@H]2CCC[NH2+]CC2)nc1 ZINC000414720751 1038030505 /nfs/dbraw/zinc/03/05/05/1038030505.db2.gz ZQZVJARZCVLTHE-JOCHJYFZSA-N 2 1 335.495 4.103 20 0 EIADMP Fc1cccc([C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2cccc(Cl)c2)c1 ZINC000423209299 1038039038 /nfs/dbraw/zinc/03/90/38/1038039038.db2.gz IYYZMIWEJYJLQH-KUHUBIRLSA-N 2 1 332.850 4.158 20 0 EIADMP Fc1ccc([C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423215518 1038057056 /nfs/dbraw/zinc/05/70/56/1038057056.db2.gz QRUTTYFPUAPALP-ZHRRBRCNSA-N 2 1 349.453 4.053 20 0 EIADMP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1sc(-c2ccc(OC)cc2)nc1C ZINC000423287890 1038092742 /nfs/dbraw/zinc/09/27/42/1038092742.db2.gz PBSNNVCLLSEUTP-ZDUSSCGKSA-N 2 1 347.528 4.295 20 0 EIADMP [NH3+]C[C@@H]([NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C1CC1 ZINC000423284207 1038093652 /nfs/dbraw/zinc/09/36/52/1038093652.db2.gz WQEHQIBQDKDWQT-GOEBONIOSA-N 2 1 347.915 4.168 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@H]3C1)CCCO2 ZINC000489557421 1038113285 /nfs/dbraw/zinc/11/32/85/1038113285.db2.gz YMMGWIIWAFEFKI-RVKKMQEKSA-N 2 1 334.891 4.079 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CCCO2 ZINC000489557421 1038113310 /nfs/dbraw/zinc/11/33/10/1038113310.db2.gz YMMGWIIWAFEFKI-RVKKMQEKSA-N 2 1 334.891 4.079 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H]2CCCOc3ccc(C(C)C)cc32)CC1 ZINC000489554657 1038113777 /nfs/dbraw/zinc/11/37/77/1038113777.db2.gz GWNKLKDZPBMIIB-FQEVSTJZSA-N 2 1 330.516 4.488 20 0 EIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CCCO2 ZINC000489582800 1038124970 /nfs/dbraw/zinc/12/49/70/1038124970.db2.gz IREUETYDYFMPAB-NRFANRHFSA-N 2 1 342.527 4.488 20 0 EIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423331033 1038140974 /nfs/dbraw/zinc/14/09/74/1038140974.db2.gz UNUBPZSXZYJCON-MEBBXXQBSA-N 2 1 335.904 4.160 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc2ccccc2c1OC(F)F ZINC000423362019 1038177883 /nfs/dbraw/zinc/17/78/83/1038177883.db2.gz AQVPRANJCCDASJ-IIYDPXPESA-N 2 1 334.410 4.090 20 0 EIADMP C[C@@H]1C[C@@H](C[N@H+]2CCC[C@H]2c2ccc(Br)s2)CC[NH2+]1 ZINC000414760289 1038349301 /nfs/dbraw/zinc/34/93/01/1038349301.db2.gz QHDJGKJAWFSZHV-AGIUHOORSA-N 2 1 343.334 4.036 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)C1 ZINC000594784436 1038399772 /nfs/dbraw/zinc/39/97/72/1038399772.db2.gz KPNCJRFUUQICNU-FQEVSTJZSA-N 2 1 347.506 4.121 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000608067798 1038489883 /nfs/dbraw/zinc/48/98/83/1038489883.db2.gz TVURLRNJGCECBL-ABAIWWIYSA-N 2 1 334.813 4.179 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000608067798 1038489885 /nfs/dbraw/zinc/48/98/85/1038489885.db2.gz TVURLRNJGCECBL-ABAIWWIYSA-N 2 1 334.813 4.179 20 0 EIADMP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000924682345 1038802398 /nfs/dbraw/zinc/80/23/98/1038802398.db2.gz VQTIVJWMIVRPRT-STQMWFEESA-N 2 1 346.359 4.256 20 0 EIADMP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000924682345 1038802404 /nfs/dbraw/zinc/80/24/04/1038802404.db2.gz VQTIVJWMIVRPRT-STQMWFEESA-N 2 1 346.359 4.256 20 0 EIADMP C[C@H]([NH2+]CCCN(C)Cc1ccccc1)c1nccc2ccccc21 ZINC000554997531 1038821795 /nfs/dbraw/zinc/82/17/95/1038821795.db2.gz MTNMRKOSCXTKIO-SFHVURJKSA-N 2 1 333.479 4.408 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1nccc2ccccc21 ZINC000554997531 1038821797 /nfs/dbraw/zinc/82/17/97/1038821797.db2.gz MTNMRKOSCXTKIO-SFHVURJKSA-N 2 1 333.479 4.408 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1nccc2ccccc21 ZINC000554997531 1038821804 /nfs/dbraw/zinc/82/18/04/1038821804.db2.gz MTNMRKOSCXTKIO-SFHVURJKSA-N 2 1 333.479 4.408 20 0 EIADMP CCc1noc(C)c1C[NH+]1CCC(CC[N@H+](CC)CC(C)C)CC1 ZINC000539099139 1038836907 /nfs/dbraw/zinc/83/69/07/1038836907.db2.gz XPVJDBUCGKBKDU-UHFFFAOYSA-N 2 1 335.536 4.125 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC2=Cc3ccccc3OC2)cc1 ZINC000086279333 1038855187 /nfs/dbraw/zinc/85/51/87/1038855187.db2.gz UHSHHLNFDSOYPW-INIZCTEOSA-N 2 1 345.446 4.307 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCC[N@@H+]2C)cc1OCC ZINC000539269212 1038902942 /nfs/dbraw/zinc/90/29/42/1038902942.db2.gz CAWSSLQGGLLHGU-SJLPKXTDSA-N 2 1 334.504 4.009 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCC[N@H+]2C)cc1OCC ZINC000539269212 1038902993 /nfs/dbraw/zinc/90/29/93/1038902993.db2.gz CAWSSLQGGLLHGU-SJLPKXTDSA-N 2 1 334.504 4.009 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(-c3ccc(OC)cc3)cc2)CC1 ZINC000539259677 1038916656 /nfs/dbraw/zinc/91/66/56/1038916656.db2.gz KWGMDQIGRZDDPA-UHFFFAOYSA-N 2 1 338.495 4.326 20 0 EIADMP CC[N@@H+](Cc1ccc(Br)cc1)C1CCC([NH+](C)C)CC1 ZINC001168328168 1038936468 /nfs/dbraw/zinc/93/64/68/1038936468.db2.gz YFWVUSAOSJMFQH-UHFFFAOYSA-N 2 1 339.321 4.144 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CCSCc1ccc(Cl)cc1Cl ZINC000539296777 1038948430 /nfs/dbraw/zinc/94/84/30/1038948430.db2.gz LCWGAQDDCUDUBA-LRDDRELGSA-N 2 1 347.355 4.156 20 0 EIADMP C[C@@H](c1cccc(Br)c1)[N@@H+](C)C1CCC([NH+](C)C)CC1 ZINC001168328747 1038949459 /nfs/dbraw/zinc/94/94/59/1038949459.db2.gz CAXJOUQSNDZUNR-IGEOTXOUSA-N 2 1 339.321 4.315 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccc(Br)cc2)C1 ZINC000481027713 1038967928 /nfs/dbraw/zinc/96/79/28/1038967928.db2.gz WRTCKLVHDILORN-YOEHRIQHSA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@@H]2c2ccc(OC)c(F)c2)C1 ZINC000481039925 1038989610 /nfs/dbraw/zinc/98/96/10/1038989610.db2.gz QINATYYIUFKGPW-POAQFYNOSA-N 2 1 348.506 4.182 20 0 EIADMP C[NH+](C)C1CCC([N@@H+](C)CCc2ccc(C(F)(F)F)cc2)CC1 ZINC001168333939 1039035694 /nfs/dbraw/zinc/03/56/94/1039035694.db2.gz GOSVNMFFNKRRFZ-UHFFFAOYSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1cccc(F)c1 ZINC000481184833 1039088641 /nfs/dbraw/zinc/08/86/41/1039088641.db2.gz GAMOIFNXJKCGGH-AVRDEDQJSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1cccc(F)c1 ZINC000481184833 1039088662 /nfs/dbraw/zinc/08/86/62/1039088662.db2.gz GAMOIFNXJKCGGH-AVRDEDQJSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3cccc(Cl)c3F)CCCC2)CC[N@H+]1C ZINC000477864124 1039141856 /nfs/dbraw/zinc/14/18/56/1039141856.db2.gz ZUZJOOCGZVMZSM-HUUCEWRRSA-N 2 1 338.898 4.363 20 0 EIADMP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccc(Br)s1 ZINC000477931941 1039219827 /nfs/dbraw/zinc/21/98/27/1039219827.db2.gz DKVLTWPILGXHMS-GFCCVEGCSA-N 2 1 345.350 4.283 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc(Cl)ccc1OC ZINC000481326137 1039300549 /nfs/dbraw/zinc/30/05/49/1039300549.db2.gz YLUKERIDCJHWMK-SFHVURJKSA-N 2 1 336.907 4.264 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](CC)c2cccc(C)c2)[C@@H](C)C1 ZINC000552244526 1039310365 /nfs/dbraw/zinc/31/03/65/1039310365.db2.gz DEYJCPYKLAQTFD-JBACZVJFSA-N 2 1 332.532 4.173 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCCOC2CCCC2)CC1 ZINC000552247649 1039314486 /nfs/dbraw/zinc/31/44/86/1039314486.db2.gz WILGMMJIYIUMTI-UHFFFAOYSA-N 2 1 344.543 4.369 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000121804870 1039490048 /nfs/dbraw/zinc/49/00/48/1039490048.db2.gz BOQJXKBTNGGIDQ-FQEVSTJZSA-N 2 1 328.500 4.240 20 0 EIADMP Cc1ccnc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000514087938 1039587665 /nfs/dbraw/zinc/58/76/65/1039587665.db2.gz JHRCZCHKILILQC-RTBURBONSA-N 2 1 337.511 4.473 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC[N@@H+]1C ZINC000280948337 1039756499 /nfs/dbraw/zinc/75/64/99/1039756499.db2.gz XCUBHQRGRDSTPW-SDNTUTLCSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC[N@H+]1C ZINC000280948337 1039756521 /nfs/dbraw/zinc/75/65/21/1039756521.db2.gz XCUBHQRGRDSTPW-SDNTUTLCSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCc2c1cc(Cl)cc2Br ZINC000534792807 1039787845 /nfs/dbraw/zinc/78/78/45/1039787845.db2.gz DDAOQFSTCYADDG-MEBBXXQBSA-N 2 1 345.712 4.020 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccccc2OC(F)F)CC1 ZINC000122976631 1039834170 /nfs/dbraw/zinc/83/41/70/1039834170.db2.gz RZOBSSBREIHROQ-AWEZNQCLSA-N 2 1 326.431 4.203 20 0 EIADMP CCOC1(C)CC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC000430110105 1039848899 /nfs/dbraw/zinc/84/88/99/1039848899.db2.gz XFGMNUQONCEPOM-UHFFFAOYSA-N 2 1 332.532 4.036 20 0 EIADMP c1c2ccccc2sc1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000537692194 1039910064 /nfs/dbraw/zinc/91/00/64/1039910064.db2.gz GKCMHQRFDBPXSI-APWZRJJASA-N 2 1 326.509 4.350 20 0 EIADMP c1c2ccccc2sc1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000537692194 1039910078 /nfs/dbraw/zinc/91/00/78/1039910078.db2.gz GKCMHQRFDBPXSI-APWZRJJASA-N 2 1 326.509 4.350 20 0 EIADMP c1c2ccccc2sc1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000537692194 1039910095 /nfs/dbraw/zinc/91/00/95/1039910095.db2.gz GKCMHQRFDBPXSI-APWZRJJASA-N 2 1 326.509 4.350 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000481976092 1039921816 /nfs/dbraw/zinc/92/18/16/1039921816.db2.gz XYTFXDCAPHFMIG-LSDHHAIUSA-N 2 1 331.529 4.033 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OCC)c(OCC)c2)CC1 ZINC000481973095 1039923216 /nfs/dbraw/zinc/92/32/16/1039923216.db2.gz OYSMLJKLDAIPSN-KRWDZBQOSA-N 2 1 348.531 4.399 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC[N@@H+]1C ZINC000482010791 1039949681 /nfs/dbraw/zinc/94/96/81/1039949681.db2.gz CLUZNNAZIVUWJU-HYVNUMGLSA-N 2 1 341.524 4.260 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC[N@H+]1C ZINC000482010791 1039949700 /nfs/dbraw/zinc/94/97/00/1039949700.db2.gz CLUZNNAZIVUWJU-HYVNUMGLSA-N 2 1 341.524 4.260 20 0 EIADMP c1cc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)cs1 ZINC000537695355 1040005191 /nfs/dbraw/zinc/00/51/91/1040005191.db2.gz LZEZVVGXAVJMKS-WOJBJXKFSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)cs1 ZINC000537695355 1040005208 /nfs/dbraw/zinc/00/52/08/1040005208.db2.gz LZEZVVGXAVJMKS-WOJBJXKFSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)cs1 ZINC000537695355 1040005226 /nfs/dbraw/zinc/00/52/26/1040005226.db2.gz LZEZVVGXAVJMKS-WOJBJXKFSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)cs1 ZINC000537695355 1040005245 /nfs/dbraw/zinc/00/52/45/1040005245.db2.gz LZEZVVGXAVJMKS-WOJBJXKFSA-N 2 1 326.509 4.235 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCO1 ZINC000551147350 1040005853 /nfs/dbraw/zinc/00/58/53/1040005853.db2.gz BWVJFXLBJGDXPS-BQJUDKOJSA-N 2 1 330.516 4.005 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCO1 ZINC000551147350 1040005869 /nfs/dbraw/zinc/00/58/69/1040005869.db2.gz BWVJFXLBJGDXPS-BQJUDKOJSA-N 2 1 330.516 4.005 20 0 EIADMP Fc1ccccc1-c1ccc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)o1 ZINC000435055376 1040032441 /nfs/dbraw/zinc/03/24/41/1040032441.db2.gz HSRBGZOMWURKMO-QGZVFWFLSA-N 2 1 338.382 4.134 20 0 EIADMP C[C@H](C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)c1ccc(F)cc1 ZINC000435058110 1040035463 /nfs/dbraw/zinc/03/54/63/1040035463.db2.gz DGERAZPVAYONGM-MRXNPFEDSA-N 2 1 341.474 4.342 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551206156 1040060177 /nfs/dbraw/zinc/06/01/77/1040060177.db2.gz WNAFQKHDCWJHBS-AWEZNQCLSA-N 2 1 349.931 4.285 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551206156 1040060194 /nfs/dbraw/zinc/06/01/94/1040060194.db2.gz WNAFQKHDCWJHBS-AWEZNQCLSA-N 2 1 349.931 4.285 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)[C@@H](C)C1 ZINC000551238872 1040084165 /nfs/dbraw/zinc/08/41/65/1040084165.db2.gz FENIDPXKWAYUGS-XIRDDKMYSA-N 2 1 328.422 4.043 20 0 EIADMP Cc1sc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)nc1-c1ccc(Cl)cc1 ZINC000514737460 1040177887 /nfs/dbraw/zinc/17/78/87/1040177887.db2.gz BYFOVBHIHHNCDC-GJZGRUSLSA-N 2 1 335.904 4.131 20 0 EIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482456271 1040254910 /nfs/dbraw/zinc/25/49/10/1040254910.db2.gz ZGWQUNFJGWFIJH-QMHWCDLVSA-N 2 1 334.507 4.074 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000668063913 1040310291 /nfs/dbraw/zinc/31/02/91/1040310291.db2.gz ZLESVLDOVAOPIJ-SFHVURJKSA-N 2 1 329.513 4.035 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCc2c1cc(Br)cc2Cl ZINC000535509424 1040311638 /nfs/dbraw/zinc/31/16/38/1040311638.db2.gz ZRVGIZTWZSSSTH-MEBBXXQBSA-N 2 1 345.712 4.020 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC3(CCCC3)O2)CC[N@@H+]1Cc1ccccc1 ZINC000379655500 1040316832 /nfs/dbraw/zinc/31/68/32/1040316832.db2.gz MBXNYHLZRZDSLD-HMXCVIKNSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC3(CCCC3)O2)CC[N@H+]1Cc1ccccc1 ZINC000379655500 1040316843 /nfs/dbraw/zinc/31/68/43/1040316843.db2.gz MBXNYHLZRZDSLD-HMXCVIKNSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@H](C[N@H+]1CCC[C@@H]2C[NH+](C)CC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890642 1040329762 /nfs/dbraw/zinc/32/97/62/1040329762.db2.gz KVYNOJCNKJXPKN-KYJSFNMBSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CCC[C@@H]2C[N@H+](C)CC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890642 1040329772 /nfs/dbraw/zinc/32/97/72/1040329772.db2.gz KVYNOJCNKJXPKN-KYJSFNMBSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890642 1040329796 /nfs/dbraw/zinc/32/97/96/1040329796.db2.gz KVYNOJCNKJXPKN-KYJSFNMBSA-N 2 1 340.433 4.225 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000479461028 1040371615 /nfs/dbraw/zinc/37/16/15/1040371615.db2.gz AQMLGMKUMBHULA-NQIIRXRSSA-N 2 1 341.474 4.030 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000479461028 1040371631 /nfs/dbraw/zinc/37/16/31/1040371631.db2.gz AQMLGMKUMBHULA-NQIIRXRSSA-N 2 1 341.474 4.030 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(Br)c2C)C[C@H]1C ZINC000535585293 1040386554 /nfs/dbraw/zinc/38/65/54/1040386554.db2.gz LMYGJAYGHLZJDU-CZUORRHYSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(Br)c2C)C[C@H]1C ZINC000535585293 1040386568 /nfs/dbraw/zinc/38/65/68/1040386568.db2.gz LMYGJAYGHLZJDU-CZUORRHYSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(Br)c2C)C[C@H]1C ZINC000535585293 1040386580 /nfs/dbraw/zinc/38/65/80/1040386580.db2.gz LMYGJAYGHLZJDU-CZUORRHYSA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@H+]1CC[C@H](NCc2cnc(-c3ccc(Cl)cc3)s2)[C@@H](C)C1 ZINC000551537065 1040395186 /nfs/dbraw/zinc/39/51/86/1040395186.db2.gz ZTASCQSZKNNQHE-GUYCJALGSA-N 2 1 349.931 4.283 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)[C@@H](C)C1 ZINC000551537065 1040395197 /nfs/dbraw/zinc/39/51/97/1040395197.db2.gz ZTASCQSZKNNQHE-GUYCJALGSA-N 2 1 349.931 4.283 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2ccccc2OC(F)F)C1 ZINC000515020055 1040420959 /nfs/dbraw/zinc/42/09/59/1040420959.db2.gz MSXKPCDSPVCMGH-RBFDBLARSA-N 2 1 338.442 4.013 20 0 EIADMP Cc1ccc2cc(C[N@H+]3CCC[C@H](c4ncc5n4CCCC5)C3)[nH]c2c1 ZINC000668104701 1040431540 /nfs/dbraw/zinc/43/15/40/1040431540.db2.gz MBAKIMCCSCVCSR-SFHVURJKSA-N 2 1 348.494 4.389 20 0 EIADMP c1ccc(COc2ccccc2C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666999578 1040440607 /nfs/dbraw/zinc/44/06/07/1040440607.db2.gz ZPLDODNPTQOHRN-HXUWFJFHSA-N 2 1 336.479 4.030 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C3[C@H](C)CCC[C@H]3C)CC2)cs1 ZINC000482874301 1040532979 /nfs/dbraw/zinc/53/29/79/1040532979.db2.gz NQLNOQIZGVASGL-HZPDHXFCSA-N 2 1 349.588 4.332 20 0 EIADMP c1csc([C@H]2c3ccsc3CC[N@@H+]2CCC2CC[NH2+]CC2)c1 ZINC000479683155 1040567695 /nfs/dbraw/zinc/56/76/95/1040567695.db2.gz DTEZGISEFAUEHD-GOSISDBHSA-N 2 1 332.538 4.147 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2cccc(SCc3ccccc3)c2)C1 ZINC000553875562 1040603177 /nfs/dbraw/zinc/60/31/77/1040603177.db2.gz MJTJXWYQTOYWLA-FQEVSTJZSA-N 2 1 340.536 4.362 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2cccc(SCc3ccccc3)c2)C1 ZINC000553875562 1040603194 /nfs/dbraw/zinc/60/31/94/1040603194.db2.gz MJTJXWYQTOYWLA-FQEVSTJZSA-N 2 1 340.536 4.362 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000539610338 1040606583 /nfs/dbraw/zinc/60/65/83/1040606583.db2.gz WLINRYDIPYYXMG-ZSGPHXLJSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000539610338 1040606590 /nfs/dbraw/zinc/60/65/90/1040606590.db2.gz WLINRYDIPYYXMG-ZSGPHXLJSA-N 2 1 340.433 4.414 20 0 EIADMP Fc1ccccc1[C@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000435777864 1040625435 /nfs/dbraw/zinc/62/54/35/1040625435.db2.gz FALFRTBUISDKGH-KESTWPANSA-N 2 1 338.470 4.326 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000479852142 1040702011 /nfs/dbraw/zinc/70/20/11/1040702011.db2.gz MSYNBGGYQHSLFD-HNNXBMFYSA-N 2 1 345.556 4.281 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000479852146 1040702831 /nfs/dbraw/zinc/70/28/31/1040702831.db2.gz MSYNBGGYQHSLFD-OAHLLOKOSA-N 2 1 345.556 4.281 20 0 EIADMP C[NH+](C)CCC[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000479858105 1040717361 /nfs/dbraw/zinc/71/73/61/1040717361.db2.gz IGGXZYPLJNVHBQ-HNNXBMFYSA-N 2 1 349.931 4.382 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000483179003 1040744153 /nfs/dbraw/zinc/74/41/53/1040744153.db2.gz AXSOMXGPNVMJSA-GSEOLPGOSA-N 2 1 332.557 4.161 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000483179003 1040744169 /nfs/dbraw/zinc/74/41/69/1040744169.db2.gz AXSOMXGPNVMJSA-GSEOLPGOSA-N 2 1 332.557 4.161 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@@H]1C ZINC000539820935 1040817789 /nfs/dbraw/zinc/81/77/89/1040817789.db2.gz MABFMRKCGFJNEY-PKOBYXMFSA-N 2 1 348.531 4.035 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@@H]1C ZINC000539820935 1040817792 /nfs/dbraw/zinc/81/77/92/1040817792.db2.gz MABFMRKCGFJNEY-PKOBYXMFSA-N 2 1 348.531 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@@H]1C ZINC000539820935 1040817797 /nfs/dbraw/zinc/81/77/97/1040817797.db2.gz MABFMRKCGFJNEY-PKOBYXMFSA-N 2 1 348.531 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@@H]1C ZINC000539820935 1040817802 /nfs/dbraw/zinc/81/78/02/1040817802.db2.gz MABFMRKCGFJNEY-PKOBYXMFSA-N 2 1 348.531 4.035 20 0 EIADMP CC[C@H](c1ccc(F)cc1)[N@@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1 ZINC000436048983 1040839667 /nfs/dbraw/zinc/83/96/67/1040839667.db2.gz GOIZLPAJQPLRCT-MAUKXSAKSA-N 2 1 347.503 4.153 20 0 EIADMP CC[C@H](c1ccc(F)cc1)[N@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1 ZINC000436048983 1040839674 /nfs/dbraw/zinc/83/96/74/1040839674.db2.gz GOIZLPAJQPLRCT-MAUKXSAKSA-N 2 1 347.503 4.153 20 0 EIADMP Cc1ccc2ccccc2c1C[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000483392629 1040840768 /nfs/dbraw/zinc/84/07/68/1040840768.db2.gz IJRLYYMXLGWOEV-UHFFFAOYSA-N 2 1 333.479 4.336 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1nc2c(s1)CCCC2 ZINC000537883088 1040872526 /nfs/dbraw/zinc/87/25/26/1040872526.db2.gz QQVZAXXVLDWKCE-IXDOHACOSA-N 2 1 349.588 4.431 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483483452 1040872751 /nfs/dbraw/zinc/87/27/51/1040872751.db2.gz NNFKUGPRECHSNE-UKPHBRMFSA-N 2 1 326.406 4.183 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000483483452 1040872759 /nfs/dbraw/zinc/87/27/59/1040872759.db2.gz NNFKUGPRECHSNE-UKPHBRMFSA-N 2 1 326.406 4.183 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000483483452 1040872762 /nfs/dbraw/zinc/87/27/62/1040872762.db2.gz NNFKUGPRECHSNE-UKPHBRMFSA-N 2 1 326.406 4.183 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1cncs1 ZINC000537941600 1040905126 /nfs/dbraw/zinc/90/51/26/1040905126.db2.gz XLEMBIUWVDPEBJ-XYJFISCASA-N 2 1 329.513 4.094 20 0 EIADMP COc1ccc(F)cc1C[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000462775304 1040913170 /nfs/dbraw/zinc/91/31/70/1040913170.db2.gz FWXMOULHPCDHBK-LIRRHRJNSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(F)cc1C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000462775304 1040913184 /nfs/dbraw/zinc/91/31/84/1040913184.db2.gz FWXMOULHPCDHBK-LIRRHRJNSA-N 2 1 348.487 4.069 20 0 EIADMP C[C@@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000903160613 1040928790 /nfs/dbraw/zinc/92/87/90/1040928790.db2.gz RZMHVBILXVLOSN-HYCNCBECSA-N 2 1 344.568 4.161 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CC[N@@H+](C)C[C@H]1C)c1cccc(C(F)(F)F)c1 ZINC000483700462 1040967039 /nfs/dbraw/zinc/96/70/39/1040967039.db2.gz KTWOGAWJMHEAIV-CKEIUWERSA-N 2 1 328.422 4.129 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)C1CC(F)(F)C1 ZINC000898519772 1040976037 /nfs/dbraw/zinc/97/60/37/1040976037.db2.gz RBKNZMMVEHXVCZ-NFBUACBFSA-N 2 1 348.481 4.311 20 0 EIADMP COc1cc(C)c([C@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C)cc1OC ZINC000483863495 1041049489 /nfs/dbraw/zinc/04/94/89/1041049489.db2.gz UQXYFRSCYJLYFD-KRWDZBQOSA-N 2 1 336.520 4.172 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)CC1 ZINC000462888275 1041051421 /nfs/dbraw/zinc/05/14/21/1041051421.db2.gz FFJSYLXUPYJUAC-INIZCTEOSA-N 2 1 327.516 4.298 20 0 EIADMP COc1ccc(Cl)cc1C(C)(C)[NH2+]CCCCn1cc[nH+]c1C ZINC000425510451 1041054737 /nfs/dbraw/zinc/05/47/37/1041054737.db2.gz KCESVEXGGWCFCN-UHFFFAOYSA-N 2 1 335.879 4.159 20 0 EIADMP C(NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436299354 1041066367 /nfs/dbraw/zinc/06/63/67/1041066367.db2.gz JTPIIKIQTKGQJX-JOCHJYFZSA-N 2 1 347.591 4.170 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CC[C@H]2CCCC[N@@H+]2C)ccc1OC(C)C ZINC000538154820 1041096305 /nfs/dbraw/zinc/09/63/05/1041096305.db2.gz MTNAIKQHBRTUQQ-SJLPKXTDSA-N 2 1 334.504 4.007 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CC[C@H]2CCCC[N@H+]2C)ccc1OC(C)C ZINC000538154820 1041096320 /nfs/dbraw/zinc/09/63/20/1041096320.db2.gz MTNAIKQHBRTUQQ-SJLPKXTDSA-N 2 1 334.504 4.007 20 0 EIADMP Cc1ccc(SC2(C[NH2+][C@@H]3CC[N@H+](C)C[C@@H]3C)CCCC2)cc1 ZINC000484308116 1041205621 /nfs/dbraw/zinc/20/56/21/1041205621.db2.gz LYLMDENCGWLWEA-PKOBYXMFSA-N 2 1 332.557 4.330 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000540170830 1041214378 /nfs/dbraw/zinc/21/43/78/1041214378.db2.gz PQQFQAZQSDWNND-OTWHNJEPSA-N 2 1 348.531 4.015 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(OCC(C)C)cc1 ZINC000540170154 1041214918 /nfs/dbraw/zinc/21/49/18/1041214918.db2.gz ZBLONICDPGCQLL-SJORKVTESA-N 2 1 329.488 4.213 20 0 EIADMP c1cc(-c2ccccc2)sc1C[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000414884203 1041227424 /nfs/dbraw/zinc/22/74/24/1041227424.db2.gz UUCYMSXMOHHWHW-UHFFFAOYSA-N 2 1 337.492 4.080 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000667663586 1041227498 /nfs/dbraw/zinc/22/74/98/1041227498.db2.gz QSOQHEPXODHSDN-GOSISDBHSA-N 2 1 341.524 4.036 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1cccc(O)c1 ZINC000194852051 1041232338 /nfs/dbraw/zinc/23/23/38/1041232338.db2.gz OSRRLZCQGGDWCB-ROUUACIJSA-N 2 1 338.495 4.475 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)C[C@H]1C ZINC000667664402 1041234576 /nfs/dbraw/zinc/23/45/76/1041234576.db2.gz KDPCUOVIJUOZTH-DNVCBOLYSA-N 2 1 343.540 4.423 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)C[C@H]1C ZINC000667664402 1041234594 /nfs/dbraw/zinc/23/45/94/1041234594.db2.gz KDPCUOVIJUOZTH-DNVCBOLYSA-N 2 1 343.540 4.423 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3scnc3C)cc2)C[C@H]1C ZINC000667664402 1041234609 /nfs/dbraw/zinc/23/46/09/1041234609.db2.gz KDPCUOVIJUOZTH-DNVCBOLYSA-N 2 1 343.540 4.423 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(-c3scnc3C)cc2)C[C@H]1C ZINC000667664402 1041234628 /nfs/dbraw/zinc/23/46/28/1041234628.db2.gz KDPCUOVIJUOZTH-DNVCBOLYSA-N 2 1 343.540 4.423 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1cc(Br)ccc1F ZINC000484464512 1041255046 /nfs/dbraw/zinc/25/50/46/1041255046.db2.gz DUJFLMUTKXAJPU-FPMFFAJLSA-N 2 1 343.284 4.112 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cc(F)ccc1F ZINC000484471969 1041266468 /nfs/dbraw/zinc/26/64/68/1041266468.db2.gz JAVFSMHULNLQSC-IIBYNOLFSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cccc(OCC3CCCCC3)c2)CC[N@H+]1C ZINC000538411211 1041329872 /nfs/dbraw/zinc/32/98/72/1041329872.db2.gz XUYZHNNVBKUPNU-FXAWDEMLSA-N 2 1 330.516 4.218 20 0 EIADMP FC(F)(F)c1cc(Cl)ccc1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168358835 1041333921 /nfs/dbraw/zinc/33/39/21/1041333921.db2.gz VVZXSPNBCAUQII-UHFFFAOYSA-N 2 1 346.824 4.323 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cc(F)cc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463114932 1041342926 /nfs/dbraw/zinc/34/29/26/1041342926.db2.gz IBNORDXGCPXBPM-IERDGZPVSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cc(F)cc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463114932 1041342941 /nfs/dbraw/zinc/34/29/41/1041342941.db2.gz IBNORDXGCPXBPM-IERDGZPVSA-N 2 1 344.449 4.150 20 0 EIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1cncc(C(F)(F)F)c1 ZINC000463126808 1041350817 /nfs/dbraw/zinc/35/08/17/1041350817.db2.gz LOSWHICVPHTANZ-DOTOQJQBSA-N 2 1 343.437 4.091 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000538445500 1041350851 /nfs/dbraw/zinc/35/08/51/1041350851.db2.gz GYRACTDDELWKEB-UHFFFAOYSA-N 2 1 344.405 4.109 20 0 EIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463152754 1041385542 /nfs/dbraw/zinc/38/55/42/1041385542.db2.gz SWUVDJHJEMRNKB-WZONZLPQSA-N 2 1 334.507 4.217 20 0 EIADMP Clc1ccccc1[C@H]1CCC[C@H]1[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000414888149 1041386191 /nfs/dbraw/zinc/38/61/91/1041386191.db2.gz XRNHORPVUASYMM-UYAOXDASSA-N 2 1 343.902 4.141 20 0 EIADMP Clc1ccccc1[C@@H]1CCC[C@H]1[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000414888137 1041386488 /nfs/dbraw/zinc/38/64/88/1041386488.db2.gz XRNHORPVUASYMM-AZUAARDMSA-N 2 1 343.902 4.141 20 0 EIADMP CCS[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000463189492 1041405933 /nfs/dbraw/zinc/40/59/33/1041405933.db2.gz AKVUGFSKCALAPQ-LEWJYISDSA-N 2 1 346.584 4.347 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)COC2 ZINC000480612953 1041423359 /nfs/dbraw/zinc/42/33/59/1041423359.db2.gz RPJSHZXXKGXWNW-FGTMMUONSA-N 2 1 330.516 4.126 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904337676 1041430730 /nfs/dbraw/zinc/43/07/30/1041430730.db2.gz DQJXSNHXMJNNQU-INMHGKMJSA-N 2 1 329.513 4.157 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000480629483 1041432906 /nfs/dbraw/zinc/43/29/06/1041432906.db2.gz DVGRKGHDZNNMQG-CVEARBPZSA-N 2 1 340.458 4.451 20 0 EIADMP Clc1ccc([C@H]2CCC[C@H]2[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000414889623 1041433739 /nfs/dbraw/zinc/43/37/39/1041433739.db2.gz YWPSAXDATSBGET-WOJBJXKFSA-N 2 1 343.902 4.141 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccccc1OC(F)F ZINC000480618628 1041435795 /nfs/dbraw/zinc/43/57/95/1041435795.db2.gz TZBGZKUIYRRMAZ-JKSUJKDBSA-N 2 1 340.458 4.451 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(-n2cccn2)cc1 ZINC000480631815 1041445523 /nfs/dbraw/zinc/44/55/23/1041445523.db2.gz QXAXBFPIROSAGF-RTBURBONSA-N 2 1 340.515 4.178 20 0 EIADMP Fc1ccc(CC[NH+]2CCC(Nc3cccc4cc[nH+]cc43)CC2)cc1 ZINC000538629437 1041461095 /nfs/dbraw/zinc/46/10/95/1041461095.db2.gz UIYLPOAFJJDDTR-UHFFFAOYSA-N 2 1 349.453 4.493 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCCC2CCOCC2)CC1 ZINC000463284748 1041474181 /nfs/dbraw/zinc/47/41/81/1041474181.db2.gz WDOGCXQZLWLNJU-LJQANCHMSA-N 2 1 336.564 4.170 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)C[C@@H]1C ZINC000538718695 1041487368 /nfs/dbraw/zinc/48/73/68/1041487368.db2.gz IGLRUKDKEUFGHL-OXJNMPFZSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc3cc(OC)ccc3c2)C[C@@H]1C ZINC000538718695 1041487372 /nfs/dbraw/zinc/48/73/72/1041487372.db2.gz IGLRUKDKEUFGHL-OXJNMPFZSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc3cc(OC)ccc3c2)C[C@@H]1C ZINC000538718695 1041487374 /nfs/dbraw/zinc/48/73/74/1041487374.db2.gz IGLRUKDKEUFGHL-OXJNMPFZSA-N 2 1 326.484 4.153 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000538750379 1041522644 /nfs/dbraw/zinc/52/26/44/1041522644.db2.gz WUVMTEXQOYQFJS-HNNXBMFYSA-N 2 1 332.875 4.374 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000538750379 1041522654 /nfs/dbraw/zinc/52/26/54/1041522654.db2.gz WUVMTEXQOYQFJS-HNNXBMFYSA-N 2 1 332.875 4.374 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000538750379 1041522669 /nfs/dbraw/zinc/52/26/69/1041522669.db2.gz WUVMTEXQOYQFJS-HNNXBMFYSA-N 2 1 332.875 4.374 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000538750379 1041522678 /nfs/dbraw/zinc/52/26/78/1041522678.db2.gz WUVMTEXQOYQFJS-HNNXBMFYSA-N 2 1 332.875 4.374 20 0 EIADMP COc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c2ccccc12 ZINC000538751050 1041526374 /nfs/dbraw/zinc/52/63/74/1041526374.db2.gz MZVVMGCGSREMSA-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c2ccccc12 ZINC000538751050 1041526390 /nfs/dbraw/zinc/52/63/90/1041526390.db2.gz MZVVMGCGSREMSA-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c2ccccc12 ZINC000538751050 1041526400 /nfs/dbraw/zinc/52/64/00/1041526400.db2.gz MZVVMGCGSREMSA-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP c1csc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000538798677 1041539772 /nfs/dbraw/zinc/53/97/72/1041539772.db2.gz STYLXVGJAHAIQX-AZUAARDMSA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000538798677 1041539773 /nfs/dbraw/zinc/53/97/73/1041539773.db2.gz STYLXVGJAHAIQX-AZUAARDMSA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)c1 ZINC000538798677 1041539778 /nfs/dbraw/zinc/53/97/78/1041539778.db2.gz STYLXVGJAHAIQX-AZUAARDMSA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000538798677 1041539781 /nfs/dbraw/zinc/53/97/81/1041539781.db2.gz STYLXVGJAHAIQX-AZUAARDMSA-N 2 1 326.509 4.235 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1 ZINC000540606583 1041559925 /nfs/dbraw/zinc/55/99/25/1041559925.db2.gz LWOYDULCWRLGHY-OAQYLSRUSA-N 2 1 340.898 4.475 20 0 EIADMP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000540708397 1041608078 /nfs/dbraw/zinc/60/80/78/1041608078.db2.gz WMIAPMCCSXQCHM-LMQGHGSNSA-N 2 1 330.516 4.182 20 0 EIADMP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000540708397 1041608079 /nfs/dbraw/zinc/60/80/79/1041608079.db2.gz WMIAPMCCSXQCHM-LMQGHGSNSA-N 2 1 330.516 4.182 20 0 EIADMP Cn1cncc1CCC[N@@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000516875846 1041791911 /nfs/dbraw/zinc/79/19/11/1041791911.db2.gz YCCZXVRLAXMLSS-UHFFFAOYSA-N 2 1 349.400 4.161 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000516875846 1041791917 /nfs/dbraw/zinc/79/19/17/1041791917.db2.gz YCCZXVRLAXMLSS-UHFFFAOYSA-N 2 1 349.400 4.161 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000516875846 1041791924 /nfs/dbraw/zinc/79/19/24/1041791924.db2.gz YCCZXVRLAXMLSS-UHFFFAOYSA-N 2 1 349.400 4.161 20 0 EIADMP CC[C@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)CC(F)(F)F ZINC000402556494 1041853035 /nfs/dbraw/zinc/85/30/35/1041853035.db2.gz JIXLBDAKHXLYFB-HNNXBMFYSA-N 2 1 328.422 4.219 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]Cc3ccc4[nH]ccc4c3)C2)c1 ZINC000517172218 1041889931 /nfs/dbraw/zinc/88/99/31/1041889931.db2.gz FOFYHLBUHGKCMH-QGZVFWFLSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]Cc3ccc4[nH]ccc4c3)C2)c1 ZINC000517172218 1041889935 /nfs/dbraw/zinc/88/99/35/1041889935.db2.gz FOFYHLBUHGKCMH-QGZVFWFLSA-N 2 1 339.508 4.231 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2ccco2)c2ccccc2)C1 ZINC000541549262 1042006963 /nfs/dbraw/zinc/00/69/63/1042006963.db2.gz PWOUUFIZYRXYQX-WIYYLYMNSA-N 2 1 326.484 4.471 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)CC(F)(F)F ZINC000402771432 1042029247 /nfs/dbraw/zinc/02/92/47/1042029247.db2.gz LGRWOEMYMWNVDE-ZMSDIMECSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)CC(F)(F)F ZINC000402771432 1042029253 /nfs/dbraw/zinc/02/92/53/1042029253.db2.gz LGRWOEMYMWNVDE-ZMSDIMECSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@@H](NCc1cccc(OC(C)(C)C)n1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603188 1042039117 /nfs/dbraw/zinc/03/91/17/1042039117.db2.gz ORGLHWFQCXOBAK-SJORKVTESA-N 2 1 345.531 4.002 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541603188 1042039118 /nfs/dbraw/zinc/03/91/18/1042039118.db2.gz ORGLHWFQCXOBAK-SJORKVTESA-N 2 1 345.531 4.002 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603188 1042039123 /nfs/dbraw/zinc/03/91/23/1042039123.db2.gz ORGLHWFQCXOBAK-SJORKVTESA-N 2 1 345.531 4.002 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438094683 1042043240 /nfs/dbraw/zinc/04/32/40/1042043240.db2.gz OBVLVGAIPKHDMW-ILWGZMRPSA-N 2 1 326.528 4.161 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438094683 1042043245 /nfs/dbraw/zinc/04/32/45/1042043245.db2.gz OBVLVGAIPKHDMW-ILWGZMRPSA-N 2 1 326.528 4.161 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438094683 1042043251 /nfs/dbraw/zinc/04/32/51/1042043251.db2.gz OBVLVGAIPKHDMW-ILWGZMRPSA-N 2 1 326.528 4.161 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CC[C@](C)(c4ccccc4)C3)CC2)[nH+]c1 ZINC000438194489 1042084473 /nfs/dbraw/zinc/08/44/73/1042084473.db2.gz ZQUBKCZUVCAHSK-GGAORHGYSA-N 2 1 349.522 4.459 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000464782619 1042161709 /nfs/dbraw/zinc/16/17/09/1042161709.db2.gz YTFUOVJONGUGBC-GJZGRUSLSA-N 2 1 328.422 4.430 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000464782619 1042161711 /nfs/dbraw/zinc/16/17/11/1042161711.db2.gz YTFUOVJONGUGBC-GJZGRUSLSA-N 2 1 328.422 4.430 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464828954 1042186833 /nfs/dbraw/zinc/18/68/33/1042186833.db2.gz FDFZHJOKSBMKAG-FUHWJXTLSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464828954 1042186838 /nfs/dbraw/zinc/18/68/38/1042186838.db2.gz FDFZHJOKSBMKAG-FUHWJXTLSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464828954 1042186844 /nfs/dbraw/zinc/18/68/44/1042186844.db2.gz FDFZHJOKSBMKAG-FUHWJXTLSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464828954 1042186848 /nfs/dbraw/zinc/18/68/48/1042186848.db2.gz FDFZHJOKSBMKAG-FUHWJXTLSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCOc2ccc(F)cc2)C1 ZINC000303603352 1042484130 /nfs/dbraw/zinc/48/41/30/1042484130.db2.gz NYEWPCQBRHPXPM-RBUKOAKNSA-N 2 1 348.506 4.181 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCOc2ccc(F)cc2)C1 ZINC000303603352 1042484134 /nfs/dbraw/zinc/48/41/34/1042484134.db2.gz NYEWPCQBRHPXPM-RBUKOAKNSA-N 2 1 348.506 4.181 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCOc2ccc(F)cc2)C1 ZINC000303603352 1042484137 /nfs/dbraw/zinc/48/41/37/1042484137.db2.gz NYEWPCQBRHPXPM-RBUKOAKNSA-N 2 1 348.506 4.181 20 0 EIADMP CC[N@@H+](CCNc1cc[nH+]c2cc(F)ccc12)CCC(F)(F)F ZINC000491831249 1042504686 /nfs/dbraw/zinc/50/46/86/1042504686.db2.gz HZHHJNYFWFAVBE-UHFFFAOYSA-N 2 1 329.341 4.060 20 0 EIADMP CCOc1ccc([C@H](CC)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1OCC ZINC000295954678 1042541332 /nfs/dbraw/zinc/54/13/32/1042541332.db2.gz MMGJRMGBXOFYGU-IPQPSQTFSA-N 2 1 346.515 4.150 20 0 EIADMP FC1(F)CC(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000518977307 1042779674 /nfs/dbraw/zinc/77/96/74/1042779674.db2.gz KBMHJCQGRPQFKM-GOSISDBHSA-N 2 1 334.454 4.209 20 0 EIADMP FC1(F)CC(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000518977307 1042779685 /nfs/dbraw/zinc/77/96/85/1042779685.db2.gz KBMHJCQGRPQFKM-GOSISDBHSA-N 2 1 334.454 4.209 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)ccc1OCC(C)C ZINC000298230016 1042800591 /nfs/dbraw/zinc/80/05/91/1042800591.db2.gz BGAFIWPSANPVLI-MRXNPFEDSA-N 2 1 346.515 4.007 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000310067875 1042827298 /nfs/dbraw/zinc/82/72/98/1042827298.db2.gz CCUIKCVOFUJRII-RDJZCZTQSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000310067875 1042827299 /nfs/dbraw/zinc/82/72/99/1042827299.db2.gz CCUIKCVOFUJRII-RDJZCZTQSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1F ZINC000310093549 1042828221 /nfs/dbraw/zinc/82/82/21/1042828221.db2.gz SWFBCCOMKFVDSG-DOTOQJQBSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)ccc1F ZINC000310093549 1042828223 /nfs/dbraw/zinc/82/82/23/1042828223.db2.gz SWFBCCOMKFVDSG-DOTOQJQBSA-N 2 1 330.422 4.138 20 0 EIADMP Cc1ccc(F)c(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310235035 1042832034 /nfs/dbraw/zinc/83/20/34/1042832034.db2.gz KOKHXRXOVUOFPH-MJGOQNOKSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1ccc(F)c(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310235035 1042832037 /nfs/dbraw/zinc/83/20/37/1042832037.db2.gz KOKHXRXOVUOFPH-MJGOQNOKSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3ccccc3Cl)CC2)[nH+]1 ZINC000177347600 1042835115 /nfs/dbraw/zinc/83/51/15/1042835115.db2.gz NYSDTVIXJAMUEE-HNNXBMFYSA-N 2 1 329.875 4.363 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3ccccc3Cl)CC2)[nH+]c1 ZINC000177367932 1042836150 /nfs/dbraw/zinc/83/61/50/1042836150.db2.gz OXWQKXYHUPSCJV-HNNXBMFYSA-N 2 1 329.875 4.363 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310473095 1042837903 /nfs/dbraw/zinc/83/79/03/1042837903.db2.gz BXUBODHVCUMBPF-QKLQHJQFSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]C2CC(OC(C)(C)C)C2)CC1 ZINC000493173025 1042838019 /nfs/dbraw/zinc/83/80/19/1042838019.db2.gz BQTDFUDABBOIFJ-PBPGXSGUSA-N 2 1 330.516 4.148 20 0 EIADMP c1ccc(COc2ccccc2C[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000311057169 1042851677 /nfs/dbraw/zinc/85/16/77/1042851677.db2.gz RRNXHBZDVFXUPR-UHFFFAOYSA-N 2 1 338.495 4.231 20 0 EIADMP Cc1ccsc1[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000177969242 1042855532 /nfs/dbraw/zinc/85/55/32/1042855532.db2.gz UDRFHPYKEYSSFJ-KRWDZBQOSA-N 2 1 328.525 4.414 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]C2CC(OC(C)(C)C)C2)[C@H]1c1cccs1 ZINC000493305923 1042890838 /nfs/dbraw/zinc/89/08/38/1042890838.db2.gz QTJXGFGEHCOQLP-USSHROBNSA-N 2 1 336.545 4.067 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CC(OC(C)(C)C)C2)[C@H]1c1cccs1 ZINC000493305923 1042890842 /nfs/dbraw/zinc/89/08/42/1042890842.db2.gz QTJXGFGEHCOQLP-USSHROBNSA-N 2 1 336.545 4.067 20 0 EIADMP COc1ccc([C@H]([NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)c2ccccc2)cc1 ZINC000493277235 1042891178 /nfs/dbraw/zinc/89/11/78/1042891178.db2.gz PQZVAEDXJRBGLU-TUNNFDKTSA-N 2 1 338.495 4.247 20 0 EIADMP c1cc(C[NH+]2CCCCC2)ccc1C[N@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000520575618 1042899611 /nfs/dbraw/zinc/89/96/11/1042899611.db2.gz WNIPTQWPYKYQRX-FCHUYYIVSA-N 2 1 342.527 4.064 20 0 EIADMP CC(C)Oc1ccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1Cl ZINC000493367853 1042900912 /nfs/dbraw/zinc/90/09/12/1042900912.db2.gz WBMFYIWTMYBVTO-WMZOPIPTSA-N 2 1 336.907 4.043 20 0 EIADMP COC[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(Cl)cc1 ZINC000493884680 1042971195 /nfs/dbraw/zinc/97/11/95/1042971195.db2.gz ZNNQGCITJNPICD-LPHOPBHVSA-N 2 1 338.923 4.272 20 0 EIADMP Cc1nc2ccc(C[NH2+]C3CC[NH+](C4CCCC4)CC3)cc2s1 ZINC000494087502 1043016556 /nfs/dbraw/zinc/01/65/56/1043016556.db2.gz GWNWBDNZNIZNFU-UHFFFAOYSA-N 2 1 329.513 4.101 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+]CCCCn1cc[nH+]c1C ZINC000183062400 1043037222 /nfs/dbraw/zinc/03/72/22/1043037222.db2.gz VVQCUWIMQFNPFX-UHFFFAOYSA-N 2 1 349.478 4.437 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000183192170 1043039470 /nfs/dbraw/zinc/03/94/70/1043039470.db2.gz XWFVSDGZTDXWMT-DOADOZAASA-N 2 1 344.543 4.430 20 0 EIADMP C[C@@H]([NH2+]Cc1ccnc2ccccc12)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000388842125 1043061936 /nfs/dbraw/zinc/06/19/36/1043061936.db2.gz YFOLSSDRRPBLHW-NQIIRXRSSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCC2(O)CCCCC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168008559 1043073221 /nfs/dbraw/zinc/07/32/21/1043073221.db2.gz FMBLGEWCNWKJBB-CEQLMSFQSA-N 2 1 344.543 4.103 20 0 EIADMP CN1CCC([N@@H+](C2CCCC2)[C@@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168743178 1043085421 /nfs/dbraw/zinc/08/54/21/1043085421.db2.gz JOYOKHJDBFDYMH-GOSISDBHSA-N 2 1 332.919 4.146 20 0 EIADMP Fc1ccc(F)c2c1CC[C@@H]2[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000507820774 1043100931 /nfs/dbraw/zinc/10/09/31/1043100931.db2.gz INIRZIOKHPFJML-FQEVSTJZSA-N 2 1 342.433 4.338 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)C1CCSCC1 ZINC000187122148 1043328845 /nfs/dbraw/zinc/32/88/45/1043328845.db2.gz GWUCORRZDFNTMC-JKSUJKDBSA-N 2 1 338.586 4.081 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCSCC1 ZINC000187122148 1043328852 /nfs/dbraw/zinc/32/88/52/1043328852.db2.gz GWUCORRZDFNTMC-JKSUJKDBSA-N 2 1 338.586 4.081 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2cccnc2c1 ZINC000674067648 1043386939 /nfs/dbraw/zinc/38/69/39/1043386939.db2.gz MRFXEFYUGRPDEB-XMSQKQJNSA-N 2 1 345.490 4.235 20 0 EIADMP CCCC[N@@H+](C)CCCNC1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168012146 1043415748 /nfs/dbraw/zinc/41/57/48/1043415748.db2.gz WWWWPYMMZRNMTK-WOJBJXKFSA-N 2 1 345.575 4.140 20 0 EIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+]C1CC(c2ccc(Br)cc2)C1 ZINC000312490038 1043474523 /nfs/dbraw/zinc/47/45/23/1043474523.db2.gz CMWOCQOQJSDTFQ-BZOOQXSSSA-N 2 1 339.321 4.013 20 0 EIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+]C1CC(c2ccc(Br)cc2)C1 ZINC000312490038 1043474527 /nfs/dbraw/zinc/47/45/27/1043474527.db2.gz CMWOCQOQJSDTFQ-BZOOQXSSSA-N 2 1 339.321 4.013 20 0 EIADMP C(=C\C[N@H+]1CCC[C@@H]1c1ccccn1)\C[NH+]1CCC[C@@H]1c1ccccn1 ZINC000674371432 1043646053 /nfs/dbraw/zinc/64/60/53/1043646053.db2.gz QRCNTDULJDXPFL-UQMQSGJDSA-N 2 1 348.494 4.007 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH2+]C(C)(C)Cc1ccc(C(F)(F)F)cc1 ZINC000442761783 1043825405 /nfs/dbraw/zinc/82/54/05/1043825405.db2.gz CULNVAGOPGLQJR-MRXNPFEDSA-N 2 1 328.422 4.100 20 0 EIADMP CC1(C)CN(Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cnc(Cl)s1 ZINC000282522562 1043861438 /nfs/dbraw/zinc/86/14/38/1043861438.db2.gz PRAWIGGERCUOQT-INIZCTEOSA-N 2 1 349.931 4.187 20 0 EIADMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000442917288 1043889168 /nfs/dbraw/zinc/88/91/68/1043889168.db2.gz DCWFTKXTXGAQOU-CYBMUJFWSA-N 2 1 335.904 4.024 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)cc1 ZINC000658268385 1044204603 /nfs/dbraw/zinc/20/46/03/1044204603.db2.gz MUVNPIXAMVAGPP-OAHLLOKOSA-N 2 1 349.482 4.033 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cccc(O)c2Cl)cc1 ZINC000393353435 1044258413 /nfs/dbraw/zinc/25/84/13/1044258413.db2.gz LUODAORBYJLOAO-UHFFFAOYSA-N 2 1 332.875 4.177 20 0 EIADMP C[C@H]1CC([NH2+]C2(c3ccncc3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168017998 1044320409 /nfs/dbraw/zinc/32/04/09/1044320409.db2.gz YJUOOQRWEDLDMA-ROUUACIJSA-N 2 1 335.495 4.102 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCCNc2ccccc2)cc1 ZINC000347955411 1044340486 /nfs/dbraw/zinc/34/04/86/1044340486.db2.gz MNFDMZFANHTKFJ-KRWDZBQOSA-N 2 1 334.467 4.334 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1Cc1ccccc1Cl ZINC000348068034 1044373303 /nfs/dbraw/zinc/37/33/03/1044373303.db2.gz FVWSPHABLOOSCC-GOSISDBHSA-N 2 1 331.891 4.332 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1Cc1ccccc1Cl ZINC000348068034 1044373333 /nfs/dbraw/zinc/37/33/33/1044373333.db2.gz FVWSPHABLOOSCC-GOSISDBHSA-N 2 1 331.891 4.332 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](COc1c(C)cccc1C)C(C)(C)C ZINC001168767048 1044398737 /nfs/dbraw/zinc/39/87/37/1044398737.db2.gz XIDZJYNENLESAZ-LJQANCHMSA-N 2 1 343.515 4.282 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](CCc3ccncc3)CC1)CCC2 ZINC000166427618 1044459710 /nfs/dbraw/zinc/45/97/10/1044459710.db2.gz MVZRMACXLPCYGK-HSZRJFAPSA-N 2 1 349.522 4.064 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)C1 ZINC000675728293 1044461866 /nfs/dbraw/zinc/46/18/66/1044461866.db2.gz FVLGTTIIQYEYGU-OXQOHEQNSA-N 2 1 325.500 4.255 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccnc(Oc3ccccc3)c2)CC1 ZINC000675742551 1044471283 /nfs/dbraw/zinc/47/12/83/1044471283.db2.gz AZJJJTDTPPBAFO-UHFFFAOYSA-N 2 1 339.483 4.226 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000675790079 1044502381 /nfs/dbraw/zinc/50/23/81/1044502381.db2.gz RCMADJNBHUDIDA-LAUBAEHRSA-N 2 1 333.479 4.168 20 0 EIADMP CC1(C)CC[C@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)OC1 ZINC000713561105 1044513507 /nfs/dbraw/zinc/51/35/07/1044513507.db2.gz POMRNYHQUDNTSC-WOJBJXKFSA-N 2 1 344.543 4.082 20 0 EIADMP CC1(C)CC[C@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)OC1 ZINC000713561105 1044513527 /nfs/dbraw/zinc/51/35/27/1044513527.db2.gz POMRNYHQUDNTSC-WOJBJXKFSA-N 2 1 344.543 4.082 20 0 EIADMP CC1(C)CC[C@@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)OC1 ZINC000713561102 1044513707 /nfs/dbraw/zinc/51/37/07/1044513707.db2.gz POMRNYHQUDNTSC-VQTJNVASSA-N 2 1 344.543 4.082 20 0 EIADMP CC1(C)CC[C@@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)OC1 ZINC000713561102 1044513721 /nfs/dbraw/zinc/51/37/21/1044513721.db2.gz POMRNYHQUDNTSC-VQTJNVASSA-N 2 1 344.543 4.082 20 0 EIADMP CC1(C)CC[C@@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)OC1 ZINC000713561095 1044514308 /nfs/dbraw/zinc/51/43/08/1044514308.db2.gz POMRNYHQUDNTSC-PMACEKPBSA-N 2 1 344.543 4.082 20 0 EIADMP CC1(C)CC[C@@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)OC1 ZINC000713561095 1044514324 /nfs/dbraw/zinc/51/43/24/1044514324.db2.gz POMRNYHQUDNTSC-PMACEKPBSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1ccccc1[C@H]([NH2+]CCc1c[nH+]cn1C)[C@@H]1CCC[C@@H](C)C1 ZINC001168724421 1044599059 /nfs/dbraw/zinc/59/90/59/1044599059.db2.gz WCBBJAYPNAXICG-HGHGUNKESA-N 2 1 325.500 4.428 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000543461463 1044650927 /nfs/dbraw/zinc/65/09/27/1044650927.db2.gz GYLWTVOGIWUTRG-OALUTQOASA-N 2 1 330.516 4.007 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]CCC[N@H+]3CCCC[C@H]3C)s2)cc1 ZINC000522382733 1044689599 /nfs/dbraw/zinc/68/95/99/1044689599.db2.gz LIBYOYOREWSGNV-QGZVFWFLSA-N 2 1 343.540 4.473 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]CCC[N@@H+]3CCCC[C@H]3C)s2)cc1 ZINC000522382733 1044689609 /nfs/dbraw/zinc/68/96/09/1044689609.db2.gz LIBYOYOREWSGNV-QGZVFWFLSA-N 2 1 343.540 4.473 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2nc(C)sc2C)c1 ZINC000676488095 1044766857 /nfs/dbraw/zinc/76/68/57/1044766857.db2.gz BBSZZUVREHKMSY-CQSZACIVSA-N 2 1 331.529 4.453 20 0 EIADMP CC1(C[NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532368 1044800683 /nfs/dbraw/zinc/80/06/83/1044800683.db2.gz OAUAXHSXRHJXKP-SJLPKXTDSA-N 2 1 334.454 4.380 20 0 EIADMP CC1(C[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532368 1044800687 /nfs/dbraw/zinc/80/06/87/1044800687.db2.gz OAUAXHSXRHJXKP-SJLPKXTDSA-N 2 1 334.454 4.380 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)[C@H]1CCCOC1 ZINC000895663399 1044843086 /nfs/dbraw/zinc/84/30/86/1044843086.db2.gz KPSUGSYYLBWXJN-YUVXSKOASA-N 2 1 342.527 4.149 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)[C@H]1CCCOC1 ZINC000895663399 1044843088 /nfs/dbraw/zinc/84/30/88/1044843088.db2.gz KPSUGSYYLBWXJN-YUVXSKOASA-N 2 1 342.527 4.149 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCCc1ccccc1Cl ZINC000429263518 1044860632 /nfs/dbraw/zinc/86/06/32/1044860632.db2.gz XWLGORSCTVPWPZ-UHFFFAOYSA-N 2 1 333.907 4.444 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCCc1ccccc1Cl ZINC000429263518 1044860634 /nfs/dbraw/zinc/86/06/34/1044860634.db2.gz XWLGORSCTVPWPZ-UHFFFAOYSA-N 2 1 333.907 4.444 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836940 1044981872 /nfs/dbraw/zinc/98/18/72/1044981872.db2.gz FIBCOBMCMXYNCX-NZSAHSFTSA-N 2 1 330.541 4.057 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836940 1044981882 /nfs/dbraw/zinc/98/18/82/1044981882.db2.gz FIBCOBMCMXYNCX-NZSAHSFTSA-N 2 1 330.541 4.057 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1cccc(Cl)c1 ZINC000673627873 1045047713 /nfs/dbraw/zinc/04/77/13/1045047713.db2.gz WEBYHMHCIMXESU-RBUKOAKNSA-N 2 1 336.907 4.024 20 0 EIADMP CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H](C[C@H]([NH3+])C3CCCC3)C2)co1 ZINC000923421341 1045097942 /nfs/dbraw/zinc/09/79/42/1045097942.db2.gz NBZDUSZAQPDADL-YJBOKZPZSA-N 2 1 333.520 4.092 20 0 EIADMP CC(C)(C)c1nc(C[N@H+]2CCC[C@@H](C[C@H]([NH3+])C3CCCC3)C2)co1 ZINC000923421341 1045097958 /nfs/dbraw/zinc/09/79/58/1045097958.db2.gz NBZDUSZAQPDADL-YJBOKZPZSA-N 2 1 333.520 4.092 20 0 EIADMP c1c2ccccc2oc1C[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000394047270 1045143853 /nfs/dbraw/zinc/14/38/53/1045143853.db2.gz JYYUGAVRDYJDBG-LJQANCHMSA-N 2 1 334.463 4.435 20 0 EIADMP c1c2ccccc2oc1C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000394047270 1045143857 /nfs/dbraw/zinc/14/38/57/1045143857.db2.gz JYYUGAVRDYJDBG-LJQANCHMSA-N 2 1 334.463 4.435 20 0 EIADMP C[C@H]([NH2+]Cc1scnc1C1CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487567675 1045227545 /nfs/dbraw/zinc/22/75/45/1045227545.db2.gz YJPUMVZNOLODDQ-YJBOKZPZSA-N 2 1 341.524 4.021 20 0 EIADMP C[C@H]([NH2+]Cc1scnc1C1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487567675 1045227559 /nfs/dbraw/zinc/22/75/59/1045227559.db2.gz YJPUMVZNOLODDQ-YJBOKZPZSA-N 2 1 341.524 4.021 20 0 EIADMP CC[N@H+]1CC[C@H](N[C@@H]2CCOc3c(Cl)c(Cl)ccc32)[C@@H](C)C1 ZINC000766259415 1045251435 /nfs/dbraw/zinc/25/14/35/1045251435.db2.gz YLSAAUYOGXAUSR-TUKIKUTGSA-N 2 1 343.298 4.137 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](CC)c2ccccc2OC(F)F)CC1 ZINC000161636939 1045302172 /nfs/dbraw/zinc/30/21/72/1045302172.db2.gz QXEOEZHVWXTZMD-INIZCTEOSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1F ZINC000495721982 1045313358 /nfs/dbraw/zinc/31/33/58/1045313358.db2.gz AXHDATKRPAJKMO-HOTGVXAUSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1F ZINC000495721982 1045313367 /nfs/dbraw/zinc/31/33/67/1045313367.db2.gz AXHDATKRPAJKMO-HOTGVXAUSA-N 2 1 332.488 4.450 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000236810704 1045365949 /nfs/dbraw/zinc/36/59/49/1045365949.db2.gz FIXUPTMGBZAYMS-CQSZACIVSA-N 2 1 334.410 4.046 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000236810704 1045365958 /nfs/dbraw/zinc/36/59/58/1045365958.db2.gz FIXUPTMGBZAYMS-CQSZACIVSA-N 2 1 334.410 4.046 20 0 EIADMP C[C@H](CC[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000237463495 1045386267 /nfs/dbraw/zinc/38/62/67/1045386267.db2.gz REHDFNYQZCUUTD-IFMALSPDSA-N 2 1 336.523 4.334 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000237557954 1045387789 /nfs/dbraw/zinc/38/77/89/1045387789.db2.gz RSVPVXQMJGCMDK-GOSISDBHSA-N 2 1 349.478 4.196 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000237569955 1045389796 /nfs/dbraw/zinc/38/97/96/1045389796.db2.gz LBUCXXLULATHRN-MAUKXSAKSA-N 2 1 330.422 4.108 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000237569955 1045389802 /nfs/dbraw/zinc/38/98/02/1045389802.db2.gz LBUCXXLULATHRN-MAUKXSAKSA-N 2 1 330.422 4.108 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CCC[C@@H]1C[NH3+] ZINC001206026688 1045712440 /nfs/dbraw/zinc/71/24/40/1045712440.db2.gz TZBDZPMOSDNFDY-ZYHUDNBSSA-N 2 1 335.706 4.454 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(Br)cc2)cc1 ZINC000768169050 1045734377 /nfs/dbraw/zinc/73/43/77/1045734377.db2.gz CVTAWDHVZQLHDV-UHFFFAOYSA-N 2 1 347.300 4.143 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCSc1ccccc1 ZINC000397977362 1045819883 /nfs/dbraw/zinc/81/98/83/1045819883.db2.gz KZLAHAZGPLXGSG-RXVVDRJESA-N 2 1 340.536 4.279 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c(C)o1 ZINC000398010506 1045822543 /nfs/dbraw/zinc/82/25/43/1045822543.db2.gz CRNVXILITBIQAG-KUDFPVQQSA-N 2 1 326.484 4.458 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c(C)o1 ZINC000398010506 1045822548 /nfs/dbraw/zinc/82/25/48/1045822548.db2.gz CRNVXILITBIQAG-KUDFPVQQSA-N 2 1 326.484 4.458 20 0 EIADMP CCn1cc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)cn1 ZINC000247015354 1045837906 /nfs/dbraw/zinc/83/79/06/1045837906.db2.gz LMFYQAPROZAPJH-MSOLQXFVSA-N 2 1 340.515 4.128 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3cncc4ccccc43)C2)CC1 ZINC000769149054 1045885134 /nfs/dbraw/zinc/88/51/34/1045885134.db2.gz XYCOKAGSKWFUAH-IBGZPJMESA-N 2 1 337.511 4.179 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3cncc4ccccc43)C2)CC1 ZINC000769149054 1045885138 /nfs/dbraw/zinc/88/51/38/1045885138.db2.gz XYCOKAGSKWFUAH-IBGZPJMESA-N 2 1 337.511 4.179 20 0 EIADMP COc1cc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)ccc1SC ZINC000769192013 1045885729 /nfs/dbraw/zinc/88/57/29/1045885729.db2.gz FSEQZGFYFVQHBF-UHFFFAOYSA-N 2 1 344.524 4.111 20 0 EIADMP CC[C@H]1C[C@@H]([N@@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170188948 1045919449 /nfs/dbraw/zinc/91/94/49/1045919449.db2.gz ABUPYMWCKAGVFT-TUFLPTIASA-N 2 1 330.516 4.025 20 0 EIADMP CC[C@H]1C[C@@H]([N@@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170194962 1045933424 /nfs/dbraw/zinc/93/34/24/1045933424.db2.gz PHMNLCQJQTZKDF-TUFLPTIASA-N 2 1 330.516 4.025 20 0 EIADMP CC[C@H]1C[C@@H]([N@@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222648 1045950236 /nfs/dbraw/zinc/95/02/36/1045950236.db2.gz OMOUBGBLPIMZCG-NXQKYAITSA-N 2 1 342.527 4.055 20 0 EIADMP CC[C@H]1C[C@@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@H+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222648 1045950254 /nfs/dbraw/zinc/95/02/54/1045950254.db2.gz OMOUBGBLPIMZCG-NXQKYAITSA-N 2 1 342.527 4.055 20 0 EIADMP CC[C@H]1C[C@@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@@H+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222648 1045950260 /nfs/dbraw/zinc/95/02/60/1045950260.db2.gz OMOUBGBLPIMZCG-NXQKYAITSA-N 2 1 342.527 4.055 20 0 EIADMP C[N@@H+](Cc1cncc2ccccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000769403344 1045952346 /nfs/dbraw/zinc/95/23/46/1045952346.db2.gz QPWQICJXPIMIQO-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cncc2ccccc21)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000769403344 1045952375 /nfs/dbraw/zinc/95/23/75/1045952375.db2.gz QPWQICJXPIMIQO-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[N@H+](Cc1cncc2ccccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000769403344 1045952361 /nfs/dbraw/zinc/95/23/61/1045952361.db2.gz QPWQICJXPIMIQO-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cncc2ccccc21)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000769403344 1045952391 /nfs/dbraw/zinc/95/23/91/1045952391.db2.gz QPWQICJXPIMIQO-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000161613197 1046006314 /nfs/dbraw/zinc/00/63/14/1046006314.db2.gz BTFUURMQZUDJHZ-JKIFEVAISA-N 2 1 340.433 4.055 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+](C)CC)c2)cc1 ZINC000124004558 1046211595 /nfs/dbraw/zinc/21/15/95/1046211595.db2.gz NYPNRKVQMARNHS-QGZVFWFLSA-N 2 1 326.484 4.388 20 0 EIADMP CCOc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+](C)CC)c1 ZINC000123984411 1046212183 /nfs/dbraw/zinc/21/21/83/1046212183.db2.gz XSEUFDSINBKSKY-QGZVFWFLSA-N 2 1 326.484 4.388 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](CCCCc2cccc(C(F)(F)F)c2)C1 ZINC000476006466 1046252336 /nfs/dbraw/zinc/25/23/36/1046252336.db2.gz BURJBNOXFDPDCB-KRWDZBQOSA-N 2 1 342.449 4.302 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](CCCCc2cccc(C(F)(F)F)c2)C1 ZINC000476006466 1046252351 /nfs/dbraw/zinc/25/23/51/1046252351.db2.gz BURJBNOXFDPDCB-KRWDZBQOSA-N 2 1 342.449 4.302 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](CCCCc2cccc(C(F)(F)F)c2)C1 ZINC000476006466 1046252371 /nfs/dbraw/zinc/25/23/71/1046252371.db2.gz BURJBNOXFDPDCB-KRWDZBQOSA-N 2 1 342.449 4.302 20 0 EIADMP C[C@H]([NH2+]CCc1c[nH]c2ccccc12)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508715206 1046360063 /nfs/dbraw/zinc/36/00/63/1046360063.db2.gz XHNHYORWEGNHNP-GHTZIAJQSA-N 2 1 347.506 4.211 20 0 EIADMP C[NH+]1C(C)(C)CC(Nc2ccc([C@@H]3CCCC[N@@H+]3C)cn2)CC1(C)C ZINC001170450925 1046496425 /nfs/dbraw/zinc/49/64/25/1046496425.db2.gz OBTBFSKBBBBHEN-SFHVURJKSA-N 2 1 344.547 4.302 20 0 EIADMP C[N@H+]1CC[C@@H](c2ccc(NC3CC(C)(C)[NH+](C)C(C)(C)C3)cc2)C1 ZINC001170453380 1046536631 /nfs/dbraw/zinc/53/66/31/1046536631.db2.gz JSDNZSABXJSJTH-QGZVFWFLSA-N 2 1 329.532 4.169 20 0 EIADMP CC(C)(C[NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000459405896 1046608080 /nfs/dbraw/zinc/60/80/80/1046608080.db2.gz OGZHYGYFLDAECM-UHFFFAOYSA-N 2 1 340.433 4.199 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C(C)(C)C ZINC000459397680 1046614433 /nfs/dbraw/zinc/61/44/33/1046614433.db2.gz SIHFAHRWMHWFOM-INIZCTEOSA-N 2 1 339.405 4.358 20 0 EIADMP CCOc1cc(C[N@H+](C)[C@H]2CCN(C)[C@H](C)C2)ccc1OCC(C)C ZINC000536658657 1046624979 /nfs/dbraw/zinc/62/49/79/1046624979.db2.gz PMXMAAFICKTECU-MJGOQNOKSA-N 2 1 348.531 4.035 20 0 EIADMP CCOc1cc(C[N@@H+](C)[C@H]2CCN(C)[C@H](C)C2)ccc1OCC(C)C ZINC000536658657 1046624995 /nfs/dbraw/zinc/62/49/95/1046624995.db2.gz PMXMAAFICKTECU-MJGOQNOKSA-N 2 1 348.531 4.035 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+]C3CC[NH+](C4CC4)CC3)cc2)cc1 ZINC000459408126 1046628124 /nfs/dbraw/zinc/62/81/24/1046628124.db2.gz IHMKYKJYHZMKME-UHFFFAOYSA-N 2 1 336.479 4.079 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CCN(Cc2ccccc2OC2CCCC2)C1 ZINC000536664515 1046635499 /nfs/dbraw/zinc/63/54/99/1046635499.db2.gz OSWBFBCINSPOKI-SFHVURJKSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2OC2CCCC2)C1 ZINC000536664515 1046635509 /nfs/dbraw/zinc/63/55/09/1046635509.db2.gz OSWBFBCINSPOKI-SFHVURJKSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2OC2CCCC2)C1 ZINC000536664515 1046635524 /nfs/dbraw/zinc/63/55/24/1046635524.db2.gz OSWBFBCINSPOKI-SFHVURJKSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2OC2CCCC2)C1 ZINC000536664515 1046635532 /nfs/dbraw/zinc/63/55/32/1046635532.db2.gz OSWBFBCINSPOKI-SFHVURJKSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2OC2CCCC2)C1 ZINC000536664515 1046635546 /nfs/dbraw/zinc/63/55/46/1046635546.db2.gz OSWBFBCINSPOKI-SFHVURJKSA-N 2 1 330.516 4.172 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCC[C@H](C(F)(F)F)C3)CC2)[nH+]c1 ZINC000127366575 1046658439 /nfs/dbraw/zinc/65/84/39/1046658439.db2.gz MLRQAQXRRXZQTO-HOCLYGCPSA-N 2 1 341.421 4.070 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(OC(F)F)c(Cl)c2)[C@H](C)C1 ZINC000536678536 1046663543 /nfs/dbraw/zinc/66/35/43/1046663543.db2.gz CASQGRBTSJJWQA-DOMZBBRYSA-N 2 1 346.849 4.104 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)[C@H](C)C1 ZINC000536678536 1046663550 /nfs/dbraw/zinc/66/35/50/1046663550.db2.gz CASQGRBTSJJWQA-DOMZBBRYSA-N 2 1 346.849 4.104 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)[C@H](C)C1 ZINC000536678536 1046663553 /nfs/dbraw/zinc/66/35/53/1046663553.db2.gz CASQGRBTSJJWQA-DOMZBBRYSA-N 2 1 346.849 4.104 20 0 EIADMP C[C@H]([NH2+]C1CC(C)(c2ccccc2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000459467893 1046703125 /nfs/dbraw/zinc/70/31/25/1046703125.db2.gz QQUSBCWKZZXLKD-NHUPUQRLSA-N 2 1 326.528 4.349 20 0 EIADMP C[C@H]1C[C@@H](NCc2cc(F)ccc2F)CC[N@H+]1Cc1ccccc1 ZINC000379624358 1046714209 /nfs/dbraw/zinc/71/42/09/1046714209.db2.gz JPDRXTPSILBZSN-KXBFYZLASA-N 2 1 330.422 4.108 20 0 EIADMP CCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379643031 1046737312 /nfs/dbraw/zinc/73/73/12/1046737312.db2.gz ASJQLZYYGUZDMV-GHTZIAJQSA-N 2 1 338.495 4.228 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3c2cccc3O)CC[N@@H+]1Cc1ccccc1 ZINC000379652752 1046745669 /nfs/dbraw/zinc/74/56/69/1046745669.db2.gz XWHZUOBYBCVFGC-HGHGUNKESA-N 2 1 336.479 4.022 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3c2cccc3O)CC[N@H+]1Cc1ccccc1 ZINC000379652752 1046745681 /nfs/dbraw/zinc/74/56/81/1046745681.db2.gz XWHZUOBYBCVFGC-HGHGUNKESA-N 2 1 336.479 4.022 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cnc3ccccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379659211 1046750836 /nfs/dbraw/zinc/75/08/36/1046750836.db2.gz ZCQMMTVUJVWULD-GCJKJVERSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cnc3ccccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379659211 1046750852 /nfs/dbraw/zinc/75/08/52/1046750852.db2.gz ZCQMMTVUJVWULD-GCJKJVERSA-N 2 1 345.490 4.378 20 0 EIADMP CCOc1ccccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379654649 1046754916 /nfs/dbraw/zinc/75/49/16/1046754916.db2.gz JFZDKHAWMFWDKU-GHTZIAJQSA-N 2 1 338.495 4.228 20 0 EIADMP CCOc1ccccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379654649 1046754925 /nfs/dbraw/zinc/75/49/25/1046754925.db2.gz JFZDKHAWMFWDKU-GHTZIAJQSA-N 2 1 338.495 4.228 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3cc4c(s3)CCC4)CC2)[nH+]1 ZINC000128159670 1046773322 /nfs/dbraw/zinc/77/33/22/1046773322.db2.gz LCRJFIQOEHUJFJ-OAHLLOKOSA-N 2 1 341.524 4.260 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000536832778 1046809976 /nfs/dbraw/zinc/80/99/76/1046809976.db2.gz NDZRRNFYLCXKLR-QUCCMNQESA-N 2 1 342.527 4.391 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000536832778 1046809979 /nfs/dbraw/zinc/80/99/79/1046809979.db2.gz NDZRRNFYLCXKLR-QUCCMNQESA-N 2 1 342.527 4.391 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(F)c(F)c(F)c2)C1 ZINC000536838952 1046813675 /nfs/dbraw/zinc/81/36/75/1046813675.db2.gz MVCZNDXVEQTOME-KBPBESRZSA-N 2 1 328.422 4.123 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(F)c(F)c(F)c2)C1 ZINC000536838952 1046813680 /nfs/dbraw/zinc/81/36/80/1046813680.db2.gz MVCZNDXVEQTOME-KBPBESRZSA-N 2 1 328.422 4.123 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000536845207 1046817745 /nfs/dbraw/zinc/81/77/45/1046817745.db2.gz KRPJOJPOCREQLT-PZJWPPBQSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC(C)(C)c1c(Cl)cccc1Cl ZINC000536865826 1046831595 /nfs/dbraw/zinc/83/15/95/1046831595.db2.gz XXYXFRFIGLYFAS-SWLSCSKDSA-N 2 1 329.315 4.201 20 0 EIADMP Cc1cc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)ccc1Oc1cccnc1 ZINC000459726992 1046865617 /nfs/dbraw/zinc/86/56/17/1046865617.db2.gz GWQAAWQSONFIQZ-SFHVURJKSA-N 2 1 339.483 4.004 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2OC)C2CCCC2)C1 ZINC000536959192 1046870497 /nfs/dbraw/zinc/87/04/97/1046870497.db2.gz KUXJAFHGOMGCCV-UWJYYQICSA-N 2 1 330.516 4.248 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000537012672 1046893227 /nfs/dbraw/zinc/89/32/27/1046893227.db2.gz BSTPTBCIEOCUPF-BBTUJRGHSA-N 2 1 337.511 4.348 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000537012672 1046893236 /nfs/dbraw/zinc/89/32/36/1046893236.db2.gz BSTPTBCIEOCUPF-BBTUJRGHSA-N 2 1 337.511 4.348 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)CCS2 ZINC000423186589 1046932536 /nfs/dbraw/zinc/93/25/36/1046932536.db2.gz LBYDBEAFYSOLFQ-QGZVFWFLSA-N 2 1 347.915 4.041 20 0 EIADMP C[NH+]1CCC(C[N@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000788011355 1047079831 /nfs/dbraw/zinc/07/98/31/1047079831.db2.gz FXPWGXGAANVHQF-KRWDZBQOSA-N 2 1 327.299 4.472 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)CC1 ZINC000537303060 1047084850 /nfs/dbraw/zinc/08/48/50/1047084850.db2.gz AYRWSNIBIVMHFT-QHCPKHFHSA-N 2 1 334.507 4.082 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@H]3CCC[N@H+](CC(C)C)C3)oc21 ZINC000537305920 1047088892 /nfs/dbraw/zinc/08/88/92/1047088892.db2.gz CRDOZOLEGWVXMP-DLBZAZTESA-N 2 1 344.499 4.460 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@H]3CCC[N@@H+](CC(C)C)C3)oc21 ZINC000537305920 1047088910 /nfs/dbraw/zinc/08/89/10/1047088910.db2.gz CRDOZOLEGWVXMP-DLBZAZTESA-N 2 1 344.499 4.460 20 0 EIADMP C[NH+]1CCC(C[N@@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)CC1 ZINC000788470982 1047195407 /nfs/dbraw/zinc/19/54/07/1047195407.db2.gz QDPQNCNSXCDBNW-UHFFFAOYSA-N 2 1 326.406 4.012 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)Oc1cccc(F)c1 ZINC000556093675 1047444197 /nfs/dbraw/zinc/44/41/97/1047444197.db2.gz KEXDFFUYKWEUIC-BSIFCXSSSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)Oc1cccc(F)c1 ZINC000556093675 1047444204 /nfs/dbraw/zinc/44/42/04/1047444204.db2.gz KEXDFFUYKWEUIC-BSIFCXSSSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)Oc1cccc(F)c1 ZINC000556093683 1047445059 /nfs/dbraw/zinc/44/50/59/1047445059.db2.gz KEXDFFUYKWEUIC-PBEJRMEISA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)Oc1cccc(F)c1 ZINC000556093683 1047445061 /nfs/dbraw/zinc/44/50/61/1047445061.db2.gz KEXDFFUYKWEUIC-PBEJRMEISA-N 2 1 342.458 4.018 20 0 EIADMP Cc1ccccc1O[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556094121 1047445811 /nfs/dbraw/zinc/44/58/11/1047445811.db2.gz QPZWVOVOCSSWIQ-NRSPTQNISA-N 2 1 338.495 4.187 20 0 EIADMP Cc1ccccc1O[C@H](C)C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556094121 1047445821 /nfs/dbraw/zinc/44/58/21/1047445821.db2.gz QPZWVOVOCSSWIQ-NRSPTQNISA-N 2 1 338.495 4.187 20 0 EIADMP CCOc1cccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000556117627 1047470506 /nfs/dbraw/zinc/47/05/06/1047470506.db2.gz FDVVGCMEOKRENS-IRLDBZIGSA-N 2 1 338.495 4.053 20 0 EIADMP CCOc1cccc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000556117627 1047470510 /nfs/dbraw/zinc/47/05/10/1047470510.db2.gz FDVVGCMEOKRENS-IRLDBZIGSA-N 2 1 338.495 4.053 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+](C)C2CCCCC2)CC[N@H+]1C ZINC000129862240 1047518338 /nfs/dbraw/zinc/51/83/38/1047518338.db2.gz RWYWXPRYSIXQFK-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862240 1047518346 /nfs/dbraw/zinc/51/83/46/1047518346.db2.gz RWYWXPRYSIXQFK-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862240 1047518354 /nfs/dbraw/zinc/51/83/54/1047518354.db2.gz RWYWXPRYSIXQFK-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCN1C ZINC000129862240 1047518369 /nfs/dbraw/zinc/51/83/69/1047518369.db2.gz RWYWXPRYSIXQFK-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCN1C ZINC000129862240 1047518381 /nfs/dbraw/zinc/51/83/81/1047518381.db2.gz RWYWXPRYSIXQFK-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@@H](NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000129862240 1047518395 /nfs/dbraw/zinc/51/83/95/1047518395.db2.gz RWYWXPRYSIXQFK-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@@H](NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@H+]1C ZINC000129862240 1047518403 /nfs/dbraw/zinc/51/84/03/1047518403.db2.gz RWYWXPRYSIXQFK-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@@H](NCc2ccccc2C[N@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862240 1047518415 /nfs/dbraw/zinc/51/84/15/1047518415.db2.gz RWYWXPRYSIXQFK-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@@H](NCc2ccccc2C[N@@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862240 1047518424 /nfs/dbraw/zinc/51/84/24/1047518424.db2.gz RWYWXPRYSIXQFK-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)C[C@H]1c1ccccc1 ZINC000556178410 1047539523 /nfs/dbraw/zinc/53/95/23/1047539523.db2.gz GWLLOFHRLCQYFN-IRLDBZIGSA-N 2 1 333.479 4.136 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)C[C@H]1c1ccccc1 ZINC000556178410 1047539544 /nfs/dbraw/zinc/53/95/44/1047539544.db2.gz GWLLOFHRLCQYFN-IRLDBZIGSA-N 2 1 333.479 4.136 20 0 EIADMP CCCNc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556178521 1047540491 /nfs/dbraw/zinc/54/04/91/1047540491.db2.gz JGCOKBKUFLCMCK-VXKWHMMOSA-N 2 1 337.511 4.434 20 0 EIADMP CCCNc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556178521 1047540507 /nfs/dbraw/zinc/54/05/07/1047540507.db2.gz JGCOKBKUFLCMCK-VXKWHMMOSA-N 2 1 337.511 4.434 20 0 EIADMP CCC[C@H](CC)[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231271 1047597010 /nfs/dbraw/zinc/59/70/10/1047597010.db2.gz UNPJRFAEUQDCEA-RTWAWAEBSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)[C@]1(C)CCCO1 ZINC000556235959 1047600843 /nfs/dbraw/zinc/60/08/43/1047600843.db2.gz KQPARIKCOFEPCD-OPYAIIAOSA-N 2 1 330.516 4.108 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000556236388 1047602566 /nfs/dbraw/zinc/60/25/66/1047602566.db2.gz KNHMRNYAOJZMIQ-TYCQWZJGSA-N 2 1 339.527 4.441 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000556236388 1047602572 /nfs/dbraw/zinc/60/25/72/1047602572.db2.gz KNHMRNYAOJZMIQ-TYCQWZJGSA-N 2 1 339.527 4.441 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242191 1047622281 /nfs/dbraw/zinc/62/22/81/1047622281.db2.gz RJIGLFQNEXNFOK-HGSOSGBHSA-N 2 1 334.507 4.290 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242191 1047622287 /nfs/dbraw/zinc/62/22/87/1047622287.db2.gz RJIGLFQNEXNFOK-HGSOSGBHSA-N 2 1 334.507 4.290 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCC(=O)c2ccccc2)CC1 ZINC000537517096 1047665717 /nfs/dbraw/zinc/66/57/17/1047665717.db2.gz YIEATYIHOJMBGC-LJQANCHMSA-N 2 1 342.527 4.236 20 0 EIADMP Cc1ccc([C@@H](O)C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)cc1 ZINC000763432485 1047753562 /nfs/dbraw/zinc/75/35/62/1047753562.db2.gz MBSRKARZGUVNEJ-KNQAVFIVSA-N 2 1 344.543 4.005 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cccnc2Cl)CC1 ZINC000763435155 1047791288 /nfs/dbraw/zinc/79/12/88/1047791288.db2.gz ZZDTWOMNBNRNRT-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccnc2Cl)CC1 ZINC000763435155 1047791297 /nfs/dbraw/zinc/79/12/97/1047791297.db2.gz ZZDTWOMNBNRNRT-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@H]2CC2(Cl)Cl)CC1 ZINC000763435101 1047805220 /nfs/dbraw/zinc/80/52/20/1047805220.db2.gz YZZGPKOSEOTUKB-GOEBONIOSA-N 2 1 333.347 4.157 20 0 EIADMP CCOc1cc(C)ccc1CN[C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550681083 1047814020 /nfs/dbraw/zinc/81/40/20/1047814020.db2.gz UCEXDJJRBNXPSP-SFTDATJTSA-N 2 1 338.495 4.319 20 0 EIADMP CCOc1cc(C)ccc1CN[C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550681083 1047814022 /nfs/dbraw/zinc/81/40/22/1047814022.db2.gz UCEXDJJRBNXPSP-SFTDATJTSA-N 2 1 338.495 4.319 20 0 EIADMP COc1ncc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1Cl ZINC000556591833 1047835303 /nfs/dbraw/zinc/83/53/03/1047835303.db2.gz NEAROMYZHHBQKU-LSDHHAIUSA-N 2 1 339.911 4.049 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000498771054 1047842935 /nfs/dbraw/zinc/84/29/35/1047842935.db2.gz WGWCYOJAUHEAQS-HXUWFJFHSA-N 2 1 341.886 4.228 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000498771054 1047842936 /nfs/dbraw/zinc/84/29/36/1047842936.db2.gz WGWCYOJAUHEAQS-HXUWFJFHSA-N 2 1 341.886 4.228 20 0 EIADMP C[C@@H]1SCC[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000814173590 1047867131 /nfs/dbraw/zinc/86/71/31/1047867131.db2.gz STUMHEPDPLWXSQ-VNVJMFPYSA-N 2 1 330.541 4.056 20 0 EIADMP Cc1ccc(-c2nc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)co2)cc1 ZINC000556686432 1047873492 /nfs/dbraw/zinc/87/34/92/1047873492.db2.gz IBDCFVUDSPIABP-UHFFFAOYSA-N 2 1 341.499 4.202 20 0 EIADMP C[NH+]1CCC2(CC1)CC[NH+](Cc1c(F)ccc(Cl)c1Cl)CC2 ZINC001143866830 1048254378 /nfs/dbraw/zinc/25/43/78/1048254378.db2.gz MFPHLWZSMJMXJF-UHFFFAOYSA-N 2 1 345.289 4.440 20 0 EIADMP C(=C/c1ccccc1)\C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499136336 1048332283 /nfs/dbraw/zinc/33/22/83/1048332283.db2.gz QMSQLGKQPZZYMG-RWCQXELZSA-N 2 1 332.491 4.485 20 0 EIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1F ZINC000499159621 1048369012 /nfs/dbraw/zinc/36/90/12/1048369012.db2.gz VTWZZCFEDRGFNC-WKCHPHFGSA-N 2 1 338.470 4.419 20 0 EIADMP CC(C)[C@@H](Cc1ccc(F)cc1)[N@H+](C)Cc1ncc(C[NH+](C)C)s1 ZINC000809585568 1048425120 /nfs/dbraw/zinc/42/51/20/1048425120.db2.gz CFVATNCINNNKNK-GOSISDBHSA-N 2 1 349.519 4.043 20 0 EIADMP CC(C)[C@@H](Cc1ccc(F)cc1)[N@@H+](C)Cc1ncc(C[NH+](C)C)s1 ZINC000809585568 1048425124 /nfs/dbraw/zinc/42/51/24/1048425124.db2.gz CFVATNCINNNKNK-GOSISDBHSA-N 2 1 349.519 4.043 20 0 EIADMP CC[N@@H+](Cc1ccccc1)C1CCN(Cc2cccc(O)c2C)CC1 ZINC001144118819 1048431050 /nfs/dbraw/zinc/43/10/50/1048431050.db2.gz LUSSUJSMWOTHFK-UHFFFAOYSA-N 2 1 338.495 4.187 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cc(Cl)c(F)cc2F)CC1 ZINC001144130176 1048454618 /nfs/dbraw/zinc/45/46/18/1048454618.db2.gz ZYJILYATZWIJCM-UHFFFAOYSA-N 2 1 330.850 4.170 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765051 1048524064 /nfs/dbraw/zinc/52/40/64/1048524064.db2.gz KSAVMGINNBJHAK-SWLSCSKDSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765051 1048524073 /nfs/dbraw/zinc/52/40/73/1048524073.db2.gz KSAVMGINNBJHAK-SWLSCSKDSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765051 1048524087 /nfs/dbraw/zinc/52/40/87/1048524087.db2.gz KSAVMGINNBJHAK-SWLSCSKDSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765051 1048524106 /nfs/dbraw/zinc/52/41/06/1048524106.db2.gz KSAVMGINNBJHAK-SWLSCSKDSA-N 2 1 332.435 4.071 20 0 EIADMP CCc1cccc(C[NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c1 ZINC001144322868 1048591207 /nfs/dbraw/zinc/59/12/07/1048591207.db2.gz GQFMGTKELPZYPW-UHFFFAOYSA-N 2 1 349.522 4.132 20 0 EIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(O)cc2C(F)(F)F)CC1 ZINC001144391920 1048625982 /nfs/dbraw/zinc/62/59/82/1048625982.db2.gz JAPHPNVKSOYTMB-UHFFFAOYSA-N 2 1 344.421 4.107 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(O)cc2C(F)(F)F)CC1 ZINC001144391920 1048625992 /nfs/dbraw/zinc/62/59/92/1048625992.db2.gz JAPHPNVKSOYTMB-UHFFFAOYSA-N 2 1 344.421 4.107 20 0 EIADMP [NH3+]CCCCCC[N@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000846223925 1048843437 /nfs/dbraw/zinc/84/34/37/1048843437.db2.gz QLNWOGBLEMYBTG-GFCCVEGCSA-N 2 1 331.323 4.167 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cnc(C3CC3)s2)c1 ZINC000134249339 1048914934 /nfs/dbraw/zinc/91/49/34/1048914934.db2.gz JMNFGWREIXLEBI-UHFFFAOYSA-N 2 1 329.513 4.151 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]CCc2ccc(C(C)(C)C)cc2)cn1 ZINC000811475355 1049096205 /nfs/dbraw/zinc/09/62/05/1049096205.db2.gz JZOBBMGLHQMYCY-UHFFFAOYSA-N 2 1 348.494 4.206 20 0 EIADMP Cc1csc(C2([NH2+][C@H](C)c3cccc(C[NH+](C)C)c3)CCC2)n1 ZINC000820835816 1049565133 /nfs/dbraw/zinc/56/51/33/1049565133.db2.gz GDMZVNBFLGBXIM-OAHLLOKOSA-N 2 1 329.513 4.243 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389392 1049600369 /nfs/dbraw/zinc/60/03/69/1049600369.db2.gz STKBZOJBHIFBSU-OTWHNJEPSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389392 1049600374 /nfs/dbraw/zinc/60/03/74/1049600374.db2.gz STKBZOJBHIFBSU-OTWHNJEPSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389392 1049600379 /nfs/dbraw/zinc/60/03/79/1049600379.db2.gz STKBZOJBHIFBSU-OTWHNJEPSA-N 2 1 348.481 4.161 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389391 1049600703 /nfs/dbraw/zinc/60/07/03/1049600703.db2.gz STKBZOJBHIFBSU-IPMKNSEASA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389391 1049600710 /nfs/dbraw/zinc/60/07/10/1049600710.db2.gz STKBZOJBHIFBSU-IPMKNSEASA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389391 1049600711 /nfs/dbraw/zinc/60/07/11/1049600711.db2.gz STKBZOJBHIFBSU-IPMKNSEASA-N 2 1 348.481 4.161 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@H]2CCc3c(F)cccc3C2)CC1 ZINC001171413609 1049645319 /nfs/dbraw/zinc/64/53/19/1049645319.db2.gz HWOLOUXLANFNET-WDSOQIARSA-N 2 1 330.491 4.198 20 0 EIADMP CC(C)(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2c(F)cccc2C1 ZINC001171414303 1049647504 /nfs/dbraw/zinc/64/75/04/1049647504.db2.gz PRYURWAFNMPKPZ-BZSNNMDCSA-N 2 1 332.507 4.301 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)c1cccc(O)c1 ZINC000716693175 1049701411 /nfs/dbraw/zinc/70/14/11/1049701411.db2.gz OGBURNTVXIMOMX-YRLHULLVSA-N 2 1 336.479 4.096 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000716629312 1049702101 /nfs/dbraw/zinc/70/21/01/1049702101.db2.gz YFYJBWDGYJSGDB-OKYOBFRVSA-N 2 1 334.454 4.207 20 0 EIADMP CC(C)(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cccc(F)c2C1 ZINC001170972573 1049702928 /nfs/dbraw/zinc/70/29/28/1049702928.db2.gz QSABAKZILKQCBP-KZNAEPCWSA-N 2 1 332.507 4.301 20 0 EIADMP COc1ccccc1[C@@H]1CC[N@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)C1 ZINC001171628587 1049761688 /nfs/dbraw/zinc/76/16/88/1049761688.db2.gz BYCHIOWWIQFDHD-MRXNPFEDSA-N 2 1 330.516 4.136 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]C2CC[NH+](C[C@@H]3CC=CCC3)CC2)CC1(C)C ZINC001171629923 1049762081 /nfs/dbraw/zinc/76/20/81/1049762081.db2.gz ZTTBSGQMDKEKMW-GOSISDBHSA-N 3 1 347.591 4.048 20 0 EIADMP C[N@@H+](CC[C@@H]1CC1(Cl)Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000822654602 1049781668 /nfs/dbraw/zinc/78/16/68/1049781668.db2.gz NTGAGONNOWMHJP-IAGOWNOFSA-N 2 1 341.326 4.024 20 0 EIADMP C[C@H]([NH3+])c1ccc2c(ccn2[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC001171726744 1049784816 /nfs/dbraw/zinc/78/48/16/1049784816.db2.gz HYUKEBSYGJXHJT-FIKGOQFSSA-N 2 1 333.479 4.497 20 0 EIADMP Cc1ccc2c(c1)c(CC[NH3+])cn2[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727765 1049784839 /nfs/dbraw/zinc/78/48/39/1049784839.db2.gz XPSVBZMJBISYAB-NQIIRXRSSA-N 2 1 347.506 4.286 20 0 EIADMP Cc1c(CC[NH3+])c2ccccc2n1[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727248 1049785070 /nfs/dbraw/zinc/78/50/70/1049785070.db2.gz TXZBBCIPFWARSQ-FXAWDEMLSA-N 2 1 347.506 4.286 20 0 EIADMP Cc1cc2cc(C[NH3+])ccc2n1[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727133 1049785593 /nfs/dbraw/zinc/78/55/93/1049785593.db2.gz QCDLNLPDTIOJRR-HRAATJIYSA-N 2 1 333.479 4.244 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2cccc(F)c2C1 ZINC001171005853 1049819554 /nfs/dbraw/zinc/81/95/54/1049819554.db2.gz RMTJOBAMWPCHOP-FHWLQOOXSA-N 2 1 330.491 4.022 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001171960695 1049824311 /nfs/dbraw/zinc/82/43/11/1049824311.db2.gz GIPFZLBHSJRLMR-XDKFSHSGSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001171960695 1049824312 /nfs/dbraw/zinc/82/43/12/1049824312.db2.gz GIPFZLBHSJRLMR-XDKFSHSGSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001171960692 1049824427 /nfs/dbraw/zinc/82/44/27/1049824427.db2.gz GIPFZLBHSJRLMR-NKGKWGDASA-N 2 1 340.433 4.241 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001171960692 1049824429 /nfs/dbraw/zinc/82/44/29/1049824429.db2.gz GIPFZLBHSJRLMR-NKGKWGDASA-N 2 1 340.433 4.241 20 0 EIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC001171961718 1049825289 /nfs/dbraw/zinc/82/52/89/1049825289.db2.gz BGGPRKUOGFDREG-HDMKZQKVSA-N 2 1 342.449 4.345 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2ccnc(Cl)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171963749 1049825365 /nfs/dbraw/zinc/82/53/65/1049825365.db2.gz JBCDUSGJKQGUGK-SFHVURJKSA-N 2 1 343.902 4.268 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2ccnc(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC001171963749 1049825369 /nfs/dbraw/zinc/82/53/69/1049825369.db2.gz JBCDUSGJKQGUGK-SFHVURJKSA-N 2 1 343.902 4.268 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171966222 1049826300 /nfs/dbraw/zinc/82/63/00/1049826300.db2.gz UGKMCHVEJQYOOE-GOSISDBHSA-N 2 1 344.449 4.498 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC001171966222 1049826301 /nfs/dbraw/zinc/82/63/01/1049826301.db2.gz UGKMCHVEJQYOOE-GOSISDBHSA-N 2 1 344.449 4.498 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171966440 1049826350 /nfs/dbraw/zinc/82/63/50/1049826350.db2.gz UTDVSGLBUZNBNQ-FQEVSTJZSA-N 2 1 326.459 4.359 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC001171966440 1049826351 /nfs/dbraw/zinc/82/63/51/1049826351.db2.gz UTDVSGLBUZNBNQ-FQEVSTJZSA-N 2 1 326.459 4.359 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001171966410 1049826789 /nfs/dbraw/zinc/82/67/89/1049826789.db2.gz VBEFQJBELLSBHQ-RDJZCZTQSA-N 2 1 342.449 4.477 20 0 EIADMP C[C@H](Cc1ccncc1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813881674 1049830577 /nfs/dbraw/zinc/83/05/77/1049830577.db2.gz SSQHLSAEVMTEME-JJXTWPQTSA-N 2 1 349.522 4.188 20 0 EIADMP CC(C)([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccncc1 ZINC001171974435 1049835745 /nfs/dbraw/zinc/83/57/45/1049835745.db2.gz FVURXICCLFARJN-HXUWFJFHSA-N 2 1 337.511 4.350 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2cccc3ncoc32)CC[N@H+]1Cc1ccccc1 ZINC001171976878 1049836882 /nfs/dbraw/zinc/83/68/82/1049836882.db2.gz UWROVHRLPRRQNE-IBGZPJMESA-N 2 1 349.478 4.361 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2cccc3ncoc32)CC[N@H+]1Cc1ccccc1 ZINC001171976879 1049837480 /nfs/dbraw/zinc/83/74/80/1049837480.db2.gz UWROVHRLPRRQNE-LJQANCHMSA-N 2 1 349.478 4.361 20 0 EIADMP CC1(C)C[C@H]([NH+]2CC[C@H](c3ccncc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171983724 1049838481 /nfs/dbraw/zinc/83/84/81/1049838481.db2.gz GNPYKHHGKJIARF-FCHUYYIVSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CC[C@H](c3ccncc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983724 1049838483 /nfs/dbraw/zinc/83/84/83/1049838483.db2.gz GNPYKHHGKJIARF-FCHUYYIVSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CC[C@H](c3ccncc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983724 1049838484 /nfs/dbraw/zinc/83/84/84/1049838484.db2.gz GNPYKHHGKJIARF-FCHUYYIVSA-N 2 1 349.522 4.314 20 0 EIADMP CCCOC1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980374 1049838724 /nfs/dbraw/zinc/83/87/24/1049838724.db2.gz DVWSNFQCAGDUHN-HXUWFJFHSA-N 2 1 344.543 4.321 20 0 EIADMP CSC1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171986340 1049839838 /nfs/dbraw/zinc/83/98/38/1049839838.db2.gz HOBXSHMDMWGVOT-SFHVURJKSA-N 2 1 332.557 4.257 20 0 EIADMP COC(C)(C)[C@@H]1CCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987836 1049840411 /nfs/dbraw/zinc/84/04/11/1049840411.db2.gz KJTYTZZLFJIPIK-UXHICEINSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@@H]1CCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987836 1049840414 /nfs/dbraw/zinc/84/04/14/1049840414.db2.gz KJTYTZZLFJIPIK-UXHICEINSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@@H]1CCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987836 1049840416 /nfs/dbraw/zinc/84/04/16/1049840416.db2.gz KJTYTZZLFJIPIK-UXHICEINSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@@H]1CCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987836 1049840419 /nfs/dbraw/zinc/84/04/19/1049840419.db2.gz KJTYTZZLFJIPIK-UXHICEINSA-N 2 1 344.543 4.319 20 0 EIADMP COCC[C@@H]1CCCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984117 1049841132 /nfs/dbraw/zinc/84/11/32/1049841132.db2.gz ICURRNLFHPMSIM-SFTDATJTSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@@H]1CCCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984117 1049841135 /nfs/dbraw/zinc/84/11/35/1049841135.db2.gz ICURRNLFHPMSIM-SFTDATJTSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@@H]1CCCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984117 1049841138 /nfs/dbraw/zinc/84/11/38/1049841138.db2.gz ICURRNLFHPMSIM-SFTDATJTSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@@H]1CCCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984117 1049841141 /nfs/dbraw/zinc/84/11/41/1049841141.db2.gz ICURRNLFHPMSIM-SFTDATJTSA-N 2 1 344.543 4.321 20 0 EIADMP CC1(C)C[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC(C)(C)O1 ZINC001171985863 1049841176 /nfs/dbraw/zinc/84/11/76/1049841176.db2.gz CKYHDFDYOZRNCF-IBGZPJMESA-N 2 1 344.543 4.319 20 0 EIADMP CC1(C)C[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC(C)(C)O1 ZINC001171985863 1049841178 /nfs/dbraw/zinc/84/11/78/1049841178.db2.gz CKYHDFDYOZRNCF-IBGZPJMESA-N 2 1 344.543 4.319 20 0 EIADMP F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070775 1049843496 /nfs/dbraw/zinc/84/34/96/1049843496.db2.gz AWJNNIBMTYBDAG-MFHSYZQISA-N 2 1 328.475 4.004 20 0 EIADMP F[C@@H]1C[C@@H]2C[C@H]1C[N@H+]2[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070775 1049843497 /nfs/dbraw/zinc/84/34/97/1049843497.db2.gz AWJNNIBMTYBDAG-MFHSYZQISA-N 2 1 328.475 4.004 20 0 EIADMP F[C@@H]1C[C@@H]2C[C@H]1C[NH+]2[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070775 1049843498 /nfs/dbraw/zinc/84/34/98/1049843498.db2.gz AWJNNIBMTYBDAG-MFHSYZQISA-N 2 1 328.475 4.004 20 0 EIADMP F[C@@H]1C[C@@H]2C[C@H]1C[NH+]2[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070775 1049843500 /nfs/dbraw/zinc/84/35/00/1049843500.db2.gz AWJNNIBMTYBDAG-MFHSYZQISA-N 2 1 328.475 4.004 20 0 EIADMP C[N@@H+](CCc1ccncc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074724 1049845098 /nfs/dbraw/zinc/84/50/98/1049845098.db2.gz LHVISXUEMLNOIP-NUNAXRQHSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1ccncc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172074724 1049845101 /nfs/dbraw/zinc/84/51/01/1049845101.db2.gz LHVISXUEMLNOIP-NUNAXRQHSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1ccncc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172074724 1049845106 /nfs/dbraw/zinc/84/51/06/1049845106.db2.gz LHVISXUEMLNOIP-NUNAXRQHSA-N 2 1 349.522 4.142 20 0 EIADMP CC(C)([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccncc1 ZINC001172077400 1049846060 /nfs/dbraw/zinc/84/60/60/1049846060.db2.gz QXQIDDDCSUOZRJ-DKUWSORSSA-N 2 1 349.522 4.492 20 0 EIADMP CC(C)([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccn1 ZINC001172077994 1049846615 /nfs/dbraw/zinc/84/66/15/1049846615.db2.gz WIUHHMMCHSGEAY-MZADTFQBSA-N 2 1 349.522 4.492 20 0 EIADMP CC(C)([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC001172077994 1049846616 /nfs/dbraw/zinc/84/66/16/1049846616.db2.gz WIUHHMMCHSGEAY-MZADTFQBSA-N 2 1 349.522 4.492 20 0 EIADMP c1cc2c(o1)CCN([C@H]1C[C@H]3CCC[C@@H](C1)[N@@H+]3Cc1ccccc1)C2 ZINC001172081315 1049847949 /nfs/dbraw/zinc/84/79/49/1049847949.db2.gz FERKYOBUOFAEEA-AERCQKQUSA-N 2 1 336.479 4.223 20 0 EIADMP F[C@@H]1CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172067065 1049850822 /nfs/dbraw/zinc/85/08/22/1049850822.db2.gz AEAWBMWKJZGXCZ-MXEMCNAFSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172067065 1049850823 /nfs/dbraw/zinc/85/08/23/1049850823.db2.gz AEAWBMWKJZGXCZ-MXEMCNAFSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172067065 1049850828 /nfs/dbraw/zinc/85/08/28/1049850828.db2.gz AEAWBMWKJZGXCZ-MXEMCNAFSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172067065 1049850830 /nfs/dbraw/zinc/85/08/30/1049850830.db2.gz AEAWBMWKJZGXCZ-MXEMCNAFSA-N 2 1 330.491 4.396 20 0 EIADMP [NH3+]Cc1cccc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172065755 1049851275 /nfs/dbraw/zinc/85/12/75/1049851275.db2.gz QIUDNHRGKGWTEN-DKUWSORSSA-N 2 1 335.495 4.143 20 0 EIADMP C[C@@H](Cc1cccs1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245770357 1049853284 /nfs/dbraw/zinc/85/32/84/1049853284.db2.gz XEBGOLFGCFCYGV-FRYIKTPZSA-N 2 1 340.536 4.464 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129293 1049854248 /nfs/dbraw/zinc/85/42/48/1049854248.db2.gz YBJQTXAQHPUBPY-DOADOZAASA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129293 1049854250 /nfs/dbraw/zinc/85/42/50/1049854250.db2.gz YBJQTXAQHPUBPY-DOADOZAASA-N 2 1 348.918 4.199 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129293 1049854252 /nfs/dbraw/zinc/85/42/52/1049854252.db2.gz YBJQTXAQHPUBPY-DOADOZAASA-N 2 1 348.918 4.199 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129293 1049854256 /nfs/dbraw/zinc/85/42/56/1049854256.db2.gz YBJQTXAQHPUBPY-DOADOZAASA-N 2 1 348.918 4.199 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(n3ccc4ccccc43)CC1)C2 ZINC001172128781 1049854650 /nfs/dbraw/zinc/85/46/50/1049854650.db2.gz UCHQBBGITAYCBS-WKCHPHFGSA-N 2 1 337.511 4.294 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(n3ccc4ccccc43)CC1)C2 ZINC001172128781 1049854656 /nfs/dbraw/zinc/85/46/56/1049854656.db2.gz UCHQBBGITAYCBS-WKCHPHFGSA-N 2 1 337.511 4.294 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)c(Cl)c1)C2 ZINC001172105059 1049856401 /nfs/dbraw/zinc/85/64/01/1049856401.db2.gz FSXNUWOIJKQUEQ-BTTYYORXSA-N 2 1 346.824 4.464 20 0 EIADMP COc1ccccc1CC1(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CCC1 ZINC001172109957 1049857157 /nfs/dbraw/zinc/85/71/57/1049857157.db2.gz HIXACCNIETZDQW-OWZKRDHZSA-N 2 1 342.527 4.013 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C[C@@H]1C ZINC001172375054 1049885238 /nfs/dbraw/zinc/88/52/38/1049885238.db2.gz BSPJXIGMVIFUHO-KGVIQGDOSA-N 2 1 326.528 4.334 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C[C@@H]1C ZINC001172375054 1049885243 /nfs/dbraw/zinc/88/52/43/1049885243.db2.gz BSPJXIGMVIFUHO-KGVIQGDOSA-N 2 1 326.528 4.334 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001172344323 1049890277 /nfs/dbraw/zinc/89/02/77/1049890277.db2.gz AOXQDIUGAREQQK-BLKABHOGSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001172344323 1049890281 /nfs/dbraw/zinc/89/02/81/1049890281.db2.gz AOXQDIUGAREQQK-BLKABHOGSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001172344323 1049890284 /nfs/dbraw/zinc/89/02/84/1049890284.db2.gz AOXQDIUGAREQQK-BLKABHOGSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC001172347918 1049891153 /nfs/dbraw/zinc/89/11/53/1049891153.db2.gz GGMBHGFWEAHNSE-XODKDNOYSA-N 2 1 332.532 4.080 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC001172347918 1049891156 /nfs/dbraw/zinc/89/11/56/1049891156.db2.gz GGMBHGFWEAHNSE-XODKDNOYSA-N 2 1 332.532 4.080 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001172352514 1049892350 /nfs/dbraw/zinc/89/23/50/1049892350.db2.gz ICKJDOXABLYJDN-RBUKOAKNSA-N 2 1 344.543 4.103 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001172352514 1049892356 /nfs/dbraw/zinc/89/23/56/1049892356.db2.gz ICKJDOXABLYJDN-RBUKOAKNSA-N 2 1 344.543 4.103 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C ZINC001172353460 1049892995 /nfs/dbraw/zinc/89/29/95/1049892995.db2.gz XAHPKWRBVBHRPK-DYQZNNLLSA-N 2 1 346.559 4.328 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172356184 1049894069 /nfs/dbraw/zinc/89/40/69/1049894069.db2.gz XYMYHUHRNXEVIR-ONTIZHBOSA-N 2 1 344.543 4.178 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172356184 1049894073 /nfs/dbraw/zinc/89/40/73/1049894073.db2.gz XYMYHUHRNXEVIR-ONTIZHBOSA-N 2 1 344.543 4.178 20 0 EIADMP C[C@@H]1CC[C@H]([NH2+][C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2[NH3+])C[C@H]1C ZINC001172369563 1049897261 /nfs/dbraw/zinc/89/72/61/1049897261.db2.gz RTASDKLVWUTVDQ-UAKKBYTISA-N 2 1 346.518 4.388 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccnc(Cl)c1F ZINC000824084602 1049898707 /nfs/dbraw/zinc/89/87/07/1049898707.db2.gz FQFHWYRRHRKONA-UHFFFAOYSA-N 2 1 335.854 4.004 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1ccnc(Cl)c1F ZINC000824084602 1049898708 /nfs/dbraw/zinc/89/87/08/1049898708.db2.gz FQFHWYRRHRKONA-UHFFFAOYSA-N 2 1 335.854 4.004 20 0 EIADMP CC(C)OCC[C@H](C)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001172450543 1049914950 /nfs/dbraw/zinc/91/49/50/1049914950.db2.gz ISVVISJCXZMORL-FQEVSTJZSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@H](C)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001172459672 1049917678 /nfs/dbraw/zinc/91/76/78/1049917678.db2.gz KPSHRPILUNLAIX-NNWRFLSQSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001172459672 1049917682 /nfs/dbraw/zinc/91/76/82/1049917682.db2.gz KPSHRPILUNLAIX-NNWRFLSQSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001172459672 1049917685 /nfs/dbraw/zinc/91/76/85/1049917685.db2.gz KPSHRPILUNLAIX-NNWRFLSQSA-N 2 1 344.543 4.034 20 0 EIADMP c1ccc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]3[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC001172552640 1049929959 /nfs/dbraw/zinc/92/99/59/1049929959.db2.gz GWRNZTSOGLLMOR-LILXYRQWSA-N 2 1 332.491 4.043 20 0 EIADMP c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC001172552640 1049929967 /nfs/dbraw/zinc/92/99/67/1049929967.db2.gz GWRNZTSOGLLMOR-LILXYRQWSA-N 2 1 332.491 4.043 20 0 EIADMP [NH3+][C@H]1CC[N@H+](Cc2ccccc2Oc2cccc(Cl)c2)CC[C@H]1F ZINC001206174472 1049970982 /nfs/dbraw/zinc/97/09/82/1049970982.db2.gz NFBYGAVVGAUBSW-MSOLQXFVSA-N 2 1 348.849 4.394 20 0 EIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccccc2Oc2cccc(Cl)c2)CC[C@H]1F ZINC001206174472 1049970989 /nfs/dbraw/zinc/97/09/89/1049970989.db2.gz NFBYGAVVGAUBSW-MSOLQXFVSA-N 2 1 348.849 4.394 20 0 EIADMP Clc1ccc2c(c1)C[C@@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001172712251 1049971782 /nfs/dbraw/zinc/97/17/82/1049971782.db2.gz ATJHLFXRNBUUDC-FQEVSTJZSA-N 2 1 344.930 4.148 20 0 EIADMP Clc1ccc2c(c1)C[C@@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001172712251 1049971785 /nfs/dbraw/zinc/97/17/85/1049971785.db2.gz ATJHLFXRNBUUDC-FQEVSTJZSA-N 2 1 344.930 4.148 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc2c(c1)OCCCO2 ZINC000247007972 1050009737 /nfs/dbraw/zinc/00/97/37/1050009737.db2.gz LBPMRJVUTZSQRU-ZWKOTPCHSA-N 2 1 346.515 4.153 20 0 EIADMP CCOCCC[N@H+]1CC[C@H](N[C@H](C)c2ccc(Cl)s2)[C@H](C)C1 ZINC000247088442 1050013311 /nfs/dbraw/zinc/01/33/11/1050013311.db2.gz PGVWWSNWJWBKNV-KFWWJZLASA-N 2 1 344.952 4.189 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(Cl)s2)[C@H](C)C1 ZINC000247088442 1050013313 /nfs/dbraw/zinc/01/33/13/1050013313.db2.gz PGVWWSNWJWBKNV-KFWWJZLASA-N 2 1 344.952 4.189 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000249163590 1050093704 /nfs/dbraw/zinc/09/37/04/1050093704.db2.gz ZXQGROWEKLXDSQ-KZNAEPCWSA-N 2 1 340.433 4.219 20 0 EIADMP Cc1nccnc1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000249208291 1050094236 /nfs/dbraw/zinc/09/42/36/1050094236.db2.gz WXTIOXPRGQORKZ-AEFFLSMTSA-N 2 1 338.499 4.010 20 0 EIADMP Clc1cc2c(c(Cl)c1)CC[C@@H]2[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000089696004 1050128741 /nfs/dbraw/zinc/12/87/41/1050128741.db2.gz PRPLALUPGOEJQE-DIFFPNOSSA-N 2 1 325.283 4.055 20 0 EIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC001206297302 1050168602 /nfs/dbraw/zinc/16/86/02/1050168602.db2.gz XOEJTDQWTDNJOQ-JOCHJYFZSA-N 2 1 338.495 4.217 20 0 EIADMP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC001177256389 1050174732 /nfs/dbraw/zinc/17/47/32/1050174732.db2.gz DYPAKMVNKXKTPW-STZQEDGTSA-N 2 1 344.543 4.356 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C)CC2 ZINC001172843751 1050182292 /nfs/dbraw/zinc/18/22/92/1050182292.db2.gz OKODCFULFVWSGI-FDFHNCONSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C)CC2 ZINC001172843751 1050182296 /nfs/dbraw/zinc/18/22/96/1050182296.db2.gz OKODCFULFVWSGI-FDFHNCONSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C)CC2 ZINC001172843751 1050182302 /nfs/dbraw/zinc/18/23/02/1050182302.db2.gz OKODCFULFVWSGI-FDFHNCONSA-N 2 1 326.528 4.191 20 0 EIADMP C[C@H](Cc1c(F)cccc1Cl)[NH+]1CCC([NH3+])(c2ccccc2)CC1 ZINC001172848279 1050186762 /nfs/dbraw/zinc/18/67/62/1050186762.db2.gz SIRVFTKEZSPHRN-OAHLLOKOSA-N 2 1 346.877 4.360 20 0 EIADMP C[N@H+](Cc1ccccc1C[NH2+]Cc1ccncc1F)C1CCCCC1 ZINC000449085874 1050216335 /nfs/dbraw/zinc/21/63/35/1050216335.db2.gz PKXYVAHOTMSJAW-UHFFFAOYSA-N 2 1 341.474 4.275 20 0 EIADMP C[N@@H+](Cc1ccccc1C[NH2+]Cc1ccncc1F)C1CCCCC1 ZINC000449085874 1050216345 /nfs/dbraw/zinc/21/63/45/1050216345.db2.gz PKXYVAHOTMSJAW-UHFFFAOYSA-N 2 1 341.474 4.275 20 0 EIADMP CC[NH+]1CCC([N@H+](C)[C@@H](C)CSc2ccc(Cl)cc2)CC1 ZINC001172877107 1050217904 /nfs/dbraw/zinc/21/79/04/1050217904.db2.gz DPQFRGLGUWVFDB-AWEZNQCLSA-N 2 1 326.937 4.237 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)[C@@H](C)CSc2ccc(Cl)cc2)CC1 ZINC001172877107 1050217921 /nfs/dbraw/zinc/21/79/21/1050217921.db2.gz DPQFRGLGUWVFDB-AWEZNQCLSA-N 2 1 326.937 4.237 20 0 EIADMP C[NH+]1CCC(c2ccc(Nc3ccc4c(c3)C[N@H+](C)CC4)cc2)CC1 ZINC001212692531 1050232466 /nfs/dbraw/zinc/23/24/66/1050232466.db2.gz YQFQIEPIAHCOJK-UHFFFAOYSA-N 2 1 335.495 4.227 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](c2ccc(OC)cc2)C2CC2)c1 ZINC000091333116 1050252087 /nfs/dbraw/zinc/25/20/87/1050252087.db2.gz TYCDJABIEABCAS-JOCHJYFZSA-N 2 1 338.495 4.388 20 0 EIADMP Cc1cc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)ccc1Cl ZINC001177669166 1050274890 /nfs/dbraw/zinc/27/48/90/1050274890.db2.gz SAIKJPVKBMDQHD-FQEVSTJZSA-N 2 1 342.914 4.303 20 0 EIADMP CCCC[NH+](CCCC)CC[NH2+]C1CCC([NH+](CC)CC)CC1 ZINC001173101639 1050302876 /nfs/dbraw/zinc/30/28/76/1050302876.db2.gz MMJLCUVDGFGFSQ-UHFFFAOYSA-N 3 1 325.585 4.131 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)c(Cl)c2)C1 ZINC001177795547 1050303046 /nfs/dbraw/zinc/30/30/46/1050303046.db2.gz VPEUZJQTAAUGPX-KRWDZBQOSA-N 2 1 328.887 4.438 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCc3c4ccccc4oc3C2)CC1 ZINC001173112646 1050309570 /nfs/dbraw/zinc/30/95/70/1050309570.db2.gz DARWBNKPHQLXOK-UHFFFAOYSA-N 2 1 326.484 4.444 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCOC2CCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001177875316 1050309952 /nfs/dbraw/zinc/30/99/52/1050309952.db2.gz JBRIEZCOVIHZLR-PZJWPPBQSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCOC2CCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001177875316 1050309955 /nfs/dbraw/zinc/30/99/55/1050309955.db2.gz JBRIEZCOVIHZLR-PZJWPPBQSA-N 2 1 344.543 4.369 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H]2c2ccc(OC)cc2)CC1 ZINC001173111579 1050309938 /nfs/dbraw/zinc/30/99/38/1050309938.db2.gz HQSSXLTYSJTWNY-GZNCHQMQSA-N 2 1 330.516 4.485 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H](OCc3ccccc3)C2)CC1 ZINC001173112953 1050309950 /nfs/dbraw/zinc/30/99/50/1050309950.db2.gz FLCRDDSRQNRHOI-LZBANZJXSA-N 2 1 344.543 4.321 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCO[C@](C)(c3ccc(C)cc3)C2)CC1 ZINC001173114342 1050310902 /nfs/dbraw/zinc/31/09/02/1050310902.db2.gz HGZKEXMBNSFIHV-HRTMPFAESA-N 2 1 344.543 4.195 20 0 EIADMP [NH3+]CCC[C@@H]1CCCC[N@H+](C2CCC(Oc3ccccc3)CC2)C1 ZINC001173201967 1050345108 /nfs/dbraw/zinc/34/51/08/1050345108.db2.gz KUVONQWGPBJSRA-JSOIOWGOSA-N 2 1 330.516 4.218 20 0 EIADMP CCOc1ccc(Cl)cc1C[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC001178248846 1050409774 /nfs/dbraw/zinc/40/97/74/1050409774.db2.gz FWYDZVOWGKAJDZ-MRXNPFEDSA-N 2 1 338.923 4.196 20 0 EIADMP CCOc1ccc(Cl)cc1C[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC001178248846 1050409782 /nfs/dbraw/zinc/40/97/82/1050409782.db2.gz FWYDZVOWGKAJDZ-MRXNPFEDSA-N 2 1 338.923 4.196 20 0 EIADMP CC[N@H+]1CC[C@H](n2c(C)c(CC[NH3+])c3c2cc(Cl)cc3Cl)C1 ZINC001173354837 1050441581 /nfs/dbraw/zinc/44/15/81/1050441581.db2.gz JVEQMMGNFJCULS-ZDUSSCGKSA-N 2 1 340.298 4.024 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1(C)C ZINC001178430252 1050456151 /nfs/dbraw/zinc/45/61/51/1050456151.db2.gz CUOSDILMSHZBOU-ZIBCJSCZSA-N 2 1 344.543 4.221 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1(C)C ZINC001178430252 1050456156 /nfs/dbraw/zinc/45/61/56/1050456156.db2.gz CUOSDILMSHZBOU-ZIBCJSCZSA-N 2 1 344.543 4.221 20 0 EIADMP CSCc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001178458104 1050474575 /nfs/dbraw/zinc/47/45/75/1050474575.db2.gz PTDPNSDNBIBCTM-VQIMIIECSA-N 2 1 332.557 4.292 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)n1cc[nH+]c1CCC[NH3+] ZINC001173547438 1050482139 /nfs/dbraw/zinc/48/21/39/1050482139.db2.gz PWRCITOVIPTEPF-GFCCVEGCSA-N 2 1 326.271 4.275 20 0 EIADMP Cc1cc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)cc(C)c1-c1ccc(F)cc1 ZINC001206211319 1050529531 /nfs/dbraw/zinc/52/95/31/1050529531.db2.gz NJZHDJAOCWXFKH-WOJBJXKFSA-N 2 1 344.449 4.371 20 0 EIADMP Cc1cc(C[N@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)cc(C)c1-c1ccc(F)cc1 ZINC001206211319 1050529551 /nfs/dbraw/zinc/52/95/51/1050529551.db2.gz NJZHDJAOCWXFKH-WOJBJXKFSA-N 2 1 344.449 4.371 20 0 EIADMP COc1ccc([C@H](C)[NH2+]Cc2ccco2)cc1C[NH+]1CCCCC1 ZINC000182191908 1050533155 /nfs/dbraw/zinc/53/31/55/1050533155.db2.gz DJYQMGAXZBEQPU-INIZCTEOSA-N 2 1 328.456 4.125 20 0 EIADMP Cc1cc(C[N@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)ccc1Oc1ccccc1 ZINC001206209690 1050536513 /nfs/dbraw/zinc/53/65/13/1050536513.db2.gz IBHJEAWSWLQLRE-RBUKOAKNSA-N 2 1 328.431 4.049 20 0 EIADMP CCCCCCOc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC001178741492 1050538927 /nfs/dbraw/zinc/53/89/27/1050538927.db2.gz FLYMLJIXIXVYIV-IHWFROFDSA-N 2 1 330.516 4.361 20 0 EIADMP C[N@H+](Cc1cccc2[nH]ccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000093337026 1050569952 /nfs/dbraw/zinc/56/99/52/1050569952.db2.gz LVBNOXXXJFINIM-IBGZPJMESA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1cccc2[nH]ccc21)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000093337026 1050569962 /nfs/dbraw/zinc/56/99/62/1050569962.db2.gz LVBNOXXXJFINIM-IBGZPJMESA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1cccc2[nH]ccc21)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000093337026 1050569977 /nfs/dbraw/zinc/56/99/77/1050569977.db2.gz LVBNOXXXJFINIM-IBGZPJMESA-N 2 1 333.479 4.122 20 0 EIADMP CC[N@H+](CCC[NH2+]Cc1cnn(-c2ccccc2)c1)C1CCCCC1 ZINC001179091707 1050629113 /nfs/dbraw/zinc/62/91/13/1050629113.db2.gz XABYSVUBXPPHNI-UHFFFAOYSA-N 2 1 340.515 4.007 20 0 EIADMP CC[N@@H+](CCC[NH2+]Cc1cnn(-c2ccccc2)c1)C1CCCCC1 ZINC001179091707 1050629122 /nfs/dbraw/zinc/62/91/22/1050629122.db2.gz XABYSVUBXPPHNI-UHFFFAOYSA-N 2 1 340.515 4.007 20 0 EIADMP CC[N@H+](CCC[NH2+]Cc1ccnn1-c1ccccc1)C1CCCCC1 ZINC001179090635 1050629313 /nfs/dbraw/zinc/62/93/13/1050629313.db2.gz GGCGAHYMSFGMCA-UHFFFAOYSA-N 2 1 340.515 4.007 20 0 EIADMP CC[N@@H+](CCC[NH2+]Cc1ccnn1-c1ccccc1)C1CCCCC1 ZINC001179090635 1050629321 /nfs/dbraw/zinc/62/93/21/1050629321.db2.gz GGCGAHYMSFGMCA-UHFFFAOYSA-N 2 1 340.515 4.007 20 0 EIADMP C[C@H](CC[NH2+]Cc1cccc(OCc2ccccc2Cl)c1)[NH+](C)C ZINC001179265857 1050661554 /nfs/dbraw/zinc/66/15/54/1050661554.db2.gz DDQWNXAIWYILQC-MRXNPFEDSA-N 2 1 346.902 4.349 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccccc2N(C)C)c1 ZINC000093944630 1050726228 /nfs/dbraw/zinc/72/62/28/1050726228.db2.gz FNJFWYRTBHWAKF-KRWDZBQOSA-N 2 1 325.500 4.055 20 0 EIADMP C[C@@]1(C[N@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCCS1 ZINC001179864190 1050808299 /nfs/dbraw/zinc/80/82/99/1050808299.db2.gz UUAYLZCESMAYMU-LEWJYISDSA-N 2 1 344.568 4.260 20 0 EIADMP C[C@@]1(C[NH+]2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)CCCS1 ZINC001179864190 1050808306 /nfs/dbraw/zinc/80/83/06/1050808306.db2.gz UUAYLZCESMAYMU-LEWJYISDSA-N 2 1 344.568 4.260 20 0 EIADMP C[C@@]1(C[NH+]2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CCCS1 ZINC001179864190 1050808311 /nfs/dbraw/zinc/80/83/11/1050808311.db2.gz UUAYLZCESMAYMU-LEWJYISDSA-N 2 1 344.568 4.260 20 0 EIADMP CCCOc1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877782 1050815125 /nfs/dbraw/zinc/81/51/25/1050815125.db2.gz JQLRXLIWTXDPBN-HXUWFJFHSA-N 2 1 330.516 4.092 20 0 EIADMP CCCOc1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877782 1050815133 /nfs/dbraw/zinc/81/51/33/1050815133.db2.gz JQLRXLIWTXDPBN-HXUWFJFHSA-N 2 1 330.516 4.092 20 0 EIADMP CC[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1(OC)CCCCC1 ZINC001179947913 1050828840 /nfs/dbraw/zinc/82/88/40/1050828840.db2.gz ZEZSXAKQSKSRFJ-OAQYLSRUSA-N 2 1 344.543 4.180 20 0 EIADMP CC[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC1(OC)CCCCC1 ZINC001179947913 1050828844 /nfs/dbraw/zinc/82/88/44/1050828844.db2.gz ZEZSXAKQSKSRFJ-OAQYLSRUSA-N 2 1 344.543 4.180 20 0 EIADMP CC[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC1(OC)CCCCC1 ZINC001179947913 1050828852 /nfs/dbraw/zinc/82/88/52/1050828852.db2.gz ZEZSXAKQSKSRFJ-OAQYLSRUSA-N 2 1 344.543 4.180 20 0 EIADMP CCc1cccc2cc(C[N@@H+]3CC[C@H](C[NH+](C)CC4CC4)C3)oc21 ZINC001180083486 1050879922 /nfs/dbraw/zinc/87/99/22/1050879922.db2.gz ZTAPCGUMAAXABS-QGZVFWFLSA-N 2 1 326.484 4.159 20 0 EIADMP CCc1cccc2cc(C[N@H+]3CC[C@H](C[NH+](C)CC4CC4)C3)oc21 ZINC001180083486 1050879924 /nfs/dbraw/zinc/87/99/24/1050879924.db2.gz ZTAPCGUMAAXABS-QGZVFWFLSA-N 2 1 326.484 4.159 20 0 EIADMP CCc1cccc2cc(C[NH+]3CC[C@H](C[N@H+](C)CC4CC4)C3)oc21 ZINC001180083486 1050879933 /nfs/dbraw/zinc/87/99/33/1050879933.db2.gz ZTAPCGUMAAXABS-QGZVFWFLSA-N 2 1 326.484 4.159 20 0 EIADMP CCc1cccc2cc(C[NH+]3CC[C@H](C[N@@H+](C)CC4CC4)C3)oc21 ZINC001180083486 1050879936 /nfs/dbraw/zinc/87/99/36/1050879936.db2.gz ZTAPCGUMAAXABS-QGZVFWFLSA-N 2 1 326.484 4.159 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCc2ccc(F)c(F)c2)CC1 ZINC001180125013 1050891643 /nfs/dbraw/zinc/89/16/43/1050891643.db2.gz ORBYJSKOHZCJGA-UHFFFAOYSA-N 2 1 338.486 4.341 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H]2CCc3ccccc3C2)CC1 ZINC001180125402 1050891868 /nfs/dbraw/zinc/89/18/68/1050891868.db2.gz YEACTWANRZFUPT-HXUWFJFHSA-N 2 1 328.544 4.235 20 0 EIADMP Cc1cc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)cc(C)c1O ZINC001180225162 1050920595 /nfs/dbraw/zinc/92/05/95/1050920595.db2.gz OQAUJZYSHKCFLC-IBGZPJMESA-N 2 1 344.543 4.486 20 0 EIADMP C[C@@H](CCC1CCCCC1)[NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC001180802466 1051086767 /nfs/dbraw/zinc/08/67/67/1051086767.db2.gz QWLFDKWMGRIRJH-PGRDOPGGSA-N 2 1 344.543 4.092 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NCc1cccn1C(F)F ZINC001181153363 1051166558 /nfs/dbraw/zinc/16/65/58/1051166558.db2.gz CIWOSHVXTAKOQL-GOSISDBHSA-N 2 1 347.453 4.274 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1cccn1C(F)F ZINC001181153363 1051166568 /nfs/dbraw/zinc/16/65/68/1051166568.db2.gz CIWOSHVXTAKOQL-GOSISDBHSA-N 2 1 347.453 4.274 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccn1C(F)F ZINC001181153363 1051166575 /nfs/dbraw/zinc/16/65/75/1051166575.db2.gz CIWOSHVXTAKOQL-GOSISDBHSA-N 2 1 347.453 4.274 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccn1C(F)F ZINC001181153363 1051166582 /nfs/dbraw/zinc/16/65/82/1051166582.db2.gz CIWOSHVXTAKOQL-GOSISDBHSA-N 2 1 347.453 4.274 20 0 EIADMP CC(C)(C)[C@@]1(C[NH2+][C@@H]2CSC2(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001181204826 1051180754 /nfs/dbraw/zinc/18/07/54/1051180754.db2.gz IMBBSNPNWGJUDA-WIYYLYMNSA-N 2 1 346.584 4.408 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775388776 1051187546 /nfs/dbraw/zinc/18/75/46/1051187546.db2.gz TVIZAXSSTPSNNB-GUYCJALGSA-N 2 1 340.483 4.310 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC[N@@H+]1C ZINC000775393143 1051199975 /nfs/dbraw/zinc/19/99/75/1051199975.db2.gz LNHQCZMULJIFDY-HACGYAERSA-N 2 1 340.483 4.451 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC[N@H+]1C ZINC000775393143 1051199983 /nfs/dbraw/zinc/19/99/83/1051199983.db2.gz LNHQCZMULJIFDY-HACGYAERSA-N 2 1 340.483 4.451 20 0 EIADMP CC(C)c1ccc(C[N@H+]2CCO[C@H](CCC[NH+](C)C)C2)c(C(C)C)c1 ZINC001174933822 1051257142 /nfs/dbraw/zinc/25/71/42/1051257142.db2.gz OWLWOSKBVPOHLJ-OAQYLSRUSA-N 2 1 346.559 4.476 20 0 EIADMP Cc1cc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cs1 ZINC001190793110 1051279690 /nfs/dbraw/zinc/27/96/90/1051279690.db2.gz ZRSGTAPEEUQBDL-UHFFFAOYSA-N 2 1 328.525 4.401 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190826066 1051285691 /nfs/dbraw/zinc/28/56/91/1051285691.db2.gz FCEIDLAOTIVWPG-HKBOAZHASA-N 2 1 336.564 4.170 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190826066 1051285710 /nfs/dbraw/zinc/28/57/10/1051285710.db2.gz FCEIDLAOTIVWPG-HKBOAZHASA-N 2 1 336.564 4.170 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C(C)C)CC2 ZINC000154854277 1051344889 /nfs/dbraw/zinc/34/48/89/1051344889.db2.gz YZIPBRPUWSOBNF-JOCHJYFZSA-N 2 1 338.495 4.313 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)cc1 ZINC000154873371 1051347352 /nfs/dbraw/zinc/34/73/52/1051347352.db2.gz UFPRYDRLQIXZSL-QGZVFWFLSA-N 2 1 326.484 4.386 20 0 EIADMP CC[N@H+]1CCCC[C@H]1C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001182001605 1051368906 /nfs/dbraw/zinc/36/89/06/1051368906.db2.gz MGSGDZATHOBDRT-INIZCTEOSA-N 2 1 342.508 4.446 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cncs1 ZINC000268809610 1051393820 /nfs/dbraw/zinc/39/38/20/1051393820.db2.gz KDUIFGQGKPJALF-HZPDHXFCSA-N 2 1 329.513 4.368 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1cncs1 ZINC000268809610 1051393828 /nfs/dbraw/zinc/39/38/28/1051393828.db2.gz KDUIFGQGKPJALF-HZPDHXFCSA-N 2 1 329.513 4.368 20 0 EIADMP COC1CCC(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001182196752 1051423912 /nfs/dbraw/zinc/42/39/12/1051423912.db2.gz VYPCYJWRXXRGSQ-NJEKYYFSSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]1CC(C)(C)C[C@H]1[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000774300337 1051545644 /nfs/dbraw/zinc/54/56/44/1051545644.db2.gz DQYCVOBYKMIRFJ-OXJNMPFZSA-N 2 1 329.532 4.454 20 0 EIADMP [NH3+]C[C@]1(F)CCC[N@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC1 ZINC001205571010 1051549283 /nfs/dbraw/zinc/54/92/83/1051549283.db2.gz RRFIKNOGXFYMBT-AWEZNQCLSA-N 2 1 339.669 4.300 20 0 EIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC1 ZINC001205571010 1051549290 /nfs/dbraw/zinc/54/92/90/1051549290.db2.gz RRFIKNOGXFYMBT-AWEZNQCLSA-N 2 1 339.669 4.300 20 0 EIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2cc(Cl)ccc2C(F)(F)F)CC1 ZINC001205571021 1051549829 /nfs/dbraw/zinc/54/98/29/1051549829.db2.gz RSJKGHJSRFFWAR-CQSZACIVSA-N 2 1 338.776 4.012 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1cc2cc(Br)ccc2o1 ZINC000271879922 1051554693 /nfs/dbraw/zinc/55/46/93/1051554693.db2.gz PEQLCIXJWCBADN-LLVKDONJSA-N 2 1 348.244 4.051 20 0 EIADMP Cc1csc2sc(C[N@H+]3CCC[C@@](F)(C[NH3+])CC3)c(C)c12 ZINC001205571608 1051556417 /nfs/dbraw/zinc/55/64/17/1051556417.db2.gz VYEMVODJFJPIQO-INIZCTEOSA-N 2 1 326.506 4.233 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1ccc2cc(OC)ccc2c1 ZINC000163255770 1051558638 /nfs/dbraw/zinc/55/86/38/1051558638.db2.gz FLZBKIBHOAJHLJ-HRAATJIYSA-N 2 1 326.484 4.231 20 0 EIADMP [NH3+]C[C@]1(F)CCC[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC1 ZINC001205571826 1051558599 /nfs/dbraw/zinc/55/85/99/1051558599.db2.gz YQEVOZBHXNXWIE-AWEZNQCLSA-N 2 1 339.669 4.300 20 0 EIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC1 ZINC001205571826 1051558609 /nfs/dbraw/zinc/55/86/09/1051558609.db2.gz YQEVOZBHXNXWIE-AWEZNQCLSA-N 2 1 339.669 4.300 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc2c(c1)OCCCO2 ZINC000157954449 1051687852 /nfs/dbraw/zinc/68/78/52/1051687852.db2.gz CTIPVIOBBJWKRF-MSOLQXFVSA-N 2 1 346.515 4.011 20 0 EIADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cccc(C(C)C)c2)CC1 ZINC001192324263 1051692665 /nfs/dbraw/zinc/69/26/65/1051692665.db2.gz HXQZKKIXIDPYKP-UHFFFAOYSA-N 2 1 346.559 4.380 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158098861 1051708918 /nfs/dbraw/zinc/70/89/18/1051708918.db2.gz QPGLTDHJYHYLNR-RDJZCZTQSA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000158098861 1051708937 /nfs/dbraw/zinc/70/89/37/1051708937.db2.gz QPGLTDHJYHYLNR-RDJZCZTQSA-N 2 1 343.540 4.419 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000158103227 1051710855 /nfs/dbraw/zinc/71/08/55/1051710855.db2.gz BFFSAQLGOJJYKT-UONOGXRCSA-N 2 1 328.472 4.036 20 0 EIADMP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@H]3CCC[N@@H+](C)C3)cs2)cs1 ZINC000158172875 1051721772 /nfs/dbraw/zinc/72/17/72/1051721772.db2.gz QRAPHEGZORWBNI-TZMCWYRMSA-N 2 1 335.542 4.172 20 0 EIADMP COc1cc(C[N@@H+](C)CCCC[NH+]2CCCCC2)ccc1SC ZINC001175687091 1051729788 /nfs/dbraw/zinc/72/97/88/1051729788.db2.gz IXQXSTZQHFSGBG-UHFFFAOYSA-N 2 1 336.545 4.115 20 0 EIADMP CC[C@H](CSC)[N@@H+](C)CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001192635004 1051784803 /nfs/dbraw/zinc/78/48/03/1051784803.db2.gz IEJPDYZHJJWUBU-OAQYLSRUSA-N 2 1 348.600 4.405 20 0 EIADMP CC[C@@H](CSC)[N@@H+](C)CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001192634996 1051786010 /nfs/dbraw/zinc/78/60/10/1051786010.db2.gz IEJPDYZHJJWUBU-NRFANRHFSA-N 2 1 348.600 4.405 20 0 EIADMP COCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000159082972 1051810732 /nfs/dbraw/zinc/81/07/32/1051810732.db2.gz YMCWTSIPGJNTDX-CYBMUJFWSA-N 2 1 345.314 4.145 20 0 EIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@@H]1C[N@H+](CC[C@@H]1CCCC1(F)F)C2 ZINC001175974395 1051856512 /nfs/dbraw/zinc/85/65/12/1051856512.db2.gz UUXHMSUGLUUFPK-SLFFLAALSA-N 2 1 348.481 4.266 20 0 EIADMP C[C@]12C[NH+](CC[C@@H]3CCCC3(F)F)C[C@H]1C[N@H+](Cc1ccccc1)C2 ZINC001175974395 1051856519 /nfs/dbraw/zinc/85/65/19/1051856519.db2.gz UUXHMSUGLUUFPK-SLFFLAALSA-N 2 1 348.481 4.266 20 0 EIADMP C[C@]12C[NH+](CC[C@@H]3CCCC3(F)F)C[C@H]1C[N@@H+](Cc1ccccc1)C2 ZINC001175974395 1051856521 /nfs/dbraw/zinc/85/65/21/1051856521.db2.gz UUXHMSUGLUUFPK-SLFFLAALSA-N 2 1 348.481 4.266 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)CC[N@@H+]1C ZINC000621765812 1051941087 /nfs/dbraw/zinc/94/10/87/1051941087.db2.gz FNJAWHFVKXRYNS-XJKSGUPXSA-N 2 1 326.406 4.157 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)CC[N@H+]1C ZINC000621765812 1051941098 /nfs/dbraw/zinc/94/10/98/1051941098.db2.gz FNJAWHFVKXRYNS-XJKSGUPXSA-N 2 1 326.406 4.157 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccc(F)cc1F ZINC000163499819 1051991592 /nfs/dbraw/zinc/99/15/92/1051991592.db2.gz KWVORGMIVPFZJS-LJQANCHMSA-N 2 1 345.437 4.378 20 0 EIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+][C@H](CCc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC001184389482 1052002129 /nfs/dbraw/zinc/00/21/29/1052002129.db2.gz XKFWUXZHWNYIKD-KEZOAJOQSA-N 2 1 348.534 4.160 20 0 EIADMP CCC(CC)[C@@H](c1ccc(Cl)cc1)[N@H+](C)C[C@H](O)C[NH+](C)CC ZINC001193974315 1052035252 /nfs/dbraw/zinc/03/52/52/1052035252.db2.gz BOIUGEMZNICWEB-MOPGFXCFSA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@@H](c1ccc(Cl)cc1)[N@@H+](C)C[C@H](O)C[NH+](C)CC ZINC001193974315 1052035254 /nfs/dbraw/zinc/03/52/54/1052035254.db2.gz BOIUGEMZNICWEB-MOPGFXCFSA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@@H](c1ccc(Cl)cc1)[NH+](C)C[C@H](O)C[N@H+](C)CC ZINC001193974315 1052035257 /nfs/dbraw/zinc/03/52/57/1052035257.db2.gz BOIUGEMZNICWEB-MOPGFXCFSA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@@H](c1ccc(Cl)cc1)[NH+](C)C[C@H](O)C[N@@H+](C)CC ZINC001193974315 1052035258 /nfs/dbraw/zinc/03/52/58/1052035258.db2.gz BOIUGEMZNICWEB-MOPGFXCFSA-N 2 1 340.939 4.062 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(OCC(C)C)cc1 ZINC000164652413 1052035767 /nfs/dbraw/zinc/03/57/67/1052035767.db2.gz JPKIDYMTCOVRFF-KRWDZBQOSA-N 2 1 329.488 4.357 20 0 EIADMP Cc1ccsc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165309714 1052058055 /nfs/dbraw/zinc/05/80/55/1052058055.db2.gz DLVLXDIJMLATDM-HKUYNNGSSA-N 2 1 328.525 4.272 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000167511223 1052121191 /nfs/dbraw/zinc/12/11/91/1052121191.db2.gz PEXOPKSNMZTDDZ-VWKPWSFCSA-N 2 1 348.494 4.048 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC(C)(C)[C@H](c2ccccc2)C1 ZINC001176567066 1052132956 /nfs/dbraw/zinc/13/29/56/1052132956.db2.gz GURAHEMQQMICAJ-FQEVSTJZSA-N 2 1 325.500 4.487 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC(C)(C)[C@H](c2ccccc2)C1 ZINC001176567066 1052132965 /nfs/dbraw/zinc/13/29/65/1052132965.db2.gz GURAHEMQQMICAJ-FQEVSTJZSA-N 2 1 325.500 4.487 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426544 1052146893 /nfs/dbraw/zinc/14/68/93/1052146893.db2.gz LBWINWMPIAIAMK-PMACEKPBSA-N 2 1 332.532 4.082 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426544 1052146904 /nfs/dbraw/zinc/14/69/04/1052146904.db2.gz LBWINWMPIAIAMK-PMACEKPBSA-N 2 1 332.532 4.082 20 0 EIADMP C[N@H+]1CCC[C@@]2(CC[NH+](CCCOc3cccc(C(C)(C)C)c3)C2)C1 ZINC001194641022 1052184204 /nfs/dbraw/zinc/18/42/04/1052184204.db2.gz LEEWUXXFUFXLRO-JOCHJYFZSA-N 2 1 344.543 4.171 20 0 EIADMP C[NH+]1CCC[C@@]2(CC[N@H+](CCCOc3cccc(C(C)(C)C)c3)C2)C1 ZINC001194641022 1052184208 /nfs/dbraw/zinc/18/42/08/1052184208.db2.gz LEEWUXXFUFXLRO-JOCHJYFZSA-N 2 1 344.543 4.171 20 0 EIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](CCCOc3cccc(C(C)(C)C)c3)C2)C1 ZINC001194641022 1052184211 /nfs/dbraw/zinc/18/42/11/1052184211.db2.gz LEEWUXXFUFXLRO-JOCHJYFZSA-N 2 1 344.543 4.171 20 0 EIADMP C[NH+]1CCC([NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000072726304 1052580341 /nfs/dbraw/zinc/58/03/41/1052580341.db2.gz BRTZRAVKLAPACP-UHFFFAOYSA-N 2 1 344.886 4.103 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2=Cc3ccccc3OC2)CC[N@@H+]1Cc1ccccc1 ZINC000175978053 1052602516 /nfs/dbraw/zinc/60/25/16/1052602516.db2.gz IYXJESHBXMTHCL-AVRDEDQJSA-N 2 1 348.490 4.105 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2=Cc3ccccc3OC2)CC[N@H+]1Cc1ccccc1 ZINC000175978053 1052602520 /nfs/dbraw/zinc/60/25/20/1052602520.db2.gz IYXJESHBXMTHCL-AVRDEDQJSA-N 2 1 348.490 4.105 20 0 EIADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC2(CCOCC2)CC1 ZINC000671311762 1052617289 /nfs/dbraw/zinc/61/72/89/1052617289.db2.gz LRTPYGOVERXHMK-UHFFFAOYSA-N 2 1 344.543 4.037 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC2(CCOCC2)CC1 ZINC000671311762 1052617294 /nfs/dbraw/zinc/61/72/94/1052617294.db2.gz LRTPYGOVERXHMK-UHFFFAOYSA-N 2 1 344.543 4.037 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1OCC ZINC000623339360 1052626924 /nfs/dbraw/zinc/62/69/24/1052626924.db2.gz WNGHTURHUOWGAX-NVXWUHKLSA-N 2 1 334.504 4.007 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1OCC ZINC000623339360 1052626928 /nfs/dbraw/zinc/62/69/28/1052626928.db2.gz WNGHTURHUOWGAX-NVXWUHKLSA-N 2 1 334.504 4.007 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CN[C@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357194 1052634359 /nfs/dbraw/zinc/63/43/59/1052634359.db2.gz BZJDZANHKHMQGR-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CN[C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623357194 1052634363 /nfs/dbraw/zinc/63/43/63/1052634363.db2.gz BZJDZANHKHMQGR-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CN[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623357194 1052634367 /nfs/dbraw/zinc/63/43/67/1052634367.db2.gz BZJDZANHKHMQGR-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357194 1052634370 /nfs/dbraw/zinc/63/43/70/1052634370.db2.gz BZJDZANHKHMQGR-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357194 1052634372 /nfs/dbraw/zinc/63/43/72/1052634372.db2.gz BZJDZANHKHMQGR-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623357194 1052634374 /nfs/dbraw/zinc/63/43/74/1052634374.db2.gz BZJDZANHKHMQGR-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(C[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623357194 1052634375 /nfs/dbraw/zinc/63/43/75/1052634375.db2.gz BZJDZANHKHMQGR-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623382629 1052640737 /nfs/dbraw/zinc/64/07/37/1052640737.db2.gz NQGYSOUHKZLTGJ-CJNGLKHVSA-N 2 1 328.422 4.099 20 0 EIADMP C[C@@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000623447495 1052657598 /nfs/dbraw/zinc/65/75/98/1052657598.db2.gz TUJCJWJLQWLRQQ-RHSMWYFYSA-N 2 1 334.479 4.138 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000623447495 1052657599 /nfs/dbraw/zinc/65/75/99/1052657599.db2.gz TUJCJWJLQWLRQQ-RHSMWYFYSA-N 2 1 334.479 4.138 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1 ZINC000623656266 1052698601 /nfs/dbraw/zinc/69/86/01/1052698601.db2.gz QMZCRKWVRIJEII-LJQANCHMSA-N 2 1 338.495 4.184 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(F)cc1C(F)(F)F ZINC000623866241 1052825850 /nfs/dbraw/zinc/82/58/50/1052825850.db2.gz PLKBZOAQDNWXEH-FPMFFAJLSA-N 2 1 330.369 4.122 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)cc1C(F)(F)F ZINC000623866241 1052825853 /nfs/dbraw/zinc/82/58/53/1052825853.db2.gz PLKBZOAQDNWXEH-FPMFFAJLSA-N 2 1 330.369 4.122 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCc3scnc32)c1 ZINC000623867324 1052830204 /nfs/dbraw/zinc/83/02/04/1052830204.db2.gz YBNRKUSUSILHAM-QGZVFWFLSA-N 2 1 329.513 4.152 20 0 EIADMP C[C@H]([NH2+]CCSc1ccccc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185706691 1053021099 /nfs/dbraw/zinc/02/10/99/1053021099.db2.gz JJEFSPWWSXWCRU-HOTGVXAUSA-N 2 1 336.520 4.160 20 0 EIADMP Fc1cc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1Cl ZINC000380910870 1053047563 /nfs/dbraw/zinc/04/75/63/1053047563.db2.gz LQOYBRAFXOJGPH-KRWDZBQOSA-N 2 1 332.850 4.091 20 0 EIADMP C[C@H]([NH2+]C1CC(c2ccccc2)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381292740 1053064286 /nfs/dbraw/zinc/06/42/86/1053064286.db2.gz XSUKPMYVVGHJHO-AQUNBJMESA-N 2 1 334.507 4.433 20 0 EIADMP CC[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)[C@@H]1CCOC(C)(C)C1 ZINC001194781834 1053091647 /nfs/dbraw/zinc/09/16/47/1053091647.db2.gz INGGEAXNQHOVSE-OAQYLSRUSA-N 2 1 344.543 4.452 20 0 EIADMP FC1(F)CCCC[C@@H]1C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC000381874506 1053111160 /nfs/dbraw/zinc/11/11/60/1053111160.db2.gz JUQCFDHXBDZFCH-HSALFYBXSA-N 2 1 348.481 4.266 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000381874506 1053111222 /nfs/dbraw/zinc/11/12/22/1053111222.db2.gz JUQCFDHXBDZFCH-HSALFYBXSA-N 2 1 348.481 4.266 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000381874506 1053111261 /nfs/dbraw/zinc/11/12/61/1053111261.db2.gz JUQCFDHXBDZFCH-HSALFYBXSA-N 2 1 348.481 4.266 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+][C@H]3CCC[C@H]3Cc3ccccn3)CC2)cc1 ZINC000850543148 1053303887 /nfs/dbraw/zinc/30/38/87/1053303887.db2.gz ZAOGKQZBUZJSRL-REWPJTCUSA-N 2 1 349.522 4.047 20 0 EIADMP CCOc1cccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000794829650 1053441981 /nfs/dbraw/zinc/44/19/81/1053441981.db2.gz VOZNHRGEJZUUDX-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP CCOc1cccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000794829644 1053442066 /nfs/dbraw/zinc/44/20/66/1053442066.db2.gz VOZNHRGEJZUUDX-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cc(Cl)c(N)c(Cl)c1 ZINC000794832582 1053443462 /nfs/dbraw/zinc/44/34/62/1053443462.db2.gz AHJQFORUNBMLRG-LMWSTFAQSA-N 2 1 342.314 4.243 20 0 EIADMP Fc1cccc2cc(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)cnc12 ZINC000865397182 1053491616 /nfs/dbraw/zinc/49/16/16/1053491616.db2.gz AHRKSINPELTNFV-UHFFFAOYSA-N 2 1 349.453 4.128 20 0 EIADMP CC(F)(F)C(C)(C)C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000865789074 1053594193 /nfs/dbraw/zinc/59/41/93/1053594193.db2.gz OOZKWWJVHJMLHC-UHFFFAOYSA-N 2 1 342.449 4.104 20 0 EIADMP CC(C)[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C(C)C)c1ccccn1 ZINC000866231827 1053658798 /nfs/dbraw/zinc/65/87/98/1053658798.db2.gz AQJMBHBIRKOZEW-OAQYLSRUSA-N 2 1 325.500 4.409 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](c2ccccn2)C(C)C)cc1F ZINC000866241390 1053660625 /nfs/dbraw/zinc/66/06/25/1053660625.db2.gz AMYURWDHMRUVJC-FQEVSTJZSA-N 2 1 338.430 4.202 20 0 EIADMP CC(C)[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1)c1ccccn1 ZINC000866247032 1053662172 /nfs/dbraw/zinc/66/21/72/1053662172.db2.gz QHTYVMMTLAXZDL-OAQYLSRUSA-N 2 1 325.500 4.409 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000386441172 1053728213 /nfs/dbraw/zinc/72/82/13/1053728213.db2.gz PULPQTXNCZANRX-UGKGYDQZSA-N 2 1 338.495 4.258 20 0 EIADMP FC(F)(F)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000386455771 1053732050 /nfs/dbraw/zinc/73/20/50/1053732050.db2.gz RYUZVZIOURDVMB-SFHVURJKSA-N 2 1 348.412 4.317 20 0 EIADMP CCC1([NH+]2CCCC2)CC[NH+](C[C@@H]2CC[C@@H](c3ccccc3)O2)CC1 ZINC001196727900 1053732854 /nfs/dbraw/zinc/73/28/54/1053732854.db2.gz OBCNSIVWICNIAK-SFTDATJTSA-N 2 1 342.527 4.247 20 0 EIADMP CCC1([NH+]2CCCC2)CC[NH+](C[C@H]2CC[C@H](c3ccccc3)O2)CC1 ZINC001196727898 1053734197 /nfs/dbraw/zinc/73/41/97/1053734197.db2.gz OBCNSIVWICNIAK-NHCUHLMSSA-N 2 1 342.527 4.247 20 0 EIADMP CC(C)[N@@H+](C)Cc1cc(O[C@H]2CC[NH+](CCCC(C)(C)C)C2)ccn1 ZINC000856604483 1054091837 /nfs/dbraw/zinc/09/18/37/1054091837.db2.gz NZYAQMLBJOIJSM-FQEVSTJZSA-N 2 1 347.547 4.201 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@H]2CC[N@H+](CCCC(C)(C)C)C2)ccn1 ZINC000856604483 1054091848 /nfs/dbraw/zinc/09/18/48/1054091848.db2.gz NZYAQMLBJOIJSM-FQEVSTJZSA-N 2 1 347.547 4.201 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@H]2CC[N@@H+](CCCC(C)(C)C)C2)ccn1 ZINC000856604483 1054091860 /nfs/dbraw/zinc/09/18/60/1054091860.db2.gz NZYAQMLBJOIJSM-FQEVSTJZSA-N 2 1 347.547 4.201 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cccc(O)c1F ZINC000872019329 1054335074 /nfs/dbraw/zinc/33/50/74/1054335074.db2.gz VWDCPAAVGPICKL-HNNXBMFYSA-N 2 1 330.447 4.224 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc(O)ccc2F)c1 ZINC000872027616 1054344904 /nfs/dbraw/zinc/34/49/04/1054344904.db2.gz KZGCRUNXFCHKSA-HNNXBMFYSA-N 2 1 330.447 4.222 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc(O)ccc2F)c1 ZINC000872027616 1054344921 /nfs/dbraw/zinc/34/49/21/1054344921.db2.gz KZGCRUNXFCHKSA-HNNXBMFYSA-N 2 1 330.447 4.222 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCOC3(CCCC3)C2)[C@@H]1c1cccs1 ZINC000872038084 1054353468 /nfs/dbraw/zinc/35/34/68/1054353468.db2.gz HTYMGSNOBVFSGI-ZIFCJYIRSA-N 2 1 348.556 4.212 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCOC3(CCCC3)C2)[C@@H]1c1cccs1 ZINC000872038084 1054353485 /nfs/dbraw/zinc/35/34/85/1054353485.db2.gz HTYMGSNOBVFSGI-ZIFCJYIRSA-N 2 1 348.556 4.212 20 0 EIADMP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000872066304 1054375298 /nfs/dbraw/zinc/37/52/98/1054375298.db2.gz GWMCKXHFCUYFPH-SJORKVTESA-N 2 1 328.422 4.219 20 0 EIADMP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)C1 ZINC001199265875 1054377014 /nfs/dbraw/zinc/37/70/14/1054377014.db2.gz FANKTOINVGYHLA-VLCRHTCISA-N 2 1 344.543 4.498 20 0 EIADMP 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 1054392708 /nfs/dbraw/zinc/39/27/08/1054392708.db2.gz UYJZZTKBYDONBH-SNRWMIJCSA-N 2 1 344.543 4.210 20 0 EIADMP CN(C)c1cc[nH+]cc1C[NH2+]CC1(c2ccc(F)cc2)CCCCC1 ZINC001199751348 1054462510 /nfs/dbraw/zinc/46/25/10/1054462510.db2.gz PEEOXFNFJRYAPA-UHFFFAOYSA-N 2 1 341.474 4.278 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cccc2ncccc12 ZINC000873012329 1054477661 /nfs/dbraw/zinc/47/76/61/1054477661.db2.gz QMHWBDXGQKGKAF-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP [NH3+][C@@H](C[C@@H]1CCC[N@@H+](Cc2cnc(C3CC3)s2)C1)C1CCCC1 ZINC000873232528 1054511036 /nfs/dbraw/zinc/51/10/36/1054511036.db2.gz SDZZWXWQRPDLKB-KSSFIOAISA-N 2 1 333.545 4.140 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(OC)c(OC)c2)c1 ZINC000173387735 1054557528 /nfs/dbraw/zinc/55/75/28/1054557528.db2.gz CIUHDTVTKQXEAV-INIZCTEOSA-N 2 1 342.483 4.006 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1cccc(C(F)(F)F)c1)Cc1ccccc1 ZINC000061556847 1054762372 /nfs/dbraw/zinc/76/23/72/1054762372.db2.gz UDHGTSKAJMDLKQ-UHFFFAOYSA-N 2 1 336.401 4.317 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(NCC3CCSCC3)cc2)CC1 ZINC000876867420 1054977050 /nfs/dbraw/zinc/97/70/50/1054977050.db2.gz VIECVRSJJFZGOF-UHFFFAOYSA-N 2 1 347.572 4.020 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc2nc(Cl)ccc2s1 ZINC000877058536 1055008170 /nfs/dbraw/zinc/00/81/70/1055008170.db2.gz ZQVJWWZJBMIXOA-UHFFFAOYSA-N 2 1 334.876 4.025 20 0 EIADMP C[N@H+](Cc1ccco1)Cc1cncc2c1CC[NH+](CCC(C)(C)C)C2 ZINC001202079403 1055019585 /nfs/dbraw/zinc/01/95/85/1055019585.db2.gz YRBGFTOHQQHADK-UHFFFAOYSA-N 2 1 341.499 4.101 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1cncc2c1CC[NH+](CCC(C)(C)C)C2 ZINC001202079403 1055019603 /nfs/dbraw/zinc/01/96/03/1055019603.db2.gz YRBGFTOHQQHADK-UHFFFAOYSA-N 2 1 341.499 4.101 20 0 EIADMP C[NH+](Cc1ccco1)Cc1cncc2c1CC[N@H+](CCC(C)(C)C)C2 ZINC001202079403 1055019620 /nfs/dbraw/zinc/01/96/20/1055019620.db2.gz YRBGFTOHQQHADK-UHFFFAOYSA-N 2 1 341.499 4.101 20 0 EIADMP C[NH+](Cc1ccco1)Cc1cncc2c1CC[N@@H+](CCC(C)(C)C)C2 ZINC001202079403 1055019633 /nfs/dbraw/zinc/01/96/33/1055019633.db2.gz YRBGFTOHQQHADK-UHFFFAOYSA-N 2 1 341.499 4.101 20 0 EIADMP Cc1c(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)ccnc1F ZINC000862270939 1055041014 /nfs/dbraw/zinc/04/10/14/1055041014.db2.gz AMSVKXUJQVLLHH-INIZCTEOSA-N 2 1 341.474 4.051 20 0 EIADMP Clc1ccc2sc(C[NH2+]C3CC([NH+]4CCCCC4)C3)cc2n1 ZINC000877492309 1055063179 /nfs/dbraw/zinc/06/31/79/1055063179.db2.gz UTWHRLYFQZVDHX-UHFFFAOYSA-N 2 1 335.904 4.056 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000877546917 1055076433 /nfs/dbraw/zinc/07/64/33/1055076433.db2.gz NPUPSUNBSGIMEB-VJNRDTIXSA-N 2 1 330.541 4.056 20 0 EIADMP c1ccc([C@H]2C[C@@H]([NH2+]CCC3SCCS3)CC[N@@H+]2C2CC2)cc1 ZINC000877636969 1055095486 /nfs/dbraw/zinc/09/54/86/1055095486.db2.gz LSQFGIGWIQOQEI-FUHWJXTLSA-N 2 1 348.581 4.140 20 0 EIADMP c1ccc([C@H]2C[C@@H]([NH2+]CCC3SCCS3)CC[N@H+]2C2CC2)cc1 ZINC000877636969 1055095496 /nfs/dbraw/zinc/09/54/96/1055095496.db2.gz LSQFGIGWIQOQEI-FUHWJXTLSA-N 2 1 348.581 4.140 20 0 EIADMP C[NH+](C)[C@H]1CCCC[C@@H]1Nc1ccc2c(c1)C[N@H+](Cc1ccccc1)C2 ZINC001168600887 1055101353 /nfs/dbraw/zinc/10/13/53/1055101353.db2.gz HOMUDHIEDHZFRE-GOTSBHOMSA-N 2 1 349.522 4.487 20 0 EIADMP Clc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001168676001 1056650423 /nfs/dbraw/zinc/65/04/23/1056650423.db2.gz MGWIMSVXIZFQBH-IBGZPJMESA-N 2 1 340.898 4.061 20 0 EIADMP CSc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000062426732 1056724286 /nfs/dbraw/zinc/72/42/86/1056724286.db2.gz KJRBCKLMSDCTHQ-HXUWFJFHSA-N 2 1 340.536 4.410 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cnccc32)C1 ZINC000183201045 1059949752 /nfs/dbraw/zinc/94/97/52/1059949752.db2.gz TWOMJUITTMQFJZ-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379638613 1060143422 /nfs/dbraw/zinc/14/34/22/1060143422.db2.gz UQWCRVDEWZETOB-WIYYLYMNSA-N 2 1 338.495 4.146 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379638613 1060143445 /nfs/dbraw/zinc/14/34/45/1060143445.db2.gz UQWCRVDEWZETOB-WIYYLYMNSA-N 2 1 338.495 4.146 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccnc(Cl)c1 ZINC000766466660 1060370920 /nfs/dbraw/zinc/37/09/20/1060370920.db2.gz ZNPOAJVJVYBDSK-JTDSTZFVSA-N 2 1 343.902 4.296 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccnc(Cl)c1 ZINC000766466660 1060370944 /nfs/dbraw/zinc/37/09/44/1060370944.db2.gz ZNPOAJVJVYBDSK-JTDSTZFVSA-N 2 1 343.902 4.296 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(SC(F)(F)F)cc1)C2 ZINC001169091390 1060645113 /nfs/dbraw/zinc/64/51/13/1060645113.db2.gz QBYJQMRCNWLOOS-BTTYYORXSA-N 2 1 330.419 4.013 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(SC(F)(F)F)cc1)C2 ZINC001169091390 1060645125 /nfs/dbraw/zinc/64/51/25/1060645125.db2.gz QBYJQMRCNWLOOS-BTTYYORXSA-N 2 1 330.419 4.013 20 0 EIADMP FC1(F)CCC[C@@H](Nc2ccc3c(c2)[nH+]cn3[C@H]2CCC[NH2+]CC2)C1 ZINC001169213865 1060694771 /nfs/dbraw/zinc/69/47/71/1060694771.db2.gz QCMQDAODUHYJMS-CVEARBPZSA-N 2 1 348.441 4.341 20 0 EIADMP FC1(F)CCC[C@H](Nc2ccc3c(c2)[nH+]cn3[C@H]2CCC[NH2+]CC2)C1 ZINC001169213866 1060695027 /nfs/dbraw/zinc/69/50/27/1060695027.db2.gz QCMQDAODUHYJMS-HOTGVXAUSA-N 2 1 348.441 4.341 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(Cc3ccccc3)CCC(F)(F)CC2)CC1 ZINC001169238965 1060713406 /nfs/dbraw/zinc/71/34/06/1060713406.db2.gz OUULSJXBJOBIKJ-UHFFFAOYSA-N 2 1 336.470 4.251 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(c3ccccc3C)CCC(F)(F)CC2)CC1 ZINC001169240581 1060717987 /nfs/dbraw/zinc/71/79/87/1060717987.db2.gz ARTHLQFQFISKDP-UHFFFAOYSA-N 2 1 336.470 4.474 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cccc(C(C)(C)C)c2)[C@@H](C)C1 ZINC001169555160 1060856559 /nfs/dbraw/zinc/85/65/59/1060856559.db2.gz NQRBEKGDIJDOAC-RXVVDRJESA-N 2 1 346.559 4.211 20 0 EIADMP CC1(C)CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCS1 ZINC001169871919 1061015004 /nfs/dbraw/zinc/01/50/04/1061015004.db2.gz DNFIIZQNXAPJNB-UHFFFAOYSA-N 2 1 332.557 4.390 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1COc1ccc(Cl)cc1 ZINC000767346423 1061202463 /nfs/dbraw/zinc/20/24/63/1061202463.db2.gz KYOMLTHSLQPRLG-GOSISDBHSA-N 2 1 347.890 4.169 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1COc1ccc(Cl)cc1 ZINC000767346423 1061202492 /nfs/dbraw/zinc/20/24/92/1061202492.db2.gz KYOMLTHSLQPRLG-GOSISDBHSA-N 2 1 347.890 4.169 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(Br)s1 ZINC000038003493 202080881 /nfs/dbraw/zinc/08/08/81/202080881.db2.gz QZHJLTCTJVYFRI-NSHDSACASA-N 2 1 345.350 4.424 20 0 EIADMP CC(C)(C)C[N@@H+](Cc1ccccc1C(F)(F)F)C1CC[NH2+]CC1 ZINC000036093128 202315023 /nfs/dbraw/zinc/31/50/23/202315023.db2.gz NYTKHXFTKWNXNT-UHFFFAOYSA-N 2 1 328.422 4.306 20 0 EIADMP COc1ccc2c[nH+]c(N3CCCC[C@H]3CC[NH+]3CCCC3)cc2c1 ZINC001165050613 721973491 /nfs/dbraw/zinc/97/34/91/721973491.db2.gz ZSBYAFHWJQUBQZ-IBGZPJMESA-N 2 1 339.483 4.088 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCc4ccccc43)C2)c1 ZINC000532219514 1032101045 /nfs/dbraw/zinc/10/10/45/1032101045.db2.gz WYNUXRUDTBNCGV-OXQOHEQNSA-N 2 1 326.509 4.237 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CCc4ccccc43)C2)c1 ZINC000532219514 1032101051 /nfs/dbraw/zinc/10/10/51/1032101051.db2.gz WYNUXRUDTBNCGV-OXQOHEQNSA-N 2 1 326.509 4.237 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc3c(c2)CC(C)(C)O3)C1 ZINC000729678963 1032128368 /nfs/dbraw/zinc/12/83/68/1032128368.db2.gz YIUYZORGKRSIDT-QGZVFWFLSA-N 2 1 330.516 4.002 20 0 EIADMP CCc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)o1 ZINC000532367449 1032173765 /nfs/dbraw/zinc/17/37/65/1032173765.db2.gz OZWXYHPJBFBUDG-KRWDZBQOSA-N 2 1 326.484 4.364 20 0 EIADMP CCc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)o1 ZINC000532367449 1032173769 /nfs/dbraw/zinc/17/37/69/1032173769.db2.gz OZWXYHPJBFBUDG-KRWDZBQOSA-N 2 1 326.484 4.364 20 0 EIADMP FC1(F)CC(C[N@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)C1 ZINC000450451538 1032508946 /nfs/dbraw/zinc/50/89/46/1032508946.db2.gz HWCBVUCYSLUPBZ-IBGZPJMESA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC(C[NH+]2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)C1 ZINC000450451538 1032508956 /nfs/dbraw/zinc/50/89/56/1032508956.db2.gz HWCBVUCYSLUPBZ-IBGZPJMESA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)C1 ZINC000450451538 1032508962 /nfs/dbraw/zinc/50/89/62/1032508962.db2.gz HWCBVUCYSLUPBZ-IBGZPJMESA-N 2 1 334.454 4.020 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2)cc1 ZINC000178134620 1032529594 /nfs/dbraw/zinc/52/95/94/1032529594.db2.gz ANKMRMAMGNKVTM-HOTGVXAUSA-N 2 1 337.471 4.370 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccc(Cl)nc1 ZINC000760172512 1032561963 /nfs/dbraw/zinc/56/19/63/1032561963.db2.gz TXJBWUUUULGTTG-HNNXBMFYSA-N 2 1 335.923 4.430 20 0 EIADMP CCC[N@H+](CCC(C)(C)C)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000533380829 1032701486 /nfs/dbraw/zinc/70/14/86/1032701486.db2.gz GSDFYIRKZBKILK-UHFFFAOYSA-N 2 1 332.536 4.210 20 0 EIADMP CCC[N@@H+](CCC(C)(C)C)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000533380829 1032701499 /nfs/dbraw/zinc/70/14/99/1032701499.db2.gz GSDFYIRKZBKILK-UHFFFAOYSA-N 2 1 332.536 4.210 20 0 EIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccc(F)cc4)s3)C2)C1 ZINC000430144600 1018844904 /nfs/dbraw/zinc/84/49/04/1018844904.db2.gz CCLDXDNBNLTLPO-LJQANCHMSA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(-c4ccc(F)cc4)s3)C2)C1 ZINC000430144600 1018844907 /nfs/dbraw/zinc/84/49/07/1018844907.db2.gz CCLDXDNBNLTLPO-LJQANCHMSA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(-c4ccc(F)cc4)s3)C2)C1 ZINC000430144600 1018844911 /nfs/dbraw/zinc/84/49/11/1018844911.db2.gz CCLDXDNBNLTLPO-LJQANCHMSA-N 2 1 330.472 4.082 20 0 EIADMP Cc1csc([C@H](C)C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000274735589 1019085307 /nfs/dbraw/zinc/08/53/07/1019085307.db2.gz DAOHAAWPIFJESE-HHXXYDBFSA-N 2 1 343.540 4.055 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000432791579 1032811512 /nfs/dbraw/zinc/81/15/12/1032811512.db2.gz GTUMWXMLUUGTGI-NRFANRHFSA-N 2 1 338.495 4.278 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000432791579 1032811514 /nfs/dbraw/zinc/81/15/14/1032811514.db2.gz GTUMWXMLUUGTGI-NRFANRHFSA-N 2 1 338.495 4.278 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000432791580 1032812038 /nfs/dbraw/zinc/81/20/38/1032812038.db2.gz GTUMWXMLUUGTGI-OAQYLSRUSA-N 2 1 338.495 4.278 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000432791580 1032812043 /nfs/dbraw/zinc/81/20/43/1032812043.db2.gz GTUMWXMLUUGTGI-OAQYLSRUSA-N 2 1 338.495 4.278 20 0 EIADMP C[NH+]1CCC([NH2+]CC2(c3cccc(C(F)(F)F)c3)CCCC2)CC1 ZINC000237166748 1032850441 /nfs/dbraw/zinc/85/04/41/1032850441.db2.gz IQPDVJJJRFDPRM-UHFFFAOYSA-N 2 1 340.433 4.201 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(Cl)cn1 ZINC000274886555 1019842919 /nfs/dbraw/zinc/84/29/19/1019842919.db2.gz IQTUIZATKQCOEH-HNNXBMFYSA-N 2 1 329.875 4.182 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccc(Cl)cn1 ZINC000274928806 1019867615 /nfs/dbraw/zinc/86/76/15/1019867615.db2.gz QKRPMVDXCBDSCF-HNNXBMFYSA-N 2 1 331.891 4.426 20 0 EIADMP CCOC(C)(C)C[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001209074609 1019975816 /nfs/dbraw/zinc/97/58/16/1019975816.db2.gz DNVQTHZGZAULPZ-UHFFFAOYSA-N 2 1 338.923 4.051 20 0 EIADMP CCOC(C)(C)C[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001209074609 1019975837 /nfs/dbraw/zinc/97/58/37/1019975837.db2.gz DNVQTHZGZAULPZ-UHFFFAOYSA-N 2 1 338.923 4.051 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cccnc1Cl ZINC000154855339 1020059549 /nfs/dbraw/zinc/05/95/49/1020059549.db2.gz BVAUWYQMSWHWOB-HNNXBMFYSA-N 2 1 331.891 4.426 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cccnc1Cl ZINC000154855339 1020059553 /nfs/dbraw/zinc/05/95/53/1020059553.db2.gz BVAUWYQMSWHWOB-HNNXBMFYSA-N 2 1 331.891 4.426 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCc3ccc(F)cc32)cc1F ZINC000153717008 1020384973 /nfs/dbraw/zinc/38/49/73/1020384973.db2.gz ZYODISGBCLQQKE-IBGZPJMESA-N 2 1 339.389 4.236 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398187925 1020531338 /nfs/dbraw/zinc/53/13/38/1020531338.db2.gz LVOYFKRDSBKHFI-HMFYCAOWSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398187925 1020531347 /nfs/dbraw/zinc/53/13/47/1020531347.db2.gz LVOYFKRDSBKHFI-HMFYCAOWSA-N 2 1 340.486 4.257 20 0 EIADMP CC(C)n1ccc(C[C@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)n1 ZINC000543993053 1020944219 /nfs/dbraw/zinc/94/42/19/1020944219.db2.gz SRGFQMDQNGKURV-SFHVURJKSA-N 2 1 342.531 4.025 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2C[C@@H]3[C@H](C2)C3(F)F)CC1 ZINC001167307625 1021003121 /nfs/dbraw/zinc/00/31/21/1021003121.db2.gz ZHPPXFDOCRJVQA-ACDBMABISA-N 2 1 348.481 4.122 20 0 EIADMP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000655839884 1021005252 /nfs/dbraw/zinc/00/52/52/1021005252.db2.gz XZKRYTGXSNQLPB-UFYCRDLUSA-N 2 1 342.527 4.119 20 0 EIADMP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000655839884 1021005258 /nfs/dbraw/zinc/00/52/58/1021005258.db2.gz XZKRYTGXSNQLPB-UFYCRDLUSA-N 2 1 342.527 4.119 20 0 EIADMP CC[C@H]([NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)[C@H]1CCCCO1 ZINC000655850376 1021015465 /nfs/dbraw/zinc/01/54/65/1021015465.db2.gz VKMOHPZIUZDGNB-UIAACRFSSA-N 2 1 327.472 4.179 20 0 EIADMP C[C@@H](NCc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccncc1F ZINC000340469444 1021072930 /nfs/dbraw/zinc/07/29/30/1021072930.db2.gz JRMTVAAEYVEIHA-IAGOWNOFSA-N 2 1 341.474 4.303 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccncc1F ZINC000340469444 1021072938 /nfs/dbraw/zinc/07/29/38/1021072938.db2.gz JRMTVAAEYVEIHA-IAGOWNOFSA-N 2 1 341.474 4.303 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccncc1F ZINC000340469444 1021072941 /nfs/dbraw/zinc/07/29/41/1021072941.db2.gz JRMTVAAEYVEIHA-IAGOWNOFSA-N 2 1 341.474 4.303 20 0 EIADMP COc1ccc(C(C)C)cc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC001167322494 1021094363 /nfs/dbraw/zinc/09/43/63/1021094363.db2.gz WLKDEHCTGDEPOB-UHFFFAOYSA-N 2 1 332.532 4.371 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000309744358 1021457006 /nfs/dbraw/zinc/45/70/06/1021457006.db2.gz SYLILSLEHDTYAU-MRXNPFEDSA-N 2 1 334.916 4.403 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000309744358 1021457027 /nfs/dbraw/zinc/45/70/27/1021457027.db2.gz SYLILSLEHDTYAU-MRXNPFEDSA-N 2 1 334.916 4.403 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c(C)o1 ZINC000310074147 1021589499 /nfs/dbraw/zinc/58/94/99/1021589499.db2.gz FLRCARBSYLIXGZ-YLJYHZDGSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c(C)o1 ZINC000310074147 1021589511 /nfs/dbraw/zinc/58/95/11/1021589511.db2.gz FLRCARBSYLIXGZ-YLJYHZDGSA-N 2 1 326.484 4.459 20 0 EIADMP CC[NH+](CC)Cc1ccc(NC(=O)CC[N@@H+](C)C2CCCCC2)cc1 ZINC000548064088 1021671357 /nfs/dbraw/zinc/67/13/57/1021671357.db2.gz SOSNWKUEHSQBJZ-UHFFFAOYSA-N 2 1 345.531 4.122 20 0 EIADMP Fc1ccc(CC[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000685845600 1021711857 /nfs/dbraw/zinc/71/18/57/1021711857.db2.gz CFXDXEQRMMONLO-KRWDZBQOSA-N 2 1 346.877 4.133 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc3cnccc3c2)C1 ZINC000683827230 1021723946 /nfs/dbraw/zinc/72/39/46/1021723946.db2.gz ADAVNNOGCLNGDG-UYAOXDASSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc3cnccc3c2)C1 ZINC000683827230 1021723959 /nfs/dbraw/zinc/72/39/59/1021723959.db2.gz ADAVNNOGCLNGDG-UYAOXDASSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc3cnccc3c2)C1 ZINC000683827230 1021723967 /nfs/dbraw/zinc/72/39/67/1021723967.db2.gz ADAVNNOGCLNGDG-UYAOXDASSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc3cnccc3c2)C1 ZINC000683827230 1021723986 /nfs/dbraw/zinc/72/39/86/1021723986.db2.gz ADAVNNOGCLNGDG-UYAOXDASSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc3cnccc3c2)C1 ZINC000683827230 1021724002 /nfs/dbraw/zinc/72/40/02/1021724002.db2.gz ADAVNNOGCLNGDG-UYAOXDASSA-N 2 1 337.511 4.321 20 0 EIADMP C[N@H+](Cc1ccc2cnccc2c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000683830923 1021747848 /nfs/dbraw/zinc/74/78/48/1021747848.db2.gz ZNVJAAIGYURHSZ-OAQYLSRUSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2cnccc2c1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000683830923 1021747877 /nfs/dbraw/zinc/74/78/77/1021747877.db2.gz ZNVJAAIGYURHSZ-OAQYLSRUSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2cnccc2c1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000683830923 1021747891 /nfs/dbraw/zinc/74/78/91/1021747891.db2.gz ZNVJAAIGYURHSZ-OAQYLSRUSA-N 2 1 345.490 4.189 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398028276 1021948655 /nfs/dbraw/zinc/94/86/55/1021948655.db2.gz DEHRFTWRIWFEMI-NJNPRVFISA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398028276 1021948661 /nfs/dbraw/zinc/94/86/61/1021948661.db2.gz DEHRFTWRIWFEMI-NJNPRVFISA-N 2 1 340.486 4.257 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cc3ccccc3[nH]2)[C@H]1c1cccs1 ZINC000683930269 1021999299 /nfs/dbraw/zinc/99/92/99/1021999299.db2.gz YITXFXZDCDRIGH-UZLBHIALSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cc3ccccc3[nH]2)[C@H]1c1cccs1 ZINC000683930269 1021999311 /nfs/dbraw/zinc/99/93/11/1021999311.db2.gz YITXFXZDCDRIGH-UZLBHIALSA-N 2 1 339.508 4.402 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000398053771 1022051426 /nfs/dbraw/zinc/05/14/26/1022051426.db2.gz YTONRPZHVFJZJR-QRWLVFNGSA-N 2 1 346.877 4.479 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccccc2OC(F)F)CC1 ZINC000613491086 1022155701 /nfs/dbraw/zinc/15/57/01/1022155701.db2.gz FCDXGIGFBGYSCH-UHFFFAOYSA-N 2 1 340.458 4.232 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](CCOc2ccccc2Cl)CC1 ZINC000613491618 1022166331 /nfs/dbraw/zinc/16/63/31/1022166331.db2.gz ZIZFPWGOFJJAKM-UHFFFAOYSA-N 2 1 338.923 4.163 20 0 EIADMP FC(F)(F)c1cccc(C2([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CCC2)c1 ZINC000245925492 1033038822 /nfs/dbraw/zinc/03/88/22/1033038822.db2.gz SCHWLBLEPDEOJM-IRXDYDNUSA-N 2 1 338.417 4.301 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CCC[C@@H]([NH+](C)C)CC3)s2)cc1C ZINC000656257133 1022256117 /nfs/dbraw/zinc/25/61/17/1022256117.db2.gz HOBFBUPFVMANGO-GOSISDBHSA-N 2 1 343.540 4.343 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CCC[C@@H]([NH+](C)C)CC3)s2)cc1C ZINC000656257133 1022256130 /nfs/dbraw/zinc/25/61/30/1022256130.db2.gz HOBFBUPFVMANGO-GOSISDBHSA-N 2 1 343.540 4.343 20 0 EIADMP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2csc(C(F)(F)F)n2)C1 ZINC000892590179 1022357732 /nfs/dbraw/zinc/35/77/32/1022357732.db2.gz RSXCFPLELMEWBU-CHWSQXEVSA-N 2 1 349.466 4.010 20 0 EIADMP C[C@@]1(C[NH2+]Cc2cccc3[nH]ccc32)CC[N@@H+](Cc2ccccc2)C1 ZINC000310940638 1022680865 /nfs/dbraw/zinc/68/08/65/1022680865.db2.gz WAPMIJIMYZVXIW-QFIPXVFZSA-N 2 1 333.479 4.170 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+]2CCCC23CC[NH+](C)CC3)o1 ZINC000472594124 1022706593 /nfs/dbraw/zinc/70/65/93/1022706593.db2.gz AIKGOAWZKIJCBQ-UHFFFAOYSA-N 2 1 342.458 4.454 20 0 EIADMP FC(F)(F)Sc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000373941199 1022716439 /nfs/dbraw/zinc/71/64/39/1022716439.db2.gz DCBVOXZHNIBODL-UONOGXRCSA-N 2 1 330.419 4.015 20 0 EIADMP FC(F)(F)Sc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000373941199 1022716465 /nfs/dbraw/zinc/71/64/65/1022716465.db2.gz DCBVOXZHNIBODL-UONOGXRCSA-N 2 1 330.419 4.015 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H](Cc2ccccc2)C2CC2)C[C@@H]1c1ccccc1 ZINC000580955651 1022746406 /nfs/dbraw/zinc/74/64/06/1022746406.db2.gz KVEMPZPDJUATCX-RJGXRXQPSA-N 2 1 334.507 4.433 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@@H](Cc2ccccc2)C2CC2)C[C@@H]1c1ccccc1 ZINC000580955651 1022746419 /nfs/dbraw/zinc/74/64/19/1022746419.db2.gz KVEMPZPDJUATCX-RJGXRXQPSA-N 2 1 334.507 4.433 20 0 EIADMP c1nc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)sc1-c1ccccc1 ZINC000647542748 1022780120 /nfs/dbraw/zinc/78/01/20/1022780120.db2.gz BJFDCXQURDSEQC-ZWKOTPCHSA-N 2 1 341.524 4.022 20 0 EIADMP Cc1cc2cc(C[NH2+][C@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)ccc2[nH]1 ZINC000581026087 1022802760 /nfs/dbraw/zinc/80/27/60/1022802760.db2.gz QHKURDSJSCTSON-UNMCSNQZSA-N 2 1 333.479 4.401 20 0 EIADMP Cc1cc2cc(C[NH2+][C@H]3CC[N@H+](C)[C@H](c4ccccc4)C3)ccc2[nH]1 ZINC000581026087 1022802766 /nfs/dbraw/zinc/80/27/66/1022802766.db2.gz QHKURDSJSCTSON-UNMCSNQZSA-N 2 1 333.479 4.401 20 0 EIADMP Brc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CC2)cc1 ZINC000378431634 1022817411 /nfs/dbraw/zinc/81/74/11/1022817411.db2.gz ODKQNFPVEZOZLG-RCCFBDPRSA-N 2 1 349.316 4.117 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000311058167 1022818954 /nfs/dbraw/zinc/81/89/54/1022818954.db2.gz WIHIIKPSQURYFO-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP COc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000311058173 1022819242 /nfs/dbraw/zinc/81/92/42/1022819242.db2.gz WIHIIKPSQURYFO-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP CS[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000581131476 1022848099 /nfs/dbraw/zinc/84/80/99/1022848099.db2.gz RKORXKPMNUBNIJ-HSALFYBXSA-N 2 1 344.568 4.447 20 0 EIADMP CS[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000581131476 1022848100 /nfs/dbraw/zinc/84/81/00/1022848100.db2.gz RKORXKPMNUBNIJ-HSALFYBXSA-N 2 1 344.568 4.447 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000545461205 1022869794 /nfs/dbraw/zinc/86/97/94/1022869794.db2.gz SEMYOSDJWXHMQS-XPGWFJOJSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC[N@H+]1C ZINC000545461205 1022869797 /nfs/dbraw/zinc/86/97/97/1022869797.db2.gz SEMYOSDJWXHMQS-XPGWFJOJSA-N 2 1 343.902 4.091 20 0 EIADMP COc1cccc(C=C2CCN(CC[C@H]3CCCC[N@H+]3C)CC2)c1 ZINC000473007771 1022954653 /nfs/dbraw/zinc/95/46/53/1022954653.db2.gz HOIHLCGRQWXHAW-HXUWFJFHSA-N 2 1 328.500 4.049 20 0 EIADMP COc1cccc(C=C2CC[NH+](CC[C@H]3CCCC[N@@H+]3C)CC2)c1 ZINC000473007771 1022954663 /nfs/dbraw/zinc/95/46/63/1022954663.db2.gz HOIHLCGRQWXHAW-HXUWFJFHSA-N 2 1 328.500 4.049 20 0 EIADMP COc1cccc(C=C2CC[NH+](CC[C@H]3CCCC[N@H+]3C)CC2)c1 ZINC000473007771 1022954672 /nfs/dbraw/zinc/95/46/72/1022954672.db2.gz HOIHLCGRQWXHAW-HXUWFJFHSA-N 2 1 328.500 4.049 20 0 EIADMP Fc1ccc2c(c1)[C@H]([N@@H+]1CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C1)CCC2 ZINC000510377675 1022963927 /nfs/dbraw/zinc/96/39/27/1022963927.db2.gz WLKQPGGEKZZSIG-ZLGUVYLKSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([N@H+]1CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C1)CCC2 ZINC000510377675 1022963938 /nfs/dbraw/zinc/96/39/38/1022963938.db2.gz WLKQPGGEKZZSIG-ZLGUVYLKSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH+]1CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C1)CCC2 ZINC000510377675 1022963941 /nfs/dbraw/zinc/96/39/41/1022963941.db2.gz WLKQPGGEKZZSIG-ZLGUVYLKSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH+]1CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C1)CCC2 ZINC000510377675 1022963944 /nfs/dbraw/zinc/96/39/44/1022963944.db2.gz WLKQPGGEKZZSIG-ZLGUVYLKSA-N 2 1 328.475 4.152 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](CC)c2cccc(F)c2)[C@@H](C)C1 ZINC000188019242 1023132839 /nfs/dbraw/zinc/13/28/39/1023132839.db2.gz ZJIIEAWNBLZGIC-VDGAXYAQSA-N 2 1 336.495 4.003 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417338815 1023272419 /nfs/dbraw/zinc/27/24/19/1023272419.db2.gz ZFWHXMSZUDDDLK-OJAHFUOMSA-N 2 1 340.536 4.352 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](C)c2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000188143617 1023293376 /nfs/dbraw/zinc/29/33/76/1023293376.db2.gz XENCLJLFTDPAAX-CPUCHLNUSA-N 2 1 328.422 4.129 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@H]2CCC3(CCCC3)O2)CC1)CC1CC1 ZINC000549136810 1023363360 /nfs/dbraw/zinc/36/33/60/1023363360.db2.gz YUDPKQXWGVKNRQ-OAQYLSRUSA-N 2 1 348.575 4.312 20 0 EIADMP Clc1csc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000309697142 1023399716 /nfs/dbraw/zinc/39/97/16/1023399716.db2.gz FINUGCRLXFDSGC-INIZCTEOSA-N 2 1 334.916 4.403 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@H]1c1ccccc1 ZINC000581621798 1023441304 /nfs/dbraw/zinc/44/13/04/1023441304.db2.gz HGAOZWZIEBGCFV-CTNGQTDRSA-N 2 1 338.495 4.269 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@H]1c1ccccc1 ZINC000581621798 1023441309 /nfs/dbraw/zinc/44/13/09/1023441309.db2.gz HGAOZWZIEBGCFV-CTNGQTDRSA-N 2 1 338.495 4.269 20 0 EIADMP CC[C@@H](c1ccc(Br)cc1)[N@@H+](C)C[C@H]1CCCN(C)C1 ZINC000472737618 1023475830 /nfs/dbraw/zinc/47/58/30/1023475830.db2.gz KLPBVDSFEFTOMX-YOEHRIQHSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@@H](c1ccc(Br)cc1)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000472737618 1023475832 /nfs/dbraw/zinc/47/58/32/1023475832.db2.gz KLPBVDSFEFTOMX-YOEHRIQHSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@@H](c1ccc(Br)cc1)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000472737618 1023475834 /nfs/dbraw/zinc/47/58/34/1023475834.db2.gz KLPBVDSFEFTOMX-YOEHRIQHSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@@H](c1ccc(Br)cc1)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000472737618 1023475836 /nfs/dbraw/zinc/47/58/36/1023475836.db2.gz KLPBVDSFEFTOMX-YOEHRIQHSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@@H](c1ccc(Br)cc1)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000472737618 1023475843 /nfs/dbraw/zinc/47/58/43/1023475843.db2.gz KLPBVDSFEFTOMX-YOEHRIQHSA-N 2 1 339.321 4.174 20 0 EIADMP C[C@@H](C[N@@H+](C)C[C@@H]1CCC[NH+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078114 1023491540 /nfs/dbraw/zinc/49/15/40/1023491540.db2.gz ZUTLUDNOUHBORZ-LSDHHAIUSA-N 2 1 328.422 4.083 20 0 EIADMP C[C@@H](C[NH+](C)C[C@@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078114 1023491549 /nfs/dbraw/zinc/49/15/49/1023491549.db2.gz ZUTLUDNOUHBORZ-LSDHHAIUSA-N 2 1 328.422 4.083 20 0 EIADMP C[C@@H](C[NH+](C)C[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078114 1023491553 /nfs/dbraw/zinc/49/15/53/1023491553.db2.gz ZUTLUDNOUHBORZ-LSDHHAIUSA-N 2 1 328.422 4.083 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125069 1023513825 /nfs/dbraw/zinc/51/38/25/1023513825.db2.gz OZSFSCZNMILEBA-JKSUJKDBSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125069 1023513832 /nfs/dbraw/zinc/51/38/32/1023513832.db2.gz OZSFSCZNMILEBA-JKSUJKDBSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125069 1023513842 /nfs/dbraw/zinc/51/38/42/1023513842.db2.gz OZSFSCZNMILEBA-JKSUJKDBSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125066 1023514222 /nfs/dbraw/zinc/51/42/22/1023514222.db2.gz OZSFSCZNMILEBA-CVEARBPZSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125066 1023514228 /nfs/dbraw/zinc/51/42/28/1023514228.db2.gz OZSFSCZNMILEBA-CVEARBPZSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125066 1023514235 /nfs/dbraw/zinc/51/42/35/1023514235.db2.gz OZSFSCZNMILEBA-CVEARBPZSA-N 2 1 342.449 4.473 20 0 EIADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC000656786430 1023532958 /nfs/dbraw/zinc/53/29/58/1023532958.db2.gz MNUMTVRDIVJSBK-BDTNDASRSA-N 2 1 342.527 4.063 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1 ZINC000364312266 1023605018 /nfs/dbraw/zinc/60/50/18/1023605018.db2.gz BTBQEGLLVHVWBE-YXJHDRRASA-N 2 1 330.497 4.100 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000394556598 1023607052 /nfs/dbraw/zinc/60/70/52/1023607052.db2.gz IXSPKLHYOKXVBD-YTQUADARSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCCNc1cc[nH+]c(C2(C(F)(F)F)CC2)c1 ZINC001167752641 1023626337 /nfs/dbraw/zinc/62/63/37/1023626337.db2.gz HIUUDCDDFJRFMP-AWEZNQCLSA-N 2 1 341.421 4.352 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCNc1cc[nH+]c(C2(C(F)(F)F)CC2)c1 ZINC001167752641 1023626345 /nfs/dbraw/zinc/62/63/45/1023626345.db2.gz HIUUDCDDFJRFMP-AWEZNQCLSA-N 2 1 341.421 4.352 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cn1 ZINC000164118716 1023698662 /nfs/dbraw/zinc/69/86/62/1023698662.db2.gz PVIWOGOKFHIMDE-WFXMLNOXSA-N 2 1 340.515 4.025 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cn1 ZINC000164118716 1023698666 /nfs/dbraw/zinc/69/86/66/1023698666.db2.gz PVIWOGOKFHIMDE-WFXMLNOXSA-N 2 1 340.515 4.025 20 0 EIADMP Cc1ccsc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390699140 1023782535 /nfs/dbraw/zinc/78/25/35/1023782535.db2.gz SMYLXXRDLJKCTC-LJQANCHMSA-N 2 1 328.525 4.447 20 0 EIADMP Cc1ccsc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390699140 1023782540 /nfs/dbraw/zinc/78/25/40/1023782540.db2.gz SMYLXXRDLJKCTC-LJQANCHMSA-N 2 1 328.525 4.447 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCc1c[nH+]cn1C ZINC000276652285 1023814055 /nfs/dbraw/zinc/81/40/55/1023814055.db2.gz MPENAYHEXOACKO-CQSZACIVSA-N 2 1 340.496 4.054 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c(C)nn(C(C)C)c2C)CC1 ZINC000891611094 1023822074 /nfs/dbraw/zinc/82/20/74/1023822074.db2.gz GBKCUWLSMZAWEW-UHFFFAOYSA-N 2 1 334.552 4.025 20 0 EIADMP CC[C@H](CC(F)F)C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC000660496211 1023869249 /nfs/dbraw/zinc/86/92/49/1023869249.db2.gz FSTHSQXEIAAZCJ-CVEARBPZSA-N 2 1 344.515 4.492 20 0 EIADMP CC[C@H](CC(F)F)C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(C)s2)C1 ZINC000660496211 1023869250 /nfs/dbraw/zinc/86/92/50/1023869250.db2.gz FSTHSQXEIAAZCJ-CVEARBPZSA-N 2 1 344.515 4.492 20 0 EIADMP CC[C@H](CC(F)F)C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(C)s2)C1 ZINC000660496211 1023869252 /nfs/dbraw/zinc/86/92/52/1023869252.db2.gz FSTHSQXEIAAZCJ-CVEARBPZSA-N 2 1 344.515 4.492 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]CCC[C@@H]3CCCCO3)CC23CC3)cc1 ZINC000647201803 1023884964 /nfs/dbraw/zinc/88/49/64/1023884964.db2.gz ANVBJSKPENWUDH-SFTDATJTSA-N 2 1 342.527 4.123 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CCC[C@@H]3CCCCO3)CC23CC3)cc1 ZINC000647201803 1023884968 /nfs/dbraw/zinc/88/49/68/1023884968.db2.gz ANVBJSKPENWUDH-SFTDATJTSA-N 2 1 342.527 4.123 20 0 EIADMP Cn1ccnc1[C@@H]1CCN(Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000367701026 1023893213 /nfs/dbraw/zinc/89/32/13/1023893213.db2.gz JSXIGGOPGOCMKU-GFCCVEGCSA-N 2 1 343.780 4.082 20 0 EIADMP C[C@@H](c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)cc1)C(F)(F)F ZINC000660661343 1024004276 /nfs/dbraw/zinc/00/42/76/1024004276.db2.gz CHIBTHAKEVSHST-YJBOKZPZSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[N@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)cc1)C(F)(F)F ZINC000660661343 1024004289 /nfs/dbraw/zinc/00/42/89/1024004289.db2.gz CHIBTHAKEVSHST-YJBOKZPZSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[NH+]2CCC[C@@]3(CC[N@H+](C)C3)C2)cc1)C(F)(F)F ZINC000660661343 1024004302 /nfs/dbraw/zinc/00/43/02/1024004302.db2.gz CHIBTHAKEVSHST-YJBOKZPZSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[NH+]2CCC[C@@]3(CC[N@@H+](C)C3)C2)cc1)C(F)(F)F ZINC000660661343 1024004316 /nfs/dbraw/zinc/00/43/16/1024004316.db2.gz CHIBTHAKEVSHST-YJBOKZPZSA-N 2 1 340.433 4.270 20 0 EIADMP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000510719951 1024314081 /nfs/dbraw/zinc/31/40/81/1024314081.db2.gz KMJLHEZDTASOJB-LNLFQRSKSA-N 2 1 338.536 4.468 20 0 EIADMP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000510719951 1024314093 /nfs/dbraw/zinc/31/40/93/1024314093.db2.gz KMJLHEZDTASOJB-LNLFQRSKSA-N 2 1 338.536 4.468 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000510735628 1024372146 /nfs/dbraw/zinc/37/21/46/1024372146.db2.gz ONUHUSMTAVQWHW-OLMNPRSZSA-N 2 1 340.433 4.243 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000510737089 1024379479 /nfs/dbraw/zinc/37/94/79/1024379479.db2.gz RVTIFRMEUHRMFC-CKEIUWERSA-N 2 1 328.422 4.099 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000510737089 1024379499 /nfs/dbraw/zinc/37/94/99/1024379499.db2.gz RVTIFRMEUHRMFC-CKEIUWERSA-N 2 1 328.422 4.099 20 0 EIADMP Cc1ccc2[nH]c(C[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)cc2c1C ZINC000473146660 1024528274 /nfs/dbraw/zinc/52/82/74/1024528274.db2.gz NDWANXMKVIWYGT-SFHVURJKSA-N 2 1 325.500 4.093 20 0 EIADMP Cc1ccc2[nH]c(C[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)cc2c1C ZINC000473146660 1024528320 /nfs/dbraw/zinc/52/83/20/1024528320.db2.gz NDWANXMKVIWYGT-SFHVURJKSA-N 2 1 325.500 4.093 20 0 EIADMP CCCC[N@H+](Cc1nc(C(C)(C)[NH3+])no1)[C@H](CC)c1ccccc1 ZINC000431074714 1024550343 /nfs/dbraw/zinc/55/03/43/1024550343.db2.gz XIKCUQRNNMYOSP-MRXNPFEDSA-N 2 1 330.476 4.017 20 0 EIADMP CCCC[N@@H+](Cc1nc(C(C)(C)[NH3+])no1)[C@H](CC)c1ccccc1 ZINC000431074714 1024550359 /nfs/dbraw/zinc/55/03/59/1024550359.db2.gz XIKCUQRNNMYOSP-MRXNPFEDSA-N 2 1 330.476 4.017 20 0 EIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000164674645 1024784844 /nfs/dbraw/zinc/78/48/44/1024784844.db2.gz ZOHYTFJWALENCZ-CYBMUJFWSA-N 2 1 334.533 4.385 20 0 EIADMP C[C@@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)C1(c2ccccc2)CCCC1 ZINC000511929449 1024805891 /nfs/dbraw/zinc/80/58/91/1024805891.db2.gz YOBLNXHASZVNNC-MRXNPFEDSA-N 2 1 343.540 4.195 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cc[nH+]c3c(O)cccc23)C1 ZINC000684575019 1024828198 /nfs/dbraw/zinc/82/81/98/1024828198.db2.gz IZRMWAWKYAIKLM-IAGOWNOFSA-N 2 1 339.483 4.031 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582002540 1024835906 /nfs/dbraw/zinc/83/59/06/1024835906.db2.gz QSPRFYPJLPMWFP-UYAOXDASSA-N 2 1 338.495 4.388 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582002540 1024835907 /nfs/dbraw/zinc/83/59/07/1024835907.db2.gz QSPRFYPJLPMWFP-UYAOXDASSA-N 2 1 338.495 4.388 20 0 EIADMP CS[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000548486108 1024836204 /nfs/dbraw/zinc/83/62/04/1024836204.db2.gz NUSRTGGYACPLJY-YTQUADARSA-N 2 1 334.573 4.264 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCSCC1 ZINC000510944318 1024859139 /nfs/dbraw/zinc/85/91/39/1024859139.db2.gz JDFXHTQPWZAQRX-FXAWDEMLSA-N 2 1 346.584 4.408 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCSCC1 ZINC000510944318 1024859141 /nfs/dbraw/zinc/85/91/41/1024859141.db2.gz JDFXHTQPWZAQRX-FXAWDEMLSA-N 2 1 346.584 4.408 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]CCCn1cc[nH+]c1C ZINC000510957684 1024865318 /nfs/dbraw/zinc/86/53/18/1024865318.db2.gz IPAGWLSRJDTSEZ-MRXNPFEDSA-N 2 1 340.298 4.499 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc2cc(Cl)ccc2o1 ZINC000278858972 1024946868 /nfs/dbraw/zinc/94/68/68/1024946868.db2.gz AWZQZOOOSQJIOM-CHWSQXEVSA-N 2 1 329.831 4.196 20 0 EIADMP C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295627 1025045821 /nfs/dbraw/zinc/04/58/21/1025045821.db2.gz VYYDMTBTTWHOLV-APWZRJJASA-N 2 1 339.483 4.114 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc(Cl)cc3)n2)[C@@H]1CCC[NH3+] ZINC000662312729 1025063265 /nfs/dbraw/zinc/06/32/65/1025063265.db2.gz CLUIEJBAVYGYLD-RDTXWAMCSA-N 2 1 347.890 4.334 20 0 EIADMP CC1(C)CC[C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)c2ccccc21 ZINC000684612472 1025069713 /nfs/dbraw/zinc/06/97/13/1025069713.db2.gz UOANEFWKNRZIRH-GHTZIAJQSA-N 2 1 342.527 4.032 20 0 EIADMP CC1(C)CC[C@@H]([NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)c2ccccc21 ZINC000684612479 1025070690 /nfs/dbraw/zinc/07/06/90/1025070690.db2.gz UOANEFWKNRZIRH-WIYYLYMNSA-N 2 1 342.527 4.032 20 0 EIADMP CC(C)(C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)CC(F)(F)F ZINC000663357072 1025177713 /nfs/dbraw/zinc/17/77/13/1025177713.db2.gz ZVZHLKMXYRUFSC-UHFFFAOYSA-N 2 1 342.449 4.262 20 0 EIADMP c1ccc2c(c1)[nH]c1c2CCC[C@H]1[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663466120 1025390677 /nfs/dbraw/zinc/39/06/77/1025390677.db2.gz OGPKONRAAXYPMH-DYESRHJHSA-N 2 1 337.511 4.257 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000162680081 1025391033 /nfs/dbraw/zinc/39/10/33/1025391033.db2.gz HGEKBFRFFJBUKL-KRWDZBQOSA-N 2 1 340.496 4.419 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000162680081 1025391047 /nfs/dbraw/zinc/39/10/47/1025391047.db2.gz HGEKBFRFFJBUKL-KRWDZBQOSA-N 2 1 340.496 4.419 20 0 EIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]CCCn1cc[nH+]c1C ZINC000511020903 1025580554 /nfs/dbraw/zinc/58/05/54/1025580554.db2.gz WWXYLTOJYGABJY-INIZCTEOSA-N 2 1 337.920 4.396 20 0 EIADMP C[N@@H+](CCc1cccc(Cl)c1Cl)CC[C@@H]1CCCC[NH+]1C ZINC001167509505 1025814600 /nfs/dbraw/zinc/81/46/00/1025814600.db2.gz OHWLKPOWKDPJSF-HNNXBMFYSA-N 2 1 329.315 4.342 20 0 EIADMP C[N@H+](CCc1cccc(Cl)c1Cl)CC[C@@H]1CCCC[NH+]1C ZINC001167509505 1025814602 /nfs/dbraw/zinc/81/46/02/1025814602.db2.gz OHWLKPOWKDPJSF-HNNXBMFYSA-N 2 1 329.315 4.342 20 0 EIADMP C[NH+](CCc1cccc(Cl)c1Cl)CC[C@@H]1CCCC[N@@H+]1C ZINC001167509505 1025814605 /nfs/dbraw/zinc/81/46/05/1025814605.db2.gz OHWLKPOWKDPJSF-HNNXBMFYSA-N 2 1 329.315 4.342 20 0 EIADMP C[NH+](CCc1cccc(Cl)c1Cl)CC[C@@H]1CCCC[N@H+]1C ZINC001167509505 1025814608 /nfs/dbraw/zinc/81/46/08/1025814608.db2.gz OHWLKPOWKDPJSF-HNNXBMFYSA-N 2 1 329.315 4.342 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H](OCc2ccccc2)C1 ZINC001167837909 1025849891 /nfs/dbraw/zinc/84/98/91/1025849891.db2.gz NSONGBWXQUSDOW-FPOVZHCZSA-N 2 1 332.532 4.178 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H](OCc2ccccc2)C1 ZINC001167837911 1025850390 /nfs/dbraw/zinc/85/03/90/1025850390.db2.gz NSONGBWXQUSDOW-TZIWHRDSSA-N 2 1 332.532 4.178 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000431329987 1025889240 /nfs/dbraw/zinc/88/92/40/1025889240.db2.gz UKWHTWYFXDNIBL-NRFANRHFSA-N 2 1 342.527 4.488 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167968284 1025893094 /nfs/dbraw/zinc/89/30/94/1025893094.db2.gz ORNUMDWIBACICN-KOLWVEQXSA-N 2 1 330.903 4.322 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(Oc2cccnc2)cc1 ZINC000344090901 1025999725 /nfs/dbraw/zinc/99/97/25/1025999725.db2.gz JPIJOTDWBMGIDZ-WMZOPIPTSA-N 2 1 325.456 4.009 20 0 EIADMP [NH3+][C@H]1CCc2c3ccccc3n(C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)c2C1 ZINC001167969833 1026030939 /nfs/dbraw/zinc/03/09/39/1026030939.db2.gz FRZCUZAOTXHITM-HTUJPFKRSA-N 2 1 349.522 4.035 20 0 EIADMP c1cc2c(o1)CCC[NH+](CCCCC[N@H+]1CCCc3occc3C1)C2 ZINC000344240468 1026171249 /nfs/dbraw/zinc/17/12/49/1026171249.db2.gz CCGZRZAGSXKGKJ-UHFFFAOYSA-N 2 1 342.483 4.240 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC([C@H](F)c2ccccc2F)CC1 ZINC000511075253 1026188179 /nfs/dbraw/zinc/18/81/79/1026188179.db2.gz RGDCFJQBNDXMSG-XLIONFOSSA-N 2 1 336.470 4.423 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3cccc4cccnc43)C2)CC1 ZINC000512177109 1026234686 /nfs/dbraw/zinc/23/46/86/1026234686.db2.gz FBOXIQKXCAHMEX-IBGZPJMESA-N 2 1 337.511 4.179 20 0 EIADMP Fc1cccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)c1 ZINC001167975357 1026253756 /nfs/dbraw/zinc/25/37/56/1026253756.db2.gz NULPOPBQMBSAJM-OTYNDTSQSA-N 2 1 328.475 4.272 20 0 EIADMP Fc1cccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)c1 ZINC001167978164 1026343831 /nfs/dbraw/zinc/34/38/31/1026343831.db2.gz LFHKEGNRRDMQJB-SEJPIABJSA-N 2 1 342.502 4.143 20 0 EIADMP Clc1ccc([C@H]2C[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167982176 1026388002 /nfs/dbraw/zinc/38/80/02/1026388002.db2.gz ZLDWSDAWESBIHG-NOSIKRSBSA-N 2 1 330.903 4.191 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000582328345 1026454624 /nfs/dbraw/zinc/45/46/24/1026454624.db2.gz VBLBLQNFEDQMQK-WBVHZDCISA-N 2 1 342.449 4.346 20 0 EIADMP COCc1csc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000657396013 1026474061 /nfs/dbraw/zinc/47/40/61/1026474061.db2.gz DKCLWIUOJDSDDN-CQSZACIVSA-N 2 1 341.480 4.239 20 0 EIADMP C[NH+](C)CC1CC[NH+](Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000506860369 1026478436 /nfs/dbraw/zinc/47/84/36/1026478436.db2.gz HSPNLGVOZZJXQP-UHFFFAOYSA-N 2 1 334.813 4.132 20 0 EIADMP Fc1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c(C(F)(F)F)c1 ZINC000506912642 1026512032 /nfs/dbraw/zinc/51/20/32/1026512032.db2.gz UXPVPEWXHQEODD-UHFFFAOYSA-N 2 1 344.396 4.152 20 0 EIADMP CCOc1ccc([C@H](CC)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1OCC ZINC000152466672 1026586374 /nfs/dbraw/zinc/58/63/74/1026586374.db2.gz ULVCCFQPFKQDSA-LPHOPBHVSA-N 2 1 346.515 4.009 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2cc(F)cc(F)c2)CCN1Cc1ccccc1 ZINC001167573602 1026620055 /nfs/dbraw/zinc/62/00/55/1026620055.db2.gz WFFQYOZDPOICQI-KKSFZXQISA-N 2 1 344.449 4.450 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cc(F)cc(F)c2)CCN1Cc1ccccc1 ZINC001167573602 1026620064 /nfs/dbraw/zinc/62/00/64/1026620064.db2.gz WFFQYOZDPOICQI-KKSFZXQISA-N 2 1 344.449 4.450 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cc(F)cc(F)c2)CCN1Cc1ccccc1 ZINC001167573600 1026621672 /nfs/dbraw/zinc/62/16/72/1026621672.db2.gz WFFQYOZDPOICQI-IERDGZPVSA-N 2 1 344.449 4.450 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(F)cc(F)c2)CCN1Cc1ccccc1 ZINC001167573600 1026621676 /nfs/dbraw/zinc/62/16/76/1026621676.db2.gz WFFQYOZDPOICQI-IERDGZPVSA-N 2 1 344.449 4.450 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000507447446 1026796537 /nfs/dbraw/zinc/79/65/37/1026796537.db2.gz HUIWZBCSJJATQT-LQWHRVPQSA-N 2 1 337.511 4.205 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000507447446 1026796545 /nfs/dbraw/zinc/79/65/45/1026796545.db2.gz HUIWZBCSJJATQT-LQWHRVPQSA-N 2 1 337.511 4.205 20 0 EIADMP CCC[C@@H]([NH2+]C1CC[NH+](CCc2ccncc2)CC1)c1ccccc1 ZINC000152810510 1026854993 /nfs/dbraw/zinc/85/49/93/1026854993.db2.gz GMXSABOATRGCOO-JOCHJYFZSA-N 2 1 337.511 4.220 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3csc(C)n3)CC2)c(C)o1 ZINC000375721551 1026864925 /nfs/dbraw/zinc/86/49/25/1026864925.db2.gz WDWJRIVBPHLUMH-CQSZACIVSA-N 2 1 347.528 4.224 20 0 EIADMP C1=CC2(CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)c2ccccc21 ZINC001167987102 1026888332 /nfs/dbraw/zinc/88/83/32/1026888332.db2.gz KJUMRRYZORPKAN-CBQGHPETSA-N 2 1 348.534 4.452 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3cccnc32)[C@H]1c1cccs1 ZINC000684956335 1026890051 /nfs/dbraw/zinc/89/00/51/1026890051.db2.gz APVZKIAFQUYGPK-UWVAXJGDSA-N 2 1 341.524 4.193 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3cccnc32)[C@H]1c1cccs1 ZINC000684956335 1026890059 /nfs/dbraw/zinc/89/00/59/1026890059.db2.gz APVZKIAFQUYGPK-UWVAXJGDSA-N 2 1 341.524 4.193 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC000474481611 1027117623 /nfs/dbraw/zinc/11/76/23/1027117623.db2.gz YJTDCRICZLBETR-OTWHNJEPSA-N 2 1 332.532 4.289 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccccc1OC(F)(F)F ZINC000520206071 1027313710 /nfs/dbraw/zinc/31/37/10/1027313710.db2.gz VFAQCTYPZOWCSD-OAHLLOKOSA-N 2 1 344.421 4.329 20 0 EIADMP C[C@@H]1CC([N@H+]2CCc3ccccc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039976 1027352492 /nfs/dbraw/zinc/35/24/92/1027352492.db2.gz JEZKLHMOMIMYEP-RTBURBONSA-N 2 1 334.507 4.486 20 0 EIADMP CC(C)C[C@H](C[NH2+]CC1([NH+]2CCCC2)CCOCC1)c1ccccc1 ZINC000474722806 1027441413 /nfs/dbraw/zinc/44/14/13/1027441413.db2.gz MPHFRTSQUMEUMW-OAQYLSRUSA-N 2 1 344.543 4.051 20 0 EIADMP C[C@@]1(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1(F)F ZINC000657669286 1027482384 /nfs/dbraw/zinc/48/23/84/1027482384.db2.gz CMKFETUZMODAON-ZWKOTPCHSA-N 2 1 334.454 4.209 20 0 EIADMP C[C@@]1(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1(F)F ZINC000657669286 1027482397 /nfs/dbraw/zinc/48/23/97/1027482397.db2.gz CMKFETUZMODAON-ZWKOTPCHSA-N 2 1 334.454 4.209 20 0 EIADMP c1cncc([C@@H]2CCC[C@H]([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)C2)c1 ZINC000657678222 1027527426 /nfs/dbraw/zinc/52/74/26/1027527426.db2.gz NXGDMGVWSFNLIM-YZGWKJHDSA-N 2 1 327.516 4.104 20 0 EIADMP c1cncc([C@@H]2CCC[C@H]([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)C2)c1 ZINC000657678222 1027527446 /nfs/dbraw/zinc/52/74/46/1027527446.db2.gz NXGDMGVWSFNLIM-YZGWKJHDSA-N 2 1 327.516 4.104 20 0 EIADMP Cc1ccc(OCCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000441418640 1027535501 /nfs/dbraw/zinc/53/55/01/1027535501.db2.gz VJCLNCPTNWRQEA-DENIHFKCSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000441418640 1027535512 /nfs/dbraw/zinc/53/55/12/1027535512.db2.gz VJCLNCPTNWRQEA-DENIHFKCSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1C ZINC000441418640 1027535520 /nfs/dbraw/zinc/53/55/20/1027535520.db2.gz VJCLNCPTNWRQEA-DENIHFKCSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1C ZINC000441418640 1027535532 /nfs/dbraw/zinc/53/55/32/1027535532.db2.gz VJCLNCPTNWRQEA-DENIHFKCSA-N 2 1 342.527 4.021 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC[N@H+]1C ZINC000474813339 1027537476 /nfs/dbraw/zinc/53/74/76/1027537476.db2.gz GVCJIMONCACQAH-ZFWWWQNUSA-N 2 1 329.315 4.388 20 0 EIADMP Clc1cccc(OCCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441403225 1027543107 /nfs/dbraw/zinc/54/31/07/1027543107.db2.gz CERSPABZYFZHIX-OXJNMPFZSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441403225 1027543119 /nfs/dbraw/zinc/54/31/19/1027543119.db2.gz CERSPABZYFZHIX-OXJNMPFZSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441403225 1027543131 /nfs/dbraw/zinc/54/31/31/1027543131.db2.gz CERSPABZYFZHIX-OXJNMPFZSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000441403225 1027543142 /nfs/dbraw/zinc/54/31/42/1027543142.db2.gz CERSPABZYFZHIX-OXJNMPFZSA-N 2 1 348.918 4.058 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)c1ccc(Cl)cc1 ZINC000112517324 1027580705 /nfs/dbraw/zinc/58/07/05/1027580705.db2.gz KJDLKTZHBOHHKF-INIZCTEOSA-N 2 1 344.886 4.023 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1OC ZINC000161644700 1027659896 /nfs/dbraw/zinc/65/98/96/1027659896.db2.gz OOXBZTWUIMARJD-BHIYHBOVSA-N 2 1 346.515 4.152 20 0 EIADMP c1[nH+]c([C@@H]2CCCN(c3cc[nH+]c4ccccc43)C2)n2c1CCCC2 ZINC000282014614 1027793681 /nfs/dbraw/zinc/79/36/81/1027793681.db2.gz VIIIPNFRKBNYKM-MRXNPFEDSA-N 2 1 332.451 4.152 20 0 EIADMP Cc1csc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000583084074 1027969764 /nfs/dbraw/zinc/96/97/64/1027969764.db2.gz VEFRKIVWJFKLDE-SFHVURJKSA-N 2 1 326.509 4.343 20 0 EIADMP Cc1csc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000583084074 1027969776 /nfs/dbraw/zinc/96/97/76/1027969776.db2.gz VEFRKIVWJFKLDE-SFHVURJKSA-N 2 1 326.509 4.343 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188657842 1028013271 /nfs/dbraw/zinc/01/32/71/1028013271.db2.gz FWUYJXWUEOMHOY-CPUCHLNUSA-N 2 1 340.433 4.055 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2oc(C(C)C)nc2C)CC1)CC1CC1 ZINC000428311493 1028044357 /nfs/dbraw/zinc/04/43/57/1028044357.db2.gz RAXAUFXBTOLBGI-UHFFFAOYSA-N 2 1 347.547 4.440 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)Cc1cccs1 ZINC000583194607 1028219073 /nfs/dbraw/zinc/21/90/73/1028219073.db2.gz LUOJUAJMOQDQJI-XKGZKEIXSA-N 2 1 328.525 4.352 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)Cc1cccs1 ZINC000583194607 1028219093 /nfs/dbraw/zinc/21/90/93/1028219093.db2.gz LUOJUAJMOQDQJI-XKGZKEIXSA-N 2 1 328.525 4.352 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000346132380 1028272617 /nfs/dbraw/zinc/27/26/17/1028272617.db2.gz BWYYVVKMKXQPBB-FQEVSTJZSA-N 2 1 346.478 4.030 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1ccccc1)C(C)(C)C ZINC000346146248 1028281038 /nfs/dbraw/zinc/28/10/38/1028281038.db2.gz HUXAJRUUEIAIIM-UHFFFAOYSA-N 2 1 334.467 4.376 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)Cc1ccc2ccccc2c1 ZINC000346170767 1028303968 /nfs/dbraw/zinc/30/39/68/1028303968.db2.gz JUWRNMFLNLQIHV-UHFFFAOYSA-N 2 1 342.446 4.361 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000346205021 1028329517 /nfs/dbraw/zinc/32/95/17/1028329517.db2.gz QAKRBTJUXGIRQL-IBGZPJMESA-N 2 1 336.439 4.286 20 0 EIADMP COc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)ccc1SC ZINC000125918318 1028496597 /nfs/dbraw/zinc/49/65/97/1028496597.db2.gz DHNDXJXUWVLVFG-HOTGVXAUSA-N 2 1 336.545 4.188 20 0 EIADMP c1cc2c(cccc2C[N@H+]2C[C@H]3CC[NH+](Cc4ccccc4)C[C@H]3C2)[nH]1 ZINC000583423336 1028715752 /nfs/dbraw/zinc/71/57/52/1028715752.db2.gz FEADJNLCWBKOGV-CTNGQTDRSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2c(cccc2C[NH+]2C[C@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C2)[nH]1 ZINC000583423336 1028715784 /nfs/dbraw/zinc/71/57/84/1028715784.db2.gz FEADJNLCWBKOGV-CTNGQTDRSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2c(cccc2C[NH+]2C[C@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C2)[nH]1 ZINC000583423336 1028715806 /nfs/dbraw/zinc/71/58/06/1028715806.db2.gz FEADJNLCWBKOGV-CTNGQTDRSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2c(cccc2C[N@H+]2C[C@@H]3CC[NH+](Cc4ccccc4)C[C@H]3C2)[nH]1 ZINC000583423337 1028717045 /nfs/dbraw/zinc/71/70/45/1028717045.db2.gz FEADJNLCWBKOGV-FPOVZHCZSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2c(cccc2C[NH+]2C[C@@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C2)[nH]1 ZINC000583423337 1028717067 /nfs/dbraw/zinc/71/70/67/1028717067.db2.gz FEADJNLCWBKOGV-FPOVZHCZSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2c(cccc2C[NH+]2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C2)[nH]1 ZINC000583423337 1028717090 /nfs/dbraw/zinc/71/70/90/1028717090.db2.gz FEADJNLCWBKOGV-FPOVZHCZSA-N 2 1 345.490 4.122 20 0 EIADMP CC[C@H](OCC[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1 ZINC000650710180 1028846668 /nfs/dbraw/zinc/84/66/68/1028846668.db2.gz HEGUBBJSXMEPQP-BDTNDASRSA-N 2 1 338.495 4.237 20 0 EIADMP CC(C)O[C@H](C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000428325950 1028884989 /nfs/dbraw/zinc/88/49/89/1028884989.db2.gz OMVAWMLDOVTIHS-KAGYGMCKSA-N 2 1 344.543 4.395 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)Cc1ccccc1C(F)(F)F ZINC000347280311 1029020520 /nfs/dbraw/zinc/02/05/20/1029020520.db2.gz SMPZUQDOJIAUIG-CQSZACIVSA-N 2 1 339.405 4.163 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)Cc1ccccc1C(F)(F)F ZINC000347280311 1029020536 /nfs/dbraw/zinc/02/05/36/1029020536.db2.gz SMPZUQDOJIAUIG-CQSZACIVSA-N 2 1 339.405 4.163 20 0 EIADMP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650752842 1029144656 /nfs/dbraw/zinc/14/46/56/1029144656.db2.gz BREHZZIZEUOENG-GFCCVEGCSA-N 2 1 336.838 4.187 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCc3c2cccc3O)cc1 ZINC000130454940 1029183032 /nfs/dbraw/zinc/18/30/32/1029183032.db2.gz SFYZFYVIWWTWEY-VLIAUNLRSA-N 2 1 333.435 4.224 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCSCc2cccc3ccccc32)CC[N@H+]1C ZINC000151159313 1029218984 /nfs/dbraw/zinc/21/89/84/1029218984.db2.gz QMXJVMOVDKUQIQ-VQIMIIECSA-N 2 1 328.525 4.145 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCOC2CCCCCC2)C1 ZINC000524892637 1029299630 /nfs/dbraw/zinc/29/96/30/1029299630.db2.gz XXUALWYLMPJARX-WOJBJXKFSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCOC2CCCCCC2)C1 ZINC000524892637 1029299645 /nfs/dbraw/zinc/29/96/45/1029299645.db2.gz XXUALWYLMPJARX-WOJBJXKFSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCOC2CCCCCC2)C1 ZINC000524892637 1029299659 /nfs/dbraw/zinc/29/96/59/1029299659.db2.gz XXUALWYLMPJARX-WOJBJXKFSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCOC2CCCCCC2)C1 ZINC000524892637 1029299671 /nfs/dbraw/zinc/29/96/71/1029299671.db2.gz XXUALWYLMPJARX-WOJBJXKFSA-N 2 1 336.564 4.312 20 0 EIADMP c1ccc(CC(C[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)Cc2ccccc2)cc1 ZINC000562200281 1029362349 /nfs/dbraw/zinc/36/23/49/1029362349.db2.gz CPMUCCNELPYRDZ-QFIPXVFZSA-N 2 1 348.534 4.162 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(F)(F)F ZINC000583934205 1029383743 /nfs/dbraw/zinc/38/37/43/1029383743.db2.gz SGFZMEGXYIXBOS-INIZCTEOSA-N 2 1 340.433 4.362 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(F)(F)F ZINC000583934205 1029383758 /nfs/dbraw/zinc/38/37/58/1029383758.db2.gz SGFZMEGXYIXBOS-INIZCTEOSA-N 2 1 340.433 4.362 20 0 EIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000475291257 1029504842 /nfs/dbraw/zinc/50/48/42/1029504842.db2.gz NRATXTNUWIULCC-FHWLQOOXSA-N 2 1 332.557 4.018 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)CCS2 ZINC000343571148 1029519443 /nfs/dbraw/zinc/51/94/43/1029519443.db2.gz LCVTVUSGYRIWOX-CRAIPNDOSA-N 2 1 334.529 4.086 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)CCS2 ZINC000343571148 1029519448 /nfs/dbraw/zinc/51/94/48/1029519448.db2.gz LCVTVUSGYRIWOX-CRAIPNDOSA-N 2 1 334.529 4.086 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)s2)cc1C ZINC000655711519 1029624027 /nfs/dbraw/zinc/62/40/27/1029624027.db2.gz KUNZOEMOSMEAAJ-QZTJIDSGSA-N 2 1 341.524 4.143 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)s2)cc1C ZINC000655711519 1029624033 /nfs/dbraw/zinc/62/40/33/1029624033.db2.gz KUNZOEMOSMEAAJ-QZTJIDSGSA-N 2 1 341.524 4.143 20 0 EIADMP CC1(C)CCC[C@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)O1 ZINC000714342892 1029627138 /nfs/dbraw/zinc/62/71/38/1029627138.db2.gz FOEVQODATGRZDI-WOJBJXKFSA-N 2 1 344.543 4.224 20 0 EIADMP CC1(C)CCC[C@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)O1 ZINC000714342892 1029627142 /nfs/dbraw/zinc/62/71/42/1029627142.db2.gz FOEVQODATGRZDI-WOJBJXKFSA-N 2 1 344.543 4.224 20 0 EIADMP Fc1ccc(C2CC([NH2+]C[C@@H]3CC[N@@H+](Cc4ccccc4)C3)C2)cc1 ZINC000192929907 1029648131 /nfs/dbraw/zinc/64/81/31/1029648131.db2.gz KSZQKISOYVJIOZ-NLMOZGTASA-N 2 1 338.470 4.183 20 0 EIADMP Brc1ccc2[nH+]ccc(NC3CC[NH+](C4CC4)CC3)c2c1 ZINC000301081683 1029666483 /nfs/dbraw/zinc/66/64/83/1029666483.db2.gz DJXYKQJATDCUJP-UHFFFAOYSA-N 2 1 346.272 4.036 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc2ccncc2s1 ZINC000657837991 1029733416 /nfs/dbraw/zinc/73/34/16/1029733416.db2.gz LTXXPTONJRQIOW-JKSUJKDBSA-N 2 1 331.529 4.459 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNCc1ccccc1Cl ZINC000708519856 1029743245 /nfs/dbraw/zinc/74/32/45/1029743245.db2.gz KCVXAEZIGVYGHM-QFBILLFUSA-N 2 1 328.887 4.198 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccccc1Cl ZINC000708519856 1029743251 /nfs/dbraw/zinc/74/32/51/1029743251.db2.gz KCVXAEZIGVYGHM-QFBILLFUSA-N 2 1 328.887 4.198 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccccc1Cl ZINC000708519856 1029743261 /nfs/dbraw/zinc/74/32/61/1029743261.db2.gz KCVXAEZIGVYGHM-QFBILLFUSA-N 2 1 328.887 4.198 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNCc1ccccc1Cl ZINC000708519851 1029743439 /nfs/dbraw/zinc/74/34/39/1029743439.db2.gz KCVXAEZIGVYGHM-APWZRJJASA-N 2 1 328.887 4.198 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccccc1Cl ZINC000708519851 1029743444 /nfs/dbraw/zinc/74/34/44/1029743444.db2.gz KCVXAEZIGVYGHM-APWZRJJASA-N 2 1 328.887 4.198 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccccc1Cl ZINC000708519851 1029743449 /nfs/dbraw/zinc/74/34/49/1029743449.db2.gz KCVXAEZIGVYGHM-APWZRJJASA-N 2 1 328.887 4.198 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(Br)c(Cl)c2)C1 ZINC000657840430 1029747206 /nfs/dbraw/zinc/74/72/06/1029747206.db2.gz GHSFFXIHYYXJAN-VXGBXAGGSA-N 2 1 345.712 4.095 20 0 EIADMP COc1cccc2c(NC3CC[NH+](C(C)(C)C)CC3)cc(C)[nH+]c12 ZINC000301682275 1029788000 /nfs/dbraw/zinc/78/80/00/1029788000.db2.gz SGLFMOMXFMZJBB-UHFFFAOYSA-N 2 1 327.472 4.227 20 0 EIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000081632081 1029810915 /nfs/dbraw/zinc/81/09/15/1029810915.db2.gz ULNWZQRTQPIOOM-INIZCTEOSA-N 2 1 343.902 4.052 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000081632081 1029810918 /nfs/dbraw/zinc/81/09/18/1029810918.db2.gz ULNWZQRTQPIOOM-INIZCTEOSA-N 2 1 343.902 4.052 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000081632081 1029810921 /nfs/dbraw/zinc/81/09/21/1029810921.db2.gz ULNWZQRTQPIOOM-INIZCTEOSA-N 2 1 343.902 4.052 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000081632081 1029810925 /nfs/dbraw/zinc/81/09/25/1029810925.db2.gz ULNWZQRTQPIOOM-INIZCTEOSA-N 2 1 343.902 4.052 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000708525631 1029812746 /nfs/dbraw/zinc/81/27/46/1029812746.db2.gz WTWGNUQRWUBCHO-CRAIPNDOSA-N 2 1 346.877 4.337 20 0 EIADMP C[N@H+]1CC[C@H](C[NH2+]C/C=C/c2ccc(F)c(F)c2)[C@H]1c1cccs1 ZINC000375752047 1029859977 /nfs/dbraw/zinc/85/99/77/1029859977.db2.gz YWUBBPJFJMGRDR-WYLRSBHASA-N 2 1 348.462 4.322 20 0 EIADMP CCc1ccc([C@H](CO)[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000090844063 1029870180 /nfs/dbraw/zinc/87/01/80/1029870180.db2.gz VTPNTRGOTUWVND-AOMKIAJQSA-N 2 1 349.478 4.127 20 0 EIADMP CC(C)[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C(C)C)c1cccnc1 ZINC000091285232 1029882276 /nfs/dbraw/zinc/88/22/76/1029882276.db2.gz SDUTVYCMARHVRD-NRFANRHFSA-N 2 1 325.500 4.409 20 0 EIADMP CC[C@H]1CCCC[C@@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000181747241 1029912913 /nfs/dbraw/zinc/91/29/13/1029912913.db2.gz MPUMBANXNCPVBY-OALUTQOASA-N 2 1 333.520 4.062 20 0 EIADMP CC[C@@H]1CCCC[C@@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000181747226 1029913718 /nfs/dbraw/zinc/91/37/18/1029913718.db2.gz MPUMBANXNCPVBY-MOPGFXCFSA-N 2 1 333.520 4.062 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccc(F)cn1 ZINC000092720870 1029929239 /nfs/dbraw/zinc/92/92/39/1029929239.db2.gz XLWAEKYMSYRKCK-INIZCTEOSA-N 2 1 327.447 4.057 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657867189 1029949652 /nfs/dbraw/zinc/94/96/52/1029949652.db2.gz KJUJATXCGMCYMJ-HKUYNNGSSA-N 2 1 349.478 4.043 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657867189 1029949665 /nfs/dbraw/zinc/94/96/65/1029949665.db2.gz KJUJATXCGMCYMJ-HKUYNNGSSA-N 2 1 349.478 4.043 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CCSc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183183535 1029988626 /nfs/dbraw/zinc/98/86/26/1029988626.db2.gz UDTWLPJFSYPALN-JTDSTZFVSA-N 2 1 330.541 4.466 20 0 EIADMP Cc1sccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390640579 1030013869 /nfs/dbraw/zinc/01/38/69/1030013869.db2.gz HAZKXHXZTYYOHF-IBGZPJMESA-N 2 1 328.525 4.447 20 0 EIADMP Cc1sccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390640579 1030013895 /nfs/dbraw/zinc/01/38/95/1030013895.db2.gz HAZKXHXZTYYOHF-IBGZPJMESA-N 2 1 328.525 4.447 20 0 EIADMP Cc1ccc(C)c([C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000392266644 1030080502 /nfs/dbraw/zinc/08/05/02/1030080502.db2.gz OQQNUZCYDRYQMX-CVDCTZTESA-N 2 1 334.507 4.467 20 0 EIADMP Clc1ccc2c(c1)CC[C@H]2[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000530217932 1030224044 /nfs/dbraw/zinc/22/40/44/1030224044.db2.gz CUYJBJOIXGCIRF-MISYRCLQSA-N 2 1 326.871 4.410 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CC(CF)(CF)C1 ZINC000657890855 1030334933 /nfs/dbraw/zinc/33/49/33/1030334933.db2.gz SMMHNBGQTQGQRG-UHFFFAOYSA-N 2 1 348.437 4.089 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2nc3c(s2)CCC3)CC1)CC(C)C ZINC000685462596 1030343598 /nfs/dbraw/zinc/34/35/98/1030343598.db2.gz BSVLXSPDJUBWCL-UHFFFAOYSA-N 2 1 349.588 4.212 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)ccc1C ZINC000447813058 1030353027 /nfs/dbraw/zinc/35/30/27/1030353027.db2.gz PTOCSLBXQFWEJH-SFHVURJKSA-N 2 1 344.524 4.067 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1C ZINC000447813058 1030353051 /nfs/dbraw/zinc/35/30/51/1030353051.db2.gz PTOCSLBXQFWEJH-SFHVURJKSA-N 2 1 344.524 4.067 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH+](C)[C@@H]1CC[N@@H+](C)C[C@H]1C ZINC000685470048 1030353607 /nfs/dbraw/zinc/35/36/07/1030353607.db2.gz LMSWROTUWHNWPP-DJDSVLOFSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH+](C)[C@@H]1CC[N@H+](C)C[C@H]1C ZINC000685470048 1030353625 /nfs/dbraw/zinc/35/36/25/1030353625.db2.gz LMSWROTUWHNWPP-DJDSVLOFSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[N@@H+](C)[C@@H]1CC[NH+](C)C[C@H]1C ZINC000685470048 1030353642 /nfs/dbraw/zinc/35/36/42/1030353642.db2.gz LMSWROTUWHNWPP-DJDSVLOFSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[N@H+](C)[C@@H]1CC[NH+](C)C[C@H]1C ZINC000685470048 1030353658 /nfs/dbraw/zinc/35/36/58/1030353658.db2.gz LMSWROTUWHNWPP-DJDSVLOFSA-N 2 1 340.433 4.381 20 0 EIADMP CSCC1CCC([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000708573362 1030397020 /nfs/dbraw/zinc/39/70/20/1030397020.db2.gz IWENDDZNZUOBEN-AFVILVPDSA-N 2 1 346.584 4.266 20 0 EIADMP Cc1[nH+]ccn1CCCCN1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000189494603 1030472677 /nfs/dbraw/zinc/47/26/77/1030472677.db2.gz NIYCUVXXUYJCJW-HNAYVOBHSA-N 2 1 347.890 4.087 20 0 EIADMP COc1ccc([C@@H](Cc2ccccc2)[NH2+]CCCn2cc[nH+]c2C)cc1 ZINC000685597936 1030554698 /nfs/dbraw/zinc/55/46/98/1030554698.db2.gz FBSDVXUXOVEDID-JOCHJYFZSA-N 2 1 349.478 4.164 20 0 EIADMP COC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccc(Cl)c1 ZINC000685645166 1030615518 /nfs/dbraw/zinc/61/55/18/1030615518.db2.gz KLIOHYXLUTZTLB-QFBILLFUSA-N 2 1 338.923 4.129 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527349639 1030641500 /nfs/dbraw/zinc/64/15/00/1030641500.db2.gz PVYVVBGCFVMPMX-JQHSSLGASA-N 2 1 342.449 4.464 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000398133007 1030714316 /nfs/dbraw/zinc/71/43/16/1030714316.db2.gz KDLIBUYHNUNNGB-LAUBAEHRSA-N 2 1 333.479 4.168 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000658027978 1030775208 /nfs/dbraw/zinc/77/52/08/1030775208.db2.gz BHTOSNKYBKKERI-CSNJMZFVSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNCc1ccncc1Cl ZINC000527637814 1030790390 /nfs/dbraw/zinc/79/03/90/1030790390.db2.gz CWDWXADVZYJQSF-MRXNPFEDSA-N 2 1 343.902 4.399 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccncc1Cl ZINC000527637814 1030790411 /nfs/dbraw/zinc/79/04/11/1030790411.db2.gz CWDWXADVZYJQSF-MRXNPFEDSA-N 2 1 343.902 4.399 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccncc1Cl ZINC000527637814 1030790435 /nfs/dbraw/zinc/79/04/35/1030790435.db2.gz CWDWXADVZYJQSF-MRXNPFEDSA-N 2 1 343.902 4.399 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)CCOc2c(Cl)cccc2Cl)CC1 ZINC000530905368 1030792324 /nfs/dbraw/zinc/79/23/24/1030792324.db2.gz VNVJTXXUIYSMDN-UHFFFAOYSA-N 2 1 345.314 4.178 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)CCOc2c(Cl)cccc2Cl)CC1 ZINC000530905368 1030792340 /nfs/dbraw/zinc/79/23/40/1030792340.db2.gz VNVJTXXUIYSMDN-UHFFFAOYSA-N 2 1 345.314 4.178 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@H]1c1cccs1 ZINC000527669030 1030807460 /nfs/dbraw/zinc/80/74/60/1030807460.db2.gz WSPZSNIJISZGCE-PXNSSMCTSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@H]1c1cccs1 ZINC000527669030 1030807465 /nfs/dbraw/zinc/80/74/65/1030807465.db2.gz WSPZSNIJISZGCE-PXNSSMCTSA-N 2 1 339.508 4.402 20 0 EIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ncccc1F ZINC000528036453 1031051702 /nfs/dbraw/zinc/05/17/02/1031051702.db2.gz SQQIVYJXZWLHGS-IVMQYODDSA-N 2 1 341.474 4.315 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCC1 ZINC000340306987 1031206329 /nfs/dbraw/zinc/20/63/29/1031206329.db2.gz WDZYUMRCPRISIP-PMACEKPBSA-N 2 1 330.516 4.008 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCC1 ZINC000340306987 1031206341 /nfs/dbraw/zinc/20/63/41/1031206341.db2.gz WDZYUMRCPRISIP-PMACEKPBSA-N 2 1 330.516 4.008 20 0 EIADMP Fc1ccccc1-c1ncc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)s1 ZINC000449015209 1031342738 /nfs/dbraw/zinc/34/27/38/1031342738.db2.gz KQADVHDIAVVFNI-ZDUSSCGKSA-N 2 1 342.443 4.052 20 0 EIADMP Clc1ccc(C[C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000449090469 1031449277 /nfs/dbraw/zinc/44/92/77/1031449277.db2.gz NDBVQOMVJODAMD-RNQOJCNYSA-N 2 1 332.919 4.268 20 0 EIADMP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)c2cccc(O)c2)CC1 ZINC000449129588 1031466063 /nfs/dbraw/zinc/46/60/63/1031466063.db2.gz CSAIJQUWEVHKKB-MSOLQXFVSA-N 2 1 338.495 4.138 20 0 EIADMP Cc1nn(C)cc1[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449131319 1031466652 /nfs/dbraw/zinc/46/66/52/1031466652.db2.gz LUYGWTSIGQOTJA-OAHLLOKOSA-N 2 1 334.552 4.058 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc2ccccc21 ZINC000449133137 1031468707 /nfs/dbraw/zinc/46/87/07/1031468707.db2.gz XFFDDVFUNJBPBV-KRWDZBQOSA-N 2 1 326.484 4.058 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CSCCc3ccccc32)C1 ZINC000531681416 1031473860 /nfs/dbraw/zinc/47/38/60/1031473860.db2.gz VHWIFIOIVVOQKZ-YLJYHZDGSA-N 2 1 332.557 4.119 20 0 EIADMP COc1cc(F)cc(C[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)c1 ZINC000449150643 1031485681 /nfs/dbraw/zinc/48/56/81/1031485681.db2.gz SEEOFOURPZNISB-MRXNPFEDSA-N 2 1 342.458 4.150 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cnc(-c2ccccc2F)s1 ZINC000449162210 1031500650 /nfs/dbraw/zinc/50/06/50/1031500650.db2.gz IKDSXMMJOURXCS-UHFFFAOYSA-N 2 1 344.459 4.024 20 0 EIADMP COc1cc(C)ccc1[C@@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000531737065 1031515386 /nfs/dbraw/zinc/51/53/86/1031515386.db2.gz CMYXAHQNWHUYSP-QGZVFWFLSA-N 2 1 330.516 4.451 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000124861009 1031560131 /nfs/dbraw/zinc/56/01/31/1031560131.db2.gz RDFZJFHNBYBMRF-UHFFFAOYSA-N 2 1 337.389 4.265 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000124861009 1031560149 /nfs/dbraw/zinc/56/01/49/1031560149.db2.gz RDFZJFHNBYBMRF-UHFFFAOYSA-N 2 1 337.389 4.265 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cn2)C1 ZINC000453075798 1031562907 /nfs/dbraw/zinc/56/29/07/1031562907.db2.gz AYHIMWPANPYGRL-MSOLQXFVSA-N 2 1 339.483 4.256 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cn2)C1 ZINC000453075798 1031562924 /nfs/dbraw/zinc/56/29/24/1031562924.db2.gz AYHIMWPANPYGRL-MSOLQXFVSA-N 2 1 339.483 4.256 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cn2)C1 ZINC000453075800 1031563848 /nfs/dbraw/zinc/56/38/48/1031563848.db2.gz AYHIMWPANPYGRL-QZTJIDSGSA-N 2 1 339.483 4.256 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cn2)C1 ZINC000453075800 1031563860 /nfs/dbraw/zinc/56/38/60/1031563860.db2.gz AYHIMWPANPYGRL-QZTJIDSGSA-N 2 1 339.483 4.256 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccccc2Oc2cccnc2)C[C@@H]1C ZINC000531140009 1031582564 /nfs/dbraw/zinc/58/25/64/1031582564.db2.gz SFKMHDRSDYQSHV-PKOBYXMFSA-N 2 1 339.483 4.179 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2Oc2cccnc2)C[C@@H]1C ZINC000531140009 1031582581 /nfs/dbraw/zinc/58/25/81/1031582581.db2.gz SFKMHDRSDYQSHV-PKOBYXMFSA-N 2 1 339.483 4.179 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2Oc2cccnc2)C[C@@H]1C ZINC000531140009 1031582591 /nfs/dbraw/zinc/58/25/91/1031582591.db2.gz SFKMHDRSDYQSHV-PKOBYXMFSA-N 2 1 339.483 4.179 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2Oc2cccnc2)C[C@@H]1C ZINC000531140009 1031582603 /nfs/dbraw/zinc/58/26/03/1031582603.db2.gz SFKMHDRSDYQSHV-PKOBYXMFSA-N 2 1 339.483 4.179 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)CCCc2cccnc2)c1 ZINC000453107483 1031599274 /nfs/dbraw/zinc/59/92/74/1031599274.db2.gz LELYOUNGXLHLAN-SFHVURJKSA-N 2 1 325.500 4.034 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000125535727 1031602072 /nfs/dbraw/zinc/60/20/72/1031602072.db2.gz QJGPURVAKGVXDH-SFHVURJKSA-N 2 1 329.513 4.086 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000125535727 1031602083 /nfs/dbraw/zinc/60/20/83/1031602083.db2.gz QJGPURVAKGVXDH-SFHVURJKSA-N 2 1 329.513 4.086 20 0 EIADMP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C1CCC1 ZINC000453133193 1031635903 /nfs/dbraw/zinc/63/59/03/1031635903.db2.gz YGTDHNBPTPVJCI-LJQANCHMSA-N 2 1 333.520 4.062 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccncc2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449417513 1031701375 /nfs/dbraw/zinc/70/13/75/1031701375.db2.gz YOTGVOHOVWQSCD-QFIPXVFZSA-N 2 1 349.522 4.204 20 0 EIADMP CC(C)[C@@H]1C[C@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000449493655 1031789206 /nfs/dbraw/zinc/78/92/06/1031789206.db2.gz LXIPYKOQZGAACF-YJMBLLCNSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000449493655 1031789220 /nfs/dbraw/zinc/78/92/20/1031789220.db2.gz LXIPYKOQZGAACF-YJMBLLCNSA-N 2 1 344.543 4.080 20 0 EIADMP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc3ccccc3n2)CC1 ZINC000531956067 1031873103 /nfs/dbraw/zinc/87/31/03/1031873103.db2.gz TZNLVWIMHWCYHP-JTSKRJEESA-N 2 1 337.511 4.368 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531963216 1031883915 /nfs/dbraw/zinc/88/39/15/1031883915.db2.gz CTLJBTYWOUYBOW-COXVUDFISA-N 2 1 328.422 4.475 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531963216 1031883922 /nfs/dbraw/zinc/88/39/22/1031883922.db2.gz CTLJBTYWOUYBOW-COXVUDFISA-N 2 1 328.422 4.475 20 0 EIADMP CC(C)(C)CC(C)(C)[NH+]1CCC([N@H+]2CCC[C@@]3(CCOC3)C2)CC1 ZINC000453384693 1031894650 /nfs/dbraw/zinc/89/46/50/1031894650.db2.gz TYKQGDOUNFDYDD-OAQYLSRUSA-N 2 1 336.564 4.168 20 0 EIADMP CCn1cc([C@H](C)[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cn1 ZINC000449678444 1031923747 /nfs/dbraw/zinc/92/37/47/1031923747.db2.gz PRXQFOIMNDTJMQ-INIZCTEOSA-N 2 1 334.552 4.233 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1nc(-c2ccccc2)cs1 ZINC000453390051 1031955681 /nfs/dbraw/zinc/95/56/81/1031955681.db2.gz CUHUMLCOOUALAF-OAHLLOKOSA-N 2 1 329.513 4.335 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@H](Cc1ccccc1)c1ccccc1 ZINC000531993770 1031959682 /nfs/dbraw/zinc/95/96/82/1031959682.db2.gz LEIBZYUZJOKJCW-PJIZGREPSA-N 2 1 336.523 4.331 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H]2CC[C@H](c3cccc(Cl)c3)C2)s1 ZINC000449774340 1031996323 /nfs/dbraw/zinc/99/63/23/1031996323.db2.gz OQLQHPVMYFFLDC-GOEBONIOSA-N 2 1 349.931 4.284 20 0 EIADMP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000449763795 1032009576 /nfs/dbraw/zinc/00/95/76/1032009576.db2.gz VOSJVWIUXNDXSR-CDHQVMDDSA-N 2 1 327.472 4.179 20 0 EIADMP C[C@@H](C[NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000453591453 1032037122 /nfs/dbraw/zinc/03/71/22/1032037122.db2.gz CCAAJQZVGFDLBI-AWEZNQCLSA-N 2 1 328.422 4.273 20 0 EIADMP C[C@H](C[NH2+]CCCC[N@@H+](C)C1CC1)c1cccc(Br)c1 ZINC000453601702 1032038202 /nfs/dbraw/zinc/03/82/02/1032038202.db2.gz VHCRROJRXCBRID-CQSZACIVSA-N 2 1 339.321 4.017 20 0 EIADMP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH2+]CC4CCSCC4)[C@H]3C2)cc1 ZINC000512612347 1033492738 /nfs/dbraw/zinc/49/27/38/1033492738.db2.gz OMBCFARABUWQKZ-PCCBWWKXSA-N 2 1 344.568 4.020 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000513216687 1034832760 /nfs/dbraw/zinc/83/27/60/1034832760.db2.gz GWTBOYIXNDELRX-FRYIKTPZSA-N 2 1 332.557 4.303 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000513216687 1034832762 /nfs/dbraw/zinc/83/27/62/1034832762.db2.gz GWTBOYIXNDELRX-FRYIKTPZSA-N 2 1 332.557 4.303 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CSc4ccccc43)CC2)C1 ZINC000513207722 1034835820 /nfs/dbraw/zinc/83/58/20/1034835820.db2.gz FEGAYTNUNOSWSB-HHXXYDBFSA-N 2 1 330.541 4.466 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H](c3cnn(C)c3)C(C)(C)C)CC2)C1 ZINC000513326333 1034880170 /nfs/dbraw/zinc/88/01/70/1034880170.db2.gz PECDWYSAFXXOHW-UXPWSPDFSA-N 2 1 346.563 4.140 20 0 EIADMP c1cnc2ccc(C[N@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)cc2c1 ZINC000513419296 1034925096 /nfs/dbraw/zinc/92/50/96/1034925096.db2.gz GPEKUWNWPVGPBM-FQEVSTJZSA-N 2 1 337.511 4.323 20 0 EIADMP c1cnc2ccc(C[N@@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)cc2c1 ZINC000513419296 1034925106 /nfs/dbraw/zinc/92/51/06/1034925106.db2.gz GPEKUWNWPVGPBM-FQEVSTJZSA-N 2 1 337.511 4.323 20 0 EIADMP Cc1ccc(F)c(C[N@@H+](C)C2CCN(Cc3ccccc3)CC2)c1 ZINC000513454222 1034951722 /nfs/dbraw/zinc/95/17/22/1034951722.db2.gz DKBMCEAXOREKOC-UHFFFAOYSA-N 2 1 326.459 4.231 20 0 EIADMP Cc1ccc(F)c(C[N@H+](C)C2CCN(Cc3ccccc3)CC2)c1 ZINC000513454222 1034951732 /nfs/dbraw/zinc/95/17/32/1034951732.db2.gz DKBMCEAXOREKOC-UHFFFAOYSA-N 2 1 326.459 4.231 20 0 EIADMP CCc1nc(C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cs1 ZINC000513546754 1035027943 /nfs/dbraw/zinc/02/79/43/1035027943.db2.gz ZPSJVNKCPWTJRS-FUHWJXTLSA-N 2 1 343.540 4.096 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2cc3ccnc(Cl)c3s2)C1 ZINC000894242023 1035307998 /nfs/dbraw/zinc/30/79/98/1035307998.db2.gz QSHBQICFSUEPQO-ZDUSSCGKSA-N 2 1 337.920 4.160 20 0 EIADMP C[N@@H+](CC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCc2ccc(F)cc21 ZINC000501072136 1035372088 /nfs/dbraw/zinc/37/20/88/1035372088.db2.gz ZEHMPFFFSFJTNN-NRFANRHFSA-N 2 1 339.458 4.056 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501378236 1035432713 /nfs/dbraw/zinc/43/27/13/1035432713.db2.gz PACLTWOMMVQFQZ-IIZPIQPGSA-N 2 1 343.559 4.456 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+](C)CC2CC[NH+](C)CC2)o1 ZINC000513713811 1035445032 /nfs/dbraw/zinc/44/50/32/1035445032.db2.gz UHSNEZIJQXVHSO-UHFFFAOYSA-N 2 1 330.447 4.168 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@H+]1C ZINC000501465711 1035449912 /nfs/dbraw/zinc/44/99/12/1035449912.db2.gz GLQWXKQJLVHTFW-MGPUTAFESA-N 2 1 344.449 4.169 20 0 EIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000420299093 1035502568 /nfs/dbraw/zinc/50/25/68/1035502568.db2.gz GGBHINVZIOAIMJ-ZIAGYGMSSA-N 2 1 326.406 4.230 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CC[C@@H]([C@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420302784 1035503292 /nfs/dbraw/zinc/50/32/92/1035503292.db2.gz GOBOQPVHVMSESW-CORIIIEPSA-N 2 1 333.863 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@@H]([C@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420302784 1035503303 /nfs/dbraw/zinc/50/33/03/1035503303.db2.gz GOBOQPVHVMSESW-CORIIIEPSA-N 2 1 333.863 4.034 20 0 EIADMP C[C@@H](C[N@H+]1CCC[C@@H]([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501951054 1035753806 /nfs/dbraw/zinc/75/38/06/1035753806.db2.gz OBQYKHKYSRXORP-WMLDXEAASA-N 2 1 328.422 4.225 20 0 EIADMP FC(F)C1CCC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC000282089009 1035836061 /nfs/dbraw/zinc/83/60/61/1035836061.db2.gz YGTQZLPVFZXNHJ-UHFFFAOYSA-N 2 1 336.470 4.107 20 0 EIADMP FC1(F)CC[C@H](C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC000485496600 1035971386 /nfs/dbraw/zinc/97/13/86/1035971386.db2.gz UMTJKSGMZBODCB-IBGZPJMESA-N 2 1 348.481 4.410 20 0 EIADMP C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000502258107 1036015645 /nfs/dbraw/zinc/01/56/45/1036015645.db2.gz QYEBPULHCLQPJZ-FIRLOTFOSA-N 2 1 329.532 4.064 20 0 EIADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000502258107 1036015670 /nfs/dbraw/zinc/01/56/70/1036015670.db2.gz QYEBPULHCLQPJZ-FIRLOTFOSA-N 2 1 329.532 4.064 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000502285035 1036042420 /nfs/dbraw/zinc/04/24/20/1036042420.db2.gz SWPJOXCVANDCNI-SFKKXYGYSA-N 2 1 340.433 4.382 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000502285035 1036042443 /nfs/dbraw/zinc/04/24/43/1036042443.db2.gz SWPJOXCVANDCNI-SFKKXYGYSA-N 2 1 340.433 4.382 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000502285035 1036042462 /nfs/dbraw/zinc/04/24/62/1036042462.db2.gz SWPJOXCVANDCNI-SFKKXYGYSA-N 2 1 340.433 4.382 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000502285035 1036042489 /nfs/dbraw/zinc/04/24/89/1036042489.db2.gz SWPJOXCVANDCNI-SFKKXYGYSA-N 2 1 340.433 4.382 20 0 EIADMP CC[C@@H](NCc1nc2c(s1)C[N@H+](C(C)C)CC2)c1ccccc1 ZINC000414497292 1036044671 /nfs/dbraw/zinc/04/46/71/1036044671.db2.gz SJZNJGNPWQTXMA-MRXNPFEDSA-N 2 1 329.513 4.151 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+]CC1([NH2+][C@H](C)c2ccccc2)CCCC1 ZINC000502452271 1036221311 /nfs/dbraw/zinc/22/13/11/1036221311.db2.gz MJPVPWYTKLPIJQ-HLAWJBBLSA-N 2 1 344.543 4.445 20 0 EIADMP c1ncc(-c2ccc(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)cc2)o1 ZINC000906519604 1036311142 /nfs/dbraw/zinc/31/11/42/1036311142.db2.gz DGBBQJYYRMJBCN-UHFFFAOYSA-N 2 1 347.462 4.096 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CC23CCSCC3)cc1 ZINC000421374268 1036326934 /nfs/dbraw/zinc/32/69/34/1036326934.db2.gz HGLZTJSBLGMTCT-MAUKXSAKSA-N 2 1 341.524 4.365 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000502699178 1036519510 /nfs/dbraw/zinc/51/95/10/1036519510.db2.gz XMMPUJWYZLAFAR-NYVOZVTQSA-N 2 1 344.543 4.356 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CC1 ZINC000602709890 1036582594 /nfs/dbraw/zinc/58/25/94/1036582594.db2.gz JKAKYPCQCGQEFL-ICSRJNTNSA-N 2 1 344.568 4.477 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CC1 ZINC000602709890 1036582621 /nfs/dbraw/zinc/58/26/21/1036582621.db2.gz JKAKYPCQCGQEFL-ICSRJNTNSA-N 2 1 344.568 4.477 20 0 EIADMP c1ccc(C[N@@H+](C2CCCCC2)C2CC[NH+](CC3CC3)CC2)nc1 ZINC001168387899 1036710994 /nfs/dbraw/zinc/71/09/94/1036710994.db2.gz XSVLVISNRSIUQL-UHFFFAOYSA-N 2 1 327.516 4.091 20 0 EIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168389634 1036759062 /nfs/dbraw/zinc/75/90/62/1036759062.db2.gz UXVPOGONXUQEJE-UHFFFAOYSA-N 2 1 340.433 4.402 20 0 EIADMP COc1ccc([C@H]([NH2+]CCCCn2cc[nH+]c2C)C(C)C)c(F)c1 ZINC000421836448 1036800437 /nfs/dbraw/zinc/80/04/37/1036800437.db2.gz QZAARKIPRZNMDW-LJQANCHMSA-N 2 1 333.451 4.106 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CC12CCSCC2 ZINC000421869869 1036839744 /nfs/dbraw/zinc/83/97/44/1036839744.db2.gz DYFYOEIPJOPGHU-RLLQIKCJSA-N 2 1 344.568 4.020 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCC(F)(F)F ZINC000271518928 1036934134 /nfs/dbraw/zinc/93/41/34/1036934134.db2.gz PHBPWADVVPZKAG-DOTOQJQBSA-N 2 1 328.422 4.219 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCC(F)(F)F ZINC000271518928 1036934153 /nfs/dbraw/zinc/93/41/53/1036934153.db2.gz PHBPWADVVPZKAG-DOTOQJQBSA-N 2 1 328.422 4.219 20 0 EIADMP C[C@@H]([NH2+][C@H]1CCCc2c3cc(Cl)ccc3[nH]c21)c1c[nH+]ccc1N ZINC000629548367 1036941660 /nfs/dbraw/zinc/94/16/60/1036941660.db2.gz NIXJQOQTDBHQKE-ZMZPIMSZSA-N 2 1 340.858 4.357 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)nc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272265918 1037148442 /nfs/dbraw/zinc/14/84/42/1037148442.db2.gz AKVPTBQQKHUFBX-FCEWJHQRSA-N 2 1 343.902 4.296 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)s1 ZINC000573018198 1037226827 /nfs/dbraw/zinc/22/68/27/1037226827.db2.gz DJVINNMBEMOSKJ-HXUWFJFHSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)s1 ZINC000573018198 1037226852 /nfs/dbraw/zinc/22/68/52/1037226852.db2.gz DJVINNMBEMOSKJ-HXUWFJFHSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)s1 ZINC000573018198 1037226882 /nfs/dbraw/zinc/22/68/82/1037226882.db2.gz DJVINNMBEMOSKJ-HXUWFJFHSA-N 2 1 326.509 4.155 20 0 EIADMP Brc1ccc2c(N[C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc[nH+]c2c1 ZINC000604757129 1037527714 /nfs/dbraw/zinc/52/77/14/1037527714.db2.gz VPNPQULDXMIWLN-KGLIPLIRSA-N 2 1 346.272 4.036 20 0 EIADMP Brc1ccc2c(N[C@@H]3CC[N@H+]4CCC[C@H]4C3)cc[nH+]c2c1 ZINC000604757129 1037527733 /nfs/dbraw/zinc/52/77/33/1037527733.db2.gz VPNPQULDXMIWLN-KGLIPLIRSA-N 2 1 346.272 4.036 20 0 EIADMP Brc1ccc2c(N[C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc[nH+]c2c1 ZINC000604757130 1037528040 /nfs/dbraw/zinc/52/80/40/1037528040.db2.gz VPNPQULDXMIWLN-UONOGXRCSA-N 2 1 346.272 4.036 20 0 EIADMP Brc1ccc2c(N[C@H]3CC[N@H+]4CCC[C@@H]4C3)cc[nH+]c2c1 ZINC000604757130 1037528069 /nfs/dbraw/zinc/52/80/69/1037528069.db2.gz VPNPQULDXMIWLN-UONOGXRCSA-N 2 1 346.272 4.036 20 0 EIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@@H]3CCC[N@@H+](C(C)C)C3)o2)cc1 ZINC000591712672 1037543503 /nfs/dbraw/zinc/54/35/03/1037543503.db2.gz ROLHXZAGXCYOMZ-SFHVURJKSA-N 2 1 326.484 4.465 20 0 EIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@@H]3CCC[N@H+](C(C)C)C3)o2)cc1 ZINC000591712672 1037543514 /nfs/dbraw/zinc/54/35/14/1037543514.db2.gz ROLHXZAGXCYOMZ-SFHVURJKSA-N 2 1 326.484 4.465 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CS[C@H](C(C)C)C2)CC1 ZINC000488449916 1037606761 /nfs/dbraw/zinc/60/67/61/1037606761.db2.gz PJYSOXGRURLBFB-PMACEKPBSA-N 2 1 332.557 4.079 20 0 EIADMP C[N@@H+](CC1CC1)C[C@H]1CCN(CCc2cc(Cl)ccc2Cl)C1 ZINC000488469424 1037615731 /nfs/dbraw/zinc/61/57/31/1037615731.db2.gz ZJDCQLKPMPRJKZ-OAHLLOKOSA-N 2 1 341.326 4.200 20 0 EIADMP C[C@@H]1C[C@H]1c1ccc(CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)o1 ZINC000488513688 1037641439 /nfs/dbraw/zinc/64/14/39/1037641439.db2.gz LMQRTQDPUWGUKD-YFVAEKQCSA-N 2 1 338.495 4.057 20 0 EIADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)o1 ZINC000488513688 1037641457 /nfs/dbraw/zinc/64/14/57/1037641457.db2.gz LMQRTQDPUWGUKD-YFVAEKQCSA-N 2 1 338.495 4.057 20 0 EIADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)o1 ZINC000488513688 1037641482 /nfs/dbraw/zinc/64/14/82/1037641482.db2.gz LMQRTQDPUWGUKD-YFVAEKQCSA-N 2 1 338.495 4.057 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2ncc(C)cc2C)cc1 ZINC000573799066 1037688096 /nfs/dbraw/zinc/68/80/96/1037688096.db2.gz WADGBONOWWDXLN-QGZVFWFLSA-N 2 1 334.467 4.086 20 0 EIADMP C[C@@H]([NH3+])[C@H]1CC[N@@H+](Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000414663839 1037722073 /nfs/dbraw/zinc/72/20/73/1037722073.db2.gz RWETVPMXQOHTNH-WBVHZDCISA-N 2 1 344.886 4.088 20 0 EIADMP C[N@@H+](CCCOc1ccc(C(C)(C)C)cc1)C[C@H]1CCC[NH+](C)C1 ZINC000605421260 1037776541 /nfs/dbraw/zinc/77/65/41/1037776541.db2.gz WVTBJLWGTAWXJN-SFHVURJKSA-N 2 1 332.532 4.027 20 0 EIADMP C[NH+](CCCOc1ccc(C(C)(C)C)cc1)C[C@H]1CCC[N@H+](C)C1 ZINC000605421260 1037776559 /nfs/dbraw/zinc/77/65/59/1037776559.db2.gz WVTBJLWGTAWXJN-SFHVURJKSA-N 2 1 332.532 4.027 20 0 EIADMP C[NH+](CCCOc1ccc(C(C)(C)C)cc1)C[C@H]1CCC[N@@H+](C)C1 ZINC000605421260 1037776577 /nfs/dbraw/zinc/77/65/77/1037776577.db2.gz WVTBJLWGTAWXJN-SFHVURJKSA-N 2 1 332.532 4.027 20 0 EIADMP Cc1nc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)oc1-c1ccc(Cl)cc1 ZINC000422625617 1037782585 /nfs/dbraw/zinc/78/25/85/1037782585.db2.gz BZDKDVQCACVCHK-ZENOOKHLSA-N 2 1 347.890 4.109 20 0 EIADMP Cc1nc(C[N@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)oc1-c1ccc(Cl)cc1 ZINC000422625617 1037782607 /nfs/dbraw/zinc/78/26/07/1037782607.db2.gz BZDKDVQCACVCHK-ZENOOKHLSA-N 2 1 347.890 4.109 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2ccccc2)cc1F ZINC000503569035 1037822022 /nfs/dbraw/zinc/82/20/22/1037822022.db2.gz MUQRBMAISXJUKR-INIZCTEOSA-N 2 1 337.442 4.424 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)c1cccc(C(F)(F)F)c1)c1c[nH+]ccc1N ZINC000422803324 1037836407 /nfs/dbraw/zinc/83/64/07/1037836407.db2.gz CPJYLGINQGHFMN-QWHCGFSZSA-N 2 1 337.389 4.357 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(OC(F)(F)F)cc1 ZINC000422813900 1037839796 /nfs/dbraw/zinc/83/97/96/1037839796.db2.gz YXAPRZZAIYTMPI-YMRXKLBXSA-N 2 1 336.357 4.381 20 0 EIADMP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000422871099 1037857561 /nfs/dbraw/zinc/85/75/61/1037857561.db2.gz ZTNKZTZETRYJIZ-HIFRSBDPSA-N 2 1 341.480 4.034 20 0 EIADMP C[C@@H]([NH2+]CC(C)(C)c1cccc(C(F)(F)F)c1)c1c[nH+]ccc1N ZINC000422912078 1037866150 /nfs/dbraw/zinc/86/61/50/1037866150.db2.gz VGKRHEKJKKSTOL-GFCCVEGCSA-N 2 1 337.389 4.141 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1OCc1ccccc1 ZINC000423010907 1037899031 /nfs/dbraw/zinc/89/90/31/1037899031.db2.gz AFLZACHUPZBTKP-BLMTVLTRSA-N 2 1 336.479 4.199 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c2ccccc21 ZINC000423019749 1037905612 /nfs/dbraw/zinc/90/56/12/1037905612.db2.gz WZVNPLBIODRIHF-AKHDSKFASA-N 2 1 346.833 4.044 20 0 EIADMP Fc1ccc(CCCC[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1F ZINC000423045286 1037925412 /nfs/dbraw/zinc/92/54/12/1037925412.db2.gz BXLISVLCYHSWJM-NQIIRXRSSA-N 2 1 344.449 4.370 20 0 EIADMP CC(C)N(C)c1ccccc1C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000423056736 1037926201 /nfs/dbraw/zinc/92/62/01/1037926201.db2.gz GDKCNPSHJOLKFX-NHCUHLMSSA-N 2 1 337.511 4.114 20 0 EIADMP Fc1ccc(CCCC[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1F ZINC000423045285 1037926449 /nfs/dbraw/zinc/92/64/49/1037926449.db2.gz BXLISVLCYHSWJM-GHTZIAJQSA-N 2 1 344.449 4.370 20 0 EIADMP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)c1 ZINC000423103034 1037963530 /nfs/dbraw/zinc/96/35/30/1037963530.db2.gz XJCLKYUGIRMILD-QYRPDUKASA-N 2 1 342.433 4.294 20 0 EIADMP Cc1sc(C2([NH2+][C@H](C)C[C@@H](C)[NH3+])CCC2)nc1-c1ccccc1F ZINC000423144224 1038016920 /nfs/dbraw/zinc/01/69/20/1038016920.db2.gz GJRFNVZILBAVFD-CHWSQXEVSA-N 2 1 347.503 4.352 20 0 EIADMP Clc1ccc([C@@H]2CC[C@@H]([NH2+]CCC[NH2+]Cc3cccnc3)C2)cc1 ZINC000423186587 1038017571 /nfs/dbraw/zinc/01/75/71/1038017571.db2.gz LBVSDVWEWPZJBB-UYAOXDASSA-N 2 1 343.902 4.141 20 0 EIADMP Cc1ccc(C[N@@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)s1 ZINC000414721886 1038026197 /nfs/dbraw/zinc/02/61/97/1038026197.db2.gz JMUHRKYHQMZKDT-QGZVFWFLSA-N 2 1 332.538 4.262 20 0 EIADMP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(Cl)c(Cl)c1 ZINC000423187180 1038041966 /nfs/dbraw/zinc/04/19/66/1038041966.db2.gz MEABVSSRIXJSMR-CYBMUJFWSA-N 2 1 338.282 4.219 20 0 EIADMP FC(F)(F)c1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000606447673 1038067744 /nfs/dbraw/zinc/06/77/44/1038067744.db2.gz JSZXLVDFUFWENS-QGZVFWFLSA-N 2 1 326.406 4.156 20 0 EIADMP FC(F)(F)c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000606447673 1038067770 /nfs/dbraw/zinc/06/77/70/1038067770.db2.gz JSZXLVDFUFWENS-QGZVFWFLSA-N 2 1 326.406 4.156 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@@H]3C1)CCCO2 ZINC000489630265 1038174676 /nfs/dbraw/zinc/17/46/76/1038174676.db2.gz LHSSCYAGOJDHFR-QWFCFKBJSA-N 2 1 328.500 4.240 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCCO2 ZINC000489630265 1038174695 /nfs/dbraw/zinc/17/46/95/1038174695.db2.gz LHSSCYAGOJDHFR-QWFCFKBJSA-N 2 1 328.500 4.240 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1cccc(F)c1)c1cccc(Cl)c1 ZINC000490165547 1038363917 /nfs/dbraw/zinc/36/39/17/1038363917.db2.gz XSXHGEOTMPYMNP-LJQANCHMSA-N 2 1 343.833 4.363 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000594786052 1038400739 /nfs/dbraw/zinc/40/07/39/1038400739.db2.gz ISDGXNRSXYNHSL-CQSZACIVSA-N 2 1 334.916 4.500 20 0 EIADMP CCCCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480769817 1038797573 /nfs/dbraw/zinc/79/75/73/1038797573.db2.gz MQSLKWJNMVCVTM-QZTJIDSGSA-N 2 1 330.516 4.391 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(OC(F)F)c2)C1 ZINC000539050699 1038799156 /nfs/dbraw/zinc/79/91/56/1038799156.db2.gz QBZXBNXLVIXRNG-CVEARBPZSA-N 2 1 340.458 4.307 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000504911582 1038848231 /nfs/dbraw/zinc/84/82/31/1038848231.db2.gz IOXDDFXEJSVCAA-RPCJCACASA-N 2 1 325.500 4.318 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000537616142 1038897853 /nfs/dbraw/zinc/89/78/53/1038897853.db2.gz YFTQYIZAJRGKSX-MLGOLLRUSA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000537616142 1038897854 /nfs/dbraw/zinc/89/78/54/1038897854.db2.gz YFTQYIZAJRGKSX-MLGOLLRUSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000537616142 1038897855 /nfs/dbraw/zinc/89/78/55/1038897855.db2.gz YFTQYIZAJRGKSX-MLGOLLRUSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000537616142 1038897856 /nfs/dbraw/zinc/89/78/56/1038897856.db2.gz YFTQYIZAJRGKSX-MLGOLLRUSA-N 2 1 332.385 4.007 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2OC(F)F)C1 ZINC000481017566 1038950206 /nfs/dbraw/zinc/95/02/06/1038950206.db2.gz CJLCLPALLKLFND-QWHCGFSZSA-N 2 1 346.849 4.324 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2OC(F)F)C1 ZINC000481017566 1038950235 /nfs/dbraw/zinc/95/02/35/1038950235.db2.gz CJLCLPALLKLFND-QWHCGFSZSA-N 2 1 346.849 4.324 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cccc(Br)c2)C1 ZINC000481024776 1038962438 /nfs/dbraw/zinc/96/24/38/1038962438.db2.gz NJPQJONRZQKKHC-WMLDXEAASA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000481024738 1038964444 /nfs/dbraw/zinc/96/44/44/1038964444.db2.gz OQTDSOJOKCVWHG-CABCVRRESA-N 2 1 344.421 4.010 20 0 EIADMP FC(F)(F)Oc1cccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000537623371 1039004089 /nfs/dbraw/zinc/00/40/89/1039004089.db2.gz DJKXWUIQOYLNBE-INIZCTEOSA-N 2 1 342.405 4.036 20 0 EIADMP FC(F)(F)Oc1cccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000537623371 1039004107 /nfs/dbraw/zinc/00/41/07/1039004107.db2.gz DJKXWUIQOYLNBE-INIZCTEOSA-N 2 1 342.405 4.036 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCC[C@@H]1Cc1ccccc1 ZINC000481191182 1039102833 /nfs/dbraw/zinc/10/28/33/1039102833.db2.gz MUMCXAFGBHDGHO-RTWAWAEBSA-N 2 1 325.500 4.363 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc(F)c(F)c2F)C[C@H]1c1ccccc1 ZINC000550780555 1039129849 /nfs/dbraw/zinc/12/98/49/1039129849.db2.gz HSAPQDJNKZKVKB-WMZOPIPTSA-N 2 1 348.412 4.072 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc(F)c(F)c2F)C[C@H]1c1ccccc1 ZINC000550780555 1039129877 /nfs/dbraw/zinc/12/98/77/1039129877.db2.gz HSAPQDJNKZKVKB-WMZOPIPTSA-N 2 1 348.412 4.072 20 0 EIADMP c1csc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)c1 ZINC000537628808 1039143111 /nfs/dbraw/zinc/14/31/11/1039143111.db2.gz CFFHLQYUDVPCHB-FQEVSTJZSA-N 2 1 326.509 4.236 20 0 EIADMP c1csc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)c1 ZINC000537628808 1039143129 /nfs/dbraw/zinc/14/31/29/1039143129.db2.gz CFFHLQYUDVPCHB-FQEVSTJZSA-N 2 1 326.509 4.236 20 0 EIADMP c1csc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)c1 ZINC000537628808 1039143141 /nfs/dbraw/zinc/14/31/41/1039143141.db2.gz CFFHLQYUDVPCHB-FQEVSTJZSA-N 2 1 326.509 4.236 20 0 EIADMP c1csc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)c1 ZINC000537628808 1039143159 /nfs/dbraw/zinc/14/31/59/1039143159.db2.gz CFFHLQYUDVPCHB-FQEVSTJZSA-N 2 1 326.509 4.236 20 0 EIADMP CN(CC[C@@H]1CCCC[N@H+]1C)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000537632307 1039213581 /nfs/dbraw/zinc/21/35/81/1039213581.db2.gz JKGFGELRMVYSNP-SFHVURJKSA-N 2 1 346.906 4.036 20 0 EIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000537632307 1039213611 /nfs/dbraw/zinc/21/36/11/1039213611.db2.gz JKGFGELRMVYSNP-SFHVURJKSA-N 2 1 346.906 4.036 20 0 EIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000537632307 1039213630 /nfs/dbraw/zinc/21/36/30/1039213630.db2.gz JKGFGELRMVYSNP-SFHVURJKSA-N 2 1 346.906 4.036 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000537632307 1039213644 /nfs/dbraw/zinc/21/36/44/1039213644.db2.gz JKGFGELRMVYSNP-SFHVURJKSA-N 2 1 346.906 4.036 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000537632307 1039213671 /nfs/dbraw/zinc/21/36/71/1039213671.db2.gz JKGFGELRMVYSNP-SFHVURJKSA-N 2 1 346.906 4.036 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000090409169 1039221040 /nfs/dbraw/zinc/22/10/40/1039221040.db2.gz NIZBCNXFITUOFB-AQXGTKIOSA-N 2 1 341.524 4.298 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)s1 ZINC000090409169 1039221053 /nfs/dbraw/zinc/22/10/53/1039221053.db2.gz NIZBCNXFITUOFB-AQXGTKIOSA-N 2 1 341.524 4.298 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000061558251 1039222949 /nfs/dbraw/zinc/22/29/49/1039222949.db2.gz OBMNIYLBCOCCBK-UHFFFAOYSA-N 2 1 326.484 4.060 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]CC(C)(C)C[NH+]3CCCC3)oc21 ZINC000477917071 1039229007 /nfs/dbraw/zinc/22/90/07/1039229007.db2.gz SAKSRFDWNUFMOQ-HNNXBMFYSA-N 2 1 330.472 4.214 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)c2cccc(F)c2)CC1 ZINC000481307705 1039252481 /nfs/dbraw/zinc/25/24/81/1039252481.db2.gz KCQMTIKHKOWXID-KRWDZBQOSA-N 2 1 326.459 4.449 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000690 1039295837 /nfs/dbraw/zinc/29/58/37/1039295837.db2.gz IQXGHXSNVQBBMJ-GJZGRUSLSA-N 2 1 328.422 4.430 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000690 1039295849 /nfs/dbraw/zinc/29/58/49/1039295849.db2.gz IQXGHXSNVQBBMJ-GJZGRUSLSA-N 2 1 328.422 4.430 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)CC[N@@H+]1C ZINC000513830997 1039311864 /nfs/dbraw/zinc/31/18/64/1039311864.db2.gz IGXRHLLXUZDFMM-LMMKCTJWSA-N 2 1 328.500 4.285 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)CC[N@H+]1C ZINC000513830997 1039311880 /nfs/dbraw/zinc/31/18/80/1039311880.db2.gz IGXRHLLXUZDFMM-LMMKCTJWSA-N 2 1 328.500 4.285 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000481334800 1039313606 /nfs/dbraw/zinc/31/36/06/1039313606.db2.gz WSZSAPQTJFVZMW-GOSISDBHSA-N 2 1 338.495 4.319 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000555598409 1039421162 /nfs/dbraw/zinc/42/11/62/1039421162.db2.gz ZACGXEKXCIHKNQ-RHSMWYFYSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000555598409 1039421173 /nfs/dbraw/zinc/42/11/73/1039421173.db2.gz ZACGXEKXCIHKNQ-RHSMWYFYSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000555598409 1039421210 /nfs/dbraw/zinc/42/12/10/1039421210.db2.gz ZACGXEKXCIHKNQ-RHSMWYFYSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000555598413 1039423645 /nfs/dbraw/zinc/42/36/45/1039423645.db2.gz ZACGXEKXCIHKNQ-YOEHRIQHSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000555598413 1039423659 /nfs/dbraw/zinc/42/36/59/1039423659.db2.gz ZACGXEKXCIHKNQ-YOEHRIQHSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000555598413 1039423677 /nfs/dbraw/zinc/42/36/77/1039423677.db2.gz ZACGXEKXCIHKNQ-YOEHRIQHSA-N 2 1 342.405 4.064 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](CCOC)c2ccccc2)CC1 ZINC000534543248 1039534363 /nfs/dbraw/zinc/53/43/63/1039534363.db2.gz NZLCBUBJJYPDOB-OAQYLSRUSA-N 2 1 332.532 4.208 20 0 EIADMP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000481680172 1039722171 /nfs/dbraw/zinc/72/21/71/1039722171.db2.gz XOXBENQXUYFKLS-HZTRTUMWSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000481680172 1039722192 /nfs/dbraw/zinc/72/21/92/1039722192.db2.gz XOXBENQXUYFKLS-HZTRTUMWSA-N 2 1 340.433 4.241 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCOc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000429781287 1039735935 /nfs/dbraw/zinc/73/59/35/1039735935.db2.gz SLHKRVDIHLAAPB-BBRMVZONSA-N 2 1 345.314 4.034 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCOc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000429781287 1039735959 /nfs/dbraw/zinc/73/59/59/1039735959.db2.gz SLHKRVDIHLAAPB-BBRMVZONSA-N 2 1 345.314 4.034 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCOc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000429781287 1039735987 /nfs/dbraw/zinc/73/59/87/1039735987.db2.gz SLHKRVDIHLAAPB-BBRMVZONSA-N 2 1 345.314 4.034 20 0 EIADMP Fc1cccc(CCC[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000434663780 1039793692 /nfs/dbraw/zinc/79/36/92/1039793692.db2.gz HACODRAVAAJTCJ-UHFFFAOYSA-N 2 1 341.474 4.171 20 0 EIADMP CCc1ccc(CC[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000434688724 1039812740 /nfs/dbraw/zinc/81/27/40/1039812740.db2.gz OZSCBFJVODUXFZ-UHFFFAOYSA-N 2 1 337.511 4.204 20 0 EIADMP CC[N@@H+](C)C[C@H]1CCN(Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000537649555 1039815565 /nfs/dbraw/zinc/81/55/65/1039815565.db2.gz NDGHXGBTYUYITF-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000537649555 1039815569 /nfs/dbraw/zinc/81/55/69/1039815569.db2.gz NDGHXGBTYUYITF-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000537649555 1039815570 /nfs/dbraw/zinc/81/55/70/1039815570.db2.gz NDGHXGBTYUYITF-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000537649555 1039815572 /nfs/dbraw/zinc/81/55/72/1039815572.db2.gz NDGHXGBTYUYITF-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000537649555 1039815573 /nfs/dbraw/zinc/81/55/73/1039815573.db2.gz NDGHXGBTYUYITF-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP c1ccc(CSCCC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000534869030 1039821103 /nfs/dbraw/zinc/82/11/03/1039821103.db2.gz QJCYXANTBLRFNH-HXUWFJFHSA-N 2 1 332.557 4.260 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccccc2OC(F)F)CC1 ZINC000122976820 1039834121 /nfs/dbraw/zinc/83/41/21/1039834121.db2.gz RZOBSSBREIHROQ-CQSZACIVSA-N 2 1 326.431 4.203 20 0 EIADMP CN1CC[C@@H]([NH2+]Cc2ccccc2OC(F)F)C[C@@H]1c1ccccc1 ZINC000550990266 1039855336 /nfs/dbraw/zinc/85/53/36/1039855336.db2.gz FZBNQKFQXNIYJC-QZTJIDSGSA-N 2 1 346.421 4.213 20 0 EIADMP C[C@H](COc1cccc(F)c1)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000551008618 1039861549 /nfs/dbraw/zinc/86/15/49/1039861549.db2.gz YLIHBXHXVGQXAU-BSIFCXSSSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](COc1cccc(F)c1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000551008618 1039861550 /nfs/dbraw/zinc/86/15/50/1039861550.db2.gz YLIHBXHXVGQXAU-BSIFCXSSSA-N 2 1 342.458 4.018 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)s2)C[C@@H]1c1ccccc1 ZINC000551012529 1039873954 /nfs/dbraw/zinc/87/39/54/1039873954.db2.gz RPYKINXGHQDCQT-NVXWUHKLSA-N 2 1 334.916 4.369 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)s2)C[C@@H]1c1ccccc1 ZINC000551012529 1039873961 /nfs/dbraw/zinc/87/39/61/1039873961.db2.gz RPYKINXGHQDCQT-NVXWUHKLSA-N 2 1 334.916 4.369 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc3ccccc3n2)C[C@H]1c1ccccc1 ZINC000551029284 1039887106 /nfs/dbraw/zinc/88/71/06/1039887106.db2.gz CBIANMYTINVFEZ-GMAHTHKFSA-N 2 1 345.490 4.202 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc3ccccc3n2)C[C@H]1c1ccccc1 ZINC000551029284 1039887107 /nfs/dbraw/zinc/88/71/07/1039887107.db2.gz CBIANMYTINVFEZ-GMAHTHKFSA-N 2 1 345.490 4.202 20 0 EIADMP c1c2ccccc2sc1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000537692195 1039907429 /nfs/dbraw/zinc/90/74/29/1039907429.db2.gz GKCMHQRFDBPXSI-LPHOPBHVSA-N 2 1 326.509 4.350 20 0 EIADMP c1c2ccccc2sc1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000537692195 1039907457 /nfs/dbraw/zinc/90/74/57/1039907457.db2.gz GKCMHQRFDBPXSI-LPHOPBHVSA-N 2 1 326.509 4.350 20 0 EIADMP c1c2ccccc2sc1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000537692195 1039907477 /nfs/dbraw/zinc/90/74/77/1039907477.db2.gz GKCMHQRFDBPXSI-LPHOPBHVSA-N 2 1 326.509 4.350 20 0 EIADMP c1c[nH+]c(C2CC[NH+](Cc3cnc(C4CCCCC4)s3)CC2)[nH]1 ZINC000535083793 1039925232 /nfs/dbraw/zinc/92/52/32/1039925232.db2.gz KRXDTHIPUBUZIA-UHFFFAOYSA-N 2 1 330.501 4.294 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCOc2ccccc2Cl)C[C@H]1c1ccccc1 ZINC000551086042 1039967878 /nfs/dbraw/zinc/96/78/78/1039967878.db2.gz MCAMXBXRQNTZNA-HKUYNNGSSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCOc2ccccc2Cl)C[C@H]1c1ccccc1 ZINC000551086042 1039967900 /nfs/dbraw/zinc/96/79/00/1039967900.db2.gz MCAMXBXRQNTZNA-HKUYNNGSSA-N 2 1 344.886 4.144 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000551175564 1040018141 /nfs/dbraw/zinc/01/81/41/1040018141.db2.gz MTYKFPLPLPEVBW-NFYVFUGESA-N 2 1 330.516 4.007 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000551175564 1040018160 /nfs/dbraw/zinc/01/81/60/1040018160.db2.gz MTYKFPLPLPEVBW-NFYVFUGESA-N 2 1 330.516 4.007 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000551176433 1040021996 /nfs/dbraw/zinc/02/19/96/1040021996.db2.gz XPOZPJVJBOEJSW-MHTWAQMVSA-N 2 1 330.516 4.005 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000551176433 1040022016 /nfs/dbraw/zinc/02/20/16/1040022016.db2.gz XPOZPJVJBOEJSW-MHTWAQMVSA-N 2 1 330.516 4.005 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132481 1040024947 /nfs/dbraw/zinc/02/49/47/1040024947.db2.gz YHANFRQDDNUZKB-IERDGZPVSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132481 1040024963 /nfs/dbraw/zinc/02/49/63/1040024963.db2.gz YHANFRQDDNUZKB-IERDGZPVSA-N 2 1 344.449 4.008 20 0 EIADMP Cc1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1F ZINC000435055905 1040036787 /nfs/dbraw/zinc/03/67/87/1040036787.db2.gz DMVSJLGCVHXXPJ-UHFFFAOYSA-N 2 1 327.447 4.047 20 0 EIADMP C[C@@H]1C[C@H]1c1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)o1 ZINC000435062034 1040040677 /nfs/dbraw/zinc/04/06/77/1040040677.db2.gz WIPBGNZPCHKIPR-DNVCBOLYSA-N 2 1 339.483 4.315 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]CCCc1c(Cl)cccc1Cl ZINC000482163770 1040051770 /nfs/dbraw/zinc/05/17/70/1040051770.db2.gz MPYNOKRKTHZBDP-CYBMUJFWSA-N 2 1 340.298 4.357 20 0 EIADMP CC(C)CC[C@](C)(O)C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000551266770 1040130973 /nfs/dbraw/zinc/13/09/73/1040130973.db2.gz DUCTULVQMKIMSR-HRTMPFAESA-N 2 1 346.559 4.206 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2c3cc(F)ccc3C[C@@H]2C)c1 ZINC000482323923 1040164849 /nfs/dbraw/zinc/16/48/49/1040164849.db2.gz UJJGFRKNQMULGQ-YCRPNKLZSA-N 2 1 326.459 4.301 20 0 EIADMP Cc1sc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)nc1-c1ccc(Cl)cc1 ZINC000514737464 1040179422 /nfs/dbraw/zinc/17/94/22/1040179422.db2.gz BYFOVBHIHHNCDC-LSDHHAIUSA-N 2 1 335.904 4.131 20 0 EIADMP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)c1 ZINC000482353531 1040202122 /nfs/dbraw/zinc/20/21/22/1040202122.db2.gz DABIGEQNDKCVMQ-HZPDHXFCSA-N 2 1 340.458 4.367 20 0 EIADMP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000482353531 1040202154 /nfs/dbraw/zinc/20/21/54/1040202154.db2.gz DABIGEQNDKCVMQ-HZPDHXFCSA-N 2 1 340.458 4.367 20 0 EIADMP Cc1ccc([C@H]([NH2+]CCC[NH+]2CCC(O)CC2)C2CCCCC2)cc1 ZINC000479277107 1040234430 /nfs/dbraw/zinc/23/44/30/1040234430.db2.gz IXNKTARTAXXCKN-JOCHJYFZSA-N 2 1 344.543 4.053 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc3ccccc3)C1)CC2 ZINC000482436764 1040246324 /nfs/dbraw/zinc/24/63/24/1040246324.db2.gz JKFZVVXQHNJRHN-NFBKMPQASA-N 2 1 334.507 4.137 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]CCOC3CCCCC3)CC23CC3)cc1 ZINC000565774297 1040356716 /nfs/dbraw/zinc/35/67/16/1040356716.db2.gz PQPLCNPYLKJSFW-FQEVSTJZSA-N 2 1 342.527 4.123 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CCOC3CCCCC3)CC23CC3)cc1 ZINC000565774297 1040356729 /nfs/dbraw/zinc/35/67/29/1040356729.db2.gz PQPLCNPYLKJSFW-FQEVSTJZSA-N 2 1 342.527 4.123 20 0 EIADMP CN(C)c1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000514938660 1040378800 /nfs/dbraw/zinc/37/88/00/1040378800.db2.gz YAGDYVNMQNDXBV-OAQYLSRUSA-N 2 1 349.522 4.039 20 0 EIADMP CN(C)c1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000514938660 1040378817 /nfs/dbraw/zinc/37/88/17/1040378817.db2.gz YAGDYVNMQNDXBV-OAQYLSRUSA-N 2 1 349.522 4.039 20 0 EIADMP CC[C@@H](C[N@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000435447646 1040393645 /nfs/dbraw/zinc/39/36/45/1040393645.db2.gz HVSMZVGYXGXIGI-MSOLQXFVSA-N 2 1 343.540 4.057 20 0 EIADMP CCC1(Cc2ccccc2)CC[NH+]([C@@H]2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000479540564 1040445578 /nfs/dbraw/zinc/44/55/78/1040445578.db2.gz GHACOGIEPKFVBY-NHCUHLMSSA-N 2 1 326.528 4.348 20 0 EIADMP C[C@H]([NH2+]C1CC(N2CCCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000479542053 1040445706 /nfs/dbraw/zinc/44/57/06/1040445706.db2.gz NRKOROVTXPASJD-IGEOTXOUSA-N 2 1 326.406 4.373 20 0 EIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000479542053 1040445712 /nfs/dbraw/zinc/44/57/12/1040445712.db2.gz NRKOROVTXPASJD-IGEOTXOUSA-N 2 1 326.406 4.373 20 0 EIADMP c1cc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)n(-c2cc[nH+]cc2)n1 ZINC000668110550 1040449128 /nfs/dbraw/zinc/44/91/28/1040449128.db2.gz IZYMAEGAYBQXDC-NUZGMZIFSA-N 2 1 344.462 4.178 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)C1(C)C ZINC000539497138 1040487100 /nfs/dbraw/zinc/48/71/00/1040487100.db2.gz XQJDQAJIWZGALS-FFZOFVMBSA-N 2 1 330.516 4.005 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(F)c1F ZINC000539546536 1040532970 /nfs/dbraw/zinc/53/29/70/1040532970.db2.gz QXHPFYWFPKHXKL-FUHWJXTLSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc(F)c1F ZINC000539546536 1040532986 /nfs/dbraw/zinc/53/29/86/1040532986.db2.gz QXHPFYWFPKHXKL-FUHWJXTLSA-N 2 1 344.449 4.180 20 0 EIADMP FC(F)(F)c1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1Cl ZINC001168357533 1040539726 /nfs/dbraw/zinc/53/97/26/1040539726.db2.gz GCQZKSYKUWZBGN-UHFFFAOYSA-N 2 1 346.824 4.323 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@]4(CC[NH2+]C4)C3)s2)cc1 ZINC000462407877 1040572059 /nfs/dbraw/zinc/57/20/59/1040572059.db2.gz FOTSWNCUCXALAB-FQEVSTJZSA-N 2 1 341.524 4.119 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@]4(CC[NH2+]C4)C3)s2)cc1 ZINC000462407877 1040572081 /nfs/dbraw/zinc/57/20/81/1040572081.db2.gz FOTSWNCUCXALAB-FQEVSTJZSA-N 2 1 341.524 4.119 20 0 EIADMP C[NH+](C)CCC[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000479858106 1040718150 /nfs/dbraw/zinc/71/81/50/1040718150.db2.gz IGGXZYPLJNVHBQ-OAHLLOKOSA-N 2 1 349.931 4.382 20 0 EIADMP CN1CCC([NH+]2CCC(CC[N@@H+](C)CCCC3CCCC3)CC2)CC1 ZINC000483220390 1040776882 /nfs/dbraw/zinc/77/68/82/1040776882.db2.gz WNOSGXPAZUVPPB-UHFFFAOYSA-N 2 1 349.607 4.085 20 0 EIADMP C[N@H+](CCCC1CCCC1)CCC1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000483220390 1040776900 /nfs/dbraw/zinc/77/69/00/1040776900.db2.gz WNOSGXPAZUVPPB-UHFFFAOYSA-N 3 1 349.607 4.085 20 0 EIADMP C[N@@H+](CCCC1CCCC1)CCC1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000483220390 1040776919 /nfs/dbraw/zinc/77/69/19/1040776919.db2.gz WNOSGXPAZUVPPB-UHFFFAOYSA-N 3 1 349.607 4.085 20 0 EIADMP CCc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cc1 ZINC000462727847 1040859827 /nfs/dbraw/zinc/85/98/27/1040859827.db2.gz XJQJBCOOMDPBBI-ICSRJNTNSA-N 2 1 328.525 4.483 20 0 EIADMP CCc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)cc1 ZINC000462727847 1040859834 /nfs/dbraw/zinc/85/98/34/1040859834.db2.gz XJQJBCOOMDPBBI-ICSRJNTNSA-N 2 1 328.525 4.483 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000483483450 1040873000 /nfs/dbraw/zinc/87/30/00/1040873000.db2.gz NNFKUGPRECHSNE-FRFSOERESA-N 2 1 326.406 4.183 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000483483450 1040873006 /nfs/dbraw/zinc/87/30/06/1040873006.db2.gz NNFKUGPRECHSNE-FRFSOERESA-N 2 1 326.406 4.183 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000483483450 1040873013 /nfs/dbraw/zinc/87/30/13/1040873013.db2.gz NNFKUGPRECHSNE-FRFSOERESA-N 2 1 326.406 4.183 20 0 EIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CCSc2ccc(Cl)cc2)C1 ZINC000470966841 1040947142 /nfs/dbraw/zinc/94/71/42/1040947142.db2.gz LDJSYEJGIPLGCS-INIZCTEOSA-N 2 1 338.948 4.096 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](CCSc2ccc(Cl)cc2)C1 ZINC000470966841 1040947165 /nfs/dbraw/zinc/94/71/65/1040947165.db2.gz LDJSYEJGIPLGCS-INIZCTEOSA-N 2 1 338.948 4.096 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](CCSc2ccc(Cl)cc2)C1 ZINC000470966841 1040947188 /nfs/dbraw/zinc/94/71/88/1040947188.db2.gz LDJSYEJGIPLGCS-INIZCTEOSA-N 2 1 338.948 4.096 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](CCSc2ccc(Cl)cc2)C1 ZINC000470966841 1040947210 /nfs/dbraw/zinc/94/72/10/1040947210.db2.gz LDJSYEJGIPLGCS-INIZCTEOSA-N 2 1 338.948 4.096 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1CCc1ccccc1 ZINC000537966069 1040970672 /nfs/dbraw/zinc/97/06/72/1040970672.db2.gz SXIUWNXFIJJYDL-DUXKGJEZSA-N 2 1 325.500 4.219 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]CCC[NH+]2CCCCC2)cc1OCC ZINC000480134180 1040999376 /nfs/dbraw/zinc/99/93/76/1040999376.db2.gz GGIRSNLFLDHERS-KRWDZBQOSA-N 2 1 334.504 4.011 20 0 EIADMP C(C[NH+]1CCCCC1)C[NH+]1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000425501814 1041004860 /nfs/dbraw/zinc/00/48/60/1041004860.db2.gz GKSGAKCQUSGXNZ-UHFFFAOYSA-N 2 1 347.572 4.077 20 0 EIADMP CC(C)[NH+]1CCC([NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000436273144 1041046065 /nfs/dbraw/zinc/04/60/65/1041046065.db2.gz VGIHEIGIKIPFER-UHFFFAOYSA-N 2 1 334.813 4.321 20 0 EIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)c(C)c1 ZINC000064616191 1041053007 /nfs/dbraw/zinc/05/30/07/1041053007.db2.gz DFPFBJFYFOYSPR-GOSISDBHSA-N 2 1 328.525 4.367 20 0 EIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)c(C)c1 ZINC000064616191 1041053025 /nfs/dbraw/zinc/05/30/25/1041053025.db2.gz DFPFBJFYFOYSPR-GOSISDBHSA-N 2 1 328.525 4.367 20 0 EIADMP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000554374163 1041057568 /nfs/dbraw/zinc/05/75/68/1041057568.db2.gz PKOFMVVZQXZXPM-HGJUEJDCSA-N 2 1 330.491 4.157 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@H](C)C1 ZINC000436293352 1041059683 /nfs/dbraw/zinc/05/96/83/1041059683.db2.gz CWRYXMKBPIFSNM-MOIQIXESSA-N 2 1 340.433 4.271 20 0 EIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000480253194 1041133962 /nfs/dbraw/zinc/13/39/62/1041133962.db2.gz WOSGGUXKBRVXJV-AEFFLSMTSA-N 2 1 342.449 4.262 20 0 EIADMP Cc1ccc(C)c([C@@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)c1 ZINC000484279503 1041179753 /nfs/dbraw/zinc/17/97/53/1041179753.db2.gz WKXTVTNIPGSQCT-QGZVFWFLSA-N 2 1 338.499 4.030 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](c2cccnc2)C2CC2)CC1 ZINC000540151493 1041198008 /nfs/dbraw/zinc/19/80/08/1041198008.db2.gz QAGIFJWOQSSAST-HBGVWJBISA-N 2 1 327.516 4.165 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1sccc1Br ZINC000540167469 1041208777 /nfs/dbraw/zinc/20/87/77/1041208777.db2.gz ZHHBAWZBPUKNSX-QWRGUYRKSA-N 2 1 342.306 4.002 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000540170104 1041211479 /nfs/dbraw/zinc/21/14/79/1041211479.db2.gz YSABVYQJEXRRNP-RYUDHWBXSA-N 2 1 326.271 4.485 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(OCC(C)C)cc1 ZINC000540170149 1041214595 /nfs/dbraw/zinc/21/45/95/1041214595.db2.gz ZBLONICDPGCQLL-IAGOWNOFSA-N 2 1 329.488 4.213 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCC1 ZINC000540163764 1041226547 /nfs/dbraw/zinc/22/65/47/1041226547.db2.gz JQNRLHHFLQVDPH-SUMWQHHRSA-N 2 1 341.326 4.345 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(C)(C)c1c(F)cccc1Cl ZINC000540188949 1041231990 /nfs/dbraw/zinc/23/19/90/1041231990.db2.gz MXWPAJHLSJZFEN-DVOMOZLQSA-N 2 1 326.887 4.075 20 0 EIADMP Cc1ccccc1OCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463063900 1041299558 /nfs/dbraw/zinc/29/95/58/1041299558.db2.gz FTFGNRQFWPGFJU-PZJWPPBQSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1ccccc1OCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463063900 1041299579 /nfs/dbraw/zinc/29/95/79/1041299579.db2.gz FTFGNRQFWPGFJU-PZJWPPBQSA-N 2 1 338.495 4.017 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(OCC3CCCCC3)c2)CC[N@H+]1C ZINC000538411213 1041330028 /nfs/dbraw/zinc/33/00/28/1041330028.db2.gz XUYZHNNVBKUPNU-XLIONFOSSA-N 2 1 330.516 4.218 20 0 EIADMP CC[C@@H](Cc1ccccc1)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463114265 1041340889 /nfs/dbraw/zinc/34/08/89/1041340889.db2.gz DYVMILLDKJIQRV-QFIPXVFZSA-N 2 1 336.523 4.304 20 0 EIADMP Cc1ccc(OCC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000463133538 1041367925 /nfs/dbraw/zinc/36/79/25/1041367925.db2.gz TZDPKHMRBFMBMT-TZIWHRDSSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1ccc(OCC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000463133538 1041367939 /nfs/dbraw/zinc/36/79/39/1041367939.db2.gz TZDPKHMRBFMBMT-TZIWHRDSSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1ccc(OCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000463133536 1041368448 /nfs/dbraw/zinc/36/84/48/1041368448.db2.gz TZDPKHMRBFMBMT-FPOVZHCZSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1ccc(OCC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000463133536 1041368455 /nfs/dbraw/zinc/36/84/55/1041368455.db2.gz TZDPKHMRBFMBMT-FPOVZHCZSA-N 2 1 338.495 4.017 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000463141441 1041375188 /nfs/dbraw/zinc/37/51/88/1041375188.db2.gz KCGUPNLZPBZXAY-UWJYYQICSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2)CC[N@H+]1Cc1ccccc1 ZINC000463141441 1041375197 /nfs/dbraw/zinc/37/51/97/1041375197.db2.gz KCGUPNLZPBZXAY-UWJYYQICSA-N 2 1 326.459 4.011 20 0 EIADMP Fc1cccc(CCC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000463153201 1041384723 /nfs/dbraw/zinc/38/47/23/1041384723.db2.gz ARDQIRKLHNCNFG-UHFFFAOYSA-N 2 1 340.486 4.055 20 0 EIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+]([C@H]4C[C@@H]4c4ccccc4)C3)C2)cc1 ZINC000463195390 1041410032 /nfs/dbraw/zinc/41/00/32/1041410032.db2.gz WXQLQIMQIKDFFF-VJBWXMMDSA-N 2 1 332.491 4.141 20 0 EIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+]([C@H]4C[C@@H]4c4ccccc4)C3)C2)cc1 ZINC000463195390 1041410035 /nfs/dbraw/zinc/41/00/35/1041410035.db2.gz WXQLQIMQIKDFFF-VJBWXMMDSA-N 2 1 332.491 4.141 20 0 EIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+]([C@H]4C[C@@H]4c4ccccc4)C3)C2)cc1 ZINC000463195390 1041410038 /nfs/dbraw/zinc/41/00/38/1041410038.db2.gz WXQLQIMQIKDFFF-VJBWXMMDSA-N 2 1 332.491 4.141 20 0 EIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+]([C@@H]4C[C@H]4c4ccccc4)C3)C2)cc1 ZINC000463195392 1041410898 /nfs/dbraw/zinc/41/08/98/1041410898.db2.gz WXQLQIMQIKDFFF-ZRBLBEILSA-N 2 1 332.491 4.141 20 0 EIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+]([C@@H]4C[C@H]4c4ccccc4)C3)C2)cc1 ZINC000463195392 1041410906 /nfs/dbraw/zinc/41/09/06/1041410906.db2.gz WXQLQIMQIKDFFF-ZRBLBEILSA-N 2 1 332.491 4.141 20 0 EIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+]([C@@H]4C[C@H]4c4ccccc4)C3)C2)cc1 ZINC000463195392 1041410913 /nfs/dbraw/zinc/41/09/13/1041410913.db2.gz WXQLQIMQIKDFFF-ZRBLBEILSA-N 2 1 332.491 4.141 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC000667706285 1041422475 /nfs/dbraw/zinc/42/24/75/1041422475.db2.gz WBQTYGYDSJMMNF-RBUKOAKNSA-N 2 1 341.524 4.035 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCSCc2ccc(Cl)cc2Cl)CC[N@H+]1C ZINC000540396774 1041439931 /nfs/dbraw/zinc/43/99/31/1041439931.db2.gz DLILSPOWAWAWBZ-SWLSCSKDSA-N 2 1 347.355 4.299 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1N(C)C ZINC000480638493 1041450181 /nfs/dbraw/zinc/45/01/81/1041450181.db2.gz IXZQRFUQUVQIIR-IAGOWNOFSA-N 2 1 335.511 4.197 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000480659344 1041458244 /nfs/dbraw/zinc/45/82/44/1041458244.db2.gz FLWYDUWMAUDAFJ-GOSISDBHSA-N 2 1 330.516 4.220 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2(Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463285435 1041473949 /nfs/dbraw/zinc/47/39/49/1041473949.db2.gz XPBNQHVRSROCAS-KNQAVFIVSA-N 2 1 334.507 4.404 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2(Cc3ccccc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463285435 1041473951 /nfs/dbraw/zinc/47/39/51/1041473951.db2.gz XPBNQHVRSROCAS-KNQAVFIVSA-N 2 1 334.507 4.404 20 0 EIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000480692418 1041475802 /nfs/dbraw/zinc/47/58/02/1041475802.db2.gz IGUSJXWGIZQOAW-SBHAEUEKSA-N 2 1 330.516 4.389 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c(OC)ccc3ccccc32)C[C@@H]1C ZINC000538717254 1041487010 /nfs/dbraw/zinc/48/70/10/1041487010.db2.gz NWMOKQDDPBYJLK-WMZOPIPTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c(OC)ccc3ccccc32)C[C@@H]1C ZINC000538717254 1041487018 /nfs/dbraw/zinc/48/70/18/1041487018.db2.gz NWMOKQDDPBYJLK-WMZOPIPTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c(OC)ccc3ccccc32)C[C@@H]1C ZINC000538717254 1041487021 /nfs/dbraw/zinc/48/70/21/1041487021.db2.gz NWMOKQDDPBYJLK-WMZOPIPTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c(OC)ccc3ccccc32)C[C@@H]1C ZINC000538717254 1041487027 /nfs/dbraw/zinc/48/70/27/1041487027.db2.gz NWMOKQDDPBYJLK-WMZOPIPTSA-N 2 1 326.484 4.153 20 0 EIADMP COc1ccc([C@H](CCC(C)C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480749106 1041505164 /nfs/dbraw/zinc/50/51/64/1041505164.db2.gz ZWJARYOOIGBSRA-UTKZUKDTSA-N 2 1 330.516 4.246 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000538749950 1041523487 /nfs/dbraw/zinc/52/34/87/1041523487.db2.gz PGYJWGGTARIHPN-OAHLLOKOSA-N 2 1 348.437 4.215 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000538749950 1041523500 /nfs/dbraw/zinc/52/35/00/1041523500.db2.gz PGYJWGGTARIHPN-OAHLLOKOSA-N 2 1 348.437 4.215 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000538749950 1041523504 /nfs/dbraw/zinc/52/35/04/1041523504.db2.gz PGYJWGGTARIHPN-OAHLLOKOSA-N 2 1 348.437 4.215 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000538749950 1041523519 /nfs/dbraw/zinc/52/35/19/1041523519.db2.gz PGYJWGGTARIHPN-OAHLLOKOSA-N 2 1 348.437 4.215 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000538749949 1041523792 /nfs/dbraw/zinc/52/37/92/1041523792.db2.gz PGYJWGGTARIHPN-HNNXBMFYSA-N 2 1 348.437 4.215 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000538749949 1041523798 /nfs/dbraw/zinc/52/37/98/1041523798.db2.gz PGYJWGGTARIHPN-HNNXBMFYSA-N 2 1 348.437 4.215 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000538749949 1041523808 /nfs/dbraw/zinc/52/38/08/1041523808.db2.gz PGYJWGGTARIHPN-HNNXBMFYSA-N 2 1 348.437 4.215 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000538749949 1041523817 /nfs/dbraw/zinc/52/38/17/1041523817.db2.gz PGYJWGGTARIHPN-HNNXBMFYSA-N 2 1 348.437 4.215 20 0 EIADMP c1cc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc(-c2ccncc2)c1 ZINC000538799317 1041539026 /nfs/dbraw/zinc/53/90/26/1041539026.db2.gz YOXZFEVMKODDEY-GMAHTHKFSA-N 2 1 347.506 4.197 20 0 EIADMP c1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc(-c2ccncc2)c1 ZINC000538799317 1041539033 /nfs/dbraw/zinc/53/90/33/1041539033.db2.gz YOXZFEVMKODDEY-GMAHTHKFSA-N 2 1 347.506 4.197 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+]CCC3=CCCCCC3)sc2C1 ZINC000463718031 1041716787 /nfs/dbraw/zinc/71/67/87/1041716787.db2.gz XWEKBAHRMRSEHW-UHFFFAOYSA-N 2 1 333.545 4.280 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+]CCC3=CCCCCC3)sc2C1 ZINC000463718031 1041716795 /nfs/dbraw/zinc/71/67/95/1041716795.db2.gz XWEKBAHRMRSEHW-UHFFFAOYSA-N 2 1 333.545 4.280 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000540915737 1041736428 /nfs/dbraw/zinc/73/64/28/1041736428.db2.gz LHCSUNFIYOXKKS-UZLBHIALSA-N 2 1 328.887 4.361 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000540915737 1041736436 /nfs/dbraw/zinc/73/64/36/1041736436.db2.gz LHCSUNFIYOXKKS-UZLBHIALSA-N 2 1 328.887 4.361 20 0 EIADMP COc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1 ZINC000540962863 1041753280 /nfs/dbraw/zinc/75/32/80/1041753280.db2.gz XRCHRDRUYPJUDB-GHTZIAJQSA-N 2 1 338.495 4.004 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc3nc(C)ccc3c2)CC1 ZINC000437579758 1041845794 /nfs/dbraw/zinc/84/57/94/1041845794.db2.gz MCQZTKYHHPWFOP-UHFFFAOYSA-N 2 1 339.527 4.487 20 0 EIADMP C[C@@H]([NH2+]C[C@@H](C)CC(F)(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000402757738 1042005219 /nfs/dbraw/zinc/00/52/19/1042005219.db2.gz GDVVHUYJVJMJAI-ZMSDIMECSA-N 2 1 328.422 4.075 20 0 EIADMP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)c1ccc2ccccc2c1OC(F)F ZINC000425940477 1042020576 /nfs/dbraw/zinc/02/05/76/1042020576.db2.gz HCIWBHDUQLPJMR-UONOGXRCSA-N 2 1 336.426 4.290 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)CC(F)(F)F ZINC000402771429 1042028772 /nfs/dbraw/zinc/02/87/72/1042028772.db2.gz LGRWOEMYMWNVDE-YQQAZPJKSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)CC(F)(F)F ZINC000402771429 1042028781 /nfs/dbraw/zinc/02/87/81/1042028781.db2.gz LGRWOEMYMWNVDE-YQQAZPJKSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12)CC(F)(F)F ZINC000402796800 1042041336 /nfs/dbraw/zinc/04/13/36/1042041336.db2.gz VYJVFJGJJHIOAA-XOYOTBSWSA-N 2 1 340.433 4.075 20 0 EIADMP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)o2)C1 ZINC000517536479 1042070241 /nfs/dbraw/zinc/07/02/41/1042070241.db2.gz MZAXLDGXLMDOSM-HNNXBMFYSA-N 2 1 332.875 4.455 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)o2)C1 ZINC000517536479 1042070242 /nfs/dbraw/zinc/07/02/42/1042070242.db2.gz MZAXLDGXLMDOSM-HNNXBMFYSA-N 2 1 332.875 4.455 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000425955269 1042073782 /nfs/dbraw/zinc/07/37/82/1042073782.db2.gz RCDOQFNMVUDLCH-HXUWFJFHSA-N 2 1 343.902 4.093 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](CCOc2cc(Cl)cc(Cl)c2)C1 ZINC000464778409 1042160464 /nfs/dbraw/zinc/16/04/64/1042160464.db2.gz OEGOXHKLDOJXSD-AWEZNQCLSA-N 2 1 345.314 4.036 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCOc2cc(Cl)cc(Cl)c2)C1 ZINC000464778409 1042160467 /nfs/dbraw/zinc/16/04/67/1042160467.db2.gz OEGOXHKLDOJXSD-AWEZNQCLSA-N 2 1 345.314 4.036 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](CSC)c2ccc(C(F)(F)F)cc2)C1 ZINC000541916179 1042178705 /nfs/dbraw/zinc/17/87/05/1042178705.db2.gz DTIGOMLQKZAYKM-CJNGLKHVSA-N 2 1 346.462 4.041 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCOc2ccccc2)C1 ZINC000303657674 1042492185 /nfs/dbraw/zinc/49/21/85/1042492185.db2.gz VEFNWMSIQKHOGN-UXHICEINSA-N 2 1 330.516 4.042 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCOc2ccccc2)C1 ZINC000303657674 1042492187 /nfs/dbraw/zinc/49/21/87/1042492187.db2.gz VEFNWMSIQKHOGN-UXHICEINSA-N 2 1 330.516 4.042 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCOc2ccccc2)C1 ZINC000303657674 1042492189 /nfs/dbraw/zinc/49/21/89/1042492189.db2.gz VEFNWMSIQKHOGN-UXHICEINSA-N 2 1 330.516 4.042 20 0 EIADMP Clc1ccc(CCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167964364 1042594893 /nfs/dbraw/zinc/59/48/93/1042594893.db2.gz POAKFWTXIFKWAI-IHWFROFDSA-N 2 1 332.919 4.268 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)[C@@H](C)C1 ZINC000492335648 1042611385 /nfs/dbraw/zinc/61/13/85/1042611385.db2.gz SQMUEZOROOSWCW-YJBOKZPZSA-N 2 1 338.923 4.289 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000518796439 1042700634 /nfs/dbraw/zinc/70/06/34/1042700634.db2.gz HKWZKMVMXDMGBN-FQEVSTJZSA-N 2 1 330.516 4.077 20 0 EIADMP CCN1CCC([N@H+](C)Cc2ccc(OC)c(OCCC(C)C)c2)CC1 ZINC000506645554 1042726112 /nfs/dbraw/zinc/72/61/12/1042726112.db2.gz JIMSKPFBFRSGOE-UHFFFAOYSA-N 2 1 348.531 4.036 20 0 EIADMP CCN1CCC([N@@H+](C)Cc2ccc(OC)c(OCCC(C)C)c2)CC1 ZINC000506645554 1042726122 /nfs/dbraw/zinc/72/61/22/1042726122.db2.gz JIMSKPFBFRSGOE-UHFFFAOYSA-N 2 1 348.531 4.036 20 0 EIADMP Cc1ccc2c(CC[NH3+])cn(C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)c2c1 ZINC001167965383 1042794130 /nfs/dbraw/zinc/79/41/30/1042794130.db2.gz DKMPPZLFHFATIY-YOFSQIOKSA-N 2 1 337.511 4.029 20 0 EIADMP c1ccc(CSCCC[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000536382715 1042816735 /nfs/dbraw/zinc/81/67/35/1042816735.db2.gz NEUBRQROERRPBU-HXUWFJFHSA-N 2 1 332.557 4.118 20 0 EIADMP Fc1cc(Cl)cc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000309682204 1042818852 /nfs/dbraw/zinc/81/88/52/1042818852.db2.gz BESKXQBWUIXEOG-MRXNPFEDSA-N 2 1 332.850 4.091 20 0 EIADMP C[C@H](c1ccccn1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000493106051 1042819864 /nfs/dbraw/zinc/81/98/64/1042819864.db2.gz OCODLTKKIXXSNL-KNQAVFIVSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccccn1)[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000493106051 1042819866 /nfs/dbraw/zinc/81/98/66/1042819866.db2.gz OCODLTKKIXXSNL-KNQAVFIVSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccccn1)[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000493106051 1042819867 /nfs/dbraw/zinc/81/98/67/1042819867.db2.gz OCODLTKKIXXSNL-KNQAVFIVSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccccn1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000493106051 1042819869 /nfs/dbraw/zinc/81/98/69/1042819869.db2.gz OCODLTKKIXXSNL-KNQAVFIVSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(Cl)s1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309912991 1042824563 /nfs/dbraw/zinc/82/45/63/1042824563.db2.gz MWGOGHDMVJUKMZ-ZBFHGGJFSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(Cl)s1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309912988 1042824619 /nfs/dbraw/zinc/82/46/19/1042824619.db2.gz MWGOGHDMVJUKMZ-GDBMZVCRSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@@H]([NH2+]CCSc1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310170867 1042829867 /nfs/dbraw/zinc/82/98/67/1042829867.db2.gz UAUPBAFOHWMDDW-QUCCMNQESA-N 2 1 340.536 4.279 20 0 EIADMP C[C@H]([NH2+][C@@H]1CSc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310241568 1042832011 /nfs/dbraw/zinc/83/20/11/1042832011.db2.gz LUQHJMUOCXVFCP-ILZDJORESA-N 2 1 338.520 4.334 20 0 EIADMP C[C@H]([NH2+][C@@H]1CSc2ccccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310241568 1042832012 /nfs/dbraw/zinc/83/20/12/1042832012.db2.gz LUQHJMUOCXVFCP-ILZDJORESA-N 2 1 338.520 4.334 20 0 EIADMP Cc1ccc(F)c(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310235032 1042832114 /nfs/dbraw/zinc/83/21/14/1042832114.db2.gz KOKHXRXOVUOFPH-IEBWSBKVSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1ccc(F)c(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310235032 1042832115 /nfs/dbraw/zinc/83/21/15/1042832115.db2.gz KOKHXRXOVUOFPH-IEBWSBKVSA-N 2 1 326.459 4.134 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000310473094 1042838266 /nfs/dbraw/zinc/83/82/66/1042838266.db2.gz BXUBODHVCUMBPF-ABSDTBQOSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310537053 1042839565 /nfs/dbraw/zinc/83/95/65/1042839565.db2.gz RNGFZEDVUMOLHA-ABSDTBQOSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000310591408 1042840604 /nfs/dbraw/zinc/84/06/04/1042840604.db2.gz OPYBISDIEXOZAY-BBTUJRGHSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000310591408 1042840608 /nfs/dbraw/zinc/84/06/08/1042840608.db2.gz OPYBISDIEXOZAY-BBTUJRGHSA-N 2 1 338.495 4.399 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310998859 1042850174 /nfs/dbraw/zinc/85/01/74/1042850174.db2.gz UVEIKUHUHJNACO-WFXMLNOXSA-N 2 1 338.495 4.256 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2cc[nH]c21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311064208 1042852235 /nfs/dbraw/zinc/85/22/35/1042852235.db2.gz JCQRFOBBWYZVPE-UWJYYQICSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000311236759 1042855019 /nfs/dbraw/zinc/85/50/19/1042855019.db2.gz UILJTIOHHLKWFH-HKUYNNGSSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000311236759 1042855020 /nfs/dbraw/zinc/85/50/20/1042855020.db2.gz UILJTIOHHLKWFH-HKUYNNGSSA-N 2 1 341.474 4.174 20 0 EIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000178256484 1042861972 /nfs/dbraw/zinc/86/19/72/1042861972.db2.gz YJGCMDUTTMHUTR-CYBMUJFWSA-N 2 1 335.561 4.274 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CC(OC(C)(C)C)C2)[C@@H]1c1cccs1 ZINC000493305924 1042890890 /nfs/dbraw/zinc/89/08/90/1042890890.db2.gz QTJXGFGEHCOQLP-YHOLWWCESA-N 2 1 336.545 4.067 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]C2CC(OC(C)(C)C)C2)[C@@H]1c1cccs1 ZINC000493305924 1042890891 /nfs/dbraw/zinc/89/08/91/1042890891.db2.gz QTJXGFGEHCOQLP-YHOLWWCESA-N 2 1 336.545 4.067 20 0 EIADMP COC[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(Cl)cc1 ZINC000493884681 1042970472 /nfs/dbraw/zinc/97/04/72/1042970472.db2.gz ZNNQGCITJNPICD-QFBILLFUSA-N 2 1 338.923 4.272 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccccc1N(C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183195435 1043040250 /nfs/dbraw/zinc/04/02/50/1043040250.db2.gz VVPWURMSYYSBGE-FGTMMUONSA-N 2 1 329.532 4.056 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@H](C)C[NH+]3CCCCC3)oc21 ZINC000391917584 1043077280 /nfs/dbraw/zinc/07/72/80/1043077280.db2.gz DHJNADBIUBIOKJ-HOTGVXAUSA-N 2 1 330.472 4.214 20 0 EIADMP Cc1cc(F)ccc1C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310070959 1043099529 /nfs/dbraw/zinc/09/95/29/1043099529.db2.gz ACFSARWIWJXXAN-LJQANCHMSA-N 2 1 326.459 4.136 20 0 EIADMP FC(F)(F)c1ccc2c(NC[C@H]3CC[N@H+](C4CC4)C3)cc[nH+]c2c1 ZINC000516143218 1043122163 /nfs/dbraw/zinc/12/21/63/1043122163.db2.gz KOVYWBYFLJSGOA-GFCCVEGCSA-N 2 1 335.373 4.150 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3ccc(F)cc3Cl)CCCC2)CC[N@H+]1C ZINC000427882718 1043247284 /nfs/dbraw/zinc/24/72/84/1043247284.db2.gz ANQQNIRAJHNZNV-HOCLYGCPSA-N 2 1 338.898 4.363 20 0 EIADMP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CC3([NH3+])CCCC3)s2)cc1 ZINC000665249406 1043272124 /nfs/dbraw/zinc/27/21/24/1043272124.db2.gz PTUZQCCDDUSLEJ-CYBMUJFWSA-N 2 1 345.512 4.049 20 0 EIADMP CSCCCCC[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000186772630 1043308401 /nfs/dbraw/zinc/30/84/01/1043308401.db2.gz SZBDANACFHFKGN-SLFFLAALSA-N 2 1 332.557 4.020 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]C[C@H](c2ccccc2)C(F)(F)F)CC1 ZINC000186851345 1043313773 /nfs/dbraw/zinc/31/37/73/1043313773.db2.gz ZTSCAHRDSHNFQT-MRXNPFEDSA-N 2 1 328.422 4.185 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CCSCC1 ZINC000187215540 1043335462 /nfs/dbraw/zinc/33/54/62/1043335462.db2.gz FYRRGBXZXGBERM-SJORKVTESA-N 2 1 332.557 4.333 20 0 EIADMP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000665272161 1043477443 /nfs/dbraw/zinc/47/74/43/1043477443.db2.gz ZPMPOKKSJQOYJG-KGSLCBSSSA-N 2 1 347.506 4.041 20 0 EIADMP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000665272162 1043477833 /nfs/dbraw/zinc/47/78/33/1043477833.db2.gz ZPMPOKKSJQOYJG-QXUYBEEESA-N 2 1 347.506 4.041 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000065932243 1043508253 /nfs/dbraw/zinc/50/82/53/1043508253.db2.gz SOFXTINHXNEHQK-MRXNPFEDSA-N 2 1 346.421 4.189 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccnn1-c1ccccc1 ZINC000467364159 1043580724 /nfs/dbraw/zinc/58/07/24/1043580724.db2.gz JIHAYROLHMUBSG-RBUKOAKNSA-N 2 1 340.515 4.178 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)C1 ZINC000731678394 1043815125 /nfs/dbraw/zinc/81/51/25/1043815125.db2.gz LQXILVUBFUAGCK-SFHVURJKSA-N 2 1 330.516 4.000 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)C1 ZINC000731678393 1043815158 /nfs/dbraw/zinc/81/51/58/1043815158.db2.gz LQXILVUBFUAGCK-GOSISDBHSA-N 2 1 330.516 4.000 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000191548943 1043825093 /nfs/dbraw/zinc/82/50/93/1043825093.db2.gz MDHZUEBSKVIIJX-CJNGLKHVSA-N 2 1 328.422 4.055 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1ccnn1-c1ccccc1)C(C)C ZINC000467383900 1043886079 /nfs/dbraw/zinc/88/60/79/1043886079.db2.gz GXLBUYBVWGRMIN-SFHVURJKSA-N 2 1 328.504 4.032 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCOC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000674910095 1043936282 /nfs/dbraw/zinc/93/62/82/1043936282.db2.gz ZVYMRMPLJIOGFN-QUCCMNQESA-N 2 1 332.532 4.177 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCOC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC000674910095 1043936304 /nfs/dbraw/zinc/93/63/04/1043936304.db2.gz ZVYMRMPLJIOGFN-QUCCMNQESA-N 2 1 332.532 4.177 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCOC(C)(C)C)CC[NH+]1Cc1ccccc1 ZINC000674910095 1043936324 /nfs/dbraw/zinc/93/63/24/1043936324.db2.gz ZVYMRMPLJIOGFN-QUCCMNQESA-N 2 1 332.532 4.177 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCOC(C)(C)C)CC[NH+]1Cc1ccccc1 ZINC000674910095 1043936344 /nfs/dbraw/zinc/93/63/44/1043936344.db2.gz ZVYMRMPLJIOGFN-QUCCMNQESA-N 2 1 332.532 4.177 20 0 EIADMP C[C@H](CC[NH2+][C@@H](C)c1cc(Br)cs1)[NH+]1CCCCC1 ZINC000494749610 1044016858 /nfs/dbraw/zinc/01/68/58/1044016858.db2.gz RSWJBTNKWBTYHE-OLZOCXBDSA-N 2 1 345.350 4.426 20 0 EIADMP CCc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000195137256 1044027211 /nfs/dbraw/zinc/02/72/11/1044027211.db2.gz IPPMCUBVLGIEKT-YJBOKZPZSA-N 2 1 343.540 4.187 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2ccc(F)cc2)s1 ZINC000521856325 1044031265 /nfs/dbraw/zinc/03/12/65/1044031265.db2.gz SMRFJGGXQWEIMN-CQSZACIVSA-N 2 1 343.471 4.485 20 0 EIADMP C[C@H]([NH2+]CCc1ccc(F)cc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000428271201 1044065055 /nfs/dbraw/zinc/06/50/55/1044065055.db2.gz YHMKTQBJKAQMKQ-HOCLYGCPSA-N 2 1 338.898 4.264 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2cc(Br)cs2)CC1 ZINC000226394332 1044175277 /nfs/dbraw/zinc/17/52/77/1044175277.db2.gz ZJDWMFJGCJRSQB-GFCCVEGCSA-N 2 1 345.350 4.426 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1[C@H]1CCOC1 ZINC000474043036 1044165845 /nfs/dbraw/zinc/16/58/45/1044165845.db2.gz YUZAUSYSQXRLHW-FDFHNCONSA-N 2 1 344.543 4.212 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1[C@H]1CCOC1 ZINC000474043030 1044167855 /nfs/dbraw/zinc/16/78/55/1044167855.db2.gz YUZAUSYSQXRLHW-BHDDXSALSA-N 2 1 344.543 4.212 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168714743 1044271876 /nfs/dbraw/zinc/27/18/76/1044271876.db2.gz KYLPZLLQLOQXJN-KBAYOESNSA-N 2 1 332.919 4.322 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000358343727 1044276739 /nfs/dbraw/zinc/27/67/39/1044276739.db2.gz UBLGSBIDTSWKHU-QAPCUYQASA-N 2 1 336.520 4.320 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000358343727 1044276756 /nfs/dbraw/zinc/27/67/56/1044276756.db2.gz UBLGSBIDTSWKHU-QAPCUYQASA-N 2 1 336.520 4.320 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000466343339 1044294795 /nfs/dbraw/zinc/29/47/95/1044294795.db2.gz JRCYCOVUKHXFGD-PSWRPDDJSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H](Cc1ccoc1)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658317270 1044301119 /nfs/dbraw/zinc/30/11/19/1044301119.db2.gz KBPMAQSBOBACFD-RXVVDRJESA-N 2 1 338.495 4.103 20 0 EIADMP C[C@@H]1C[C@@H](NCc2cccc(Cl)n2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168018150 1044321503 /nfs/dbraw/zinc/32/15/03/1044321503.db2.gz YUBJRCBIKSYUSO-HGKCTWBKSA-N 2 1 343.902 4.266 20 0 EIADMP Cc1cccc2c1OCC[C@H]2[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC000474090865 1044454168 /nfs/dbraw/zinc/45/41/68/1044454168.db2.gz UVLFWPAXNINBND-LKUPVBHCSA-N 2 1 342.527 4.451 20 0 EIADMP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000675752481 1044465709 /nfs/dbraw/zinc/46/57/09/1044465709.db2.gz XJMPTKVKZHEKCW-MKBNYLNASA-N 2 1 325.283 4.197 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCc2c(Cl)cccc2Cl)CC[N@@H+]1C ZINC000428283424 1044474259 /nfs/dbraw/zinc/47/42/59/1044474259.db2.gz HXJKOPJKQAHWEV-KBPBESRZSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCc2c(Cl)cccc2Cl)CC[N@H+]1C ZINC000428283424 1044474269 /nfs/dbraw/zinc/47/42/69/1044474269.db2.gz HXJKOPJKQAHWEV-KBPBESRZSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)CCCc2c(Cl)cccc2Cl)CC[NH+]1C ZINC000428283424 1044474278 /nfs/dbraw/zinc/47/42/78/1044474278.db2.gz HXJKOPJKQAHWEV-KBPBESRZSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCc2c(Cl)cccc2Cl)CC[NH+]1C ZINC000428283424 1044474288 /nfs/dbraw/zinc/47/42/88/1044474288.db2.gz HXJKOPJKQAHWEV-KBPBESRZSA-N 2 1 329.315 4.341 20 0 EIADMP C[NH+](C)CC(C)(C)CNc1ccc2c(c1)C[N@H+](Cc1ccccc1)C2 ZINC001168769153 1044534136 /nfs/dbraw/zinc/53/41/36/1044534136.db2.gz NLGHRMVMYSIIPD-UHFFFAOYSA-N 2 1 337.511 4.202 20 0 EIADMP CC(C)c1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000675881462 1044551263 /nfs/dbraw/zinc/55/12/63/1044551263.db2.gz LRNOFJIJGBTORW-LAUBAEHRSA-N 2 1 330.516 4.104 20 0 EIADMP C[N@H+]1CC=C(C[NH2+][C@@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000494973131 1044555173 /nfs/dbraw/zinc/55/51/73/1044555173.db2.gz SNFJKSYFQCGPTQ-FQEVSTJZSA-N 2 1 344.861 4.420 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000494973131 1044555189 /nfs/dbraw/zinc/55/51/89/1044555189.db2.gz SNFJKSYFQCGPTQ-FQEVSTJZSA-N 2 1 344.861 4.420 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000443662018 1044641539 /nfs/dbraw/zinc/64/15/39/1044641539.db2.gz UKCUEEALMCCLJF-GOSISDBHSA-N 2 1 340.433 4.464 20 0 EIADMP Cc1cc(F)cc(C[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC001143619164 1044642794 /nfs/dbraw/zinc/64/27/94/1044642794.db2.gz KPFCKGJDLBVRJM-NHCUHLMSSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC001143619164 1044642807 /nfs/dbraw/zinc/64/28/07/1044642807.db2.gz KPFCKGJDLBVRJM-NHCUHLMSSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)c1 ZINC001143619164 1044642833 /nfs/dbraw/zinc/64/28/33/1044642833.db2.gz KPFCKGJDLBVRJM-NHCUHLMSSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)c1 ZINC001143619164 1044642858 /nfs/dbraw/zinc/64/28/58/1044642858.db2.gz KPFCKGJDLBVRJM-NHCUHLMSSA-N 2 1 338.470 4.088 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000673600439 1044854473 /nfs/dbraw/zinc/85/44/73/1044854473.db2.gz XCQRJQGARZZKLI-IDJPSDCMSA-N 2 1 326.406 4.040 20 0 EIADMP COc1ccc2nc(C[NH2+]CCCC[N@H+]3CCCC[C@@H]3C)sc2c1 ZINC000474346089 1044871311 /nfs/dbraw/zinc/87/13/11/1044871311.db2.gz CLGDAFMYVCVCMB-HNNXBMFYSA-N 2 1 347.528 4.049 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cncc(F)c1 ZINC001168034972 1044987762 /nfs/dbraw/zinc/98/77/62/1044987762.db2.gz RXHJKWWFBDUXDQ-KYFSNAEOSA-N 2 1 341.474 4.313 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cncc(F)c1 ZINC001168034972 1044987774 /nfs/dbraw/zinc/98/77/74/1044987774.db2.gz RXHJKWWFBDUXDQ-KYFSNAEOSA-N 2 1 341.474 4.313 20 0 EIADMP Clc1ccc(CCCC[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1Cl ZINC000474458783 1045007580 /nfs/dbraw/zinc/00/75/80/1045007580.db2.gz JBKKYJGSBCWODQ-OAHLLOKOSA-N 2 1 341.326 4.390 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cn2cnc3cc(C)c(C)cc32)CC1 ZINC000738068272 1045033983 /nfs/dbraw/zinc/03/39/83/1045033983.db2.gz ZQFQYJPFGIGGKT-UHFFFAOYSA-N 2 1 342.531 4.055 20 0 EIADMP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c2ccccc21 ZINC000635005855 1045060427 /nfs/dbraw/zinc/06/04/27/1045060427.db2.gz WZVNPLBIODRIHF-RDGPPVDQSA-N 2 1 346.833 4.044 20 0 EIADMP Cc1ccccc1C[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000237355665 1045382999 /nfs/dbraw/zinc/38/29/99/1045382999.db2.gz LJCPYTLTZBSWGA-FQEVSTJZSA-N 2 1 336.523 4.223 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000237552432 1045387901 /nfs/dbraw/zinc/38/79/01/1045387901.db2.gz ABWYIOOICXBBPA-FDQGKXFDSA-N 2 1 340.433 4.476 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000237552432 1045387903 /nfs/dbraw/zinc/38/79/03/1045387903.db2.gz ABWYIOOICXBBPA-FDQGKXFDSA-N 2 1 340.433 4.476 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC(c2nc(C(C)(C)C)cs2)CC1 ZINC000767384197 1045525011 /nfs/dbraw/zinc/52/50/11/1045525011.db2.gz TYTIKTLSAGVVKA-MRXNPFEDSA-N 2 1 335.561 4.104 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C[C@@H](C)C(C)(C)C)CC2)cs1 ZINC000670267610 1045760341 /nfs/dbraw/zinc/76/03/41/1045760341.db2.gz LYRISBUEXCMNMW-OAHLLOKOSA-N 2 1 337.577 4.189 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)[C@H](C)c1nc2ccccc2s1 ZINC000246868607 1045833901 /nfs/dbraw/zinc/83/39/01/1045833901.db2.gz CJEHZSJWGWLJNW-QLFBSQMISA-N 2 1 342.512 4.219 20 0 EIADMP Oc1cccc2c1CCC[C@@H]2[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000792186508 1045876417 /nfs/dbraw/zinc/87/64/17/1045876417.db2.gz OLCIPFPAJKWRQF-NRFANRHFSA-N 2 1 342.527 4.404 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3cncc4ccccc43)C2)CC1 ZINC000769149055 1045885945 /nfs/dbraw/zinc/88/59/45/1045885945.db2.gz XYCOKAGSKWFUAH-LJQANCHMSA-N 2 1 337.511 4.179 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3cncc4ccccc43)C2)CC1 ZINC000769149055 1045885950 /nfs/dbraw/zinc/88/59/50/1045885950.db2.gz XYCOKAGSKWFUAH-LJQANCHMSA-N 2 1 337.511 4.179 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000509454720 1045939989 /nfs/dbraw/zinc/93/99/89/1045939989.db2.gz OKVHKSGRKNUCFY-HBMCJLEFSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000509454720 1045940002 /nfs/dbraw/zinc/94/00/02/1045940002.db2.gz OKVHKSGRKNUCFY-HBMCJLEFSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1ccc[nH+]c1N([C@@H](C)Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001170293067 1045977435 /nfs/dbraw/zinc/97/74/35/1045977435.db2.gz KBOMIBSPZZOYQA-INIZCTEOSA-N 2 1 343.902 4.233 20 0 EIADMP Cc1cccc(N([C@@H](C)Cc2ccccc2Cl)C2CC[NH2+]CC2)[nH+]1 ZINC001170293448 1045978324 /nfs/dbraw/zinc/97/83/24/1045978324.db2.gz LBVHASKPSQPVOW-INIZCTEOSA-N 2 1 343.902 4.233 20 0 EIADMP Cc1cc2cc[nH+]c(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2[nH]1 ZINC001170330420 1046001094 /nfs/dbraw/zinc/00/10/94/1046001094.db2.gz MSFIULUBXBBOQD-OWZKRDHZSA-N 2 1 346.478 4.479 20 0 EIADMP Cc1cc2cc[nH+]c(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)c2[nH]1 ZINC001170330420 1046001104 /nfs/dbraw/zinc/00/11/04/1046001104.db2.gz MSFIULUBXBBOQD-OWZKRDHZSA-N 2 1 346.478 4.479 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2sc(-c3cccnc3)nc2C)CC1 ZINC000161628191 1046011321 /nfs/dbraw/zinc/01/13/21/1046011321.db2.gz LPUZIWXRONBOLK-CQSZACIVSA-N 2 1 344.528 4.039 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(F)c(Br)c2)CC1 ZINC000037236787 1046088747 /nfs/dbraw/zinc/08/87/47/1046088747.db2.gz XGOPJVRIVFXFJQ-GFCCVEGCSA-N 2 1 343.284 4.112 20 0 EIADMP CCc1noc(C)c1[C@H](C)[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000769875462 1046103002 /nfs/dbraw/zinc/10/30/02/1046103002.db2.gz USFYGXJBNJVEAU-HNNXBMFYSA-N 2 1 329.488 4.236 20 0 EIADMP C[C@@H]([N@@H+](C)Cc1ccccc1N(C)C1CC[NH+](C)CC1)C(C)(C)C ZINC000536655870 1046602704 /nfs/dbraw/zinc/60/27/04/1046602704.db2.gz BTHLHEPXCHMRDA-QGZVFWFLSA-N 2 1 331.548 4.083 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@@H](C)C1 ZINC000536660002 1046626717 /nfs/dbraw/zinc/62/67/17/1046626717.db2.gz SASDIZZBPCSPCK-RDJZCZTQSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@@H](C)C1 ZINC000536660002 1046626729 /nfs/dbraw/zinc/62/67/29/1046626729.db2.gz SASDIZZBPCSPCK-RDJZCZTQSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@@H](C)C1 ZINC000536660002 1046626747 /nfs/dbraw/zinc/62/67/47/1046626747.db2.gz SASDIZZBPCSPCK-RDJZCZTQSA-N 2 1 340.458 4.067 20 0 EIADMP COc1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c2ccccc12 ZINC000536662397 1046633071 /nfs/dbraw/zinc/63/30/71/1046633071.db2.gz TUYOTWUFMNFILT-LJQANCHMSA-N 2 1 338.495 4.299 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2c(OC)ccc3ccccc32)C1 ZINC000536664034 1046637204 /nfs/dbraw/zinc/63/72/04/1046637204.db2.gz DAHBRQQMFLFXIA-KRWDZBQOSA-N 2 1 326.484 4.012 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2c(OC)ccc3ccccc32)C1 ZINC000536664034 1046637205 /nfs/dbraw/zinc/63/72/05/1046637205.db2.gz DAHBRQQMFLFXIA-KRWDZBQOSA-N 2 1 326.484 4.012 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CC[C@H](c4ccccc4)C3)CC2)[nH+]c1 ZINC000127365355 1046658487 /nfs/dbraw/zinc/65/84/87/1046658487.db2.gz GBJCZTRKKSVJRG-FPOVZHCZSA-N 2 1 335.495 4.285 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCC1 ZINC000459464654 1046700373 /nfs/dbraw/zinc/70/03/73/1046700373.db2.gz WUJWXZUZZMTPBL-QGZVFWFLSA-N 2 1 337.389 4.112 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379625307 1046715171 /nfs/dbraw/zinc/71/51/71/1046715171.db2.gz KPWJNFOUVJPFLV-LQWHRVPQSA-N 2 1 340.486 4.399 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379625307 1046715191 /nfs/dbraw/zinc/71/51/91/1046715191.db2.gz KPWJNFOUVJPFLV-LQWHRVPQSA-N 2 1 340.486 4.399 20 0 EIADMP COc1cccc2c1C[C@@H]([NH2+][C@H](C)c1ccc(-n3cc[nH+]c3C)cc1)C2 ZINC000459722636 1046864264 /nfs/dbraw/zinc/86/42/64/1046864264.db2.gz IDSVSYGRCBUHQY-BEFAXECRSA-N 2 1 347.462 4.007 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536998060 1046890137 /nfs/dbraw/zinc/89/01/37/1046890137.db2.gz CYABIDFZTKQNEC-WMLDXEAASA-N 2 1 328.422 4.334 20 0 EIADMP CC(C)CCC[C@@H](C)[NH2+][C@@H](CCCC[NH3+])C(=O)OCc1ccccc1 ZINC001170070214 1046921869 /nfs/dbraw/zinc/92/18/69/1046921869.db2.gz ULKAGSAXOGISQV-QUCCMNQESA-N 2 1 348.531 4.032 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)C12CCC2 ZINC000537293481 1047076499 /nfs/dbraw/zinc/07/64/99/1047076499.db2.gz UPJLKQBWSUXMIV-JRGCBEDISA-N 2 1 342.527 4.149 20 0 EIADMP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000537302985 1047085694 /nfs/dbraw/zinc/08/56/94/1047085694.db2.gz AMRQRMIVZFBCGM-LJQANCHMSA-N 2 1 326.509 4.192 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3ccc(Cl)nc32)c1 ZINC000788643684 1047246637 /nfs/dbraw/zinc/24/66/37/1047246637.db2.gz KVJUNDPGPRUFDZ-SFHVURJKSA-N 2 1 343.902 4.352 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccccc2Cl)C[C@H]1c1ccccc1 ZINC000556062147 1047428136 /nfs/dbraw/zinc/42/81/36/1047428136.db2.gz NKDAHKBEOCVUJQ-ICSRJNTNSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccccc2Cl)C[C@H]1c1ccccc1 ZINC000556062147 1047428142 /nfs/dbraw/zinc/42/81/42/1047428142.db2.gz NKDAHKBEOCVUJQ-ICSRJNTNSA-N 2 1 328.887 4.308 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)o1 ZINC000556092717 1047444967 /nfs/dbraw/zinc/44/49/67/1047444967.db2.gz BZTLYFMANGBODN-NBHGPNQESA-N 2 1 326.484 4.334 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)o1 ZINC000556092717 1047444976 /nfs/dbraw/zinc/44/49/76/1047444976.db2.gz BZTLYFMANGBODN-NBHGPNQESA-N 2 1 326.484 4.334 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1F ZINC000556119574 1047473223 /nfs/dbraw/zinc/47/32/23/1047473223.db2.gz AMKZVECWNUIPEJ-AOIWGVFYSA-N 2 1 341.474 4.172 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC[N@H+]2C2CC2)cc1 ZINC000897746549 1047481742 /nfs/dbraw/zinc/48/17/42/1047481742.db2.gz NLWSJCUAKIKCQL-ICTWHWLLSA-N 2 1 342.552 4.371 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC[N@@H+]2C2CC2)cc1 ZINC000897746549 1047481746 /nfs/dbraw/zinc/48/17/46/1047481746.db2.gz NLWSJCUAKIKCQL-ICTWHWLLSA-N 2 1 342.552 4.371 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)C[C@@H]1c1ccccc1 ZINC000556178411 1047538808 /nfs/dbraw/zinc/53/88/08/1047538808.db2.gz GWLLOFHRLCQYFN-RBBKRZOGSA-N 2 1 333.479 4.136 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)C[C@@H]1c1ccccc1 ZINC000556178411 1047538824 /nfs/dbraw/zinc/53/88/24/1047538824.db2.gz GWLLOFHRLCQYFN-RBBKRZOGSA-N 2 1 333.479 4.136 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C1(C)C ZINC000556179631 1047540978 /nfs/dbraw/zinc/54/09/78/1047540978.db2.gz URIJMELPMOVCGE-FUMNGEBKSA-N 2 1 330.516 4.004 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C1(C)C ZINC000556179631 1047540996 /nfs/dbraw/zinc/54/09/96/1047540996.db2.gz URIJMELPMOVCGE-FUMNGEBKSA-N 2 1 330.516 4.004 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000556236384 1047603123 /nfs/dbraw/zinc/60/31/23/1047603123.db2.gz KNHMRNYAOJZMIQ-HBGVWJBISA-N 2 1 339.527 4.441 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000556236384 1047603130 /nfs/dbraw/zinc/60/31/30/1047603130.db2.gz KNHMRNYAOJZMIQ-HBGVWJBISA-N 2 1 339.527 4.441 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccnc(Cl)c1 ZINC000154866033 1047720714 /nfs/dbraw/zinc/72/07/14/1047720714.db2.gz KQSBAGITBSRBSH-OAHLLOKOSA-N 2 1 331.891 4.426 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCOc2ccc(F)cc2)C[C@@H]1c1ccccc1 ZINC000550644328 1047799569 /nfs/dbraw/zinc/79/95/69/1047799569.db2.gz QXWFJWPGUVQKII-TZIWHRDSSA-N 2 1 342.458 4.020 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCOc2ccc(F)cc2)C[C@@H]1c1ccccc1 ZINC000550644328 1047799587 /nfs/dbraw/zinc/79/95/87/1047799587.db2.gz QXWFJWPGUVQKII-TZIWHRDSSA-N 2 1 342.458 4.020 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@@H]2CC2(Cl)Cl)CC1 ZINC000763435102 1047805001 /nfs/dbraw/zinc/80/50/01/1047805001.db2.gz YZZGPKOSEOTUKB-HOCLYGCPSA-N 2 1 333.347 4.157 20 0 EIADMP CSC1(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000814173664 1047867015 /nfs/dbraw/zinc/86/70/15/1047867015.db2.gz VITUGCHNGVFVBZ-IHWFROFDSA-N 2 1 344.568 4.447 20 0 EIADMP CC1([NH+]2CCCC2)CC[NH+]([C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171057377 1047872400 /nfs/dbraw/zinc/87/24/00/1047872400.db2.gz YLIIJZCSKYLSPB-QGZVFWFLSA-N 2 1 332.919 4.148 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1c[nH]c2cccc(F)c12 ZINC001136985419 1048028581 /nfs/dbraw/zinc/02/85/81/1048028581.db2.gz GMUUNSGNENQQRO-DLBZAZTESA-N 2 1 329.463 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1c[nH]c2cccc(F)c12 ZINC001136985419 1048028597 /nfs/dbraw/zinc/02/85/97/1048028597.db2.gz GMUUNSGNENQQRO-DLBZAZTESA-N 2 1 329.463 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1c[nH]c2cccc(F)c12 ZINC001136985419 1048028610 /nfs/dbraw/zinc/02/86/10/1048028610.db2.gz GMUUNSGNENQQRO-DLBZAZTESA-N 2 1 329.463 4.146 20 0 EIADMP CC(C)[N@@H+](Cc1ccc(OC(F)(F)F)cc1F)C1CCN(C)CC1 ZINC001143792712 1048206137 /nfs/dbraw/zinc/20/61/37/1048206137.db2.gz ARKIRNJICLCZGC-UHFFFAOYSA-N 2 1 348.384 4.029 20 0 EIADMP CC(C)N(Cc1ccc(OC(F)(F)F)cc1F)C1CC[NH+](C)CC1 ZINC001143792712 1048206156 /nfs/dbraw/zinc/20/61/56/1048206156.db2.gz ARKIRNJICLCZGC-UHFFFAOYSA-N 2 1 348.384 4.029 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)s1 ZINC000499140407 1048336409 /nfs/dbraw/zinc/33/64/09/1048336409.db2.gz VVMJPZVXHNBMIK-LDLYASANSA-N 2 1 326.509 4.342 20 0 EIADMP FC1(F)C[C@@]12CCC[NH+](CCCC[N@@H+]1CCC[C@]3(CC3(F)F)C1)C2 ZINC000844437051 1048337401 /nfs/dbraw/zinc/33/74/01/1048337401.db2.gz KUQCXMLMZFCPOB-IYBDPMFKSA-N 2 1 348.428 4.009 20 0 EIADMP FC1(F)C[C@@]12CCC[N@@H+](CCCC[NH+]1CCC[C@]3(CC3(F)F)C1)C2 ZINC000844437051 1048337418 /nfs/dbraw/zinc/33/74/18/1048337418.db2.gz KUQCXMLMZFCPOB-IYBDPMFKSA-N 2 1 348.428 4.009 20 0 EIADMP FC1(F)C[C@@]12CCC[N@H+](CCCC[NH+]1CCC[C@]3(CC3(F)F)C1)C2 ZINC000844437051 1048337435 /nfs/dbraw/zinc/33/74/35/1048337435.db2.gz KUQCXMLMZFCPOB-IYBDPMFKSA-N 2 1 348.428 4.009 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2CCc4ccccc4C2)C3)cc1 ZINC000499164507 1048371615 /nfs/dbraw/zinc/37/16/15/1048371615.db2.gz OFZVSRHICCXJAA-JLLPCOHGSA-N 2 1 346.518 4.329 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171133532 1048394891 /nfs/dbraw/zinc/39/48/91/1048394891.db2.gz MMMLHPBAUVPUOV-HXUWFJFHSA-N 2 1 334.935 4.394 20 0 EIADMP CC(C)C[N@H+](CCc1ccc(F)cc1)Cc1ncc(C[NH+](C)C)s1 ZINC000809549398 1048411735 /nfs/dbraw/zinc/41/17/35/1048411735.db2.gz WMKZBVMQCACTKR-UHFFFAOYSA-N 2 1 349.519 4.045 20 0 EIADMP CC(C)C[N@@H+](CCc1ccc(F)cc1)Cc1ncc(C[NH+](C)C)s1 ZINC000809549398 1048411738 /nfs/dbraw/zinc/41/17/38/1048411738.db2.gz WMKZBVMQCACTKR-UHFFFAOYSA-N 2 1 349.519 4.045 20 0 EIADMP c1ccc(C[C@@H]2C[C@H]2[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000499215472 1048424506 /nfs/dbraw/zinc/42/45/06/1048424506.db2.gz QDIBNRAWADIYQP-ZSXJVMONSA-N 2 1 346.518 4.403 20 0 EIADMP Clc1cc2c(cc1Cl)C[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CC2 ZINC001171142708 1048452142 /nfs/dbraw/zinc/45/21/42/1048452142.db2.gz CIFGSSSQKVNXBR-HNNXBMFYSA-N 2 1 339.310 4.067 20 0 EIADMP COc1cccc2cc(C[N@@H+](C)Cc3ccc(C[NH+](C)C)cc3)oc21 ZINC000809738384 1048510314 /nfs/dbraw/zinc/51/03/14/1048510314.db2.gz WWJJYKKCLMROLX-UHFFFAOYSA-N 2 1 338.451 4.135 20 0 EIADMP C[C@H](NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccccc1SC(C)(C)C ZINC000815576096 1048516478 /nfs/dbraw/zinc/51/64/78/1048516478.db2.gz JIEIFKOYYBCREI-BBWFWOEESA-N 2 1 348.556 4.091 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CN2CCC[C@@H]2CO1)c1ccccc1SC(C)(C)C ZINC000815576096 1048516490 /nfs/dbraw/zinc/51/64/90/1048516490.db2.gz JIEIFKOYYBCREI-BBWFWOEESA-N 2 1 348.556 4.091 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(F)nc2C)CC1)CC(C)C ZINC000809756009 1048522553 /nfs/dbraw/zinc/52/25/53/1048522553.db2.gz NTXGDEQZDSJDSW-UHFFFAOYSA-N 2 1 335.511 4.109 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1c[nH]c2nc(Cl)ccc12 ZINC001144415865 1048650804 /nfs/dbraw/zinc/65/08/04/1048650804.db2.gz OQBDGSFXXMHGPJ-HOTGVXAUSA-N 2 1 346.906 4.055 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1c[nH]c2nc(Cl)ccc12 ZINC001144415865 1048650811 /nfs/dbraw/zinc/65/08/11/1048650811.db2.gz OQBDGSFXXMHGPJ-HOTGVXAUSA-N 2 1 346.906 4.055 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1c[nH]c2nc(Cl)ccc12 ZINC001144415865 1048650815 /nfs/dbraw/zinc/65/08/15/1048650815.db2.gz OQBDGSFXXMHGPJ-HOTGVXAUSA-N 2 1 346.906 4.055 20 0 EIADMP CCCCCC[C@H](CC)[N@@H+]1CCc2ncc(C[NH+]3CCCC3)n2CC1 ZINC001170598323 1048660030 /nfs/dbraw/zinc/66/00/30/1048660030.db2.gz GYHLANQZVWOCSW-IBGZPJMESA-N 2 1 346.563 4.086 20 0 EIADMP Clc1ccc(CNC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000810178461 1048668615 /nfs/dbraw/zinc/66/86/15/1048668615.db2.gz UDBWPLGFQUOWDK-IBGZPJMESA-N 2 1 343.902 4.127 20 0 EIADMP Clc1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000810178461 1048668623 /nfs/dbraw/zinc/66/86/23/1048668623.db2.gz UDBWPLGFQUOWDK-IBGZPJMESA-N 2 1 343.902 4.127 20 0 EIADMP Clc1ccc(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000810178461 1048668631 /nfs/dbraw/zinc/66/86/31/1048668631.db2.gz UDBWPLGFQUOWDK-IBGZPJMESA-N 2 1 343.902 4.127 20 0 EIADMP C[C@H]([NH2+]CC[C@]1(C)C[C@@]1(F)Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000846036809 1048801354 /nfs/dbraw/zinc/80/13/54/1048801354.db2.gz MKEGJTXCXXRTEE-AITUJVMLSA-N 2 1 338.898 4.191 20 0 EIADMP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@H+]1CCCCCC[NH3+] ZINC000846220263 1048843915 /nfs/dbraw/zinc/84/39/15/1048843915.db2.gz MSXKFOANRCXOLI-IBGZPJMESA-N 2 1 328.504 4.273 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000236808534 1048856193 /nfs/dbraw/zinc/85/61/93/1048856193.db2.gz GBKMJZGUVAWWKY-INIZCTEOSA-N 2 1 330.447 4.216 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000236808534 1048856195 /nfs/dbraw/zinc/85/61/95/1048856195.db2.gz GBKMJZGUVAWWKY-INIZCTEOSA-N 2 1 330.447 4.216 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)o1 ZINC000237098370 1048885143 /nfs/dbraw/zinc/88/51/43/1048885143.db2.gz AXMCGYCRJNLXRG-ALOPSCKCSA-N 2 1 342.458 4.499 20 0 EIADMP COc1ccc(C(C)C)cc1C[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000846892356 1048941397 /nfs/dbraw/zinc/94/13/97/1048941397.db2.gz USHSGGNBVXRTTC-UHFFFAOYSA-N 2 1 330.516 4.126 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000237576375 1048961413 /nfs/dbraw/zinc/96/14/13/1048961413.db2.gz DFFKUHICLRREBL-GOSISDBHSA-N 2 1 349.478 4.196 20 0 EIADMP COc1cc([C@H](C)[NH2+]CC2([NH3+])CCCCC2)ccc1SC(F)F ZINC000817938434 1049060650 /nfs/dbraw/zinc/06/06/50/1049060650.db2.gz KKWSNYODPHBTQQ-LBPRGKRZSA-N 2 1 344.471 4.322 20 0 EIADMP Clc1cc(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc(Cl)c1Cl ZINC001236320555 1049094252 /nfs/dbraw/zinc/09/42/52/1049094252.db2.gz IRWBYYNUJLFSEK-TXEJJXNPSA-N 2 1 333.690 4.078 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)C[C@H]1c1ccccc1 ZINC000517045142 1049373067 /nfs/dbraw/zinc/37/30/67/1049373067.db2.gz UQDGZIRZQCGVKR-QESAQDPVSA-N 2 1 338.470 4.497 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)C[C@H]1c1ccccc1 ZINC000517045142 1049373071 /nfs/dbraw/zinc/37/30/71/1049373071.db2.gz UQDGZIRZQCGVKR-QESAQDPVSA-N 2 1 338.470 4.497 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCC2CC(OC(C)(C)C)C2)C[C@@H]1c1ccccc1 ZINC000517226225 1049503950 /nfs/dbraw/zinc/50/39/50/1049503950.db2.gz GPEUNCDPDPLNDY-BCKAPOECSA-N 2 1 344.543 4.395 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCC2CC(OC(C)(C)C)C2)C[C@@H]1c1ccccc1 ZINC000517226225 1049503963 /nfs/dbraw/zinc/50/39/63/1049503963.db2.gz GPEUNCDPDPLNDY-BCKAPOECSA-N 2 1 344.543 4.395 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171357026 1049511232 /nfs/dbraw/zinc/51/12/32/1049511232.db2.gz GEMIGECWVKKYID-BZSNNMDCSA-N 2 1 336.470 4.050 20 0 EIADMP C[N@H+]1CCC[C@H](CN[C@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809856 1049553556 /nfs/dbraw/zinc/55/35/56/1049553556.db2.gz JKVFQGSTGJAMRY-DNVCBOLYSA-N 2 1 332.875 4.148 20 0 EIADMP CN1CCC[C@H](C[NH2+][C@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809856 1049553568 /nfs/dbraw/zinc/55/35/68/1049553568.db2.gz JKVFQGSTGJAMRY-DNVCBOLYSA-N 2 1 332.875 4.148 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809856 1049553580 /nfs/dbraw/zinc/55/35/80/1049553580.db2.gz JKVFQGSTGJAMRY-DNVCBOLYSA-N 2 1 332.875 4.148 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809856 1049553593 /nfs/dbraw/zinc/55/35/93/1049553593.db2.gz JKVFQGSTGJAMRY-DNVCBOLYSA-N 2 1 332.875 4.148 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccc2c(c1)CCO2 ZINC000773079746 1049570634 /nfs/dbraw/zinc/57/06/34/1049570634.db2.gz YVNXBFMWAAPUND-FXAWDEMLSA-N 2 1 330.516 4.030 20 0 EIADMP C[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1cccc(F)c1 ZINC000812827008 1049590702 /nfs/dbraw/zinc/59/07/02/1049590702.db2.gz ZJIJSEBFPWWQKL-SFHVURJKSA-N 2 1 340.486 4.226 20 0 EIADMP FC1(F)CCC[C@H]1C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716704539 1049702970 /nfs/dbraw/zinc/70/29/70/1049702970.db2.gz GIHUGJXMZINIDQ-OKYOBFRVSA-N 2 1 334.454 4.065 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557461 1049755669 /nfs/dbraw/zinc/75/56/69/1049755669.db2.gz CEYCYRIHGYAKQL-YPAWHYETSA-N 2 1 349.522 4.019 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001171658628 1049771884 /nfs/dbraw/zinc/77/18/84/1049771884.db2.gz TXNNNIOJXHZJKC-REWPJTCUSA-N 2 1 336.523 4.428 20 0 EIADMP COc1cccc([C@@H]2CCC[N@H+]2C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171639566 1049778234 /nfs/dbraw/zinc/77/82/34/1049778234.db2.gz PGPRDRHHXAUKLQ-IBGZPJMESA-N 2 1 330.516 4.484 20 0 EIADMP C[NH+]1C(C)(C)CC([N@H+]2CCC[C@H](OCc3ccccc3)C2)CC1(C)C ZINC001171639455 1049779151 /nfs/dbraw/zinc/77/91/51/1049779151.db2.gz KMIZEHLMSCAQPA-FQEVSTJZSA-N 2 1 344.543 4.319 20 0 EIADMP Cc1ccc(CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cn1 ZINC000813789000 1049816589 /nfs/dbraw/zinc/81/65/89/1049816589.db2.gz GAZHKSJMZBEVGU-FRIKZZABSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cn1 ZINC000813789000 1049816595 /nfs/dbraw/zinc/81/65/95/1049816595.db2.gz GAZHKSJMZBEVGU-FRIKZZABSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccncc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000813789842 1049817284 /nfs/dbraw/zinc/81/72/84/1049817284.db2.gz FNIOUNMDWPGFEB-FRIKZZABSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccncc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813789842 1049817290 /nfs/dbraw/zinc/81/72/90/1049817290.db2.gz FNIOUNMDWPGFEB-FRIKZZABSA-N 2 1 335.495 4.065 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@H+](CC[NH3+])Cc1ccccc1 ZINC001171958056 1049822304 /nfs/dbraw/zinc/82/23/04/1049822304.db2.gz LSFUXBXZLYDUAS-HNNXBMFYSA-N 2 1 336.401 4.097 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+](CC[NH3+])Cc1ccccc1 ZINC001171958056 1049822307 /nfs/dbraw/zinc/82/23/07/1049822307.db2.gz LSFUXBXZLYDUAS-HNNXBMFYSA-N 2 1 336.401 4.097 20 0 EIADMP CC1(C)C[C@@H](Nc2ccc(CC[NH3+])cc2)CC[N@H+]1Cc1ccccc1 ZINC001171961722 1049824299 /nfs/dbraw/zinc/82/42/99/1049824299.db2.gz AMTPLZIVIPHRGY-NRFANRHFSA-N 2 1 337.511 4.043 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCc2ccc(F)cc2)CC[N@H+]1Cc1ccccc1 ZINC001171963644 1049825359 /nfs/dbraw/zinc/82/53/59/1049825359.db2.gz IJYCXRWNFDAMGM-NRFANRHFSA-N 2 1 340.486 4.401 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2ccc(Cl)nc2)CC[N@@H+]1Cc1ccccc1 ZINC001171965208 1049826772 /nfs/dbraw/zinc/82/67/72/1049826772.db2.gz OXAQAMISKKQMHN-GOSISDBHSA-N 2 1 343.902 4.268 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2ccc(Cl)nc2)CC[N@H+]1Cc1ccccc1 ZINC001171965208 1049826774 /nfs/dbraw/zinc/82/67/74/1049826774.db2.gz OXAQAMISKKQMHN-GOSISDBHSA-N 2 1 343.902 4.268 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+](C2CCCC2)C1 ZINC001171967332 1049827473 /nfs/dbraw/zinc/82/74/73/1049827473.db2.gz ZVWQDBMYADEMCK-RHSMWYFYSA-N 2 1 340.433 4.243 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+](C2CCCC2)C1 ZINC001171967332 1049827477 /nfs/dbraw/zinc/82/74/77/1049827477.db2.gz ZVWQDBMYADEMCK-RHSMWYFYSA-N 2 1 340.433 4.243 20 0 EIADMP CC[NH+](CC)CCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171967448 1049828000 /nfs/dbraw/zinc/82/80/00/1049828000.db2.gz MCUFNQAKVLLGFX-NRFANRHFSA-N 3 1 345.575 4.141 20 0 EIADMP CC[NH+](CC)CCCC[NH2+][C@H]1CCN(Cc2ccccc2)C(C)(C)C1 ZINC001171967448 1049828002 /nfs/dbraw/zinc/82/80/02/1049828002.db2.gz MCUFNQAKVLLGFX-NRFANRHFSA-N 2 1 345.575 4.141 20 0 EIADMP C[C@@H](Cc1ccncc1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813881673 1049830777 /nfs/dbraw/zinc/83/07/77/1049830777.db2.gz SSQHLSAEVMTEME-FNXHNPQUSA-N 2 1 349.522 4.188 20 0 EIADMP CC1(C)C[C@@H](n2cc3cc(C[NH3+])ccc3n2)CC[N@H+]1Cc1ccccc1 ZINC001171971780 1049834282 /nfs/dbraw/zinc/83/42/82/1049834282.db2.gz JYVYLLZIVCVZDH-FQEVSTJZSA-N 2 1 348.494 4.111 20 0 EIADMP CC(C)(C)OCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171974802 1049835479 /nfs/dbraw/zinc/83/54/79/1049835479.db2.gz AMPDCYBKZQYDQB-IBGZPJMESA-N 2 1 332.532 4.224 20 0 EIADMP CC(C)([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccncc1 ZINC001171974433 1049836227 /nfs/dbraw/zinc/83/62/27/1049836227.db2.gz FVURXICCLFARJN-FQEVSTJZSA-N 2 1 337.511 4.350 20 0 EIADMP CC1(C)C[C@H]([NH2+]C2(c3ccc(N)cc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171978178 1049837777 /nfs/dbraw/zinc/83/77/77/1049837777.db2.gz WYUAZWLKEFPRPK-OAQYLSRUSA-N 2 1 349.522 4.291 20 0 EIADMP c1cc2c(o1)CCC[C@@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245725358 1049838939 /nfs/dbraw/zinc/83/89/39/1049838939.db2.gz PIOQHRLTOHCOBX-JTJHWIPRSA-N 2 1 336.479 4.442 20 0 EIADMP c1cc2c(o1)CCC[C@@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245725358 1049838946 /nfs/dbraw/zinc/83/89/46/1049838946.db2.gz PIOQHRLTOHCOBX-JTJHWIPRSA-N 2 1 336.479 4.442 20 0 EIADMP C[N@@H+](CC1CC(F)(F)C1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987771 1049840616 /nfs/dbraw/zinc/84/06/16/1049840616.db2.gz JFVCWVYGWHUOAL-GOSISDBHSA-N 2 1 336.470 4.407 20 0 EIADMP C[NH+](CC1CC(F)(F)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987771 1049840619 /nfs/dbraw/zinc/84/06/19/1049840619.db2.gz JFVCWVYGWHUOAL-GOSISDBHSA-N 2 1 336.470 4.407 20 0 EIADMP C[NH+](CC1CC(F)(F)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987771 1049840621 /nfs/dbraw/zinc/84/06/21/1049840621.db2.gz JFVCWVYGWHUOAL-GOSISDBHSA-N 2 1 336.470 4.407 20 0 EIADMP Oc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001172060687 1049841860 /nfs/dbraw/zinc/84/18/60/1049841860.db2.gz BJISDRZABXJWFJ-MZADTFQBSA-N 2 1 336.479 4.068 20 0 EIADMP CO[C@H]1CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172076426 1049844111 /nfs/dbraw/zinc/84/41/11/1049844111.db2.gz YMXXYPSAOGUMMB-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP CO[C@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172076426 1049844113 /nfs/dbraw/zinc/84/41/13/1049844113.db2.gz YMXXYPSAOGUMMB-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP CO[C@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172076426 1049844115 /nfs/dbraw/zinc/84/41/15/1049844115.db2.gz YMXXYPSAOGUMMB-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP [NH3+]CCCCCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172077010 1049845171 /nfs/dbraw/zinc/84/51/71/1049845171.db2.gz NVHIFOWZYMTRDJ-DKUWSORSSA-N 3 1 343.559 4.071 20 0 EIADMP [NH3+]CCCCCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2Cc1ccccc1 ZINC001172077010 1049845175 /nfs/dbraw/zinc/84/51/75/1049845175.db2.gz NVHIFOWZYMTRDJ-DKUWSORSSA-N 2 1 343.559 4.071 20 0 EIADMP Oc1cccc(CN[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172063325 1049849443 /nfs/dbraw/zinc/84/94/43/1049849443.db2.gz YAQXKGLSUKHFPH-MZADTFQBSA-N 2 1 336.479 4.068 20 0 EIADMP Oc1cccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172063325 1049849448 /nfs/dbraw/zinc/84/94/48/1049849448.db2.gz YAQXKGLSUKHFPH-MZADTFQBSA-N 2 1 336.479 4.068 20 0 EIADMP Cc1ccccc1[C@@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172099942 1049850276 /nfs/dbraw/zinc/85/02/76/1049850276.db2.gz NVKSIITYDMAWCP-KEZQHZCBSA-N 2 1 335.495 4.084 20 0 EIADMP Cc1ccccc1[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172099942 1049850279 /nfs/dbraw/zinc/85/02/79/1049850279.db2.gz NVKSIITYDMAWCP-KEZQHZCBSA-N 2 1 335.495 4.084 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2Cc4ccccc4C2)C3)cc1 ZINC001172066673 1049851175 /nfs/dbraw/zinc/85/11/75/1049851175.db2.gz JRHBTYWCRLVJAT-BKFWDETESA-N 2 1 346.518 4.329 20 0 EIADMP F[C@@H]1CC[C@@H](C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172067400 1049851195 /nfs/dbraw/zinc/85/11/95/1049851195.db2.gz NKDYNZFSJXWLSB-SSSFQFABSA-N 2 1 330.491 4.300 20 0 EIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172134764 1049854221 /nfs/dbraw/zinc/85/42/21/1049854221.db2.gz ZHYKRJWUDAJQBJ-FVQHAEBGSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172134764 1049854222 /nfs/dbraw/zinc/85/42/22/1049854222.db2.gz ZHYKRJWUDAJQBJ-FVQHAEBGSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172134764 1049854224 /nfs/dbraw/zinc/85/42/24/1049854224.db2.gz ZHYKRJWUDAJQBJ-FVQHAEBGSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCCCCCCCCCCCO)C2 ZINC001172108836 1049856726 /nfs/dbraw/zinc/85/67/26/1049856726.db2.gz GPIIBWVFOYLUMV-MZADTFQBSA-N 2 1 338.580 4.485 20 0 EIADMP Cc1ccc2c(c1)C1(CC2)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CC1 ZINC001172115494 1049858232 /nfs/dbraw/zinc/85/82/32/1049858232.db2.gz GZTOBWOSJCYMRN-WKCHPHFGSA-N 2 1 338.539 4.290 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C[C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172114354 1049858342 /nfs/dbraw/zinc/85/83/42/1049858342.db2.gz QVDJJZHRLFMOAD-YRPNKDGESA-N 2 1 332.919 4.439 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000245949285 1049882729 /nfs/dbraw/zinc/88/27/29/1049882729.db2.gz KXGOAXRTLBQMLJ-SIKLNZKXSA-N 2 1 337.511 4.415 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000245949282 1049882849 /nfs/dbraw/zinc/88/28/49/1049882849.db2.gz KXGOAXRTLBQMLJ-DENIHFKCSA-N 2 1 337.511 4.415 20 0 EIADMP COc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)cc1 ZINC001172367736 1049897035 /nfs/dbraw/zinc/89/70/35/1049897035.db2.gz MVUZJYWYJNDXKQ-DBXWQHBBSA-N 2 1 344.543 4.116 20 0 EIADMP CCOCC[C@H](C)[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172420250 1049900787 /nfs/dbraw/zinc/90/07/87/1049900787.db2.gz LIPGYAVJXIBKLB-SNRMKQJTSA-N 2 1 338.923 4.227 20 0 EIADMP CC[C@H](CC(C)C)[NH2+][C@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1[NH3+] ZINC001172394700 1049906042 /nfs/dbraw/zinc/90/60/42/1049906042.db2.gz YOXYNPCLXXNXMX-PQZCDXGSSA-N 2 1 334.507 4.388 20 0 EIADMP CC(C)COCC[C@H](C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001172471173 1049908712 /nfs/dbraw/zinc/90/87/12/1049908712.db2.gz QTCZLVHHCSFROQ-IBGZPJMESA-N 2 1 332.532 4.034 20 0 EIADMP CC(C)OCC[C@@H](C)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172437376 1049912790 /nfs/dbraw/zinc/91/27/90/1049912790.db2.gz OSIRDDOPENJREX-NSISKUIASA-N 2 1 336.495 4.101 20 0 EIADMP CC(C)OCC[C@H](C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172457143 1049915860 /nfs/dbraw/zinc/91/58/60/1049915860.db2.gz RUOOBXBXJNKAKP-IBGZPJMESA-N 2 1 332.532 4.034 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172456912 1049915970 /nfs/dbraw/zinc/91/59/70/1049915970.db2.gz JLWADPOVWBJSBC-ZVDOUQERSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172456912 1049915973 /nfs/dbraw/zinc/91/59/73/1049915973.db2.gz JLWADPOVWBJSBC-ZVDOUQERSA-N 2 1 332.532 4.080 20 0 EIADMP c1ccc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]3[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC001172552633 1049929988 /nfs/dbraw/zinc/92/99/88/1049929988.db2.gz GWRNZTSOGLLMOR-CCSDVLNMSA-N 2 1 332.491 4.043 20 0 EIADMP c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC001172552633 1049929994 /nfs/dbraw/zinc/92/99/94/1049929994.db2.gz GWRNZTSOGLLMOR-CCSDVLNMSA-N 2 1 332.491 4.043 20 0 EIADMP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001172566476 1049935971 /nfs/dbraw/zinc/93/59/71/1049935971.db2.gz FWEXDQYZQQJVLE-MHEUCROKSA-N 2 1 342.861 4.154 20 0 EIADMP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001172568806 1049938341 /nfs/dbraw/zinc/93/83/41/1049938341.db2.gz UEGIPQGODLQJBS-GFCCVEGCSA-N 2 1 342.861 4.156 20 0 EIADMP C[C@@H](CCc1c(F)cc(Cl)cc1F)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC001172573303 1049940960 /nfs/dbraw/zinc/94/09/60/1049940960.db2.gz GYBDOEWPTITXJT-ZDUSSCGKSA-N 2 1 344.877 4.213 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CC(C)(C)OC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001172646503 1049954915 /nfs/dbraw/zinc/95/49/15/1049954915.db2.gz BOCVJGHRPFMQAR-HKUYNNGSSA-N 2 1 344.543 4.365 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CC(C)(C)OC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC001172646503 1049954920 /nfs/dbraw/zinc/95/49/20/1049954920.db2.gz BOCVJGHRPFMQAR-HKUYNNGSSA-N 2 1 344.543 4.365 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172655265 1049957034 /nfs/dbraw/zinc/95/70/34/1049957034.db2.gz TZUCLZCDMLFRAX-PXNSSMCTSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172655265 1049957036 /nfs/dbraw/zinc/95/70/36/1049957036.db2.gz TZUCLZCDMLFRAX-PXNSSMCTSA-N 2 1 344.543 4.223 20 0 EIADMP Cc1c[nH+]c2n1CCC21CC[NH+](C2CCC3(CCCC3)CC2)CC1 ZINC001172727144 1049966757 /nfs/dbraw/zinc/96/67/57/1049966757.db2.gz UNECHGPJMUFZDN-UHFFFAOYSA-N 2 1 327.516 4.432 20 0 EIADMP Cc1cccc(N(C2CC[NH2+]CC2)C2CCC3(CCCC3)CC2)[nH+]1 ZINC001172730602 1049969450 /nfs/dbraw/zinc/96/94/50/1049969450.db2.gz KXTNEWKNSGTCTQ-UHFFFAOYSA-N 2 1 327.516 4.451 20 0 EIADMP Cc1ccc[nH+]c1N(C1CC[NH2+]CC1)C1CCC2(CCCC2)CC1 ZINC001172730727 1049969595 /nfs/dbraw/zinc/96/95/95/1049969595.db2.gz OUFTXYXFFZNLFI-UHFFFAOYSA-N 2 1 327.516 4.451 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Br)s1 ZINC000246945085 1050006694 /nfs/dbraw/zinc/00/66/94/1050006694.db2.gz HCUDNDCJLJLKLP-QJPTWQEYSA-N 2 1 331.323 4.034 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccccc2OC(F)F)C1 ZINC000246979121 1050008498 /nfs/dbraw/zinc/00/84/98/1050008498.db2.gz JYFCWYIYDOYHQT-HUUCEWRRSA-N 2 1 326.431 4.059 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccccc2OC(F)F)C1 ZINC000246979121 1050008503 /nfs/dbraw/zinc/00/85/03/1050008503.db2.gz JYFCWYIYDOYHQT-HUUCEWRRSA-N 2 1 326.431 4.059 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2n2cccn2)cc1 ZINC000247045284 1050011449 /nfs/dbraw/zinc/01/14/49/1050011449.db2.gz LYAZAMZVNCQRTN-ZLGUVYLKSA-N 2 1 349.482 4.212 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(OC(F)F)c2)C1 ZINC000247119600 1050014212 /nfs/dbraw/zinc/01/42/12/1050014212.db2.gz UOBHUIYPOZZHSX-HUUCEWRRSA-N 2 1 326.431 4.059 20 0 EIADMP Cc1ccc(-c2ncc(C[NH+]3CC[C@H]4[C@@H](CCC[N@H+]4C)C3)s2)cc1 ZINC000247239337 1050018398 /nfs/dbraw/zinc/01/83/98/1050018398.db2.gz WSEJEIZJQDCDNC-HKUYNNGSSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[NH+]3CC[C@H]4[C@@H](CCC[N@@H+]4C)C3)s2)cc1 ZINC000247239337 1050018403 /nfs/dbraw/zinc/01/84/03/1050018403.db2.gz WSEJEIZJQDCDNC-HKUYNNGSSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CC[C@H]4[C@@H](CCC[NH+]4C)C3)s2)cc1 ZINC000247239337 1050018409 /nfs/dbraw/zinc/01/84/09/1050018409.db2.gz WSEJEIZJQDCDNC-HKUYNNGSSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CC[C@H]4[C@@H](CCC[NH+]4C)C3)s2)cc1 ZINC000247239337 1050018420 /nfs/dbraw/zinc/01/84/20/1050018420.db2.gz WSEJEIZJQDCDNC-HKUYNNGSSA-N 2 1 341.524 4.035 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1 ZINC000247330463 1050022107 /nfs/dbraw/zinc/02/21/07/1050022107.db2.gz MLCNDENILSQPLH-XAUMDUMWSA-N 2 1 344.524 4.490 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1 ZINC000247330463 1050022113 /nfs/dbraw/zinc/02/21/13/1050022113.db2.gz MLCNDENILSQPLH-XAUMDUMWSA-N 2 1 344.524 4.490 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC(C)(C)OC2(C)C)[C@@H]1c1cccs1 ZINC000248132771 1050043932 /nfs/dbraw/zinc/04/39/32/1050043932.db2.gz ORQUBEGJEJNYEE-HYVNUMGLSA-N 2 1 336.545 4.067 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CC(C)(C)OC2(C)C)[C@@H]1c1cccs1 ZINC000248132771 1050043936 /nfs/dbraw/zinc/04/39/36/1050043936.db2.gz ORQUBEGJEJNYEE-HYVNUMGLSA-N 2 1 336.545 4.067 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1F ZINC000248410781 1050055515 /nfs/dbraw/zinc/05/55/15/1050055515.db2.gz YGYSTDJZWHMUBS-UXLLHSPISA-N 2 1 334.479 4.138 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCC2Cc3ccccc3C2)C[C@@H]1c1ccccc1 ZINC000520621178 1050057533 /nfs/dbraw/zinc/05/75/33/1050057533.db2.gz WZTJYPLDYPZZAF-DHIUTWEWSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCC2Cc3ccccc3C2)C[C@@H]1c1ccccc1 ZINC000520621178 1050057538 /nfs/dbraw/zinc/05/75/38/1050057538.db2.gz WZTJYPLDYPZZAF-DHIUTWEWSA-N 2 1 334.507 4.217 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1cccc(O)c1 ZINC000249588562 1050102234 /nfs/dbraw/zinc/10/22/34/1050102234.db2.gz OSRRLZCQGGDWCB-QZTJIDSGSA-N 2 1 338.495 4.475 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Br)cc1 ZINC000251109886 1050154103 /nfs/dbraw/zinc/15/41/03/1050154103.db2.gz TXOITUSPGAUTNC-ULQDDVLXSA-N 2 1 337.305 4.117 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@@H+](C)C[C@H]1CC[NH+](Cc3ccccc3)C1)CC2 ZINC001172844393 1050181209 /nfs/dbraw/zinc/18/12/09/1050181209.db2.gz SQCFVCBOKKWGHM-QPPBQGQZSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH+](C)C[C@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172844393 1050181213 /nfs/dbraw/zinc/18/12/13/1050181213.db2.gz SQCFVCBOKKWGHM-QPPBQGQZSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH+](C)C[C@H]1CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC001172844393 1050181225 /nfs/dbraw/zinc/18/12/25/1050181225.db2.gz SQCFVCBOKKWGHM-QPPBQGQZSA-N 2 1 348.534 4.306 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3n2)C1 ZINC000090585781 1050187771 /nfs/dbraw/zinc/18/77/71/1050187771.db2.gz IKJYYYGWWKPGAV-ROUUACIJSA-N 2 1 325.500 4.253 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3n2)C1 ZINC000090585781 1050187780 /nfs/dbraw/zinc/18/77/80/1050187780.db2.gz IKJYYYGWWKPGAV-ROUUACIJSA-N 2 1 325.500 4.253 20 0 EIADMP C[C@H](CSc1ccc(Cl)cc1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC001172876079 1050218040 /nfs/dbraw/zinc/21/80/40/1050218040.db2.gz VZSSATJYUCOIDV-CABCVRRESA-N 2 1 326.937 4.142 20 0 EIADMP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC001172876083 1050218342 /nfs/dbraw/zinc/21/83/42/1050218342.db2.gz VZSSATJYUCOIDV-LSDHHAIUSA-N 2 1 326.937 4.142 20 0 EIADMP C[C@H](CSc1ccc(Cl)cc1)[NH+]1CCC([NH+]2CCCC2)CC1 ZINC001172878874 1050219259 /nfs/dbraw/zinc/21/92/59/1050219259.db2.gz WFBORYDFWNYNQX-OAHLLOKOSA-N 2 1 338.948 4.381 20 0 EIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(Br)ccc2Cl)CC1 ZINC001206305091 1050235736 /nfs/dbraw/zinc/23/57/36/1050235736.db2.gz SSTSTDAMJHHQMX-HNNXBMFYSA-N 2 1 345.712 4.053 20 0 EIADMP CO[C@@H]1CCC[C@@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001172922264 1050236281 /nfs/dbraw/zinc/23/62/81/1050236281.db2.gz GMXLSBDRIXULET-XJSHKYLYSA-N 2 1 342.527 4.072 20 0 EIADMP CO[C@H]1CCC[C@@H]([N@@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)C1 ZINC001172943938 1050243957 /nfs/dbraw/zinc/24/39/57/1050243957.db2.gz VGVRMMORFWDIIV-VDWMVFLBSA-N 2 1 342.527 4.055 20 0 EIADMP CO[C@H]1CCC[C@@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@H+](C)C(C)C)[C@H]3C2)C1 ZINC001172943938 1050243969 /nfs/dbraw/zinc/24/39/69/1050243969.db2.gz VGVRMMORFWDIIV-VDWMVFLBSA-N 2 1 342.527 4.055 20 0 EIADMP CO[C@H]1CCC[C@@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@@H+](C)C(C)C)[C@H]3C2)C1 ZINC001172943938 1050243976 /nfs/dbraw/zinc/24/39/76/1050243976.db2.gz VGVRMMORFWDIIV-VDWMVFLBSA-N 2 1 342.527 4.055 20 0 EIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+][C@@H]1CCCc2c(cccc2OC)C1 ZINC001177741881 1050290545 /nfs/dbraw/zinc/29/05/45/1050290545.db2.gz DZCQLOHBHKPSCG-WOJBJXKFSA-N 2 1 344.543 4.187 20 0 EIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+][C@@H]1CCCc2c(cccc2OC)C1 ZINC001177741881 1050290559 /nfs/dbraw/zinc/29/05/59/1050290559.db2.gz DZCQLOHBHKPSCG-WOJBJXKFSA-N 2 1 344.543 4.187 20 0 EIADMP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3ccc(Cl)cn3)c2)CC1 ZINC001177748401 1050291052 /nfs/dbraw/zinc/29/10/52/1050291052.db2.gz AVINXOSRLBAYDC-UHFFFAOYSA-N 2 1 343.902 4.257 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3F)o2)C1 ZINC001177744688 1050292431 /nfs/dbraw/zinc/29/24/31/1050292431.db2.gz ZXVPMIBFYNJWKA-INIZCTEOSA-N 2 1 330.447 4.296 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3F)o2)C1 ZINC001177744688 1050292433 /nfs/dbraw/zinc/29/24/33/1050292433.db2.gz ZXVPMIBFYNJWKA-INIZCTEOSA-N 2 1 330.447 4.296 20 0 EIADMP CCCOC1CCC([N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC001173103063 1050305338 /nfs/dbraw/zinc/30/53/38/1050305338.db2.gz WYAWLOLONLURRX-UHFFFAOYSA-N 2 1 336.564 4.453 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H](OCc3ccccc3)C2)CC1 ZINC001173112951 1050310277 /nfs/dbraw/zinc/31/02/77/1050310277.db2.gz FLCRDDSRQNRHOI-HRTMPFAESA-N 2 1 344.543 4.321 20 0 EIADMP CC(C)[N@H+](C1CCC(Oc2ccccc2)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173198179 1050342211 /nfs/dbraw/zinc/34/22/11/1050342211.db2.gz SUOWNEQGGIBRMC-SBHPSCBMSA-N 2 1 330.516 4.357 20 0 EIADMP CCCC[C@@H](CC(C)C)n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001173262099 1050386243 /nfs/dbraw/zinc/38/62/43/1050386243.db2.gz SEYPIRMKHQGRSG-KRWDZBQOSA-N 2 1 334.552 4.146 20 0 EIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2[NH3+])C1 ZINC001173270946 1050391675 /nfs/dbraw/zinc/39/16/75/1050391675.db2.gz DKFCHGOVZLZWIE-ZOWQKVPBSA-N 2 1 332.491 4.142 20 0 EIADMP CCSC[C@H](C)[NH+]1CCC([NH3+])(c2ccccc2C(F)(F)F)CC1 ZINC001173296815 1050398933 /nfs/dbraw/zinc/39/89/33/1050398933.db2.gz WXVYAQFKMQJJEZ-ZDUSSCGKSA-N 2 1 346.462 4.097 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C)Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001178188075 1050399611 /nfs/dbraw/zinc/39/96/11/1050399611.db2.gz JRCDUFRZGGKXRE-XXBNENTESA-N 2 1 348.534 4.434 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C)Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001178188075 1050399616 /nfs/dbraw/zinc/39/96/16/1050399616.db2.gz JRCDUFRZGGKXRE-XXBNENTESA-N 2 1 348.534 4.434 20 0 EIADMP CCSC[C@@H](C)[N@@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001173297781 1050399670 /nfs/dbraw/zinc/39/96/70/1050399670.db2.gz WMNSJVVJMPLDEL-RTNLJHFFSA-N 2 1 332.557 4.256 20 0 EIADMP CC(C)CSCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001178205138 1050404064 /nfs/dbraw/zinc/40/40/64/1050404064.db2.gz NZIRVVUYNYFZLY-ICSRJNTNSA-N 2 1 334.573 4.408 20 0 EIADMP CC(C)CSCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001178205138 1050404070 /nfs/dbraw/zinc/40/40/70/1050404070.db2.gz NZIRVVUYNYFZLY-ICSRJNTNSA-N 2 1 334.573 4.408 20 0 EIADMP CC(C)(C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)C1CCCC1 ZINC001178203958 1050404308 /nfs/dbraw/zinc/40/43/08/1050404308.db2.gz GOLJQNWJKYJSMK-UHFFFAOYSA-N 2 1 328.544 4.500 20 0 EIADMP CC[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CCC[C@H](N(C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276628 1050406749 /nfs/dbraw/zinc/40/67/49/1050406749.db2.gz CLORNAMJBCZDRP-DKBNTXJOSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CCC[C@H]([NH+](C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276628 1050406757 /nfs/dbraw/zinc/40/67/57/1050406757.db2.gz CLORNAMJBCZDRP-DKBNTXJOSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CCC[C@H]([NH+](C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276628 1050406771 /nfs/dbraw/zinc/40/67/71/1050406771.db2.gz CLORNAMJBCZDRP-DKBNTXJOSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([NH+]2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276628 1050406781 /nfs/dbraw/zinc/40/67/81/1050406781.db2.gz CLORNAMJBCZDRP-DKBNTXJOSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([NH+]2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276628 1050406789 /nfs/dbraw/zinc/40/67/89/1050406789.db2.gz CLORNAMJBCZDRP-DKBNTXJOSA-N 2 1 341.543 4.193 20 0 EIADMP COc1ccc2cc(C[NH2+]C[C@@H]3CCC[N@@H+](CC(C)C)C3)ccc2c1 ZINC001178249565 1050410335 /nfs/dbraw/zinc/41/03/35/1050410335.db2.gz QWDKCJWMNUFDDF-IBGZPJMESA-N 2 1 340.511 4.306 20 0 EIADMP CN(C)C1=[NH+]OC2(C1)CC[NH+]([C@H]1CCCC3(CCCCC3)C1)CC2 ZINC001173346559 1050437531 /nfs/dbraw/zinc/43/75/31/1050437531.db2.gz ZOJLUJSOIRULGZ-KRWDZBQOSA-N 2 1 333.520 4.010 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC001173539959 1050475956 /nfs/dbraw/zinc/47/59/56/1050475956.db2.gz VDHGRYNDANWJNF-DZGCQCFKSA-N 2 1 329.315 4.246 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC[C@@H]1CCC[N@H+]1C ZINC001173540380 1050476050 /nfs/dbraw/zinc/47/60/50/1050476050.db2.gz WMLPRIWYNPAOML-ZFWWWQNUSA-N 2 1 329.315 4.388 20 0 EIADMP [NH3+][C@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC[C@H]1F ZINC001206212286 1050543367 /nfs/dbraw/zinc/54/33/67/1050543367.db2.gz RKNYPRGXPPFSPW-MOPGFXCFSA-N 2 1 332.850 4.268 20 0 EIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC[C@H]1F ZINC001206212286 1050543370 /nfs/dbraw/zinc/54/33/70/1050543370.db2.gz RKNYPRGXPPFSPW-MOPGFXCFSA-N 2 1 332.850 4.268 20 0 EIADMP CC(C)(C)C(C)(C)C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001178795987 1050555682 /nfs/dbraw/zinc/55/56/82/1050555682.db2.gz RAUYWQAYLIVLTB-UHFFFAOYSA-N 2 1 334.523 4.495 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CC(Nc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001179520733 1050706248 /nfs/dbraw/zinc/70/62/48/1050706248.db2.gz OAKQQOFHDWXYSM-RCQCBQKRSA-N 2 1 349.522 4.272 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CC(Nc3ccccc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001179520733 1050706268 /nfs/dbraw/zinc/70/62/68/1050706268.db2.gz OAKQQOFHDWXYSM-RCQCBQKRSA-N 2 1 349.522 4.272 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1N(C)C ZINC000093941055 1050722929 /nfs/dbraw/zinc/72/29/29/1050722929.db2.gz FBBOLVFTSNERRC-GOSISDBHSA-N 2 1 337.511 4.068 20 0 EIADMP C[C@]1(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CCCS1 ZINC001179918981 1050833671 /nfs/dbraw/zinc/83/36/71/1050833671.db2.gz GEQHTJJWHJCDFZ-PWRODBHTSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@]1(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)CCCS1 ZINC001179918981 1050833675 /nfs/dbraw/zinc/83/36/75/1050833675.db2.gz GEQHTJJWHJCDFZ-PWRODBHTSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@]1(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CCCS1 ZINC001179918981 1050833681 /nfs/dbraw/zinc/83/36/81/1050833681.db2.gz GEQHTJJWHJCDFZ-PWRODBHTSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCc2cccc(Cl)c2)C1 ZINC001180031081 1050859546 /nfs/dbraw/zinc/85/95/46/1050859546.db2.gz UNLDQOOUSDDBFI-MJGOQNOKSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCc2cccc(Cl)c2)C1 ZINC001180031081 1050859556 /nfs/dbraw/zinc/85/95/56/1050859556.db2.gz UNLDQOOUSDDBFI-MJGOQNOKSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCc2cccc(Cl)c2)C1 ZINC001180031081 1050859562 /nfs/dbraw/zinc/85/95/62/1050859562.db2.gz UNLDQOOUSDDBFI-MJGOQNOKSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCc2cccc(Cl)c2)C1 ZINC001180031081 1050859564 /nfs/dbraw/zinc/85/95/64/1050859564.db2.gz UNLDQOOUSDDBFI-MJGOQNOKSA-N 2 1 334.935 4.469 20 0 EIADMP CC[N@@H+](CC1CC[NH+](CC)CC1)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC001180064421 1050871376 /nfs/dbraw/zinc/87/13/76/1050871376.db2.gz IMPGRCSWYQLWCJ-NRFANRHFSA-N 2 1 334.523 4.447 20 0 EIADMP OC[C@@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]CCC1CCCCCC1 ZINC001180310490 1050946295 /nfs/dbraw/zinc/94/62/95/1050946295.db2.gz JAZLAGYAPWUDQQ-QFIPXVFZSA-N 2 1 344.543 4.093 20 0 EIADMP FC(F)(F)Sc1cccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1 ZINC000781330495 1050969131 /nfs/dbraw/zinc/96/91/31/1050969131.db2.gz AQRDBEULIOFDJF-OAHLLOKOSA-N 2 1 344.446 4.216 20 0 EIADMP FC(F)(F)Sc1cccc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1 ZINC000781330495 1050969137 /nfs/dbraw/zinc/96/91/37/1050969137.db2.gz AQRDBEULIOFDJF-OAHLLOKOSA-N 2 1 344.446 4.216 20 0 EIADMP Cc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)s2)cc1 ZINC000620109488 1051026316 /nfs/dbraw/zinc/02/63/16/1051026316.db2.gz JLZQDFKRUGVFEU-ROUUACIJSA-N 2 1 326.509 4.440 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1)c1cccs1 ZINC000153475662 1051050682 /nfs/dbraw/zinc/05/06/82/1051050682.db2.gz WCXUCJDFWSVSNH-VQIMIIECSA-N 2 1 344.524 4.210 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@H](C)C2)c1)c1cccs1 ZINC000153475662 1051050694 /nfs/dbraw/zinc/05/06/94/1051050694.db2.gz WCXUCJDFWSVSNH-VQIMIIECSA-N 2 1 344.524 4.210 20 0 EIADMP Cc1cscc1C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716629533 1051100614 /nfs/dbraw/zinc/10/06/14/1051100614.db2.gz ZQGXIMUYBOPXAN-SXLOBPIMSA-N 2 1 326.509 4.199 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccccc2OC(C)C)CC1 ZINC000620535899 1051152417 /nfs/dbraw/zinc/15/24/17/1051152417.db2.gz UFTBLMVACFHXGP-UHFFFAOYSA-N 2 1 332.532 4.418 20 0 EIADMP CC[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)CC(F)(F)F ZINC000414248968 1051230441 /nfs/dbraw/zinc/23/04/41/1051230441.db2.gz GEQXSLNNFLOXJL-BHYGNILZSA-N 2 1 328.422 4.390 20 0 EIADMP CC[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)CC(F)(F)F ZINC000414248968 1051230450 /nfs/dbraw/zinc/23/04/50/1051230450.db2.gz GEQXSLNNFLOXJL-BHYGNILZSA-N 2 1 328.422 4.390 20 0 EIADMP CC[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)CC(F)(F)F ZINC000414248970 1051231048 /nfs/dbraw/zinc/23/10/48/1051231048.db2.gz GEQXSLNNFLOXJL-USXIJHARSA-N 2 1 328.422 4.390 20 0 EIADMP CC[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)CC(F)(F)F ZINC000414248970 1051231062 /nfs/dbraw/zinc/23/10/62/1051231062.db2.gz GEQXSLNNFLOXJL-USXIJHARSA-N 2 1 328.422 4.390 20 0 EIADMP Cc1cccc(CCC[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC001190651645 1051245705 /nfs/dbraw/zinc/24/57/05/1051245705.db2.gz OVXCPYRRULLHRW-JOCHJYFZSA-N 2 1 328.544 4.372 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc2c(cccc2O)s1 ZINC001181514582 1051246187 /nfs/dbraw/zinc/24/61/87/1051246187.db2.gz LFOIVRPMHFIFFG-UHFFFAOYSA-N 2 1 343.496 4.278 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc2c(cccc2O)s1 ZINC001181514582 1051246198 /nfs/dbraw/zinc/24/61/98/1051246198.db2.gz LFOIVRPMHFIFFG-UHFFFAOYSA-N 2 1 343.496 4.278 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2CCCC(C)(C)O2)CC1 ZINC001190790910 1051280104 /nfs/dbraw/zinc/28/01/04/1051280104.db2.gz GASYBQCUTZOJIJ-OAQYLSRUSA-N 2 1 344.543 4.178 20 0 EIADMP C[C@]1(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)CC1(Cl)Cl ZINC001190825830 1051285231 /nfs/dbraw/zinc/28/52/31/1051285231.db2.gz CXYYDJWWJLCWBG-HZPDHXFCSA-N 2 1 333.347 4.158 20 0 EIADMP C[C@]1(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)CC1(Cl)Cl ZINC001190825830 1051285240 /nfs/dbraw/zinc/28/52/40/1051285240.db2.gz CXYYDJWWJLCWBG-HZPDHXFCSA-N 2 1 333.347 4.158 20 0 EIADMP CO[C@H](C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccc(F)cc1 ZINC001190826204 1051286007 /nfs/dbraw/zinc/28/60/07/1051286007.db2.gz GEWHQWKAVGQNOG-GHTZIAJQSA-N 2 1 348.506 4.101 20 0 EIADMP CO[C@H](C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccc(F)cc1 ZINC001190826204 1051286013 /nfs/dbraw/zinc/28/60/13/1051286013.db2.gz GEWHQWKAVGQNOG-GHTZIAJQSA-N 2 1 348.506 4.101 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C(C)C)CC2 ZINC000154854376 1051344209 /nfs/dbraw/zinc/34/42/09/1051344209.db2.gz YZIPBRPUWSOBNF-QFIPXVFZSA-N 2 1 338.495 4.313 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3OC)cc2)C1 ZINC000163240119 1051357832 /nfs/dbraw/zinc/35/78/32/1051357832.db2.gz FWKAEEXJTUXSQM-ROUUACIJSA-N 2 1 338.495 4.355 20 0 EIADMP C=Cc1ccc(CC[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001181945460 1051359795 /nfs/dbraw/zinc/35/97/95/1051359795.db2.gz MFCASKALIGYAED-CVDCTZTESA-N 2 1 334.507 4.372 20 0 EIADMP CCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001191164594 1051370904 /nfs/dbraw/zinc/37/09/04/1051370904.db2.gz GXDZCEVPIBNRIG-RTWAWAEBSA-N 2 1 344.543 4.308 20 0 EIADMP CC(C)[C@@H]1CCC[N@H+]1CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001191204639 1051384598 /nfs/dbraw/zinc/38/45/98/1051384598.db2.gz UGOVLDFYEGCWGA-QFIPXVFZSA-N 2 1 328.544 4.452 20 0 EIADMP CO[C@@H](CC(C)C)C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191358530 1051428836 /nfs/dbraw/zinc/42/88/36/1051428836.db2.gz MMZBVIWRHYQDJR-FCHUYYIVSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@@H](CC(C)C)C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001191358530 1051428843 /nfs/dbraw/zinc/42/88/43/1051428843.db2.gz MMZBVIWRHYQDJR-FCHUYYIVSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@@H](CC(C)C)C[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001191358530 1051428851 /nfs/dbraw/zinc/42/88/51/1051428851.db2.gz MMZBVIWRHYQDJR-FCHUYYIVSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@H](CC[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000155862986 1051470561 /nfs/dbraw/zinc/47/05/61/1051470561.db2.gz NEGOSMYXOVFGLO-CPUCHLNUSA-N 2 1 328.422 4.271 20 0 EIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001205571453 1051553983 /nfs/dbraw/zinc/55/39/83/1051553983.db2.gz URGBZBWBMSRQIE-CQSZACIVSA-N 2 1 338.776 4.012 20 0 EIADMP CC(C)(C)[C@]1(C[NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC[N@@H+](Cc2ccccc2)C1 ZINC001182453360 1051580463 /nfs/dbraw/zinc/58/04/63/1051580463.db2.gz SIVZKAWBVNRCBL-IIZPIQPGSA-N 2 1 326.528 4.313 20 0 EIADMP Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000157538009 1051648624 /nfs/dbraw/zinc/64/86/24/1051648624.db2.gz CLKKNRGGTHULKG-MRXNPFEDSA-N 2 1 346.563 4.394 20 0 EIADMP CC[C@H](c1ccccc1)[NH+]1CCC(CCC[N@@H+](C)CCOC)CC1 ZINC001192325453 1051692562 /nfs/dbraw/zinc/69/25/62/1051692562.db2.gz NOBGPIDVPQEETD-OAQYLSRUSA-N 2 1 332.532 4.208 20 0 EIADMP CC[N@H+](CCC[NH2+]Cc1cccc2c1NCCC2)C1CCCCC1 ZINC001182742649 1051696101 /nfs/dbraw/zinc/69/61/01/1051696101.db2.gz FWXUQAVBMWXHKW-UHFFFAOYSA-N 2 1 329.532 4.179 20 0 EIADMP CC[N@@H+](CCC[NH2+]Cc1cccc2c1NCCC2)C1CCCCC1 ZINC001182742649 1051696105 /nfs/dbraw/zinc/69/61/05/1051696105.db2.gz FWXUQAVBMWXHKW-UHFFFAOYSA-N 2 1 329.532 4.179 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000158120430 1051714884 /nfs/dbraw/zinc/71/48/84/1051714884.db2.gz VBBIDKDMYNBDSN-DOTOQJQBSA-N 2 1 341.524 4.119 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000158120430 1051714896 /nfs/dbraw/zinc/71/48/96/1051714896.db2.gz VBBIDKDMYNBDSN-DOTOQJQBSA-N 2 1 341.524 4.119 20 0 EIADMP Fc1ccc2c(c1)C[N@@H+](Cc1cccc(C[NH+]3CCCCC3)c1)CC2 ZINC001192346107 1051715005 /nfs/dbraw/zinc/71/50/05/1051715005.db2.gz AKGSGUSTALUUCR-UHFFFAOYSA-N 2 1 338.470 4.370 20 0 EIADMP Fc1ccc2c(c1)C[N@H+](Cc1cccc(C[NH+]3CCCCC3)c1)CC2 ZINC001192346107 1051715015 /nfs/dbraw/zinc/71/50/15/1051715015.db2.gz AKGSGUSTALUUCR-UHFFFAOYSA-N 2 1 338.470 4.370 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158218459 1051726171 /nfs/dbraw/zinc/72/61/71/1051726171.db2.gz GATLDIWAESYHMD-ZBFHGGJFSA-N 2 1 329.513 4.111 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000158218459 1051726184 /nfs/dbraw/zinc/72/61/84/1051726184.db2.gz GATLDIWAESYHMD-ZBFHGGJFSA-N 2 1 329.513 4.111 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000158559518 1051757519 /nfs/dbraw/zinc/75/75/19/1051757519.db2.gz JRJVZSFWPOBSIO-BGYRXZFFSA-N 3 1 349.607 4.131 20 0 EIADMP C[C@@H]([NH2+]CC1CCC2(CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001183122667 1051784220 /nfs/dbraw/zinc/78/42/20/1051784220.db2.gz MAUSWJWGQOHIHZ-WIYYLYMNSA-N 2 1 326.528 4.457 20 0 EIADMP C[C@H]([NH2+]CC1CCC2(CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001183122660 1051784476 /nfs/dbraw/zinc/78/44/76/1051784476.db2.gz MAUSWJWGQOHIHZ-RXVVDRJESA-N 2 1 326.528 4.457 20 0 EIADMP C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001183093924 1051785726 /nfs/dbraw/zinc/78/57/26/1051785726.db2.gz HAORXWSGVHPCMQ-ICSRJNTNSA-N 2 1 328.544 4.454 20 0 EIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2ccc3c(c2)CCCC3)CC1 ZINC001183239219 1051809795 /nfs/dbraw/zinc/80/97/95/1051809795.db2.gz UFRFDUGEEQMMQA-UHFFFAOYSA-N 2 1 326.528 4.406 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1cccc(OC(F)(F)F)c1 ZINC000775549664 1051816190 /nfs/dbraw/zinc/81/61/90/1051816190.db2.gz ZGZFYQFQQKMWJZ-HIFRSBDPSA-N 2 1 330.394 4.110 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)Cc3cncc(Cl)c3)C2)s1 ZINC000621291875 1051823639 /nfs/dbraw/zinc/82/36/39/1051823639.db2.gz FNWVRNMUROEPAY-HNNXBMFYSA-N 2 1 349.931 4.059 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2cccc(CC3CCC3)c2)CCN1c1cc[nH+]cc1 ZINC001183534604 1051863935 /nfs/dbraw/zinc/86/39/35/1051863935.db2.gz RMQNXRVBSNRTKZ-GOSISDBHSA-N 2 1 335.495 4.135 20 0 EIADMP C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@H](CC[NH+](C)C)c1cccnc1 ZINC001183919777 1051928032 /nfs/dbraw/zinc/92/80/32/1051928032.db2.gz PKMRJJOYQIAOBX-WIYYLYMNSA-N 2 1 339.527 4.420 20 0 EIADMP COCCC[NH+]1CCC([NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)CC1 ZINC000159212187 1051946133 /nfs/dbraw/zinc/94/61/33/1051946133.db2.gz IRHVESAHSRYOEL-CYBMUJFWSA-N 2 1 345.314 4.145 20 0 EIADMP CCC1([NH+]2CCC2)CC[NH+]([C@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC001176235383 1051969256 /nfs/dbraw/zinc/96/92/56/1051969256.db2.gz VUWILKKCXNQKCG-OAHLLOKOSA-N 2 1 338.442 4.299 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)c(C)s1 ZINC000163458721 1051989381 /nfs/dbraw/zinc/98/93/81/1051989381.db2.gz UDOVVWQUJBLZNC-OAHLLOKOSA-N 2 1 329.513 4.388 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccc(F)cc1F ZINC000163499720 1051991773 /nfs/dbraw/zinc/99/17/73/1051991773.db2.gz KWVORGMIVPFZJS-IBGZPJMESA-N 2 1 345.437 4.378 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cncs1 ZINC000290210178 1052001603 /nfs/dbraw/zinc/00/16/03/1052001603.db2.gz PWFMAINYFBPMJR-FUHWJXTLSA-N 2 1 329.513 4.096 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cncs1 ZINC000290210178 1052001606 /nfs/dbraw/zinc/00/16/06/1052001606.db2.gz PWFMAINYFBPMJR-FUHWJXTLSA-N 2 1 329.513 4.096 20 0 EIADMP Cc1cc(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cs1 ZINC001194269921 1052123837 /nfs/dbraw/zinc/12/38/37/1052123837.db2.gz SELJFFPVLAKVBZ-HXUWFJFHSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1cc(C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cs1 ZINC001194269921 1052123840 /nfs/dbraw/zinc/12/38/40/1052123840.db2.gz SELJFFPVLAKVBZ-HXUWFJFHSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1cc(C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)cs1 ZINC001194269921 1052123846 /nfs/dbraw/zinc/12/38/46/1052123846.db2.gz SELJFFPVLAKVBZ-HXUWFJFHSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1cc(C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cs1 ZINC001194269921 1052123848 /nfs/dbraw/zinc/12/38/48/1052123848.db2.gz SELJFFPVLAKVBZ-HXUWFJFHSA-N 2 1 326.509 4.155 20 0 EIADMP CC(C)(C)[C@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)CCO1 ZINC001176995896 1052215868 /nfs/dbraw/zinc/21/58/68/1052215868.db2.gz OZRZIDWLPAFGCJ-OAQYLSRUSA-N 2 1 344.543 4.310 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000671298592 1052591162 /nfs/dbraw/zinc/59/11/62/1052591162.db2.gz RNQHKZKSIOUJQD-QZTJIDSGSA-N 2 1 338.417 4.193 20 0 EIADMP COc1cc([C@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348638 1052628656 /nfs/dbraw/zinc/62/86/56/1052628656.db2.gz FIHOIIMJFARUEN-WMZOPIPTSA-N 2 1 348.531 4.253 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348638 1052628658 /nfs/dbraw/zinc/62/86/58/1052628658.db2.gz FIHOIIMJFARUEN-WMZOPIPTSA-N 2 1 348.531 4.253 20 0 EIADMP COc1cc([C@@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348635 1052628774 /nfs/dbraw/zinc/62/87/74/1052628774.db2.gz FIHOIIMJFARUEN-AEFFLSMTSA-N 2 1 348.531 4.253 20 0 EIADMP COc1cc([C@@H](C)[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348635 1052628785 /nfs/dbraw/zinc/62/87/85/1052628785.db2.gz FIHOIIMJFARUEN-AEFFLSMTSA-N 2 1 348.531 4.253 20 0 EIADMP CCCOc1ccc([C@@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1OC ZINC000623360118 1052631809 /nfs/dbraw/zinc/63/18/09/1052631809.db2.gz VYPOJYINYHAJPS-WBVHZDCISA-N 2 1 334.504 4.007 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1OC ZINC000623360118 1052631812 /nfs/dbraw/zinc/63/18/12/1052631812.db2.gz VYPOJYINYHAJPS-WBVHZDCISA-N 2 1 334.504 4.007 20 0 EIADMP CCCCOc1ccc([C@@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1OC ZINC000623362426 1052633388 /nfs/dbraw/zinc/63/33/88/1052633388.db2.gz STJQQECZJOAAQS-AEFFLSMTSA-N 2 1 348.531 4.398 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1OC ZINC000623362426 1052633390 /nfs/dbraw/zinc/63/33/90/1052633390.db2.gz STJQQECZJOAAQS-AEFFLSMTSA-N 2 1 348.531 4.398 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)CC1(C)C ZINC000623425447 1052653545 /nfs/dbraw/zinc/65/35/45/1052653545.db2.gz BDIXYSHAUXEWJF-INIZCTEOSA-N 2 1 335.561 4.196 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1(C)C ZINC000623516686 1052670200 /nfs/dbraw/zinc/67/02/00/1052670200.db2.gz AQEHTGFICVNQHX-OAHLLOKOSA-N 2 1 349.931 4.426 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1(C)C ZINC000623516686 1052670211 /nfs/dbraw/zinc/67/02/11/1052670211.db2.gz AQEHTGFICVNQHX-OAHLLOKOSA-N 2 1 349.931 4.426 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)CC1(C)C ZINC000623561035 1052680243 /nfs/dbraw/zinc/68/02/43/1052680243.db2.gz ZQBMZUUOEFWIJR-HNNXBMFYSA-N 2 1 326.406 4.157 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)CC1(C)C ZINC000623561035 1052680248 /nfs/dbraw/zinc/68/02/48/1052680248.db2.gz ZQBMZUUOEFWIJR-HNNXBMFYSA-N 2 1 326.406 4.157 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)ccc1OCC(C)C ZINC000177869427 1052693518 /nfs/dbraw/zinc/69/35/18/1052693518.db2.gz OSLMKRHYLCZAMG-QGZVFWFLSA-N 2 1 348.531 4.253 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC[N@@H+]1C ZINC000179598282 1052742858 /nfs/dbraw/zinc/74/28/58/1052742858.db2.gz QWFCCIPQIIGIAQ-OAUYIBNBSA-N 2 1 326.406 4.229 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC[N@H+]1C ZINC000179598282 1052742861 /nfs/dbraw/zinc/74/28/61/1052742861.db2.gz QWFCCIPQIIGIAQ-OAUYIBNBSA-N 2 1 326.406 4.229 20 0 EIADMP Fc1ccc(S[C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000623866514 1052825232 /nfs/dbraw/zinc/82/52/32/1052825232.db2.gz YQOTVWTZTDGIBY-KVPLUYHFSA-N 2 1 348.531 4.445 20 0 EIADMP Cc1ccc(Br)cc1[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000623866017 1052825707 /nfs/dbraw/zinc/82/57/07/1052825707.db2.gz IJSORYRKXMLZGK-NUEKZKHPSA-N 2 1 337.305 4.035 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(F)cc1C(F)(F)F ZINC000623867503 1052826107 /nfs/dbraw/zinc/82/61/07/1052826107.db2.gz BBSKORMPGWMEQE-LLVKDONJSA-N 2 1 329.341 4.090 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC[N@H+]1C ZINC000623898300 1052832411 /nfs/dbraw/zinc/83/24/11/1052832411.db2.gz FAOWKUYTOFTHMU-UVBSCNOISA-N 2 1 331.891 4.271 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(F)cc1C(F)(F)F ZINC000623886645 1052833504 /nfs/dbraw/zinc/83/35/04/1052833504.db2.gz HRWBXPJOKJCLBM-NWDGAFQWSA-N 2 1 343.368 4.336 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000623999526 1052850040 /nfs/dbraw/zinc/85/00/40/1052850040.db2.gz SXFVBWIXIZANPC-QWHCGFSZSA-N 2 1 332.385 4.227 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccccc1OC(F)F ZINC000624121094 1052867337 /nfs/dbraw/zinc/86/73/37/1052867337.db2.gz NXLSPJMKPQFZCR-HOCLYGCPSA-N 2 1 326.431 4.061 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccccc1OC(F)F ZINC000624121094 1052867339 /nfs/dbraw/zinc/86/73/39/1052867339.db2.gz NXLSPJMKPQFZCR-HOCLYGCPSA-N 2 1 326.431 4.061 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]C[C@H]3CCCC[N@H+](C)C3)oc21 ZINC000624122400 1052868314 /nfs/dbraw/zinc/86/83/14/1052868314.db2.gz QJUCJAJSSBETOF-JKSUJKDBSA-N 2 1 330.472 4.214 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]C[C@H]3CCCC[N@@H+](C)C3)oc21 ZINC000624122400 1052868315 /nfs/dbraw/zinc/86/83/15/1052868315.db2.gz QJUCJAJSSBETOF-JKSUJKDBSA-N 2 1 330.472 4.214 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)c2ccccc21 ZINC000624169318 1052873599 /nfs/dbraw/zinc/87/35/99/1052873599.db2.gz DEDDZYXLPOGKMX-NYVOZVTQSA-N 2 1 342.527 4.104 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCC[C@H]2CCCCO2)cc1 ZINC000183989302 1052989036 /nfs/dbraw/zinc/98/90/36/1052989036.db2.gz RMUKVYZBMRWVBY-OXJNMPFZSA-N 2 1 327.472 4.181 20 0 EIADMP CCC[C@H]([NH2+]C1CC[NH+](Cc2ccccc2C)CC1)c1cccnc1 ZINC000185053097 1053011949 /nfs/dbraw/zinc/01/19/49/1053011949.db2.gz MQGZXOVEHQLGFB-QFIPXVFZSA-N 2 1 337.511 4.485 20 0 EIADMP C[C@H]([NH2+]Cc1cc(F)cc2cccnc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185722858 1053021408 /nfs/dbraw/zinc/02/14/08/1053021408.db2.gz FBDFHONQBNRCFN-DOTOQJQBSA-N 2 1 341.474 4.117 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1cc2ccccc2[nH]1 ZINC000775623757 1053195032 /nfs/dbraw/zinc/19/50/32/1053195032.db2.gz VRETYJAMSRYNGR-QGZVFWFLSA-N 2 1 333.479 4.267 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1cc2ccccc2[nH]1 ZINC000775623757 1053195069 /nfs/dbraw/zinc/19/50/69/1053195069.db2.gz VRETYJAMSRYNGR-QGZVFWFLSA-N 2 1 333.479 4.267 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](CCc2ccccc2)C(C)C)cn1 ZINC000765250236 1053475814 /nfs/dbraw/zinc/47/58/14/1053475814.db2.gz HWOBJBJJFNNSLH-NRFANRHFSA-N 2 1 348.494 4.323 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2cnn(-c3ccccc3)c2C)CC1 ZINC000765438983 1053546926 /nfs/dbraw/zinc/54/69/26/1053546926.db2.gz JJYSDSDOWNMLMV-QGZVFWFLSA-N 2 1 340.515 4.096 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000866281405 1053677196 /nfs/dbraw/zinc/67/71/96/1053677196.db2.gz HTYBNRFKIZIFIF-KNKQGSTJSA-N 2 1 337.511 4.045 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000866281405 1053677200 /nfs/dbraw/zinc/67/72/00/1053677200.db2.gz HTYBNRFKIZIFIF-KNKQGSTJSA-N 2 1 337.511 4.045 20 0 EIADMP CCCC[N@@H+](Cc1cncc(OC)c1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545636 1053696603 /nfs/dbraw/zinc/69/66/03/1053696603.db2.gz RVUGHLZBOWOMQP-UHFFFAOYSA-N 2 1 333.520 4.002 20 0 EIADMP Cc1ccc(C2CC([NH2+]C[C@H]3CC[N@@H+](Cc4ccccc4)C3)C2)cc1 ZINC000386481548 1053743681 /nfs/dbraw/zinc/74/36/81/1053743681.db2.gz WGKZQVYKOUKNDP-RDABAPPSSA-N 2 1 334.507 4.353 20 0 EIADMP CC(C)C[N@H+](Cc1cccc(OC(C)(C)C)n1)CC1CC[NH+](C)CC1 ZINC001197194921 1053851700 /nfs/dbraw/zinc/85/17/00/1053851700.db2.gz YCFFIXFXUYWBDG-UHFFFAOYSA-N 2 1 347.547 4.059 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1CN1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC001197702482 1053976223 /nfs/dbraw/zinc/97/62/23/1053976223.db2.gz YOTJOVBMAOJGSS-RBUKOAKNSA-N 2 1 338.495 4.296 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000429531724 1054050799 /nfs/dbraw/zinc/05/07/99/1054050799.db2.gz SFKZTMZPRWGJSX-DZGCQCFKSA-N 2 1 330.394 4.062 20 0 EIADMP CCC(C)(C)CC[N@H+]1CC[C@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856599654 1054090818 /nfs/dbraw/zinc/09/08/18/1054090818.db2.gz MPWIMWCBAVISCC-FQEVSTJZSA-N 2 1 347.547 4.201 20 0 EIADMP CCC(C)(C)CC[NH+]1CC[C@H](Oc2ccnc(C[N@H+](C)C(C)C)c2)C1 ZINC000856599654 1054090827 /nfs/dbraw/zinc/09/08/27/1054090827.db2.gz MPWIMWCBAVISCC-FQEVSTJZSA-N 2 1 347.547 4.201 20 0 EIADMP CCC(C)(C)CC[NH+]1CC[C@H](Oc2ccnc(C[N@@H+](C)C(C)C)c2)C1 ZINC000856599654 1054090837 /nfs/dbraw/zinc/09/08/37/1054090837.db2.gz MPWIMWCBAVISCC-FQEVSTJZSA-N 2 1 347.547 4.201 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@@H]3CCOC4(CCCC4)C3)C2)c1 ZINC000872029980 1054347238 /nfs/dbraw/zinc/34/72/38/1054347238.db2.gz WWNGNPLBLLIJAM-ZWKOTPCHSA-N 2 1 348.556 4.042 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3CCOC4(CCCC4)C3)C2)c1 ZINC000872029980 1054347251 /nfs/dbraw/zinc/34/72/51/1054347251.db2.gz WWNGNPLBLLIJAM-ZWKOTPCHSA-N 2 1 348.556 4.042 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001199197844 1054361243 /nfs/dbraw/zinc/36/12/43/1054361243.db2.gz KIQHFATWCUYHLE-HKUYNNGSSA-N 2 1 328.544 4.237 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)CCO1 ZINC001199275048 1054374633 /nfs/dbraw/zinc/37/46/33/1054374633.db2.gz CGUXRPGAJZDKRD-NYVOZVTQSA-N 2 1 344.543 4.354 20 0 EIADMP CC(C)n1c2ccccc2nc1C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC001199336664 1054385639 /nfs/dbraw/zinc/38/56/39/1054385639.db2.gz UVYHEZNIHSKUAG-SFHVURJKSA-N 2 1 342.531 4.361 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(F)ccc1OC(F)F ZINC001199336844 1054388069 /nfs/dbraw/zinc/38/80/69/1054388069.db2.gz YJBHKSNGDUFIBC-AWEZNQCLSA-N 2 1 344.421 4.171 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(CC(F)(F)F)cc2)C1 ZINC001199346355 1054389172 /nfs/dbraw/zinc/38/91/72/1054389172.db2.gz ZDTOYXPKGINQLJ-INIZCTEOSA-N 2 1 342.449 4.393 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2nccc3ccccc32)C1 ZINC001199319395 1054391097 /nfs/dbraw/zinc/39/10/97/1054391097.db2.gz AUOGENWNZUVIEQ-HDICACEKSA-N 2 1 325.500 4.083 20 0 EIADMP Cc1cc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c(OC(F)F)cc1C ZINC001199419790 1054404895 /nfs/dbraw/zinc/40/48/95/1054404895.db2.gz BEBOKWABMRPQRN-UHFFFAOYSA-N 2 1 340.458 4.257 20 0 EIADMP C[C@@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000858152184 1054426649 /nfs/dbraw/zinc/42/66/49/1054426649.db2.gz HBLCPDYQNWWYLE-XGRCMKMKSA-N 2 1 341.543 4.311 20 0 EIADMP C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001199963328 1054505373 /nfs/dbraw/zinc/50/53/73/1054505373.db2.gz WJORURSJCVQHEV-SWLSCSKDSA-N 2 1 329.315 4.387 20 0 EIADMP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1F ZINC000873262117 1054517420 /nfs/dbraw/zinc/51/74/20/1054517420.db2.gz JZUQKTRCXUEAGL-SECBINFHSA-N 2 1 342.245 4.145 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1)c1ccc(C(F)(F)F)nc1 ZINC000873297496 1054526872 /nfs/dbraw/zinc/52/68/72/1054526872.db2.gz XSGMZSVDXOPNFI-GUTXKFCHSA-N 2 1 329.410 4.062 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](C[C@H]1CC=CCC1)CC2 ZINC001201408954 1054787307 /nfs/dbraw/zinc/78/73/07/1054787307.db2.gz MXIJBXUSFNRJPA-AZUAARDMSA-N 2 1 328.500 4.312 20 0 EIADMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](C[C@H](C)CCC=C(C)C)C2 ZINC001201486255 1054815678 /nfs/dbraw/zinc/81/56/78/1054815678.db2.gz HWJDCUUUPYLZGV-HJNYFJLDSA-N 2 1 348.575 4.049 20 0 EIADMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](C[C@H](C)CCC=C(C)C)C2 ZINC001201486255 1054815682 /nfs/dbraw/zinc/81/56/82/1054815682.db2.gz HWJDCUUUPYLZGV-HJNYFJLDSA-N 2 1 348.575 4.049 20 0 EIADMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](C[C@H](C)CCC=C(C)C)C2 ZINC001201486255 1054815687 /nfs/dbraw/zinc/81/56/87/1054815687.db2.gz HWJDCUUUPYLZGV-HJNYFJLDSA-N 2 1 348.575 4.049 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+]Cc2cc(F)ccc2F)C[N@H+]1Cc1ccccc1 ZINC001201492027 1054818647 /nfs/dbraw/zinc/81/86/47/1054818647.db2.gz PANQHTNAIMUPLH-WMZOPIPTSA-N 2 1 344.449 4.355 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2nc3ccccc3o2)C[N@H+]1Cc1ccccc1 ZINC001201492515 1054818924 /nfs/dbraw/zinc/81/89/24/1054818924.db2.gz QHDZOIDOAGCAKO-MJGOQNOKSA-N 2 1 349.478 4.218 20 0 EIADMP c1ccc(CCC[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC001201672755 1054872384 /nfs/dbraw/zinc/87/23/84/1054872384.db2.gz XEWPHMPDEHYQPR-PKTZIBPZSA-N 2 1 334.507 4.073 20 0 EIADMP c1ccc(CCC[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201681702 1054874490 /nfs/dbraw/zinc/87/44/90/1054874490.db2.gz CIZQLBIMNVMSIZ-DNQXCXABSA-N 2 1 348.534 4.463 20 0 EIADMP c1ccc(CCC[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201681702 1054874495 /nfs/dbraw/zinc/87/44/95/1054874495.db2.gz CIZQLBIMNVMSIZ-DNQXCXABSA-N 2 1 348.534 4.463 20 0 EIADMP c1ccc(CCC[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201681702 1054874504 /nfs/dbraw/zinc/87/45/04/1054874504.db2.gz CIZQLBIMNVMSIZ-DNQXCXABSA-N 2 1 348.534 4.463 20 0 EIADMP CC(C)=CCC[C@H](C)CC[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001201983084 1054958869 /nfs/dbraw/zinc/95/88/69/1054958869.db2.gz XGZRTKXPADXZSJ-IBGZPJMESA-N 2 1 336.564 4.334 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(-c2cccnc2)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001201946725 1054962653 /nfs/dbraw/zinc/96/26/53/1054962653.db2.gz KTXXNFWZQKJBLR-XMSQKQJNSA-N 2 1 349.522 4.491 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(Cl)o2)CC1 ZINC000671755214 1055020917 /nfs/dbraw/zinc/02/09/17/1055020917.db2.gz CDXHTHSCEHCILN-UHFFFAOYSA-N 2 1 332.875 4.466 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000877546916 1055075680 /nfs/dbraw/zinc/07/56/80/1055075680.db2.gz NPUPSUNBSGIMEB-VAKYOOAGSA-N 2 1 330.541 4.056 20 0 EIADMP COCC(C)(C)CC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877803739 1055122936 /nfs/dbraw/zinc/12/29/36/1055122936.db2.gz JDMAKYZATZYEAT-QUCCMNQESA-N 2 1 330.516 4.007 20 0 EIADMP COCC(C)(C)CC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877803739 1055122944 /nfs/dbraw/zinc/12/29/44/1055122944.db2.gz JDMAKYZATZYEAT-QUCCMNQESA-N 2 1 330.516 4.007 20 0 EIADMP c1ccc([C@@H]2CCC[C@@H](C[NH+]3CCC([NH+]4CCCCC4)CC3)O2)cc1 ZINC000877971083 1055164889 /nfs/dbraw/zinc/16/48/89/1055164889.db2.gz GQMIYOLYYKLZLX-VXKWHMMOSA-N 2 1 342.527 4.247 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474473031 1055884557 /nfs/dbraw/zinc/88/45/57/1055884557.db2.gz PLWYKDMHWRBJGI-LOCSVTFISA-N 2 1 331.426 4.174 20 0 EIADMP C[C@H](Cc1ccsc1)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000542776144 1055971528 /nfs/dbraw/zinc/97/15/28/1055971528.db2.gz VDNLQTFQORFZME-FUHIMQAGSA-N 2 1 328.525 4.179 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CC[C@H]3COCC[C@@H]3C2)CC1 ZINC000921750455 1056413167 /nfs/dbraw/zinc/41/31/67/1056413167.db2.gz WPXSOKDLMYLNAG-RPUPUWCGSA-N 2 1 342.527 4.007 20 0 EIADMP COc1ccccc1CCC[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000542886069 1056695907 /nfs/dbraw/zinc/69/59/07/1056695907.db2.gz ONXNAARPNFGPKH-KRWDZBQOSA-N 2 1 349.478 4.473 20 0 EIADMP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000180187136 1058422385 /nfs/dbraw/zinc/42/23/85/1058422385.db2.gz ZOFQLQLXSOWFLR-INIZCTEOSA-N 2 1 340.515 4.333 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1OC ZINC000742374725 1058599980 /nfs/dbraw/zinc/59/99/80/1058599980.db2.gz DSSBRCAAPVIIEM-IEBWSBKVSA-N 2 1 348.531 4.227 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1OC ZINC000742374725 1058599988 /nfs/dbraw/zinc/59/99/88/1058599988.db2.gz DSSBRCAAPVIIEM-IEBWSBKVSA-N 2 1 348.531 4.227 20 0 EIADMP CCCC[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccccc1 ZINC000746047700 1059979396 /nfs/dbraw/zinc/97/93/96/1059979396.db2.gz PUIXKIYAYAQADY-SFTDATJTSA-N 2 1 330.516 4.151 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000746048242 1059984221 /nfs/dbraw/zinc/98/42/21/1059984221.db2.gz ZIRNYBVCPACIEA-LAUBAEHRSA-N 2 1 344.543 4.278 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379638611 1060140149 /nfs/dbraw/zinc/14/01/49/1060140149.db2.gz UQWCRVDEWZETOB-RXVVDRJESA-N 2 1 338.495 4.146 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379638611 1060140153 /nfs/dbraw/zinc/14/01/53/1060140153.db2.gz UQWCRVDEWZETOB-RXVVDRJESA-N 2 1 338.495 4.146 20 0 EIADMP Cc1nc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000383343404 1060246278 /nfs/dbraw/zinc/24/62/78/1060246278.db2.gz LNEFHQLOZUKONT-BEFAXECRSA-N 2 1 343.540 4.323 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCc1ccc(Oc3ccccc3)cc1)C2 ZINC001169096479 1060633211 /nfs/dbraw/zinc/63/32/11/1060633211.db2.gz XIZHZOMUUOALER-ACDBMABISA-N 2 1 336.479 4.236 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)c1ccc(C(F)(F)F)cc1)C2 ZINC001169091875 1060646102 /nfs/dbraw/zinc/64/61/02/1060646102.db2.gz WPVKOLGDRFPIEQ-PHZGNYQRSA-N 2 1 326.406 4.155 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(Cc3cccc(Cl)c3)CC1)C2 ZINC001169125580 1060651919 /nfs/dbraw/zinc/65/19/19/1060651919.db2.gz JILBOPVWCAUKEM-PMOLBWCYSA-N 2 1 332.919 4.220 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(c3nc4ccccc4s3)CC1)C2 ZINC001169142405 1060662765 /nfs/dbraw/zinc/66/27/65/1060662765.db2.gz UDWPWWFHCNBERN-FVQHAEBGSA-N 2 1 341.524 4.101 20 0 EIADMP C[N@H+]1CC[C@H](c2ccc(N[C@H]3CC(C)(C)C[C@@](C)(C[NH3+])C3)cc2)C1 ZINC001169148765 1060668995 /nfs/dbraw/zinc/66/89/95/1060668995.db2.gz ZYHNFNMFNAQZES-CUWPLCDZSA-N 2 1 329.532 4.061 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154263 1060669773 /nfs/dbraw/zinc/66/97/73/1060669773.db2.gz PCDDHHYQTQGNMG-XMTFNYHQSA-N 2 1 338.417 4.468 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154263 1060669781 /nfs/dbraw/zinc/66/97/81/1060669781.db2.gz PCDDHHYQTQGNMG-XMTFNYHQSA-N 2 1 338.417 4.468 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154263 1060669790 /nfs/dbraw/zinc/66/97/90/1060669790.db2.gz PCDDHHYQTQGNMG-XMTFNYHQSA-N 2 1 338.417 4.468 20 0 EIADMP CC[NH+]1CCC([NH+]2CCC(Cc3c(F)cccc3Cl)CC2)CC1 ZINC001169264589 1060711182 /nfs/dbraw/zinc/71/11/82/1060711182.db2.gz JKFOXPSDSJAFDP-UHFFFAOYSA-N 2 1 338.898 4.218 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(Br)s2)CC1 ZINC000038002096 202384559 /nfs/dbraw/zinc/38/45/59/202384559.db2.gz HNKBLVWQUCHOSA-LLVKDONJSA-N 2 1 331.323 4.034 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@H]1CCC[NH+](Cc2cccc3[nH]ccc32)CC1 ZINC000275824824 564010159 /nfs/dbraw/zinc/01/01/59/564010159.db2.gz VAQKXHOBQYXVGS-FQEVSTJZSA-N 2 1 348.494 4.049 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH+](Cc2cccc3[nH]ccc32)CC1 ZINC000275824824 564010160 /nfs/dbraw/zinc/01/01/60/564010160.db2.gz VAQKXHOBQYXVGS-FQEVSTJZSA-N 2 1 348.494 4.049 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@H+](Cc2cccc3[nH]ccc32)CC1 ZINC000275824824 564010161 /nfs/dbraw/zinc/01/01/61/564010161.db2.gz VAQKXHOBQYXVGS-FQEVSTJZSA-N 2 1 348.494 4.049 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)CC1 ZINC000275824824 564010162 /nfs/dbraw/zinc/01/01/62/564010162.db2.gz VAQKXHOBQYXVGS-FQEVSTJZSA-N 2 1 348.494 4.049 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188300 1032076398 /nfs/dbraw/zinc/07/63/98/1032076398.db2.gz CTDPQNUXXFUXKW-AVRDEDQJSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188300 1032076424 /nfs/dbraw/zinc/07/64/24/1032076424.db2.gz CTDPQNUXXFUXKW-AVRDEDQJSA-N 2 1 347.506 4.211 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCCOc4ccccc43)C2)cc1 ZINC000195137036 1032204155 /nfs/dbraw/zinc/20/41/55/1032204155.db2.gz XKYCQGHQBXWCFM-TZIWHRDSSA-N 2 1 336.479 4.012 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556103 1032452376 /nfs/dbraw/zinc/45/23/76/1032452376.db2.gz JTQAXXBMAOOBNC-QAPCUYQASA-N 2 1 336.470 4.311 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556103 1032452380 /nfs/dbraw/zinc/45/23/80/1032452380.db2.gz JTQAXXBMAOOBNC-QAPCUYQASA-N 2 1 336.470 4.311 20 0 EIADMP c1csc(Cn2cccc2C[NH2+]C2CC[NH+](C3CCCC3)CC2)c1 ZINC000176992664 1032487526 /nfs/dbraw/zinc/48/75/26/1032487526.db2.gz IRRFWPBXLUXMCW-UHFFFAOYSA-N 2 1 343.540 4.095 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCO3)cc1 ZINC000177791463 1032504875 /nfs/dbraw/zinc/50/48/75/1032504875.db2.gz MNRCULXXEGHYJM-HUUCEWRRSA-N 2 1 349.434 4.321 20 0 EIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C[C@H]1CCCCC1(F)F ZINC000450455631 1032511102 /nfs/dbraw/zinc/51/11/02/1032511102.db2.gz OFYUOHGZROAWRC-RBUKOAKNSA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C[C@H]1CCCCC1(F)F ZINC000450455631 1032511114 /nfs/dbraw/zinc/51/11/14/1032511114.db2.gz OFYUOHGZROAWRC-RBUKOAKNSA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C[C@H]1CCCCC1(F)F ZINC000450455631 1032511125 /nfs/dbraw/zinc/51/11/25/1032511125.db2.gz OFYUOHGZROAWRC-RBUKOAKNSA-N 2 1 336.470 4.266 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475824 1032520647 /nfs/dbraw/zinc/52/06/47/1032520647.db2.gz ZYOYMCQNFCPKTR-HOCLYGCPSA-N 2 1 328.422 4.126 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475824 1032520655 /nfs/dbraw/zinc/52/06/55/1032520655.db2.gz ZYOYMCQNFCPKTR-HOCLYGCPSA-N 2 1 328.422 4.126 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475824 1032520671 /nfs/dbraw/zinc/52/06/71/1032520671.db2.gz ZYOYMCQNFCPKTR-HOCLYGCPSA-N 2 1 328.422 4.126 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475824 1032520682 /nfs/dbraw/zinc/52/06/82/1032520682.db2.gz ZYOYMCQNFCPKTR-HOCLYGCPSA-N 2 1 328.422 4.126 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475824 1032520694 /nfs/dbraw/zinc/52/06/94/1032520694.db2.gz ZYOYMCQNFCPKTR-HOCLYGCPSA-N 2 1 328.422 4.126 20 0 EIADMP C[C@H](c1ccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1)C(F)(F)F ZINC000450504320 1032533563 /nfs/dbraw/zinc/53/35/63/1032533563.db2.gz UMSHESASPLNLOZ-FHLIZLRMSA-N 2 1 340.433 4.269 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1)C(F)(F)F ZINC000450504320 1032533571 /nfs/dbraw/zinc/53/35/71/1032533571.db2.gz UMSHESASPLNLOZ-FHLIZLRMSA-N 2 1 340.433 4.269 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1)C(F)(F)F ZINC000450504320 1032533575 /nfs/dbraw/zinc/53/35/75/1032533575.db2.gz UMSHESASPLNLOZ-FHLIZLRMSA-N 2 1 340.433 4.269 20 0 EIADMP C[C@H](c1ccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cc1)C(F)(F)F ZINC000450504321 1032534070 /nfs/dbraw/zinc/53/40/70/1032534070.db2.gz UMSHESASPLNLOZ-JLSDUUJJSA-N 2 1 340.433 4.269 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cc1)C(F)(F)F ZINC000450504321 1032534072 /nfs/dbraw/zinc/53/40/72/1032534072.db2.gz UMSHESASPLNLOZ-JLSDUUJJSA-N 2 1 340.433 4.269 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1)C(F)(F)F ZINC000450504321 1032534075 /nfs/dbraw/zinc/53/40/75/1032534075.db2.gz UMSHESASPLNLOZ-JLSDUUJJSA-N 2 1 340.433 4.269 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccccc1C(F)(F)F ZINC000178701894 1032543873 /nfs/dbraw/zinc/54/38/73/1032543873.db2.gz SZDLDEBVUAHDKI-QWHCGFSZSA-N 2 1 325.378 4.197 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC000178701881 1032544440 /nfs/dbraw/zinc/54/44/40/1032544440.db2.gz SZDLDEBVUAHDKI-OLZOCXBDSA-N 2 1 325.378 4.197 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc([C@@H](C)C(F)(F)F)cc1 ZINC000450596373 1032575084 /nfs/dbraw/zinc/57/50/84/1032575084.db2.gz GBBRFDWPVGCXDQ-CQSZACIVSA-N 2 1 339.405 4.379 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc([C@@H](C)C(F)(F)F)cc1 ZINC000450596373 1032575100 /nfs/dbraw/zinc/57/51/00/1032575100.db2.gz GBBRFDWPVGCXDQ-CQSZACIVSA-N 2 1 339.405 4.379 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000579709779 1018807169 /nfs/dbraw/zinc/80/71/69/1018807169.db2.gz GUUZLDRQCSRGIA-MRXNPFEDSA-N 2 1 326.406 4.116 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000579709779 1018807171 /nfs/dbraw/zinc/80/71/71/1018807171.db2.gz GUUZLDRQCSRGIA-MRXNPFEDSA-N 2 1 326.406 4.116 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000643545769 1018896601 /nfs/dbraw/zinc/89/66/01/1018896601.db2.gz CDSFLOQCVWTDTL-DGCLKSJQSA-N 2 1 344.833 4.267 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001208608397 1019447920 /nfs/dbraw/zinc/44/79/20/1019447920.db2.gz IQAJPTODASRYOP-KBPBESRZSA-N 2 1 327.299 4.125 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH+]2CC[C@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001208608397 1019447939 /nfs/dbraw/zinc/44/79/39/1019447939.db2.gz IQAJPTODASRYOP-KBPBESRZSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@H](C[N@@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001208608397 1019447967 /nfs/dbraw/zinc/44/79/67/1019447967.db2.gz IQAJPTODASRYOP-KBPBESRZSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@H](C[N@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001208608397 1019447993 /nfs/dbraw/zinc/44/79/93/1019447993.db2.gz IQAJPTODASRYOP-KBPBESRZSA-N 2 1 327.299 4.125 20 0 EIADMP CCCCCOc1cc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)ccc1OC ZINC000432815981 1032858489 /nfs/dbraw/zinc/85/84/89/1032858489.db2.gz LWXGQXDROYOUHF-LJQANCHMSA-N 2 1 348.531 4.180 20 0 EIADMP CCCCCOc1cc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)ccc1OC ZINC000432815981 1032858493 /nfs/dbraw/zinc/85/84/93/1032858493.db2.gz LWXGQXDROYOUHF-LJQANCHMSA-N 2 1 348.531 4.180 20 0 EIADMP C[C@@H]1C[C@@H](C[N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)C[C@H](C)O1 ZINC001209390759 1020244404 /nfs/dbraw/zinc/24/44/04/1020244404.db2.gz NBRQFKHBKRMXKK-HATOLVCRSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000246949907 1020292774 /nfs/dbraw/zinc/29/27/74/1020292774.db2.gz FMTNZNAXVAZLKT-MOPGFXCFSA-N 2 1 338.495 4.343 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000246949907 1020292786 /nfs/dbraw/zinc/29/27/86/1020292786.db2.gz FMTNZNAXVAZLKT-MOPGFXCFSA-N 2 1 338.495 4.343 20 0 EIADMP C[N@@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)CC1CCCC1 ZINC001167206502 1020553106 /nfs/dbraw/zinc/55/31/06/1020553106.db2.gz QVOPBQFWRLQWRS-UHFFFAOYSA-N 2 1 328.544 4.453 20 0 EIADMP CC[N@H+](CCC[NH+]1CCCCC1)Cc1cccc(Br)c1 ZINC001167219157 1020576999 /nfs/dbraw/zinc/57/69/99/1020576999.db2.gz XYWLHBKOYSALMD-UHFFFAOYSA-N 2 1 339.321 4.147 20 0 EIADMP CC[N@@H+](CCC[NH+]1CCCCC1)Cc1cccc(Br)c1 ZINC001167219157 1020577018 /nfs/dbraw/zinc/57/70/18/1020577018.db2.gz XYWLHBKOYSALMD-UHFFFAOYSA-N 2 1 339.321 4.147 20 0 EIADMP CC(C)Oc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000236783794 1020654221 /nfs/dbraw/zinc/65/42/21/1020654221.db2.gz VZSFAACLMCUHJU-UHFFFAOYSA-N 2 1 330.516 4.361 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](CC[C@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255606 1020678707 /nfs/dbraw/zinc/67/87/07/1020678707.db2.gz JSZUAJWRNLHXIF-HOTGVXAUSA-N 2 1 333.347 4.014 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CC[C@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255606 1020678717 /nfs/dbraw/zinc/67/87/17/1020678717.db2.gz JSZUAJWRNLHXIF-HOTGVXAUSA-N 2 1 333.347 4.014 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547831563 1020779891 /nfs/dbraw/zinc/77/98/91/1020779891.db2.gz ACPRCCVYUZNZTO-YJMBLLCNSA-N 2 1 344.543 4.080 20 0 EIADMP Cc1cnc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c(C)c1 ZINC000655806756 1020976237 /nfs/dbraw/zinc/97/62/37/1020976237.db2.gz AAQZEEVMRMLKTD-OAQYLSRUSA-N 2 1 349.522 4.028 20 0 EIADMP Cc1cnc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c(C)c1 ZINC000655806756 1020976245 /nfs/dbraw/zinc/97/62/45/1020976245.db2.gz AAQZEEVMRMLKTD-OAQYLSRUSA-N 2 1 349.522 4.028 20 0 EIADMP COc1c(C)cccc1C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000655809564 1020978726 /nfs/dbraw/zinc/97/87/26/1020978726.db2.gz ACCPLGWETFNWSO-MRXNPFEDSA-N 2 1 335.451 4.349 20 0 EIADMP CC[C@H]([NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)[C@@H]1CCCCO1 ZINC000655850448 1021013836 /nfs/dbraw/zinc/01/38/36/1021013836.db2.gz VKMOHPZIUZDGNB-XPGWFJOJSA-N 2 1 327.472 4.179 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000683690503 1021098186 /nfs/dbraw/zinc/09/81/86/1021098186.db2.gz LXCNRXJQOCVLDR-OFNKIYASSA-N 2 1 349.522 4.435 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2ccccc2)cc1F ZINC000580059982 1021587136 /nfs/dbraw/zinc/58/71/36/1021587136.db2.gz JSXSFOISMNNZTG-KKSFZXQISA-N 2 1 326.459 4.265 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC000414103512 1021858325 /nfs/dbraw/zinc/85/83/25/1021858325.db2.gz DUXDLFYWESCUCR-FGTMMUONSA-N 2 1 330.516 4.307 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000398019226 1021898745 /nfs/dbraw/zinc/89/87/45/1021898745.db2.gz JDWYDUWUNOQQJA-QRWLVFNGSA-N 2 1 346.877 4.479 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000398019226 1021898746 /nfs/dbraw/zinc/89/87/46/1021898746.db2.gz JDWYDUWUNOQQJA-QRWLVFNGSA-N 2 1 346.877 4.479 20 0 EIADMP C[NH+](C/C=C/C[N@@H+](C)Cc1ccccc1F)Cc1ccccc1F ZINC000613378816 1021914385 /nfs/dbraw/zinc/91/43/85/1021914385.db2.gz UKGMIEOQCPPHPE-BQYQJAHWSA-N 2 1 330.422 4.085 20 0 EIADMP C[NH+](C/C=C/C[N@H+](C)Cc1ccccc1F)Cc1ccccc1F ZINC000613378816 1021914417 /nfs/dbraw/zinc/91/44/17/1021914417.db2.gz UKGMIEOQCPPHPE-BQYQJAHWSA-N 2 1 330.422 4.085 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000414202827 1022126378 /nfs/dbraw/zinc/12/63/78/1022126378.db2.gz ZGTPHSNWUGHIHE-HUUCEWRRSA-N 2 1 344.421 4.010 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000892579962 1022299147 /nfs/dbraw/zinc/29/91/47/1022299147.db2.gz FCZQXSMAZNVMKO-INIZCTEOSA-N 2 1 341.499 4.067 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000892579962 1022299169 /nfs/dbraw/zinc/29/91/69/1022299169.db2.gz FCZQXSMAZNVMKO-INIZCTEOSA-N 2 1 341.499 4.067 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000471602662 1022308909 /nfs/dbraw/zinc/30/89/09/1022308909.db2.gz CTHLLGUDIXOTHK-XYJFISCASA-N 2 1 344.524 4.318 20 0 EIADMP C[NH+](C)CCC1CC[NH+](Cc2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000511536250 1022325896 /nfs/dbraw/zinc/32/58/96/1022325896.db2.gz INMPMMCOLIGUAD-UHFFFAOYSA-N 2 1 332.385 4.008 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CC[C@@H]2CC2(Cl)Cl)C1 ZINC001167426423 1022326444 /nfs/dbraw/zinc/32/64/44/1022326444.db2.gz WTHVXJBNNBZTRA-OWCLPIDISA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CC[C@@H]2CC2(Cl)Cl)C1 ZINC001167426423 1022326463 /nfs/dbraw/zinc/32/64/63/1022326463.db2.gz WTHVXJBNNBZTRA-OWCLPIDISA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CC[C@@H]2CC2(Cl)Cl)C1 ZINC001167426423 1022326478 /nfs/dbraw/zinc/32/64/78/1022326478.db2.gz WTHVXJBNNBZTRA-OWCLPIDISA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CC[C@@H]2CC2(Cl)Cl)C1 ZINC001167426423 1022326496 /nfs/dbraw/zinc/32/64/96/1022326496.db2.gz WTHVXJBNNBZTRA-OWCLPIDISA-N 2 1 333.347 4.157 20 0 EIADMP Cc1cccc(N2CCC([NH2+]C[C@H](C)c3cccc(Cl)c3)CC2)[nH+]1 ZINC000187932336 1022363855 /nfs/dbraw/zinc/36/38/55/1022363855.db2.gz FZARPMWIZGXYTK-HNNXBMFYSA-N 2 1 343.902 4.406 20 0 EIADMP Cc1ccc(N2CCC([NH2+]C[C@H](C)c3cccc(Cl)c3)CC2)[nH+]c1 ZINC000188023637 1022410101 /nfs/dbraw/zinc/41/01/01/1022410101.db2.gz IPFIVHFBESQLKK-INIZCTEOSA-N 2 1 343.902 4.406 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)[C@@H]2CCN(C)C[C@@H]2C)cc1OCC ZINC000580801447 1022510658 /nfs/dbraw/zinc/51/06/58/1022510658.db2.gz JFPYGVJEIBKKAX-PKOBYXMFSA-N 2 1 348.531 4.036 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@@H]2C)cc1OCC ZINC000580801447 1022510718 /nfs/dbraw/zinc/51/07/18/1022510718.db2.gz JFPYGVJEIBKKAX-PKOBYXMFSA-N 2 1 348.531 4.036 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1OCC ZINC000580801447 1022510733 /nfs/dbraw/zinc/51/07/33/1022510733.db2.gz JFPYGVJEIBKKAX-PKOBYXMFSA-N 2 1 348.531 4.036 20 0 EIADMP C[C@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC2(C[C@H]2C[N@@H+](C)C2CC2)CC1 ZINC000378354967 1022738098 /nfs/dbraw/zinc/73/80/98/1022738098.db2.gz MCWWHHIHHORZPY-CVEARBPZSA-N 2 1 345.531 4.229 20 0 EIADMP C[C@@H]([NH2+]CCc1c(F)cccc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000402101119 1022801395 /nfs/dbraw/zinc/80/13/95/1022801395.db2.gz VGCRZWLMUXDAJU-AEFFLSMTSA-N 2 1 344.449 4.008 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[NH+]2Cc2ccccc2)cc1 ZINC000656404134 1022845369 /nfs/dbraw/zinc/84/53/69/1022845369.db2.gz WYQSTLLFJCLBJL-GPJHCHHRSA-N 2 1 332.491 4.029 20 0 EIADMP c1ccc(C[NH+]2C[C@@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[N@@H+]2Cc2ccccc2)cc1 ZINC000656404134 1022845376 /nfs/dbraw/zinc/84/53/76/1022845376.db2.gz WYQSTLLFJCLBJL-GPJHCHHRSA-N 2 1 332.491 4.029 20 0 EIADMP c1ccc(C[NH+]2C[C@@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[N@H+]2Cc2ccccc2)cc1 ZINC000656404134 1022845382 /nfs/dbraw/zinc/84/53/82/1022845382.db2.gz WYQSTLLFJCLBJL-GPJHCHHRSA-N 2 1 332.491 4.029 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@@H]1c1ccccc1)c1ccc(Cl)nc1 ZINC000378513144 1022853650 /nfs/dbraw/zinc/85/36/50/1022853650.db2.gz AGOMEDHCRQTWOU-UCLAIMLFSA-N 2 1 329.875 4.079 20 0 EIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(-c2ccncc2)c1 ZINC000376595325 1023151813 /nfs/dbraw/zinc/15/18/13/1023151813.db2.gz MMNICNXREUKKAQ-PPNDLDFTSA-N 2 1 335.495 4.416 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000589836699 1023222320 /nfs/dbraw/zinc/22/23/20/1023222320.db2.gz QYEQHBHPIRFFLB-SFHVURJKSA-N 2 1 340.511 4.450 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H]2CCC3(CCCC3)O2)CC1)CC1CC1 ZINC000549136809 1023363531 /nfs/dbraw/zinc/36/35/31/1023363531.db2.gz YUDPKQXWGVKNRQ-NRFANRHFSA-N 2 1 348.575 4.312 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC000581561949 1023365139 /nfs/dbraw/zinc/36/51/39/1023365139.db2.gz RJKLFILCBGPMCM-QFIPXVFZSA-N 2 1 331.463 4.229 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC000581561949 1023365146 /nfs/dbraw/zinc/36/51/46/1023365146.db2.gz RJKLFILCBGPMCM-QFIPXVFZSA-N 2 1 331.463 4.229 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000378902468 1023389781 /nfs/dbraw/zinc/38/97/81/1023389781.db2.gz CNMHTIHABQBMSM-CYBMUJFWSA-N 2 1 344.421 4.499 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC(N[C@H](CCC[NH3+])c3ccccc3)CC2)C1 ZINC000415061584 1023416137 /nfs/dbraw/zinc/41/61/37/1023416137.db2.gz YRSAXICYQKMCBS-STZQEDGTSA-N 2 1 343.559 4.099 20 0 EIADMP C[N@@H+]1CC[C@H](C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)[C@H]1c1cccs1 ZINC000377386049 1023504346 /nfs/dbraw/zinc/50/43/46/1023504346.db2.gz LWZHUUPMJVUIDJ-WTTBNOFXSA-N 2 1 338.586 4.251 20 0 EIADMP C[N@H+]1CC[C@H](C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)[C@H]1c1cccs1 ZINC000377386049 1023504350 /nfs/dbraw/zinc/50/43/50/1023504350.db2.gz LWZHUUPMJVUIDJ-WTTBNOFXSA-N 2 1 338.586 4.251 20 0 EIADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC000656786437 1023532919 /nfs/dbraw/zinc/53/29/19/1023532919.db2.gz MNUMTVRDIVJSBK-YPAWHYETSA-N 2 1 342.527 4.063 20 0 EIADMP COc1cccc(-c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)cc2)c1 ZINC000192904924 1023657503 /nfs/dbraw/zinc/65/75/03/1023657503.db2.gz DLXWLPXHQCKNHP-SEJPIABJSA-N 2 1 336.479 4.077 20 0 EIADMP COc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)cc1 ZINC000390546858 1023664877 /nfs/dbraw/zinc/66/48/77/1023664877.db2.gz IUKDYHSZWUJEPA-NRFANRHFSA-N 2 1 338.495 4.086 20 0 EIADMP COc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)cc1 ZINC000390546858 1023664881 /nfs/dbraw/zinc/66/48/81/1023664881.db2.gz IUKDYHSZWUJEPA-NRFANRHFSA-N 2 1 338.495 4.086 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OCC)c(OCC)c2)CC1 ZINC000236780729 1023703537 /nfs/dbraw/zinc/70/35/37/1023703537.db2.gz KDXRQXCFEGYTKD-INIZCTEOSA-N 2 1 334.504 4.009 20 0 EIADMP COc1ccccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390609497 1023719599 /nfs/dbraw/zinc/71/95/99/1023719599.db2.gz WLVMGDUBEOQWJB-NRFANRHFSA-N 2 1 338.495 4.086 20 0 EIADMP COc1ccccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390609497 1023719608 /nfs/dbraw/zinc/71/96/08/1023719608.db2.gz WLVMGDUBEOQWJB-NRFANRHFSA-N 2 1 338.495 4.086 20 0 EIADMP CC(C)C[C@H]([NH2+]CCc1c[nH+]cn1C)c1cccc(C(F)(F)F)c1 ZINC000471781773 1023839669 /nfs/dbraw/zinc/83/96/69/1023839669.db2.gz RFGPUHPPCZBARL-KRWDZBQOSA-N 2 1 339.405 4.358 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2cc3cnccc3o2)C[N@H+]1Cc1ccccc1 ZINC000651743246 1023964336 /nfs/dbraw/zinc/96/43/36/1023964336.db2.gz NHJUMPSJZARPAI-MJGOQNOKSA-N 2 1 349.478 4.218 20 0 EIADMP FC1(F)CC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000430750926 1024009643 /nfs/dbraw/zinc/00/96/43/1024009643.db2.gz QOJRTGZZCGJBAI-ZGXWSNOMSA-N 2 1 348.481 4.312 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)ccc1OC(C)C ZINC000341638205 1024078935 /nfs/dbraw/zinc/07/89/35/1024078935.db2.gz LBMVDAAZTDHTNM-MRXNPFEDSA-N 2 1 345.487 4.118 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCSC(F)(F)F)cc1 ZINC000178418745 1024109440 /nfs/dbraw/zinc/10/94/40/1024109440.db2.gz YRNNEXHWGASQEW-NSHDSACASA-N 2 1 329.391 4.084 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000301216791 1033193519 /nfs/dbraw/zinc/19/35/19/1033193519.db2.gz ZGYBRBIMGYDIHW-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@H]3C3CCC3)CC2)cs1 ZINC000510716714 1024303851 /nfs/dbraw/zinc/30/38/51/1024303851.db2.gz FPMVBCLEEMOXKI-RBUKOAKNSA-N 2 1 347.572 4.086 20 0 EIADMP CC(C)C[C@@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)c1ccc(F)cc1 ZINC000652150002 1024332359 /nfs/dbraw/zinc/33/23/59/1024332359.db2.gz IIGDHXFIZVGJQD-HXUWFJFHSA-N 2 1 348.506 4.148 20 0 EIADMP Cc1ccc2[nH]c(C[N@@H+]3CCC[C@H]([NH+]4CCCC4)CC3)cc2c1C ZINC000473132167 1024350461 /nfs/dbraw/zinc/35/04/61/1024350461.db2.gz LEXJTUWCQMDZET-IBGZPJMESA-N 2 1 325.500 4.235 20 0 EIADMP Cc1ccc2[nH]c(C[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)cc2c1C ZINC000473132167 1024350474 /nfs/dbraw/zinc/35/04/74/1024350474.db2.gz LEXJTUWCQMDZET-IBGZPJMESA-N 2 1 325.500 4.235 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000510735629 1024370609 /nfs/dbraw/zinc/37/06/09/1024370609.db2.gz ONUHUSMTAVQWHW-ZTFGCOKTSA-N 2 1 340.433 4.243 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000164610287 1024698231 /nfs/dbraw/zinc/69/82/31/1024698231.db2.gz HOYBOVRHRPCELC-KRWDZBQOSA-N 2 1 333.863 4.129 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cc(C)ccc1OC(F)F ZINC000164614281 1024702276 /nfs/dbraw/zinc/70/22/76/1024702276.db2.gz CZOAQLXTOXFIIP-CQSZACIVSA-N 2 1 337.414 4.232 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000341818569 1024777821 /nfs/dbraw/zinc/77/78/21/1024777821.db2.gz VUFUOPOGQZTOBV-KRWDZBQOSA-N 2 1 336.907 4.406 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481312 1024825533 /nfs/dbraw/zinc/82/55/33/1024825533.db2.gz MWFKQSDJOWAXQU-WFXMLNOXSA-N 2 1 337.511 4.205 20 0 EIADMP CS[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000548486107 1024835774 /nfs/dbraw/zinc/83/57/74/1024835774.db2.gz NUSRTGGYACPLJY-QXAKKESOSA-N 2 1 334.573 4.264 20 0 EIADMP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]CCCn2cc[nH+]c2C)cc1F ZINC000510931976 1024850929 /nfs/dbraw/zinc/85/09/29/1024850929.db2.gz UGXRTASUEFWWCK-PKOBYXMFSA-N 2 1 345.462 4.045 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3ccccc32)[C@H]1c1cccs1 ZINC000247972807 1024868258 /nfs/dbraw/zinc/86/82/58/1024868258.db2.gz HNFQAAFVRZQAHY-POAQFYNOSA-N 2 1 326.509 4.408 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3ccccc32)[C@H]1c1cccs1 ZINC000247972807 1024868260 /nfs/dbraw/zinc/86/82/60/1024868260.db2.gz HNFQAAFVRZQAHY-POAQFYNOSA-N 2 1 326.509 4.408 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccnc4ccccc34)C2)CC1 ZINC000535826697 1025075714 /nfs/dbraw/zinc/07/57/14/1025075714.db2.gz SCZQCVQVWPAHFG-LJQANCHMSA-N 2 1 337.511 4.179 20 0 EIADMP CSc1ccccc1C[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467334 1025399179 /nfs/dbraw/zinc/39/91/79/1025399179.db2.gz DWCAFYHQDXYNPX-SJLPKXTDSA-N 2 1 332.557 4.051 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)ccc1SC ZINC000663466989 1025401407 /nfs/dbraw/zinc/40/14/07/1025401407.db2.gz CIPIPSTWEQQFFB-WBVHZDCISA-N 2 1 348.556 4.190 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCCc3ccc(C)cc32)cn1 ZINC000166239634 1025533928 /nfs/dbraw/zinc/53/39/28/1025533928.db2.gz ZNCHAINOBIKZCH-HXUWFJFHSA-N 2 1 332.451 4.051 20 0 EIADMP CCCC[NH+](CCCC)CCCNC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167965865 1025541842 /nfs/dbraw/zinc/54/18/42/1025541842.db2.gz OFCLLJBPJOVBDM-FRIKZZABSA-N 2 1 349.607 4.274 20 0 EIADMP CCCC[NH+](CCCC)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167965865 1025541873 /nfs/dbraw/zinc/54/18/73/1025541873.db2.gz OFCLLJBPJOVBDM-FRIKZZABSA-N 3 1 349.607 4.274 20 0 EIADMP CCCC[NH+](CCCC)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167965865 1025541891 /nfs/dbraw/zinc/54/18/91/1025541891.db2.gz OFCLLJBPJOVBDM-FRIKZZABSA-N 3 1 349.607 4.274 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)Cc1ccc(Br)cc1 ZINC001167826187 1025620879 /nfs/dbraw/zinc/62/08/79/1025620879.db2.gz OLHITYHCIJGRBZ-HNNXBMFYSA-N 2 1 341.337 4.391 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1c1ccc(OC)c(OC)c1 ZINC001167825461 1025602256 /nfs/dbraw/zinc/60/22/56/1025602256.db2.gz JHQOVICCIUBRFH-IEBWSBKVSA-N 2 1 348.531 4.351 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(Cl)cc1F ZINC000925784314 1025642285 /nfs/dbraw/zinc/64/22/85/1025642285.db2.gz QSZBZIXOVDPAKX-IAQYHMDHSA-N 2 1 334.813 4.011 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+]1C[C@H]2[C@@H](C1)CCC[C@H]2OCC1CC1 ZINC001167827664 1025665572 /nfs/dbraw/zinc/66/55/72/1025665572.db2.gz UNZHZGIPXRADAH-FYZZASKESA-N 2 1 336.564 4.024 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2COc3ccccc32)cc1 ZINC000344011448 1025873507 /nfs/dbraw/zinc/87/35/07/1025873507.db2.gz DIWGPNSOEXWKQK-CRAIPNDOSA-N 2 1 333.435 4.008 20 0 EIADMP Cc1ccc2cc(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)ccc2n1 ZINC000187635057 1025873966 /nfs/dbraw/zinc/87/39/66/1025873966.db2.gz RKNGDCNYHNFKIT-UHFFFAOYSA-N 2 1 345.490 4.297 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cncs1 ZINC000157660755 1025912652 /nfs/dbraw/zinc/91/26/52/1025912652.db2.gz KDUIFGQGKPJALF-HOTGVXAUSA-N 2 1 329.513 4.368 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1cncs1 ZINC000157660755 1025912686 /nfs/dbraw/zinc/91/26/86/1025912686.db2.gz KDUIFGQGKPJALF-HOTGVXAUSA-N 2 1 329.513 4.368 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000431333174 1025920849 /nfs/dbraw/zinc/92/08/49/1025920849.db2.gz MWJLVVBLPPQEQJ-UTKZUKDTSA-N 2 1 342.527 4.099 20 0 EIADMP c1cc2cc(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)ccc2o1 ZINC000512096899 1025965408 /nfs/dbraw/zinc/96/54/08/1025965408.db2.gz AXMNPBNRQFZPNB-UHFFFAOYSA-N 2 1 334.463 4.230 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(Oc2cccnc2)cc1 ZINC000344090899 1025996666 /nfs/dbraw/zinc/99/66/66/1025996666.db2.gz JPIJOTDWBMGIDZ-FUHWJXTLSA-N 2 1 325.456 4.009 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000432447188 1026028575 /nfs/dbraw/zinc/02/85/75/1026028575.db2.gz OKURUDITGZEMKQ-ZIAGYGMSSA-N 2 1 345.314 4.145 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](CC)CC1)c1cc(F)cc(Br)c1 ZINC000344126967 1026038477 /nfs/dbraw/zinc/03/84/77/1026038477.db2.gz PNCRWKQESYVWES-MRXNPFEDSA-N 2 1 343.284 4.113 20 0 EIADMP Fc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)cc1 ZINC001167969903 1026041554 /nfs/dbraw/zinc/04/15/54/1026041554.db2.gz HQFXFMPPASFWAZ-OTYNDTSQSA-N 2 1 328.475 4.272 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccc(F)cc1F ZINC001167970831 1026048041 /nfs/dbraw/zinc/04/80/41/1026048041.db2.gz OMBBBDKUWBCBMZ-KVMCETHSSA-N 2 1 334.454 4.411 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(F)cc1F ZINC001167970831 1026048071 /nfs/dbraw/zinc/04/80/71/1026048071.db2.gz OMBBBDKUWBCBMZ-KVMCETHSSA-N 2 1 334.454 4.411 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(C)c(Br)s2)C1 ZINC000512130022 1026076697 /nfs/dbraw/zinc/07/66/97/1026076697.db2.gz MNMSTUIGANKHDT-QWHCGFSZSA-N 2 1 345.350 4.202 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCOc3c(C)cc(Cl)cc32)C1 ZINC000431347648 1026083464 /nfs/dbraw/zinc/08/34/64/1026083464.db2.gz GGIVQORIIKOZFS-CRAIPNDOSA-N 2 1 336.907 4.184 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000431350097 1026114573 /nfs/dbraw/zinc/11/45/73/1026114573.db2.gz NMLCYCFWEFKRIB-RYRKJORJSA-N 2 1 334.891 4.079 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000431350097 1026114580 /nfs/dbraw/zinc/11/45/80/1026114580.db2.gz NMLCYCFWEFKRIB-RYRKJORJSA-N 2 1 334.891 4.079 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(F)c(F)c2F)c1 ZINC000657332564 1026143647 /nfs/dbraw/zinc/14/36/47/1026143647.db2.gz JCRUAHBCONVJGO-UHFFFAOYSA-N 2 1 336.401 4.234 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(F)c(F)c2F)c1 ZINC000657332564 1026143657 /nfs/dbraw/zinc/14/36/57/1026143657.db2.gz JCRUAHBCONVJGO-UHFFFAOYSA-N 2 1 336.401 4.234 20 0 EIADMP CC(C)C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccccn1 ZINC001167974272 1026173161 /nfs/dbraw/zinc/17/31/61/1026173161.db2.gz TWMHDQHFKNYGQL-SMLSOGCJSA-N 2 1 327.516 4.164 20 0 EIADMP CC(C)C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccccn1 ZINC001167974272 1026173171 /nfs/dbraw/zinc/17/31/71/1026173171.db2.gz TWMHDQHFKNYGQL-SMLSOGCJSA-N 2 1 327.516 4.164 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3cccc4[nH]ccc43)C2)CC1 ZINC000512165857 1026192952 /nfs/dbraw/zinc/19/29/52/1026192952.db2.gz IBJLHYRGKYPQCJ-GOSISDBHSA-N 2 1 325.500 4.112 20 0 EIADMP COc1cccc(CCC[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC000303950946 1026296819 /nfs/dbraw/zinc/29/68/19/1026296819.db2.gz VRMRGZNYEFNSAA-FPOVZHCZSA-N 2 1 344.543 4.214 20 0 EIADMP COc1cccc(CCC[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC000303950946 1026296836 /nfs/dbraw/zinc/29/68/36/1026296836.db2.gz VRMRGZNYEFNSAA-FPOVZHCZSA-N 2 1 344.543 4.214 20 0 EIADMP COc1cccc(CCC[NH+]2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)c1 ZINC000303950946 1026296853 /nfs/dbraw/zinc/29/68/53/1026296853.db2.gz VRMRGZNYEFNSAA-FPOVZHCZSA-N 2 1 344.543 4.214 20 0 EIADMP Clc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)nc1 ZINC001167977518 1026332111 /nfs/dbraw/zinc/33/21/11/1026332111.db2.gz DDWJPQOJTZVYJV-AQDPXUSMSA-N 2 1 345.918 4.181 20 0 EIADMP Clc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)nc1 ZINC001167977518 1026332127 /nfs/dbraw/zinc/33/21/27/1026332127.db2.gz DDWJPQOJTZVYJV-AQDPXUSMSA-N 2 1 345.918 4.181 20 0 EIADMP CC(C)(Cc1cccc(F)c1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167977521 1026332658 /nfs/dbraw/zinc/33/26/58/1026332658.db2.gz DEKVHXXNPNFTAT-IHWFROFDSA-N 2 1 330.491 4.142 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cc(F)cc(F)c1 ZINC001167977903 1026341791 /nfs/dbraw/zinc/34/17/91/1026341791.db2.gz ITUTZYRVLDHYIX-RAFMOHDBSA-N 2 1 334.454 4.411 20 0 EIADMP CC[C@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)CC1 ZINC000657371230 1026351173 /nfs/dbraw/zinc/35/11/73/1026351173.db2.gz ONRUTSITGSNGBA-AZUAARDMSA-N 2 1 347.547 4.452 20 0 EIADMP CCc1nc(C)c([C@@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)s1 ZINC000163454163 1026372790 /nfs/dbraw/zinc/37/27/90/1026372790.db2.gz BTISSIAKBWSAIK-CQSZACIVSA-N 2 1 344.528 4.037 20 0 EIADMP CC(C)[N@@H+](Cc1ccc(CN2CCOCC2)cc1)C1CCCCC1 ZINC001167869491 1026382038 /nfs/dbraw/zinc/38/20/38/1026382038.db2.gz ZTAHDTJEUYFWRF-UHFFFAOYSA-N 2 1 330.516 4.062 20 0 EIADMP CC(C)[N@H+](Cc1ccc(C[NH+]2CCOCC2)cc1)C1CCCCC1 ZINC001167869491 1026382058 /nfs/dbraw/zinc/38/20/58/1026382058.db2.gz ZTAHDTJEUYFWRF-UHFFFAOYSA-N 2 1 330.516 4.062 20 0 EIADMP CC(C)[N@@H+](Cc1ccc(C[NH+]2CCOCC2)cc1)C1CCCCC1 ZINC001167869491 1026382071 /nfs/dbraw/zinc/38/20/71/1026382071.db2.gz ZTAHDTJEUYFWRF-UHFFFAOYSA-N 2 1 330.516 4.062 20 0 EIADMP C[C@H](Cc1ccc(O)cc1)[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000511095820 1026389042 /nfs/dbraw/zinc/38/90/42/1026389042.db2.gz XHRJHKSRFHVXPO-QZTJIDSGSA-N 2 1 338.495 4.138 20 0 EIADMP Fc1ccc([C@@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167982805 1026399064 /nfs/dbraw/zinc/39/90/64/1026399064.db2.gz AVWUYKNQKXMVTO-JKWVGCSGSA-N 2 1 328.475 4.368 20 0 EIADMP Fc1ccc([C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167982805 1026399080 /nfs/dbraw/zinc/39/90/80/1026399080.db2.gz AVWUYKNQKXMVTO-JKWVGCSGSA-N 2 1 328.475 4.368 20 0 EIADMP Fc1ccc([C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167982805 1026399097 /nfs/dbraw/zinc/39/90/97/1026399097.db2.gz AVWUYKNQKXMVTO-JKWVGCSGSA-N 2 1 328.475 4.368 20 0 EIADMP C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000337504048 1026528056 /nfs/dbraw/zinc/52/80/56/1026528056.db2.gz XTUTVWVSKUSHCS-WBVHZDCISA-N 2 1 327.447 4.299 20 0 EIADMP C[C@H]([NH2+]Cc1cc2ccncc2s1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000657430593 1026644756 /nfs/dbraw/zinc/64/47/56/1026644756.db2.gz RSQZTABUPRTFDR-HOCLYGCPSA-N 2 1 329.513 4.039 20 0 EIADMP CC(C)(C)OCCCC[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512293897 1026658388 /nfs/dbraw/zinc/65/83/88/1026658388.db2.gz NDFPYPUWRAAVBQ-JOCHJYFZSA-N 2 1 344.543 4.180 20 0 EIADMP CC(C)(C)OCCCC[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000512293897 1026658396 /nfs/dbraw/zinc/65/83/96/1026658396.db2.gz NDFPYPUWRAAVBQ-JOCHJYFZSA-N 2 1 344.543 4.180 20 0 EIADMP CC(C)(C)OCCCC[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000512293897 1026658407 /nfs/dbraw/zinc/65/84/07/1026658407.db2.gz NDFPYPUWRAAVBQ-JOCHJYFZSA-N 2 1 344.543 4.180 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2ccnc3ccccc32)CC1 ZINC000563361630 1026668103 /nfs/dbraw/zinc/66/81/03/1026668103.db2.gz NFENYKNYZVPLFB-LJQANCHMSA-N 2 1 337.511 4.289 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000119839950 1026686755 /nfs/dbraw/zinc/68/67/55/1026686755.db2.gz KCBSFTSUWBRKFM-INIZCTEOSA-N 2 1 335.451 4.349 20 0 EIADMP Cc1nc(-c2cc([C@@H](C)[NH2+]CCCn3cc[nH+]c3C)cs2)cs1 ZINC000338007689 1026704489 /nfs/dbraw/zinc/70/44/89/1026704489.db2.gz AUMMIBFRGOHYJZ-GFCCVEGCSA-N 2 1 346.525 4.426 20 0 EIADMP CC(C)Sc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000511151589 1026761748 /nfs/dbraw/zinc/76/17/48/1026761748.db2.gz VCGUVVMBLKZBJO-IBGZPJMESA-N 2 1 332.557 4.351 20 0 EIADMP CC(C)Sc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000511151589 1026761757 /nfs/dbraw/zinc/76/17/57/1026761757.db2.gz VCGUVVMBLKZBJO-IBGZPJMESA-N 2 1 332.557 4.351 20 0 EIADMP CC(C)Sc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1 ZINC000511151589 1026761770 /nfs/dbraw/zinc/76/17/70/1026761770.db2.gz VCGUVVMBLKZBJO-IBGZPJMESA-N 2 1 332.557 4.351 20 0 EIADMP CC(C)Sc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1 ZINC000511151589 1026761782 /nfs/dbraw/zinc/76/17/82/1026761782.db2.gz VCGUVVMBLKZBJO-IBGZPJMESA-N 2 1 332.557 4.351 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)C1 ZINC000507507630 1026820837 /nfs/dbraw/zinc/82/08/37/1026820837.db2.gz IOOLLBJQJRQTIL-YDZRNGNQSA-N 2 1 334.454 4.065 20 0 EIADMP Cc1nccn1CCC[N@H+](C)[C@@H](C)c1ccccc1Br ZINC000342859628 1026854093 /nfs/dbraw/zinc/85/40/93/1026854093.db2.gz JXTKFOBPLPYJJA-ZDUSSCGKSA-N 2 1 336.277 4.037 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1ccccc1Br ZINC000342859628 1026854103 /nfs/dbraw/zinc/85/41/03/1026854103.db2.gz JXTKFOBPLPYJJA-ZDUSSCGKSA-N 2 1 336.277 4.037 20 0 EIADMP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](CCc3ccncc3)CC2)c2ccccc21 ZINC000152871803 1026858777 /nfs/dbraw/zinc/85/87/77/1026858777.db2.gz AVNMKKTZVGXIQZ-JPYJTQIMSA-N 2 1 349.522 4.317 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000684953666 1026888911 /nfs/dbraw/zinc/88/89/11/1026888911.db2.gz QQSJSTXCMJWDET-XMSQKQJNSA-N 2 1 349.522 4.481 20 0 EIADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+][C@@H]1CCCc2cccnc21 ZINC000684958874 1026896175 /nfs/dbraw/zinc/89/61/75/1026896175.db2.gz YUASGSIJEIGGPV-DBXWQHBBSA-N 2 1 349.522 4.205 20 0 EIADMP C[C@@H](Cc1cccs1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582665311 1026915483 /nfs/dbraw/zinc/91/54/83/1026915483.db2.gz ZWWILIKGKPKDMH-PKOBYXMFSA-N 2 1 340.536 4.466 20 0 EIADMP C[C@@H](Cc1cccs1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582665311 1026915492 /nfs/dbraw/zinc/91/54/92/1026915492.db2.gz ZWWILIKGKPKDMH-PKOBYXMFSA-N 2 1 340.536 4.466 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2cccc3C)cn1 ZINC000153077727 1026982764 /nfs/dbraw/zinc/98/27/64/1026982764.db2.gz QNLDTEKJPMDGJQ-DNVCBOLYSA-N 2 1 332.451 4.222 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CC(C)(C)[NH+]2CCCCC2)cc1OC ZINC000474482838 1027117331 /nfs/dbraw/zinc/11/73/31/1027117331.db2.gz PKNQAJBWAPLRNZ-IAGOWNOFSA-N 2 1 348.531 4.050 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(CNc2c(C)c(C)[nH+]c3ccccc32)cn1 ZINC000302093880 1027216289 /nfs/dbraw/zinc/21/62/89/1027216289.db2.gz QYRJAUSYPOQPBK-UHFFFAOYSA-N 2 1 343.434 4.353 20 0 EIADMP CS[C@@H]1CCCC[NH+](C[C@@H](C)C[N@@H+]2CCCC[C@H](SC)C2)C1 ZINC000441136042 1027300460 /nfs/dbraw/zinc/30/04/60/1027300460.db2.gz UXTYYTNSAHFJQD-NNZMDNLPSA-N 2 1 344.634 4.058 20 0 EIADMP CS[C@@H]1CCCC[N@@H+](C[C@@H](C)C[NH+]2CCCC[C@H](SC)C2)C1 ZINC000441136042 1027300480 /nfs/dbraw/zinc/30/04/80/1027300480.db2.gz UXTYYTNSAHFJQD-NNZMDNLPSA-N 2 1 344.634 4.058 20 0 EIADMP CS[C@@H]1CCCC[N@H+](C[C@@H](C)C[NH+]2CCCC[C@H](SC)C2)C1 ZINC000441136042 1027300508 /nfs/dbraw/zinc/30/05/08/1027300508.db2.gz UXTYYTNSAHFJQD-NNZMDNLPSA-N 2 1 344.634 4.058 20 0 EIADMP C[C@H]1c2ccccc2C[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000657617677 1027312584 /nfs/dbraw/zinc/31/25/84/1027312584.db2.gz ZHNLPBFWLIVFJA-FDDCHVKYSA-N 2 1 334.507 4.012 20 0 EIADMP Cc1cc(NC[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302504979 1027324255 /nfs/dbraw/zinc/32/42/55/1027324255.db2.gz WBRVNHILBAMCQG-KDOFPFPSSA-N 2 1 333.838 4.287 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccccc1)Cc1ccc(F)cc1 ZINC000342860177 1027326990 /nfs/dbraw/zinc/32/69/90/1027326990.db2.gz OFXJHWRJLIUMFH-UHFFFAOYSA-N 2 1 337.442 4.423 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1 ZINC000342860177 1027327011 /nfs/dbraw/zinc/32/70/11/1027327011.db2.gz OFXJHWRJLIUMFH-UHFFFAOYSA-N 2 1 337.442 4.423 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000342858359 1027330418 /nfs/dbraw/zinc/33/04/18/1027330418.db2.gz DIZKKPMVCJCRRL-KRWDZBQOSA-N 2 1 348.288 4.181 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000342858359 1027330419 /nfs/dbraw/zinc/33/04/19/1027330419.db2.gz DIZKKPMVCJCRRL-KRWDZBQOSA-N 2 1 348.288 4.181 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)C[C@@H]1c1ccccc1 ZINC000453353988 1027421686 /nfs/dbraw/zinc/42/16/86/1027421686.db2.gz OABKIFVURGNWTK-NHCUHLMSSA-N 2 1 338.470 4.326 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)C[C@@H]1c1ccccc1 ZINC000453353988 1027421705 /nfs/dbraw/zinc/42/17/05/1027421705.db2.gz OABKIFVURGNWTK-NHCUHLMSSA-N 2 1 338.470 4.326 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000441331243 1027468924 /nfs/dbraw/zinc/46/89/24/1027468924.db2.gz NMXPITKARPHRJM-ZBFHGGJFSA-N 2 1 326.431 4.155 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC000441331243 1027468927 /nfs/dbraw/zinc/46/89/27/1027468927.db2.gz NMXPITKARPHRJM-ZBFHGGJFSA-N 2 1 326.431 4.155 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC000441331243 1027468931 /nfs/dbraw/zinc/46/89/31/1027468931.db2.gz NMXPITKARPHRJM-ZBFHGGJFSA-N 2 1 326.431 4.155 20 0 EIADMP Cc1cccc(C)c1OCCC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441391666 1027512851 /nfs/dbraw/zinc/51/28/51/1027512851.db2.gz BIJGRLVQHCEYQJ-TZIWHRDSSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441391666 1027512860 /nfs/dbraw/zinc/51/28/60/1027512860.db2.gz BIJGRLVQHCEYQJ-TZIWHRDSSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441391666 1027512873 /nfs/dbraw/zinc/51/28/73/1027512873.db2.gz BIJGRLVQHCEYQJ-TZIWHRDSSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441391666 1027512884 /nfs/dbraw/zinc/51/28/84/1027512884.db2.gz BIJGRLVQHCEYQJ-TZIWHRDSSA-N 2 1 342.527 4.021 20 0 EIADMP c1ccc2cc(CC[N@H+]3CC[C@@H]4[C@@H](CCCN4C4CC4)C3)ccc2c1 ZINC000441398270 1027520607 /nfs/dbraw/zinc/52/06/07/1027520607.db2.gz HDSPGEKHWRJJKG-JTHBVZDNSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[N@@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441398270 1027520620 /nfs/dbraw/zinc/52/06/20/1027520620.db2.gz HDSPGEKHWRJJKG-JTHBVZDNSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[N@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441398270 1027520636 /nfs/dbraw/zinc/52/06/36/1027520636.db2.gz HDSPGEKHWRJJKG-JTHBVZDNSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[NH+]3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)ccc2c1 ZINC000441398270 1027520641 /nfs/dbraw/zinc/52/06/41/1027520641.db2.gz HDSPGEKHWRJJKG-JTHBVZDNSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[NH+]3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)ccc2c1 ZINC000441398270 1027520657 /nfs/dbraw/zinc/52/06/57/1027520657.db2.gz HDSPGEKHWRJJKG-JTHBVZDNSA-N 2 1 334.507 4.331 20 0 EIADMP Cc1cc(C)cc(OCCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441400063 1027525508 /nfs/dbraw/zinc/52/55/08/1027525508.db2.gz ZAPWJDIBLAJDMK-SIKLNZKXSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441400063 1027525519 /nfs/dbraw/zinc/52/55/19/1027525519.db2.gz ZAPWJDIBLAJDMK-SIKLNZKXSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441400063 1027525535 /nfs/dbraw/zinc/52/55/35/1027525535.db2.gz ZAPWJDIBLAJDMK-SIKLNZKXSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000441400063 1027525544 /nfs/dbraw/zinc/52/55/44/1027525544.db2.gz ZAPWJDIBLAJDMK-SIKLNZKXSA-N 2 1 342.527 4.021 20 0 EIADMP c1cncc([C@@H]2CCC[C@@H]([NH2+][C@H]3CC[N@@H+](C4CCCCC4)C3)C2)c1 ZINC000657678221 1027526760 /nfs/dbraw/zinc/52/67/60/1027526760.db2.gz NXGDMGVWSFNLIM-RLLQIKCJSA-N 2 1 327.516 4.104 20 0 EIADMP c1cncc([C@@H]2CCC[C@@H]([NH2+][C@H]3CC[N@H+](C4CCCCC4)C3)C2)c1 ZINC000657678221 1027526771 /nfs/dbraw/zinc/52/67/71/1027526771.db2.gz NXGDMGVWSFNLIM-RLLQIKCJSA-N 2 1 327.516 4.104 20 0 EIADMP Cc1ccc(OCCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000441418645 1027536161 /nfs/dbraw/zinc/53/61/61/1027536161.db2.gz VJCLNCPTNWRQEA-SIKLNZKXSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000441418645 1027536172 /nfs/dbraw/zinc/53/61/72/1027536172.db2.gz VJCLNCPTNWRQEA-SIKLNZKXSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1C ZINC000441418645 1027536183 /nfs/dbraw/zinc/53/61/83/1027536183.db2.gz VJCLNCPTNWRQEA-SIKLNZKXSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1C ZINC000441418645 1027536192 /nfs/dbraw/zinc/53/61/92/1027536192.db2.gz VJCLNCPTNWRQEA-SIKLNZKXSA-N 2 1 342.527 4.021 20 0 EIADMP CC(C)OC1CCC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC000090771913 1027579438 /nfs/dbraw/zinc/57/94/38/1027579438.db2.gz SKMMJPBTTDFAOE-UHFFFAOYSA-N 2 1 344.543 4.019 20 0 EIADMP c1[nH+]c([C@H]2CCCN(c3cc[nH+]c4ccccc43)C2)n2c1CCCC2 ZINC000282014613 1027793868 /nfs/dbraw/zinc/79/38/68/1027793868.db2.gz VIIIPNFRKBNYKM-INIZCTEOSA-N 2 1 332.451 4.152 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccsc4)cc3)CC[C@@H]21 ZINC001167648117 1027841981 /nfs/dbraw/zinc/84/19/81/1027841981.db2.gz RIYKVYBVUJUIQP-ICSRJNTNSA-N 2 1 326.509 4.331 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(-c4ccsc4)cc3)CC[C@@H]21 ZINC001167648117 1027841984 /nfs/dbraw/zinc/84/19/84/1027841984.db2.gz RIYKVYBVUJUIQP-ICSRJNTNSA-N 2 1 326.509 4.331 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4ccsc4)cc3)CC[C@@H]21 ZINC001167648117 1027841986 /nfs/dbraw/zinc/84/19/86/1027841986.db2.gz RIYKVYBVUJUIQP-ICSRJNTNSA-N 2 1 326.509 4.331 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CC[N@H+](C(C)C)C1 ZINC000548786340 1027931866 /nfs/dbraw/zinc/93/18/66/1027931866.db2.gz KJQZTKGRJGTALY-KMPOOHAWSA-N 2 1 340.433 4.429 20 0 EIADMP Cc1csc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000583084073 1027969977 /nfs/dbraw/zinc/96/99/77/1027969977.db2.gz VEFRKIVWJFKLDE-GOSISDBHSA-N 2 1 326.509 4.343 20 0 EIADMP Cc1csc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000583084073 1027969995 /nfs/dbraw/zinc/96/99/95/1027969995.db2.gz VEFRKIVWJFKLDE-GOSISDBHSA-N 2 1 326.509 4.343 20 0 EIADMP CC[N@H+](Cc1c[nH]c2ccccc12)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000443859400 1028010342 /nfs/dbraw/zinc/01/03/42/1028010342.db2.gz YHXCZPDTPQSCDV-UHFFFAOYSA-N 2 1 345.450 4.079 20 0 EIADMP CCC[NH+]1CCC(Nc2cc[nH+]c3cc(Br)ccc23)CC1 ZINC000522566280 1028012701 /nfs/dbraw/zinc/01/27/01/1028012701.db2.gz BXOAZHOCNXZTED-UHFFFAOYSA-N 2 1 348.288 4.284 20 0 EIADMP c1ccc2c(c1)cccc2OCC[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000441453153 1028024690 /nfs/dbraw/zinc/02/46/90/1028024690.db2.gz XMLVHJLOAWDSNA-IBGZPJMESA-N 2 1 338.495 4.026 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150769371 1028048995 /nfs/dbraw/zinc/04/89/95/1028048995.db2.gz WKDZRVQOBNPRSP-LSDHHAIUSA-N 2 1 326.406 4.184 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000346187461 1028291877 /nfs/dbraw/zinc/29/18/77/1028291877.db2.gz WTXKXGPZAXAJJJ-UHFFFAOYSA-N 2 1 338.430 4.125 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000346168258 1028298219 /nfs/dbraw/zinc/29/82/19/1028298219.db2.gz ICEXEFHNUFNBJL-UHFFFAOYSA-N 2 1 348.425 4.004 20 0 EIADMP CC[N@@H+](CCc1cccs1)Cc1nc2c(s1)CN(C(C)C)CC2 ZINC000346165743 1028300795 /nfs/dbraw/zinc/30/07/95/1028300795.db2.gz FENGIZHYMVNKGR-UHFFFAOYSA-N 2 1 349.569 4.036 20 0 EIADMP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000280963621 1028311122 /nfs/dbraw/zinc/31/11/22/1028311122.db2.gz ZGTUYTMNSFGFMK-VDHUWJSZSA-N 2 1 338.417 4.168 20 0 EIADMP Cc1nn(-c2ccncc2)cc1CN1CC[C@H]1c1ccc(Cl)cc1 ZINC000346194040 1028317350 /nfs/dbraw/zinc/31/73/50/1028317350.db2.gz XOKNLNMVBZUERY-IBGZPJMESA-N 2 1 338.842 4.176 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(C(C)(C)C)cc2)[C@@H](C)C1 ZINC000523733322 1028342065 /nfs/dbraw/zinc/34/20/65/1028342065.db2.gz VVRWNXYVOJKGRP-RXVVDRJESA-N 2 1 346.559 4.211 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](CC(C)C)c2ccncc2)c1 ZINC000647288186 1028587838 /nfs/dbraw/zinc/58/78/38/1028587838.db2.gz RBRFYLCQLKYGDR-NRFANRHFSA-N 2 1 325.500 4.410 20 0 EIADMP COc1ccc([C@@H](CC(C)C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000647289982 1028653695 /nfs/dbraw/zinc/65/36/95/1028653695.db2.gz ROIHIWCHMAUNSZ-HXUWFJFHSA-N 2 1 329.488 4.357 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2nc(C)sc2C)cc1 ZINC000319815390 1028654206 /nfs/dbraw/zinc/65/42/06/1028654206.db2.gz LEDBQDSLIBKQJC-CQSZACIVSA-N 2 1 331.529 4.453 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CCC12CCOCC2 ZINC000548794488 1028697886 /nfs/dbraw/zinc/69/78/86/1028697886.db2.gz HYECITHUGVEMOS-NQIIRXRSSA-N 2 1 342.527 4.110 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc3cccnc32)CC[N@@H+]1Cc1ccccc1 ZINC000080338933 1028716073 /nfs/dbraw/zinc/71/60/73/1028716073.db2.gz IGFJWDKCVHPEHE-XMSQKQJNSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc3cccnc32)CC[N@H+]1Cc1ccccc1 ZINC000080338933 1028716094 /nfs/dbraw/zinc/71/60/94/1028716094.db2.gz IGFJWDKCVHPEHE-XMSQKQJNSA-N 2 1 345.490 4.378 20 0 EIADMP Clc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1Cl ZINC000281644671 1028822287 /nfs/dbraw/zinc/82/22/87/1028822287.db2.gz PEJBTUTTXLYPJY-KLHDSHLOSA-N 2 1 339.310 4.456 20 0 EIADMP CC[N@@H+](CCCN[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000650710351 1028847025 /nfs/dbraw/zinc/84/70/25/1028847025.db2.gz NFVCRNSBMKOVGK-IFMALSPDSA-N 2 1 343.559 4.114 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2sc(-c3ccccc3)nc2C)C1 ZINC000163286709 1028956369 /nfs/dbraw/zinc/95/63/69/1028956369.db2.gz KPILKJDLKVOZQB-HOCLYGCPSA-N 2 1 329.513 4.111 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000647302742 1029021200 /nfs/dbraw/zinc/02/12/00/1029021200.db2.gz PFMZVYUGWPSDPR-GOSISDBHSA-N 2 1 336.470 4.455 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000647302742 1029021218 /nfs/dbraw/zinc/02/12/18/1029021218.db2.gz PFMZVYUGWPSDPR-GOSISDBHSA-N 2 1 336.470 4.455 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCc3c2cccc3O)cc1 ZINC000130455118 1029182704 /nfs/dbraw/zinc/18/27/04/1029182704.db2.gz SFYZFYVIWWTWEY-XOBRGWDASA-N 2 1 333.435 4.224 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000469980249 1029205127 /nfs/dbraw/zinc/20/51/27/1029205127.db2.gz DVHXQSPCKUADKV-HOTGVXAUSA-N 2 1 329.513 4.111 20 0 EIADMP FC(F)(F)c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000524756821 1029205920 /nfs/dbraw/zinc/20/59/20/1029205920.db2.gz AKUJFBDJDOCDFP-MRXNPFEDSA-N 2 1 326.406 4.013 20 0 EIADMP FC(F)(F)c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000524756821 1029205933 /nfs/dbraw/zinc/20/59/33/1029205933.db2.gz AKUJFBDJDOCDFP-MRXNPFEDSA-N 2 1 326.406 4.013 20 0 EIADMP C[N@H+](Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CCC2CC2)CC1 ZINC000536204688 1029570832 /nfs/dbraw/zinc/57/08/32/1029570832.db2.gz PVEKIMOGBSRTMN-UHFFFAOYSA-N 2 1 340.433 4.402 20 0 EIADMP C[N@@H+](Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CCC2CC2)CC1 ZINC000536204688 1029570838 /nfs/dbraw/zinc/57/08/38/1029570838.db2.gz PVEKIMOGBSRTMN-UHFFFAOYSA-N 2 1 340.433 4.402 20 0 EIADMP COC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000347319990 1029618482 /nfs/dbraw/zinc/61/84/82/1029618482.db2.gz JGINQJRPRMRSIJ-UWJYYQICSA-N 2 1 349.478 4.089 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2cccc(OCc3ccccc3)c2)CC1 ZINC000446978211 1029657471 /nfs/dbraw/zinc/65/74/71/1029657471.db2.gz VSPGBAKBRLTZPF-SFHVURJKSA-N 2 1 338.495 4.401 20 0 EIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H](C)c2ccc(F)cc2)CC1 ZINC000447077296 1029687530 /nfs/dbraw/zinc/68/75/30/1029687530.db2.gz MYOXUQZNGKBYQL-INIZCTEOSA-N 2 1 328.431 4.176 20 0 EIADMP Brc1ccc2c(NC3CC[NH+](C4CC4)CC3)cc[nH+]c2c1 ZINC000301314042 1029705485 /nfs/dbraw/zinc/70/54/85/1029705485.db2.gz KYENMDLFSVSVCE-UHFFFAOYSA-N 2 1 346.272 4.036 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C1CC(CF)(CF)C1 ZINC000657838423 1029717796 /nfs/dbraw/zinc/71/77/96/1029717796.db2.gz SYEWLHLVSLTVPF-MRXNPFEDSA-N 2 1 336.470 4.238 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657839226 1029740798 /nfs/dbraw/zinc/74/07/98/1029740798.db2.gz PLEIZMJYRLJVNW-XHSDSOJGSA-N 2 1 339.474 4.428 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000657840122 1029756221 /nfs/dbraw/zinc/75/62/21/1029756221.db2.gz MGTNJZLLVVUNOZ-KURKYZTESA-N 2 1 340.433 4.243 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)s1 ZINC000708528738 1029813393 /nfs/dbraw/zinc/81/33/93/1029813393.db2.gz IGKGJNJDPDFCDV-GDBMZVCRSA-N 2 1 334.916 4.259 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(F)cc1Cl ZINC000708523249 1029814360 /nfs/dbraw/zinc/81/43/60/1029814360.db2.gz LNYFQECPRRPPNA-YJBOKZPZSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(F)cc1Cl ZINC000708523249 1029814361 /nfs/dbraw/zinc/81/43/61/1029814361.db2.gz LNYFQECPRRPPNA-YJBOKZPZSA-N 2 1 346.877 4.337 20 0 EIADMP CCc1ccc([C@H](CO)[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000090844065 1029870584 /nfs/dbraw/zinc/87/05/84/1029870584.db2.gz VTPNTRGOTUWVND-ZHRRBRCNSA-N 2 1 349.478 4.127 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)o1 ZINC000092071838 1029899187 /nfs/dbraw/zinc/89/91/87/1029899187.db2.gz WRPQTTZCAISSLK-HNNXBMFYSA-N 2 1 339.414 4.497 20 0 EIADMP CC[C@@H]1CCCC[C@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000181747260 1029912399 /nfs/dbraw/zinc/91/23/99/1029912399.db2.gz MPUMBANXNCPVBY-RTBURBONSA-N 2 1 333.520 4.062 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657867195 1029948215 /nfs/dbraw/zinc/94/82/15/1029948215.db2.gz KJUJATXCGMCYMJ-PKOBYXMFSA-N 2 1 349.478 4.043 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657867195 1029948239 /nfs/dbraw/zinc/94/82/39/1029948239.db2.gz KJUJATXCGMCYMJ-PKOBYXMFSA-N 2 1 349.478 4.043 20 0 EIADMP C[C@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)c1ccc(F)cn1 ZINC000092767897 1029950361 /nfs/dbraw/zinc/95/03/61/1029950361.db2.gz VMPIVZNMVKLLBV-ZACQAIPSSA-N 2 1 341.474 4.028 20 0 EIADMP C[C@H](C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874925 1030090781 /nfs/dbraw/zinc/09/07/81/1030090781.db2.gz RSMXODSGCRGHPK-MDYRTPRTSA-N 2 1 332.919 4.392 20 0 EIADMP C[C@H](C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874925 1030090794 /nfs/dbraw/zinc/09/07/94/1030090794.db2.gz RSMXODSGCRGHPK-MDYRTPRTSA-N 2 1 332.919 4.392 20 0 EIADMP C[C@H](C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874925 1030090811 /nfs/dbraw/zinc/09/08/11/1030090811.db2.gz RSMXODSGCRGHPK-MDYRTPRTSA-N 2 1 332.919 4.392 20 0 EIADMP FC(F)c1ccc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000525985507 1030171976 /nfs/dbraw/zinc/17/19/76/1030171976.db2.gz WVFGMOFIUXKSAD-LJQANCHMSA-N 2 1 344.449 4.278 20 0 EIADMP C[C@H](c1ccc(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1)C(F)(F)F ZINC000451066190 1030219517 /nfs/dbraw/zinc/21/95/17/1030219517.db2.gz BTWDZOIDUNLJKO-CRAIPNDOSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)cc1)C(F)(F)F ZINC000451066190 1030219534 /nfs/dbraw/zinc/21/95/34/1030219534.db2.gz BTWDZOIDUNLJKO-CRAIPNDOSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1)C(F)(F)F ZINC000451066190 1030219555 /nfs/dbraw/zinc/21/95/55/1030219555.db2.gz BTWDZOIDUNLJKO-CRAIPNDOSA-N 2 1 340.433 4.270 20 0 EIADMP Cc1cc(N2CCC(Oc3cc[nH+]cc3C)CC2)c2ccccc2[nH+]1 ZINC000447681666 1030270036 /nfs/dbraw/zinc/27/00/36/1030270036.db2.gz QKCQARHJVNXDPH-UHFFFAOYSA-N 2 1 333.435 4.294 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3csc(C(C)C)n3)CC2)[nH+]1 ZINC000186343247 1030277984 /nfs/dbraw/zinc/27/79/84/1030277984.db2.gz PYCGSTQQFYMMOX-OAHLLOKOSA-N 2 1 344.528 4.290 20 0 EIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(Br)cc1 ZINC000530371015 1030348013 /nfs/dbraw/zinc/34/80/13/1030348013.db2.gz DKKNNSFCEVBYGB-IGEOTXOUSA-N 2 1 337.305 4.117 20 0 EIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(-c2ccccc2F)s1 ZINC000530407359 1030377795 /nfs/dbraw/zinc/37/77/95/1030377795.db2.gz SJBSNLNYMMUZMF-ZDUSSCGKSA-N 2 1 329.444 4.181 20 0 EIADMP Cc1ccc([C@H](Cc2ccccc2)[NH2+]CCc2c[nH+]cn2C)cc1C ZINC000530407451 1030380280 /nfs/dbraw/zinc/38/02/80/1030380280.db2.gz ZRRTWOMHYPTLFD-QFIPXVFZSA-N 2 1 333.479 4.153 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+]C(CCc1ccccc1)CCc1ccccc1 ZINC000530460505 1030437886 /nfs/dbraw/zinc/43/78/86/1030437886.db2.gz YWSULCBYUWMEBV-UHFFFAOYSA-N 2 1 347.506 4.186 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)c2cccc(CO)c2)CC1 ZINC000121857040 1030461834 /nfs/dbraw/zinc/46/18/34/1030461834.db2.gz GHVJHCXJVAJRRL-ZWKOTPCHSA-N 2 1 338.495 4.055 20 0 EIADMP C[C@@H](CCSc1ccccc1)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000431607619 1030473829 /nfs/dbraw/zinc/47/38/29/1030473829.db2.gz IIYDPFJVKASULJ-HKUYNNGSSA-N 2 1 332.557 4.221 20 0 EIADMP C[C@@H](CCSc1ccccc1)[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000431607619 1030473842 /nfs/dbraw/zinc/47/38/42/1030473842.db2.gz IIYDPFJVKASULJ-HKUYNNGSSA-N 2 1 332.557 4.221 20 0 EIADMP C[C@@H](CCSc1ccccc1)[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000431607619 1030473850 /nfs/dbraw/zinc/47/38/50/1030473850.db2.gz IIYDPFJVKASULJ-HKUYNNGSSA-N 2 1 332.557 4.221 20 0 EIADMP C[C@H](CCSc1ccccc1)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000431607621 1030473968 /nfs/dbraw/zinc/47/39/68/1030473968.db2.gz IIYDPFJVKASULJ-MJGOQNOKSA-N 2 1 332.557 4.221 20 0 EIADMP C[C@H](CCSc1ccccc1)[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000431607621 1030473974 /nfs/dbraw/zinc/47/39/74/1030473974.db2.gz IIYDPFJVKASULJ-MJGOQNOKSA-N 2 1 332.557 4.221 20 0 EIADMP C[C@H](CCSc1ccccc1)[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000431607621 1030473983 /nfs/dbraw/zinc/47/39/83/1030473983.db2.gz IIYDPFJVKASULJ-MJGOQNOKSA-N 2 1 332.557 4.221 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C[C@H](C)c2ccc(F)cc2)CC1 ZINC000527115846 1030500023 /nfs/dbraw/zinc/50/00/23/1030500023.db2.gz PRUYJMPROBUWGZ-SFHVURJKSA-N 2 1 340.486 4.492 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000398107407 1030698640 /nfs/dbraw/zinc/69/86/40/1030698640.db2.gz BYHHGMZJGWHUQN-URZJWIJPSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000398107407 1030698649 /nfs/dbraw/zinc/69/86/49/1030698649.db2.gz BYHHGMZJGWHUQN-URZJWIJPSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCc2c1cccc2F ZINC000398131413 1030710584 /nfs/dbraw/zinc/71/05/84/1030710584.db2.gz JQSJITNNAOJIFK-HVETUWLQSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCc2c1cccc2F ZINC000398131413 1030710603 /nfs/dbraw/zinc/71/06/03/1030710603.db2.gz JQSJITNNAOJIFK-HVETUWLQSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccc(Br)s1 ZINC000527489951 1030724565 /nfs/dbraw/zinc/72/45/65/1030724565.db2.gz XWPKZRUHKOAVLO-NEPJUHHUSA-N 2 1 331.323 4.036 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(Br)s1 ZINC000527489951 1030724579 /nfs/dbraw/zinc/72/45/79/1030724579.db2.gz XWPKZRUHKOAVLO-NEPJUHHUSA-N 2 1 331.323 4.036 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccc(Br)s1 ZINC000527489952 1030725297 /nfs/dbraw/zinc/72/52/97/1030725297.db2.gz XWPKZRUHKOAVLO-VXGBXAGGSA-N 2 1 331.323 4.036 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(Br)s1 ZINC000527489952 1030725315 /nfs/dbraw/zinc/72/53/15/1030725315.db2.gz XWPKZRUHKOAVLO-VXGBXAGGSA-N 2 1 331.323 4.036 20 0 EIADMP CN1CC[C@@H](C[N@@H+](C)Cc2cccc3ccccc32)[C@@H]1c1cccnc1 ZINC000448336763 1030748322 /nfs/dbraw/zinc/74/83/22/1030748322.db2.gz HWQCVXVBGNMTRQ-GMAHTHKFSA-N 2 1 345.490 4.360 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(C(F)F)nc1 ZINC000657999297 1030768786 /nfs/dbraw/zinc/76/87/86/1030768786.db2.gz TXCYQKJMBFALSV-WBVHZDCISA-N 2 1 345.437 4.192 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@H]21)c1ccccn1 ZINC000658066532 1030813840 /nfs/dbraw/zinc/81/38/40/1030813840.db2.gz MJXQFIANKRHLSJ-IYSOMAHNSA-N 2 1 349.522 4.218 20 0 EIADMP CCC(CC)(C[NH2+][C@@H]1CCC12CCOCC2)[NH2+][C@H](C)c1ccccc1 ZINC000548859479 1030820380 /nfs/dbraw/zinc/82/03/80/1030820380.db2.gz JOBALWFAWQKZAL-UYAOXDASSA-N 2 1 344.543 4.445 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)c1 ZINC000658210001 1030883703 /nfs/dbraw/zinc/88/37/03/1030883703.db2.gz STMJUKSRYSHICC-QAPCUYQASA-N 2 1 336.545 4.027 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cccnc1 ZINC000658320510 1030985686 /nfs/dbraw/zinc/98/56/86/1030985686.db2.gz YWLGNKGGFLMZFN-WIYYLYMNSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCc3cccnc3CC2)CC1 ZINC000421830392 1031036463 /nfs/dbraw/zinc/03/64/63/1031036463.db2.gz JUUDDVRAZPSZLW-GHTZIAJQSA-N 2 1 349.522 4.144 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2ccccc2OC(F)(F)F)CC1 ZINC000532451944 1031084681 /nfs/dbraw/zinc/08/46/81/1031084681.db2.gz KECAHKFBKUZKGV-CQSZACIVSA-N 2 1 344.421 4.356 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc3cccnc32)C[C@@H]1c1ccccc1 ZINC000340213235 1031191038 /nfs/dbraw/zinc/19/10/38/1031191038.db2.gz VDTBZFZNZFNWFT-LEWJYISDSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cccc3cccnc32)C[C@@H]1c1ccccc1 ZINC000340213235 1031191045 /nfs/dbraw/zinc/19/10/45/1031191045.db2.gz VDTBZFZNZFNWFT-LEWJYISDSA-N 2 1 331.463 4.160 20 0 EIADMP Cc1csc(CCCC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)n1 ZINC000340226448 1031197671 /nfs/dbraw/zinc/19/76/71/1031197671.db2.gz QPWKZNZDZPKPPB-OALUTQOASA-N 2 1 343.540 4.199 20 0 EIADMP Cc1csc(CCCC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)n1 ZINC000340226448 1031197696 /nfs/dbraw/zinc/19/76/96/1031197696.db2.gz QPWKZNZDZPKPPB-OALUTQOASA-N 2 1 343.540 4.199 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)c(OCCC)c1 ZINC000532505310 1031224014 /nfs/dbraw/zinc/22/40/14/1031224014.db2.gz AWDAVHVZWRZAKF-ZWKOTPCHSA-N 2 1 348.531 4.257 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)c(OCCC)c1 ZINC000532505310 1031224031 /nfs/dbraw/zinc/22/40/31/1031224031.db2.gz AWDAVHVZWRZAKF-ZWKOTPCHSA-N 2 1 348.531 4.257 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000532492414 1031233307 /nfs/dbraw/zinc/23/33/07/1031233307.db2.gz ZRCGIYYLZLTYAI-OAHLLOKOSA-N 2 1 339.414 4.474 20 0 EIADMP CCC(CC)(CN[C@@H]1C[C@H](C)[N@@H+](C)C[C@H]1C)[NH2+][C@@H](C)c1ccccc1 ZINC000532517025 1031247695 /nfs/dbraw/zinc/24/76/95/1031247695.db2.gz MAWIRKASXQLFEJ-XODKDNOYSA-N 2 1 345.575 4.214 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2cc(F)ccc2F)cc1 ZINC000532550461 1031264065 /nfs/dbraw/zinc/26/40/65/1031264065.db2.gz LWZHZJMLVUGXBK-CQSZACIVSA-N 2 1 341.405 4.352 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cc3cccnc3o2)CC1 ZINC000449038147 1031378223 /nfs/dbraw/zinc/37/82/23/1031378223.db2.gz RXBITQALKOWGSL-KRWDZBQOSA-N 2 1 341.499 4.304 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000532626173 1031441071 /nfs/dbraw/zinc/44/10/71/1031441071.db2.gz MCVBXDINYMBSLK-SJORKVTESA-N 2 1 343.540 4.350 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000532626173 1031441083 /nfs/dbraw/zinc/44/10/83/1031441083.db2.gz MCVBXDINYMBSLK-SJORKVTESA-N 2 1 343.540 4.350 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000532626173 1031441099 /nfs/dbraw/zinc/44/10/99/1031441099.db2.gz MCVBXDINYMBSLK-SJORKVTESA-N 2 1 343.540 4.350 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CSCCc3ccccc32)C1 ZINC000531681413 1031474539 /nfs/dbraw/zinc/47/45/39/1031474539.db2.gz VHWIFIOIVVOQKZ-FXAWDEMLSA-N 2 1 332.557 4.119 20 0 EIADMP COc1cc(F)cc(C[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)c1 ZINC000449150642 1031484118 /nfs/dbraw/zinc/48/41/18/1031484118.db2.gz SEEOFOURPZNISB-INIZCTEOSA-N 2 1 342.458 4.150 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1cccc(OC)c1 ZINC000123910662 1031491648 /nfs/dbraw/zinc/49/16/48/1031491648.db2.gz YNSPASMOJZOVDZ-NRFANRHFSA-N 2 1 326.484 4.388 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)c1cccc(C(F)(F)F)c1 ZINC000531710562 1031497604 /nfs/dbraw/zinc/49/76/04/1031497604.db2.gz ZCYGXQBPVUCTLM-CKEIUWERSA-N 2 1 342.449 4.301 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@@H]3CCCC34CCCCC4)CC2)nc(C)[nH+]1 ZINC000449228319 1031558012 /nfs/dbraw/zinc/55/80/12/1031558012.db2.gz YABGQFIYBMAYCE-LJQANCHMSA-N 2 1 342.531 4.155 20 0 EIADMP CC(C)[N@@H+](C)CCCN[C@@H](C)c1ccc(Oc2ccccc2)cn1 ZINC000453088991 1031579614 /nfs/dbraw/zinc/57/96/14/1031579614.db2.gz ZSIXXJVXYLWSAB-KRWDZBQOSA-N 2 1 327.472 4.255 20 0 EIADMP C[C@@H](C[N@@H+](Cc1ccco1)C1CCN(C)CC1)c1cc(F)cc(F)c1 ZINC000449331211 1031625914 /nfs/dbraw/zinc/62/59/14/1031625914.db2.gz NRPJZEYWUKJVIL-HNNXBMFYSA-N 2 1 348.437 4.258 20 0 EIADMP CCC[C@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C1CCC1 ZINC000453133192 1031637275 /nfs/dbraw/zinc/63/72/75/1031637275.db2.gz YGTDHNBPTPVJCI-IBGZPJMESA-N 2 1 333.520 4.062 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CCCc3ccccn3)[C@@H]3CCC[C@@H]32)cc1 ZINC000453163299 1031665330 /nfs/dbraw/zinc/66/53/30/1031665330.db2.gz PXXDVVCJCTYYCO-VABKMULXSA-N 2 1 349.522 4.047 20 0 EIADMP COc1cccc([C@@H]2C[N@H+](CCCCn3cc[nH+]c3C)CC2(C)C)c1 ZINC000528627556 1031703322 /nfs/dbraw/zinc/70/33/22/1031703322.db2.gz VWOACJOSCJGKSN-FQEVSTJZSA-N 2 1 341.499 4.106 20 0 EIADMP COc1cccc([C@@H]2C[N@@H+](CCCCn3cc[nH+]c3C)CC2(C)C)c1 ZINC000528627556 1031703342 /nfs/dbraw/zinc/70/33/42/1031703342.db2.gz VWOACJOSCJGKSN-FQEVSTJZSA-N 2 1 341.499 4.106 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccc(F)cc1 ZINC000128214506 1031731500 /nfs/dbraw/zinc/73/15/00/1031731500.db2.gz JXGDPBQYMBIPGJ-LJQANCHMSA-N 2 1 327.447 4.239 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000459345053 1031869387 /nfs/dbraw/zinc/86/93/87/1031869387.db2.gz JAPPZKJNUQIVPG-GOSISDBHSA-N 2 1 338.495 4.054 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[N@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000459345053 1031869390 /nfs/dbraw/zinc/86/93/90/1031869390.db2.gz JAPPZKJNUQIVPG-GOSISDBHSA-N 2 1 338.495 4.054 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2cc(F)cc(F)c2)cc1 ZINC000531963532 1031883325 /nfs/dbraw/zinc/88/33/25/1031883325.db2.gz OWNKXILHMJJZQB-AWEZNQCLSA-N 2 1 341.405 4.352 20 0 EIADMP COc1ccc([C@H]2CCCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1F ZINC000453359685 1031889411 /nfs/dbraw/zinc/88/94/11/1031889411.db2.gz QFNHWAAPNACHMS-CMOVJTKZSA-N 2 1 346.490 4.075 20 0 EIADMP Cc1cc(C)c(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)cn1 ZINC000453383512 1031892433 /nfs/dbraw/zinc/89/24/33/1031892433.db2.gz YZTUHIAUNIZJLO-UHFFFAOYSA-N 2 1 337.511 4.231 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000531980846 1031925347 /nfs/dbraw/zinc/92/53/47/1031925347.db2.gz WOLAVFKONUKRRB-KCQAQPDRSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000531980846 1031925357 /nfs/dbraw/zinc/92/53/57/1031925357.db2.gz WOLAVFKONUKRRB-KCQAQPDRSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000531980846 1031925364 /nfs/dbraw/zinc/92/53/64/1031925364.db2.gz WOLAVFKONUKRRB-KCQAQPDRSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000531980846 1031925376 /nfs/dbraw/zinc/92/53/76/1031925376.db2.gz WOLAVFKONUKRRB-KCQAQPDRSA-N 2 1 347.503 4.391 20 0 EIADMP CCN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000531980184 1031929333 /nfs/dbraw/zinc/92/93/33/1031929333.db2.gz AOEPSNZGRMTPHM-XMSQKQJNSA-N 2 1 337.511 4.274 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)cc1 ZINC000453417281 1031951330 /nfs/dbraw/zinc/95/13/30/1031951330.db2.gz KCOWSAHJEAKWAT-NVXWUHKLSA-N 2 1 327.472 4.037 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H](Cc1ccccc1)c1ccccc1 ZINC000531993768 1031960717 /nfs/dbraw/zinc/96/07/17/1031960717.db2.gz LEIBZYUZJOKJCW-DAVBRLECSA-N 2 1 336.523 4.331 20 0 EIADMP C[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1cccc(C[NH+](C)C)c1 ZINC000925282278 1031965279 /nfs/dbraw/zinc/96/52/79/1031965279.db2.gz FBQAQIJGUGEGKZ-CQSZACIVSA-N 2 1 341.480 4.316 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+]C[C@@H]3C(C)=CCC[C@@H]3C)CC2)oc1C ZINC000134186683 1031993464 /nfs/dbraw/zinc/99/34/64/1031993464.db2.gz RDOAYLQZCNPGCZ-OXJNMPFZSA-N 2 1 345.531 4.085 20 0 EIADMP CC(C)(C)c1cccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001168264686 1032026054 /nfs/dbraw/zinc/02/60/54/1032026054.db2.gz LTKYTYDHUCOSQM-RXVVDRJESA-N 2 1 326.528 4.433 20 0 EIADMP CC(C)(C)c1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001168264686 1032026066 /nfs/dbraw/zinc/02/60/66/1032026066.db2.gz LTKYTYDHUCOSQM-RXVVDRJESA-N 2 1 326.528 4.433 20 0 EIADMP CC(C)(C)c1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001168264686 1032026084 /nfs/dbraw/zinc/02/60/84/1032026084.db2.gz LTKYTYDHUCOSQM-RXVVDRJESA-N 2 1 326.528 4.433 20 0 EIADMP CCc1nc(C(C)C)ccc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000549860678 1033327831 /nfs/dbraw/zinc/32/78/31/1033327831.db2.gz RFYYPBPXUMFMEH-GOSISDBHSA-N 2 1 329.532 4.075 20 0 EIADMP CCc1nc(C(C)C)ccc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000549860678 1033327849 /nfs/dbraw/zinc/32/78/49/1033327849.db2.gz RFYYPBPXUMFMEH-GOSISDBHSA-N 2 1 329.532 4.075 20 0 EIADMP CC(C)[C@H]([NH2+]CCCc1c[nH+]cn1C)c1ccc(C(F)(F)F)cc1 ZINC000575932152 1033748757 /nfs/dbraw/zinc/74/87/57/1033748757.db2.gz CLAJMDLDCLDARG-KRWDZBQOSA-N 2 1 339.405 4.358 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512741790 1033840558 /nfs/dbraw/zinc/84/05/58/1033840558.db2.gz ZPKISUWAQYTNPN-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512741790 1033840562 /nfs/dbraw/zinc/84/05/62/1033840562.db2.gz ZPKISUWAQYTNPN-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512741790 1033840563 /nfs/dbraw/zinc/84/05/63/1033840563.db2.gz ZPKISUWAQYTNPN-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512741790 1033840567 /nfs/dbraw/zinc/84/05/67/1033840567.db2.gz ZPKISUWAQYTNPN-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP Cc1c(Br)cccc1C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000576412187 1034541150 /nfs/dbraw/zinc/54/11/50/1034541150.db2.gz LFFXXIQMMUGFGE-UHFFFAOYSA-N 2 1 339.321 4.110 20 0 EIADMP Clc1ccc(CC[N@H+]2CCCC3(CC[NH2+]CC3)C2)c(Cl)c1 ZINC001204727664 1034716609 /nfs/dbraw/zinc/71/66/09/1034716609.db2.gz IVDBXWHJPASBSO-UHFFFAOYSA-N 2 1 327.299 4.002 20 0 EIADMP Cc1nc(C)c(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)s1 ZINC000513493701 1034985235 /nfs/dbraw/zinc/98/52/35/1034985235.db2.gz CDCMRPVIUGMDNV-HNAYVOBHSA-N 2 1 343.540 4.150 20 0 EIADMP Cc1nccn1CCC[N@H+](C)C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000501031006 1035348608 /nfs/dbraw/zinc/34/86/08/1035348608.db2.gz IKQKBLZOPAAIMI-AWEZNQCLSA-N 2 1 339.405 4.336 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000501031006 1035348611 /nfs/dbraw/zinc/34/86/11/1035348611.db2.gz IKQKBLZOPAAIMI-AWEZNQCLSA-N 2 1 339.405 4.336 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000501031006 1035348614 /nfs/dbraw/zinc/34/86/14/1035348614.db2.gz IKQKBLZOPAAIMI-AWEZNQCLSA-N 2 1 339.405 4.336 20 0 EIADMP CC[C@@H](C)[NH+]1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000501033520 1035360900 /nfs/dbraw/zinc/36/09/00/1035360900.db2.gz UEMFHIQWMMBPNQ-CQSZACIVSA-N 2 1 328.422 4.400 20 0 EIADMP CC[C@@H](C)[NH+]1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000501033520 1035360906 /nfs/dbraw/zinc/36/09/06/1035360906.db2.gz UEMFHIQWMMBPNQ-CQSZACIVSA-N 2 1 328.422 4.400 20 0 EIADMP C[N@H+](C[C@H]1CC[NH2+]C1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000647890780 1035393866 /nfs/dbraw/zinc/39/38/66/1035393866.db2.gz RGEXVLPMSSQZMA-IFXJQAMLSA-N 2 1 332.850 4.110 20 0 EIADMP C[N@@H+](C[C@H]1CC[NH2+]C1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000647890780 1035393870 /nfs/dbraw/zinc/39/38/70/1035393870.db2.gz RGEXVLPMSSQZMA-IFXJQAMLSA-N 2 1 332.850 4.110 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2ccc(F)cc2)s1 ZINC000509944575 1035431279 /nfs/dbraw/zinc/43/12/79/1035431279.db2.gz PEEHWEMONRSPRC-UHFFFAOYSA-N 2 1 329.444 4.239 20 0 EIADMP C[N@@H+](CCC[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1)C1CCCCC1 ZINC000501379490 1035436589 /nfs/dbraw/zinc/43/65/89/1035436589.db2.gz BBZVFUPJFKATMS-AZUAARDMSA-N 2 1 329.532 4.352 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000501423739 1035443374 /nfs/dbraw/zinc/44/33/74/1035443374.db2.gz OJDHFAZUHJSFJS-SFKKXYGYSA-N 2 1 340.433 4.430 20 0 EIADMP C[C@@H]1CCC[C@](C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)([NH+](C)C)C1 ZINC000501466975 1035449077 /nfs/dbraw/zinc/44/90/77/1035449077.db2.gz MEJQJPDWNCIPCX-ZFMNYDKASA-N 2 1 329.532 4.208 20 0 EIADMP C[C@@H]1CCC[C@](C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)([NH+](C)C)C1 ZINC000501466974 1035449801 /nfs/dbraw/zinc/44/98/01/1035449801.db2.gz MEJQJPDWNCIPCX-UKAVVXHISA-N 2 1 329.532 4.208 20 0 EIADMP COc1ccccc1-c1ccc([C@@H](C)[N@@H+](C)CC[C@H]2CC[NH2+]C2)cc1 ZINC000420294552 1035492901 /nfs/dbraw/zinc/49/29/01/1035492901.db2.gz BBEGUNNBGNMCFG-QZTJIDSGSA-N 2 1 338.495 4.355 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420283195 1035497591 /nfs/dbraw/zinc/49/75/91/1035497591.db2.gz BSEMODCKBXHAOC-IVMMDQJWSA-N 2 1 347.890 4.424 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420283195 1035497594 /nfs/dbraw/zinc/49/75/94/1035497594.db2.gz BSEMODCKBXHAOC-IVMMDQJWSA-N 2 1 347.890 4.424 20 0 EIADMP c1ccc(C[N@H+](Cc2cccc3ccccc32)[C@@H]2CCC[NH2+]CC2)nc1 ZINC000420307500 1035506544 /nfs/dbraw/zinc/50/65/44/1035506544.db2.gz ISGKJUYZYGATNQ-JOCHJYFZSA-N 2 1 345.490 4.379 20 0 EIADMP c1ccc(C[N@@H+](Cc2cccc3ccccc32)[C@@H]2CCC[NH2+]CC2)nc1 ZINC000420307500 1035506556 /nfs/dbraw/zinc/50/65/56/1035506556.db2.gz ISGKJUYZYGATNQ-JOCHJYFZSA-N 2 1 345.490 4.379 20 0 EIADMP [NH3+]C[C@@H]1C[N@H+]([C@H]2CCc3c2cccc3Cl)C[C@H]1c1ccccc1 ZINC000420315844 1035511185 /nfs/dbraw/zinc/51/11/85/1035511185.db2.gz MVQOMNXGDPLRQU-BPAFIMBUSA-N 2 1 326.871 4.002 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420326863 1035530001 /nfs/dbraw/zinc/53/00/01/1035530001.db2.gz XSWMONHUSDQKKZ-IRXDYDNUSA-N 2 1 343.540 4.419 20 0 EIADMP CSCC1(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000595065891 1035545244 /nfs/dbraw/zinc/54/52/44/1035545244.db2.gz FWBZSBOXOLZYKV-ACDBMABISA-N 2 1 344.568 4.305 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000568930876 1035852476 /nfs/dbraw/zinc/85/24/76/1035852476.db2.gz PRSYYIDLNZSYOX-UZLBHIALSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2F)CC[N@H+]1Cc1ccccc1 ZINC000568930876 1035852484 /nfs/dbraw/zinc/85/24/84/1035852484.db2.gz PRSYYIDLNZSYOX-UZLBHIALSA-N 2 1 344.449 4.150 20 0 EIADMP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)C1 ZINC000571700904 1036131976 /nfs/dbraw/zinc/13/19/76/1036131976.db2.gz BOEPSEZGMPATGM-BZUAXINKSA-N 2 1 345.487 4.186 20 0 EIADMP COc1ccc(C2CCC([NH2+]C[C@H]3CC[N@H+](C(C)C)C3)CC2)cc1 ZINC000571807296 1036260331 /nfs/dbraw/zinc/26/03/31/1036260331.db2.gz XWHHSHZXOHLBSZ-PGYGNJIDSA-N 2 1 330.516 4.041 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)oc1C ZINC000502708263 1036546506 /nfs/dbraw/zinc/54/65/06/1036546506.db2.gz OVGFYDXPYWWLPT-PXNSSMCTSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)oc1C ZINC000502708263 1036546540 /nfs/dbraw/zinc/54/65/40/1036546540.db2.gz OVGFYDXPYWWLPT-PXNSSMCTSA-N 2 1 326.484 4.112 20 0 EIADMP C[C@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526520 1036784912 /nfs/dbraw/zinc/78/49/12/1036784912.db2.gz HHOKKCMPDOCUNR-KSSFIOAISA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526520 1036784919 /nfs/dbraw/zinc/78/49/19/1036784919.db2.gz HHOKKCMPDOCUNR-KSSFIOAISA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526520 1036784925 /nfs/dbraw/zinc/78/49/25/1036784925.db2.gz HHOKKCMPDOCUNR-KSSFIOAISA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526515 1036785588 /nfs/dbraw/zinc/78/55/88/1036785588.db2.gz HHOKKCMPDOCUNR-KBXCAEBGSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526515 1036785607 /nfs/dbraw/zinc/78/56/07/1036785607.db2.gz HHOKKCMPDOCUNR-KBXCAEBGSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526515 1036785622 /nfs/dbraw/zinc/78/56/22/1036785622.db2.gz HHOKKCMPDOCUNR-KBXCAEBGSA-N 2 1 332.488 4.326 20 0 EIADMP COc1ccc([C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C2CC2)c(F)c1 ZINC000421832447 1036792905 /nfs/dbraw/zinc/79/29/05/1036792905.db2.gz MPBSILVIYXDJPH-NRFANRHFSA-N 2 1 346.490 4.282 20 0 EIADMP COC1([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)CCCC1 ZINC000421835583 1036794646 /nfs/dbraw/zinc/79/46/46/1036794646.db2.gz PZMVNCQKLWIDBS-LZLYRXPVSA-N 2 1 336.545 4.068 20 0 EIADMP COC1([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CCCC1 ZINC000421835583 1036794659 /nfs/dbraw/zinc/79/46/59/1036794659.db2.gz PZMVNCQKLWIDBS-LZLYRXPVSA-N 2 1 336.545 4.068 20 0 EIADMP CC[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1(SC)CCC1 ZINC000589503844 1036804535 /nfs/dbraw/zinc/80/45/35/1036804535.db2.gz YBSNPHSYFPEUOM-LJQANCHMSA-N 2 1 332.557 4.116 20 0 EIADMP CC[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC1(SC)CCC1 ZINC000589503844 1036804536 /nfs/dbraw/zinc/80/45/36/1036804536.db2.gz YBSNPHSYFPEUOM-LJQANCHMSA-N 2 1 332.557 4.116 20 0 EIADMP CC[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC1(SC)CCC1 ZINC000589503844 1036804538 /nfs/dbraw/zinc/80/45/38/1036804538.db2.gz YBSNPHSYFPEUOM-LJQANCHMSA-N 2 1 332.557 4.116 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1[nH]nc2ccccc21 ZINC000589641371 1036857112 /nfs/dbraw/zinc/85/71/12/1036857112.db2.gz JBKFLTDUTOWVOI-KRWDZBQOSA-N 2 1 348.494 4.227 20 0 EIADMP c1nc2ccc(C[NH2+]Cc3ccc(C[NH+]4CCCCCC4)cc3)cc2[nH]1 ZINC000589647615 1036861380 /nfs/dbraw/zinc/86/13/80/1036861380.db2.gz QWMDPCNMOVLYMK-UHFFFAOYSA-N 2 1 348.494 4.229 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000503081984 1036894765 /nfs/dbraw/zinc/89/47/65/1036894765.db2.gz VMUDZVNAKVSFDF-INIZCTEOSA-N 2 1 338.948 4.381 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]C/C=C\c3ccncc3)cc2)C1 ZINC000486943618 1036897893 /nfs/dbraw/zinc/89/78/93/1036897893.db2.gz OBKWRIRGHWCTDJ-LVXZVAJSSA-N 2 1 335.495 4.117 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]C[C@@H]2CCSC2)C1 ZINC000486982924 1036934853 /nfs/dbraw/zinc/93/48/53/1036934853.db2.gz VJVFQPOHCWERLG-KSZLIROESA-N 2 1 332.557 4.007 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@H]2CCC23CCOCC3)cc1 ZINC000669698637 1037015764 /nfs/dbraw/zinc/01/57/64/1037015764.db2.gz VPQYIEAEZUJZCL-NQIIRXRSSA-N 2 1 342.527 4.110 20 0 EIADMP C[C@@H]([NH2+]CCCc1c[nH+]cn1C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000569738795 1037023203 /nfs/dbraw/zinc/02/32/03/1037023203.db2.gz ZTOPYDQGYBTPBA-ZIAGYGMSSA-N 2 1 339.405 4.153 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271902761 1037048276 /nfs/dbraw/zinc/04/82/76/1037048276.db2.gz VXFQGOVNUZZHKS-CYBMUJFWSA-N 2 1 345.487 4.170 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2Br)CC1 ZINC000590787122 1037166176 /nfs/dbraw/zinc/16/61/76/1037166176.db2.gz XMWGECJKAHHPFW-UHFFFAOYSA-N 2 1 339.321 4.001 20 0 EIADMP CSc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000590819101 1037185849 /nfs/dbraw/zinc/18/58/49/1037185849.db2.gz KIFULEIIHJTBSA-LJQANCHMSA-N 2 1 332.557 4.497 20 0 EIADMP CSc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000590819101 1037185855 /nfs/dbraw/zinc/18/58/55/1037185855.db2.gz KIFULEIIHJTBSA-LJQANCHMSA-N 2 1 332.557 4.497 20 0 EIADMP [NH3+][C@H](C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C1CC1 ZINC000573082393 1037345780 /nfs/dbraw/zinc/34/57/80/1037345780.db2.gz AFPGXLCZCACSDB-CABCVRRESA-N 2 1 347.915 4.168 20 0 EIADMP Brc1ccc2c(N[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc[nH+]c2c1 ZINC000604757131 1037530931 /nfs/dbraw/zinc/53/09/31/1037530931.db2.gz VPNPQULDXMIWLN-ZIAGYGMSSA-N 2 1 346.272 4.036 20 0 EIADMP Brc1ccc2c(N[C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc[nH+]c2c1 ZINC000604757131 1037530973 /nfs/dbraw/zinc/53/09/73/1037530973.db2.gz VPNPQULDXMIWLN-ZIAGYGMSSA-N 2 1 346.272 4.036 20 0 EIADMP c1sc(C2CCCCC2)nc1C[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000573497377 1037569386 /nfs/dbraw/zinc/56/93/86/1037569386.db2.gz XJIWWWTYHJCQNP-DLBZAZTESA-N 2 1 333.545 4.012 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)CS1 ZINC000488420097 1037575622 /nfs/dbraw/zinc/57/56/22/1037575622.db2.gz IAGOROWBFALXAD-RYRKJORJSA-N 2 1 338.586 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)CS1 ZINC000488420097 1037575644 /nfs/dbraw/zinc/57/56/44/1037575644.db2.gz IAGOROWBFALXAD-RYRKJORJSA-N 2 1 338.586 4.080 20 0 EIADMP C[C@@H]1C[C@@H]1C[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415363 1037583892 /nfs/dbraw/zinc/58/38/92/1037583892.db2.gz AMULRZHPYCSPRT-GFOCRRMGSA-N 2 1 340.433 4.334 20 0 EIADMP C[C@@H]1C[C@@H]1C[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415363 1037583901 /nfs/dbraw/zinc/58/39/01/1037583901.db2.gz AMULRZHPYCSPRT-GFOCRRMGSA-N 2 1 340.433 4.334 20 0 EIADMP CC(C)(C)[C@H]1C[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CS1 ZINC000488426871 1037587560 /nfs/dbraw/zinc/58/75/60/1037587560.db2.gz TWBCWTFSKHWRCH-WOJBJXKFSA-N 2 1 346.584 4.203 20 0 EIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CS1 ZINC000488426868 1037587788 /nfs/dbraw/zinc/58/77/88/1037587788.db2.gz TWBCWTFSKHWRCH-UXHICEINSA-N 2 1 346.584 4.203 20 0 EIADMP C[C@@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(C(F)(F)F)cc1 ZINC000414654315 1037671555 /nfs/dbraw/zinc/67/15/55/1037671555.db2.gz ITXDZNKXGOJOFZ-QIXHYMPYSA-N 2 1 326.406 4.024 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)Cc1c(Cl)cccc1Cl ZINC000513787391 1037720329 /nfs/dbraw/zinc/72/03/29/1037720329.db2.gz YDPBDOSTEAXBAW-STQMWFEESA-N 2 1 340.298 4.355 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000513788214 1037742360 /nfs/dbraw/zinc/74/23/60/1037742360.db2.gz MZURTVNXXXMGTR-HKUYNNGSSA-N 2 1 328.500 4.145 20 0 EIADMP Cc1nc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)oc1-c1ccc(Cl)cc1 ZINC000422625615 1037784761 /nfs/dbraw/zinc/78/47/61/1037784761.db2.gz BZDKDVQCACVCHK-WWGRRREGSA-N 2 1 347.890 4.109 20 0 EIADMP Cc1nc(C[N@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)oc1-c1ccc(Cl)cc1 ZINC000422625615 1037784779 /nfs/dbraw/zinc/78/47/79/1037784779.db2.gz BZDKDVQCACVCHK-WWGRRREGSA-N 2 1 347.890 4.109 20 0 EIADMP C[C@@H]1C[C@H](C[N@H+]2CCc3sccc3[C@H]2c2cccs2)CC[NH2+]1 ZINC000414680354 1037794369 /nfs/dbraw/zinc/79/43/69/1037794369.db2.gz MYGTWSVJFFXDLF-LBTNJELSSA-N 2 1 332.538 4.145 20 0 EIADMP C[C@@H]1C[C@H](C[N@H+]2CCc3sccc3[C@@H]2c2cccs2)CC[NH2+]1 ZINC000414680353 1037794425 /nfs/dbraw/zinc/79/44/25/1037794425.db2.gz MYGTWSVJFFXDLF-HBUWYVDXSA-N 2 1 332.538 4.145 20 0 EIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3cc(OC(F)F)ccc32)c2ccccc21 ZINC000422835008 1037842873 /nfs/dbraw/zinc/84/28/73/1037842873.db2.gz XWWNJRYUTBTWAG-GUDVDZBRSA-N 2 1 344.405 4.400 20 0 EIADMP Fc1cccc([C@H]([NH2+][C@H]2CCC[NH2+]CC2)c2cccc(Cl)c2)c1 ZINC000422873148 1037858090 /nfs/dbraw/zinc/85/80/90/1037858090.db2.gz KFUPLPUIQLXYQS-RBUKOAKNSA-N 2 1 332.850 4.300 20 0 EIADMP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c(OC(C)C)c1 ZINC000422872169 1037858168 /nfs/dbraw/zinc/85/81/68/1037858168.db2.gz GACHLMVMPALSKH-LEWJYISDSA-N 2 1 338.495 4.365 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c(OC(C)C)c1 ZINC000422872171 1037858993 /nfs/dbraw/zinc/85/89/93/1037858993.db2.gz GACHLMVMPALSKH-RTWAWAEBSA-N 2 1 338.495 4.365 20 0 EIADMP Clc1ccc2sc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)nc2c1 ZINC000422899187 1037860661 /nfs/dbraw/zinc/86/06/61/1037860661.db2.gz GYDIHCLLWJCUBQ-RBSFLKMASA-N 2 1 349.931 4.350 20 0 EIADMP CCOc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc2)cc1 ZINC000422939213 1037875786 /nfs/dbraw/zinc/87/57/86/1037875786.db2.gz HZBCGWQRQWPQHA-CZJMCEMMSA-N 2 1 336.479 4.047 20 0 EIADMP CC[C@H](C[N@@H+](Cc1ccccn1)[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000414706122 1037887012 /nfs/dbraw/zinc/88/70/12/1037887012.db2.gz AABSGHUCWCBEAR-DENIHFKCSA-N 2 1 337.511 4.220 20 0 EIADMP CC[C@@H](C[N@@H+](Cc1ccccn1)[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000414706128 1037887078 /nfs/dbraw/zinc/88/70/78/1037887078.db2.gz AABSGHUCWCBEAR-SIKLNZKXSA-N 2 1 337.511 4.220 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)o2)cs1 ZINC000422950916 1037887624 /nfs/dbraw/zinc/88/76/24/1037887624.db2.gz XAVXEMHNQHAYOL-IXDOHACOSA-N 2 1 345.512 4.112 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccc(F)cc3)cc2)CC[N@H+]1C ZINC000480449646 1037940517 /nfs/dbraw/zinc/94/05/17/1037940517.db2.gz SDXAQGFFJYFOPO-CRAIPNDOSA-N 2 1 328.431 4.190 20 0 EIADMP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423092384 1037948655 /nfs/dbraw/zinc/94/86/55/1037948655.db2.gz BSJSMMMOWHZOFQ-HSCHXYMDSA-N 2 1 328.887 4.134 20 0 EIADMP C[C@H]([NH2+]CCc1cccc2[nH]ccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000503903618 1037973231 /nfs/dbraw/zinc/97/32/31/1037973231.db2.gz RDJZNOIOIUYCQB-GHTZIAJQSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423146211 1037997096 /nfs/dbraw/zinc/99/70/96/1037997096.db2.gz OPPUROHPGBOIAQ-VERUCKTNSA-N 2 1 328.887 4.134 20 0 EIADMP CC(C)c1ccc(C[N@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)cc1 ZINC000414719448 1038011446 /nfs/dbraw/zinc/01/14/46/1038011446.db2.gz VGVFWRNPBJLIGT-QFIPXVFZSA-N 2 1 337.511 4.349 20 0 EIADMP CC(C)c1ccc(C[N@@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)cc1 ZINC000414719448 1038011474 /nfs/dbraw/zinc/01/14/74/1038011474.db2.gz VGVFWRNPBJLIGT-QFIPXVFZSA-N 2 1 337.511 4.349 20 0 EIADMP Cc1cc2c(cc1C)[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)CCS2 ZINC000423193305 1038051475 /nfs/dbraw/zinc/05/14/75/1038051475.db2.gz WZKADPVJTHXAGU-LJQANCHMSA-N 2 1 341.524 4.005 20 0 EIADMP Fc1ccc([C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2ccc(Cl)cc2)cc1 ZINC000423218144 1038061495 /nfs/dbraw/zinc/06/14/95/1038061495.db2.gz VCFAFIKZDFCHOH-KUHUBIRLSA-N 2 1 332.850 4.158 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423290812 1038096239 /nfs/dbraw/zinc/09/62/39/1038096239.db2.gz FODDJEPMBCTEFR-JKSUJKDBSA-N 3 1 334.467 4.051 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]CCC[N@@H+]2CCCC[C@@H]2C)C1 ZINC000467312505 1038152137 /nfs/dbraw/zinc/15/21/37/1038152137.db2.gz FUWZWUMYNRSPNV-ZCNNSNEGSA-N 2 1 329.532 4.270 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc2ccccc2c1OC(F)F ZINC000423362018 1038179540 /nfs/dbraw/zinc/17/95/40/1038179540.db2.gz AQVPRANJCCDASJ-IGCXYCKISA-N 2 1 334.410 4.090 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000594005502 1038242386 /nfs/dbraw/zinc/24/23/86/1038242386.db2.gz PZMJTERFYOYRFX-MRXNPFEDSA-N 2 1 329.875 4.343 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccc1F ZINC000423468185 1038244219 /nfs/dbraw/zinc/24/42/19/1038244219.db2.gz JNYZWLUZSLCMEN-SIXWZSSISA-N 2 1 330.422 4.009 20 0 EIADMP CC[N@H+]1CC[C@H](CN[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167133 1038365962 /nfs/dbraw/zinc/36/59/62/1038365962.db2.gz FYARYIKMISZVGT-OXQOHEQNSA-N 2 1 328.887 4.361 20 0 EIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167133 1038365976 /nfs/dbraw/zinc/36/59/76/1038365976.db2.gz FYARYIKMISZVGT-OXQOHEQNSA-N 2 1 328.887 4.361 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167133 1038365994 /nfs/dbraw/zinc/36/59/94/1038365994.db2.gz FYARYIKMISZVGT-OXQOHEQNSA-N 2 1 328.887 4.361 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)CC[N@H+]1C ZINC000608061540 1038448286 /nfs/dbraw/zinc/44/82/86/1038448286.db2.gz JLQCDGZVCNUQEF-RXVVDRJESA-N 2 1 347.506 4.262 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1Cl ZINC000539052647 1038799873 /nfs/dbraw/zinc/79/98/73/1038799873.db2.gz NXEMFGUBIGTKKJ-HOTGVXAUSA-N 2 1 338.923 4.367 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1Cl ZINC000539052641 1038800778 /nfs/dbraw/zinc/80/07/78/1038800778.db2.gz NXEMFGUBIGTKKJ-CVEARBPZSA-N 2 1 338.923 4.367 20 0 EIADMP c1ccc(CC[C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000480763301 1038804376 /nfs/dbraw/zinc/80/43/76/1038804376.db2.gz MJCOBARYOHFAJA-OFNKIYASSA-N 2 1 334.507 4.434 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000539083149 1038815210 /nfs/dbraw/zinc/81/52/10/1038815210.db2.gz WVHSAIUKVCPXFN-UONOGXRCSA-N 2 1 339.405 4.067 20 0 EIADMP C[C@@H]1C[N@H+](CCCC[NH2+][C@H](CC2CC2)c2ccccc2)C[C@H](C)O1 ZINC000539071183 1038820328 /nfs/dbraw/zinc/82/03/28/1038820328.db2.gz FRCBNMYLFVGSSE-LVCYWYKZSA-N 2 1 330.516 4.007 20 0 EIADMP Fc1cccc2c1CC[C@H]2[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000462050294 1038883250 /nfs/dbraw/zinc/88/32/50/1038883250.db2.gz QMHWLEVQOXJZMP-JOCHJYFZSA-N 2 1 338.470 4.110 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000539217824 1038888046 /nfs/dbraw/zinc/88/80/46/1038888046.db2.gz NLILVAAOJPXVII-MGPUTAFESA-N 2 1 329.463 4.488 20 0 EIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)CCN(C)C1CC[NH+](C)CC1 ZINC000539219805 1038890222 /nfs/dbraw/zinc/89/02/22/1038890222.db2.gz RPLQFWCNJZHTPT-SFHVURJKSA-N 2 1 345.575 4.003 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)C[C@H]1C ZINC000537614624 1038890639 /nfs/dbraw/zinc/89/06/39/1038890639.db2.gz MKHNEXBWDIZJJS-CVEARBPZSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)C[C@H]1C ZINC000537614624 1038890643 /nfs/dbraw/zinc/89/06/43/1038890643.db2.gz MKHNEXBWDIZJJS-CVEARBPZSA-N 2 1 330.447 4.390 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3ccccc3F)o2)C[C@H]1C ZINC000537614624 1038890648 /nfs/dbraw/zinc/89/06/48/1038890648.db2.gz MKHNEXBWDIZJJS-CVEARBPZSA-N 2 1 330.447 4.390 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)C[C@H]1C ZINC000537614624 1038890651 /nfs/dbraw/zinc/89/06/51/1038890651.db2.gz MKHNEXBWDIZJJS-CVEARBPZSA-N 2 1 330.447 4.390 20 0 EIADMP Cc1ccc(CC[C@@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)o1 ZINC000462115195 1038931332 /nfs/dbraw/zinc/93/13/32/1038931332.db2.gz DREADJAMTVNBBZ-GOSISDBHSA-N 2 1 340.511 4.206 20 0 EIADMP C[NH+]1CCC([NH2+][C@@H]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000462122748 1038941240 /nfs/dbraw/zinc/94/12/40/1038941240.db2.gz UCEDIHGBYAPWMH-ZWKOTPCHSA-N 2 1 340.433 4.415 20 0 EIADMP C[NH+](C)C1CCC([N@@H+]2CC[C@@H](Cc3ccccc3)C(F)(F)C2)CC1 ZINC001168328737 1038948722 /nfs/dbraw/zinc/94/87/22/1038948722.db2.gz BWMLPZGKZVAYPQ-VIQWUECVSA-N 2 1 336.470 4.059 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CC[C@@H](Cc3ccccc3)C(F)(F)C2)CC1 ZINC001168328737 1038948740 /nfs/dbraw/zinc/94/87/40/1038948740.db2.gz BWMLPZGKZVAYPQ-VIQWUECVSA-N 2 1 336.470 4.059 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc3cc(OC)ccc3c2)C1 ZINC000481023375 1038960724 /nfs/dbraw/zinc/96/07/24/1038960724.db2.gz NDLRMRVNLVIEHW-IAGOWNOFSA-N 2 1 326.484 4.231 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000481024741 1038965471 /nfs/dbraw/zinc/96/54/71/1038965471.db2.gz OQTDSOJOKCVWHG-LSDHHAIUSA-N 2 1 344.421 4.010 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2cccc(Br)c21 ZINC000119706515 1038993090 /nfs/dbraw/zinc/99/30/90/1038993090.db2.gz ZNGGJANLINMNIY-PXAZEXFGSA-N 2 1 349.316 4.214 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC2(O)CCCCCC2)CC1 ZINC000552046812 1039065947 /nfs/dbraw/zinc/06/59/47/1039065947.db2.gz SKSBFFLRRCYAOH-UHFFFAOYSA-N 2 1 344.543 4.105 20 0 EIADMP Clc1cc2c(c(Cl)c1)CC[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000534057987 1039075293 /nfs/dbraw/zinc/07/52/93/1039075293.db2.gz FIBPYDOCPJBYRJ-SFHVURJKSA-N 2 1 339.310 4.445 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cccc(Br)c2C)CC1 ZINC000534134273 1039150500 /nfs/dbraw/zinc/15/05/00/1039150500.db2.gz WIZHXWALSNKMBE-UHFFFAOYSA-N 2 1 339.321 4.064 20 0 EIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H](C)[C@@H](C)c1nc2ccccc2s1 ZINC000552098927 1039154768 /nfs/dbraw/zinc/15/47/68/1039154768.db2.gz SSORXKIDCRARDS-PMPSAXMXSA-N 2 1 331.529 4.252 20 0 EIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H](C)[C@@H](C)c1nc2ccccc2s1 ZINC000552098927 1039154775 /nfs/dbraw/zinc/15/47/75/1039154775.db2.gz SSORXKIDCRARDS-PMPSAXMXSA-N 2 1 331.529 4.252 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc2n[nH]cc2c1 ZINC000552099423 1039156191 /nfs/dbraw/zinc/15/61/91/1039156191.db2.gz IEMODLIUSFRSPC-XGHQBKJUSA-N 2 1 348.494 4.267 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc2n[nH]cc2c1 ZINC000552099423 1039156200 /nfs/dbraw/zinc/15/62/00/1039156200.db2.gz IEMODLIUSFRSPC-XGHQBKJUSA-N 2 1 348.494 4.267 20 0 EIADMP Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000555422766 1039179809 /nfs/dbraw/zinc/17/98/09/1039179809.db2.gz FOGQAIWSMYBRLQ-APWZRJJASA-N 2 1 329.532 4.256 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)c2cccc(F)c2)CC1 ZINC000481307706 1039253339 /nfs/dbraw/zinc/25/33/39/1039253339.db2.gz KCQMTIKHKOWXID-QGZVFWFLSA-N 2 1 326.459 4.449 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1cccc(C(F)(F)F)c1 ZINC000481325246 1039297435 /nfs/dbraw/zinc/29/74/35/1039297435.db2.gz VBJJTDJWJMBBMT-PBHICJAKSA-N 2 1 328.422 4.478 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]C[C@H](C)C[NH+]3CCCC3)c(C)c2c1 ZINC000481327462 1039302135 /nfs/dbraw/zinc/30/21/35/1039302135.db2.gz IDNRCQZAEDOSRZ-GOEBONIOSA-N 2 1 330.472 4.132 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(N[C@@H]2CC[NH+](C)[C@H]3CCC[C@@H]32)cc1 ZINC000552276353 1039353493 /nfs/dbraw/zinc/35/34/93/1039353493.db2.gz UNCGNKJUYDYSCW-CIQXWFTPSA-N 2 1 341.543 4.346 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(N[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)cc1 ZINC000552276353 1039353516 /nfs/dbraw/zinc/35/35/16/1039353516.db2.gz UNCGNKJUYDYSCW-CIQXWFTPSA-N 2 1 341.543 4.346 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(N[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)cc1 ZINC000552276353 1039353534 /nfs/dbraw/zinc/35/35/34/1039353534.db2.gz UNCGNKJUYDYSCW-CIQXWFTPSA-N 2 1 341.543 4.346 20 0 EIADMP COc1ccc2ccccc2c1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000537647607 1039806766 /nfs/dbraw/zinc/80/67/66/1039806766.db2.gz UUJYJCPSXSKQEU-SFHVURJKSA-N 2 1 338.495 4.156 20 0 EIADMP C[C@@H](CCc1ccccc1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434688796 1039812623 /nfs/dbraw/zinc/81/26/23/1039812623.db2.gz PRYZYUGEAUOGHS-SFHVURJKSA-N 2 1 337.511 4.420 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3cc4ccccc4o3)CC2)n2c1CCCC2 ZINC000434682206 1039816701 /nfs/dbraw/zinc/81/67/01/1039816701.db2.gz BCOMFYCEQQYXRL-UHFFFAOYSA-N 2 1 335.451 4.345 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000550977040 1039849967 /nfs/dbraw/zinc/84/99/67/1039849967.db2.gz BIDZTNNCIUHALN-WOJBJXKFSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000550977040 1039849970 /nfs/dbraw/zinc/84/99/70/1039849970.db2.gz BIDZTNNCIUHALN-WOJBJXKFSA-N 2 1 328.887 4.308 20 0 EIADMP CCOCc1ccccc1C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550999066 1039862092 /nfs/dbraw/zinc/86/20/92/1039862092.db2.gz HZLMNVCMSLYODK-YADHBBJMSA-N 2 1 338.495 4.148 20 0 EIADMP CCOCc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550999066 1039862094 /nfs/dbraw/zinc/86/20/94/1039862094.db2.gz HZLMNVCMSLYODK-YADHBBJMSA-N 2 1 338.495 4.148 20 0 EIADMP CCOCc1ccccc1C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550999065 1039862442 /nfs/dbraw/zinc/86/24/42/1039862442.db2.gz HZLMNVCMSLYODK-VXKWHMMOSA-N 2 1 338.495 4.148 20 0 EIADMP CCOCc1ccccc1C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550999065 1039862443 /nfs/dbraw/zinc/86/24/43/1039862443.db2.gz HZLMNVCMSLYODK-VXKWHMMOSA-N 2 1 338.495 4.148 20 0 EIADMP COc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1Cl ZINC000552923844 1039869633 /nfs/dbraw/zinc/86/96/33/1039869633.db2.gz XIOKVIKWWXNVQM-UHFFFAOYSA-N 2 1 336.907 4.235 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H](c2cccnc2)C2CCC2)C1 ZINC000481922280 1039895582 /nfs/dbraw/zinc/89/55/82/1039895582.db2.gz XUYVXBVHIKKIPK-LVCYWYKZSA-N 2 1 329.532 4.271 20 0 EIADMP CN(C)c1ccccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000567851432 1039928989 /nfs/dbraw/zinc/92/89/89/1039928989.db2.gz HQAAAEPWXSJPKA-OAQYLSRUSA-N 2 1 349.522 4.039 20 0 EIADMP CN(c1ccccc1C[N@H+]1CC[C@@H]1c1ccccc1)C1CC[NH+](C)CC1 ZINC000434986059 1039984553 /nfs/dbraw/zinc/98/45/53/1039984553.db2.gz MCCNCNUUAFFMCO-HSZRJFAPSA-N 2 1 349.522 4.164 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ncc(-c3ccccc3)s2)CC1 ZINC000553134660 1040010113 /nfs/dbraw/zinc/01/01/13/1040010113.db2.gz NVSKLTZZAFMQAW-UHFFFAOYSA-N 2 1 343.540 4.362 20 0 EIADMP Fc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000482117251 1040017449 /nfs/dbraw/zinc/01/74/49/1040017449.db2.gz CFYYPEDEADZPKH-QRWLVFNGSA-N 2 1 344.499 4.376 20 0 EIADMP Fc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000482117251 1040017466 /nfs/dbraw/zinc/01/74/66/1040017466.db2.gz CFYYPEDEADZPKH-QRWLVFNGSA-N 2 1 344.499 4.376 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132483 1040025569 /nfs/dbraw/zinc/02/55/69/1040025569.db2.gz YHANFRQDDNUZKB-KKSFZXQISA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132483 1040025586 /nfs/dbraw/zinc/02/55/86/1040025586.db2.gz YHANFRQDDNUZKB-KKSFZXQISA-N 2 1 344.449 4.008 20 0 EIADMP CC1=CCC[C@H](C)[C@H]1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000435057814 1040037188 /nfs/dbraw/zinc/03/71/88/1040037188.db2.gz CPBSXWLIWJJWBT-PXNSSMCTSA-N 2 1 327.516 4.391 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000666969027 1040056010 /nfs/dbraw/zinc/05/60/10/1040056010.db2.gz XZLNFBAPAXKCSU-SJLPKXTDSA-N 2 1 333.545 4.155 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000666969027 1040056035 /nfs/dbraw/zinc/05/60/35/1040056035.db2.gz XZLNFBAPAXKCSU-SJLPKXTDSA-N 2 1 333.545 4.155 20 0 EIADMP CCOC[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(C)C ZINC000551279881 1040142077 /nfs/dbraw/zinc/14/20/77/1040142077.db2.gz KRNHUUYWOOFYCP-CBNMVNINSA-N 2 1 332.532 4.080 20 0 EIADMP [NH3+]CCN(c1cccc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167958105 1040158442 /nfs/dbraw/zinc/15/84/42/1040158442.db2.gz BYDXPMNJXDYUNW-WCRBZPEASA-N 2 1 349.522 4.010 20 0 EIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(-c2ccccc2F)s1 ZINC000553439250 1040220063 /nfs/dbraw/zinc/22/00/63/1040220063.db2.gz UDKDPPJBNQZMRO-AWEZNQCLSA-N 2 1 330.472 4.467 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc(F)c1 ZINC000482442759 1040251251 /nfs/dbraw/zinc/25/12/51/1040251251.db2.gz XCIACAPNNAVCIN-HKUYNNGSSA-N 2 1 326.459 4.041 20 0 EIADMP Cc1cc(N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)nc(C2CC2)n1 ZINC000477167127 1040275312 /nfs/dbraw/zinc/27/53/12/1040275312.db2.gz NKTVPUOVRNDZLA-QGZVFWFLSA-N 2 1 342.531 4.143 20 0 EIADMP Cc1ccc(O[C@H](C)C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000565670189 1040294944 /nfs/dbraw/zinc/29/49/44/1040294944.db2.gz JFEHZXADLMEUNC-SYYKKAFVSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1ccc(O[C@H](C)C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000565670189 1040294962 /nfs/dbraw/zinc/29/49/62/1040294962.db2.gz JFEHZXADLMEUNC-SYYKKAFVSA-N 2 1 338.495 4.187 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]CCOC3CCCCC3)CC23CC3)cc1 ZINC000565774298 1040356143 /nfs/dbraw/zinc/35/61/43/1040356143.db2.gz PQPLCNPYLKJSFW-HXUWFJFHSA-N 2 1 342.527 4.123 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]CCOC3CCCCC3)CC23CC3)cc1 ZINC000565774298 1040356154 /nfs/dbraw/zinc/35/61/54/1040356154.db2.gz PQPLCNPYLKJSFW-HXUWFJFHSA-N 2 1 342.527 4.123 20 0 EIADMP CC[C@H](C[N@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000435447650 1040395195 /nfs/dbraw/zinc/39/51/95/1040395195.db2.gz HVSMZVGYXGXIGI-ZWKOTPCHSA-N 2 1 343.540 4.057 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(C)cc(C)c2)[C@@H](C)C1 ZINC000482647708 1040407922 /nfs/dbraw/zinc/40/79/22/1040407922.db2.gz BMAQCEUHBIJGKV-ZJOUEHCJSA-N 2 1 332.532 4.091 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+](C)CCC[NH+]2CCCC2)cc1 ZINC000668100570 1040420180 /nfs/dbraw/zinc/42/01/80/1040420180.db2.gz QHQIZAZVENKGGE-UHFFFAOYSA-N 2 1 329.513 4.036 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+](C)CCC[NH+]2CCCC2)cc1 ZINC000668100570 1040420187 /nfs/dbraw/zinc/42/01/87/1040420187.db2.gz QHQIZAZVENKGGE-UHFFFAOYSA-N 2 1 329.513 4.036 20 0 EIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(OC(F)(F)F)c1 ZINC000479522014 1040421883 /nfs/dbraw/zinc/42/18/83/1040421883.db2.gz AYGKXURPGXQGHP-IUDNXUCKSA-N 2 1 342.405 4.253 20 0 EIADMP C[N@H+](CCCC[NH+]1CCCCC1)Cc1csc(-c2ccoc2)n1 ZINC000640531355 1040490665 /nfs/dbraw/zinc/49/06/65/1040490665.db2.gz OJRXGLYFILCMKW-UHFFFAOYSA-N 2 1 333.501 4.101 20 0 EIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1csc(-c2ccoc2)n1 ZINC000640531355 1040490675 /nfs/dbraw/zinc/49/06/75/1040490675.db2.gz OJRXGLYFILCMKW-UHFFFAOYSA-N 2 1 333.501 4.101 20 0 EIADMP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000539500225 1040491204 /nfs/dbraw/zinc/49/12/04/1040491204.db2.gz VCCSMAYZGQBXQB-HZPDHXFCSA-N 2 1 326.484 4.439 20 0 EIADMP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000539500225 1040491215 /nfs/dbraw/zinc/49/12/15/1040491215.db2.gz VCCSMAYZGQBXQB-HZPDHXFCSA-N 2 1 326.484 4.439 20 0 EIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000539508892 1040504249 /nfs/dbraw/zinc/50/42/49/1040504249.db2.gz BVDBEZRBYBVVLN-CABCVRRESA-N 2 1 325.456 4.487 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cc3ccncc3s2)C1 ZINC000667560868 1040680124 /nfs/dbraw/zinc/68/01/24/1040680124.db2.gz DTBMXQMJEWIRCQ-IRXDYDNUSA-N 2 1 343.540 4.383 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cc3ccncc3s2)C1 ZINC000667560868 1040680133 /nfs/dbraw/zinc/68/01/33/1040680133.db2.gz DTBMXQMJEWIRCQ-IRXDYDNUSA-N 2 1 343.540 4.383 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cc3ccncc3s2)C1 ZINC000667560868 1040680137 /nfs/dbraw/zinc/68/01/37/1040680137.db2.gz DTBMXQMJEWIRCQ-IRXDYDNUSA-N 2 1 343.540 4.383 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cc3ccncc3s2)C1 ZINC000667560868 1040680142 /nfs/dbraw/zinc/68/01/42/1040680142.db2.gz DTBMXQMJEWIRCQ-IRXDYDNUSA-N 2 1 343.540 4.383 20 0 EIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCc2ccc(F)cc21 ZINC000483088698 1040697340 /nfs/dbraw/zinc/69/73/40/1040697340.db2.gz LILZWBICRUBQOU-AVRDEDQJSA-N 2 1 338.470 4.267 20 0 EIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CCc2ccc(F)cc21 ZINC000483088698 1040697363 /nfs/dbraw/zinc/69/73/63/1040697363.db2.gz LILZWBICRUBQOU-AVRDEDQJSA-N 2 1 338.470 4.267 20 0 EIADMP CCCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)cc1OC ZINC000539817426 1040811655 /nfs/dbraw/zinc/81/16/55/1040811655.db2.gz YUKAVFOYRFBYRD-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)cc1OC ZINC000539817426 1040811659 /nfs/dbraw/zinc/81/16/59/1040811659.db2.gz YUKAVFOYRFBYRD-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](CC)[C@H](C)C2)cc1OC ZINC000539817426 1040811664 /nfs/dbraw/zinc/81/16/64/1040811664.db2.gz YUKAVFOYRFBYRD-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)[C@H](C)C2)cc1OC ZINC000539817426 1040811672 /nfs/dbraw/zinc/81/16/72/1040811672.db2.gz YUKAVFOYRFBYRD-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCOc3cccc4ccccc43)CC[C@H]21 ZINC000483485343 1040874648 /nfs/dbraw/zinc/87/46/48/1040874648.db2.gz RQPXRQZARCKAHI-PZJWPPBQSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCOc3cccc4ccccc43)CC[C@H]21 ZINC000483485343 1040874652 /nfs/dbraw/zinc/87/46/52/1040874652.db2.gz RQPXRQZARCKAHI-PZJWPPBQSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCOc3cccc4ccccc43)CC[C@H]21 ZINC000483485343 1040874658 /nfs/dbraw/zinc/87/46/58/1040874658.db2.gz RQPXRQZARCKAHI-PZJWPPBQSA-N 2 1 338.495 4.025 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCOc2ccccc2C)cc1 ZINC000537992287 1040987818 /nfs/dbraw/zinc/98/78/18/1040987818.db2.gz XIWDKGBXDUNWLQ-QGZVFWFLSA-N 2 1 335.451 4.219 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000462818064 1040992864 /nfs/dbraw/zinc/99/28/64/1040992864.db2.gz ITRNJCCWGJAPIA-BRWVUGGUSA-N 2 1 327.516 4.296 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000462818064 1040992887 /nfs/dbraw/zinc/99/28/87/1040992887.db2.gz ITRNJCCWGJAPIA-BRWVUGGUSA-N 2 1 327.516 4.296 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000462818069 1040993704 /nfs/dbraw/zinc/99/37/04/1040993704.db2.gz ITRNJCCWGJAPIA-ZACQAIPSSA-N 2 1 327.516 4.296 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000462818069 1040993725 /nfs/dbraw/zinc/99/37/25/1040993725.db2.gz ITRNJCCWGJAPIA-ZACQAIPSSA-N 2 1 327.516 4.296 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC(Nc2cc[nH+]c3ccsc32)CC1 ZINC000462834885 1041016723 /nfs/dbraw/zinc/01/67/23/1041016723.db2.gz BVGZAQWVEIFEGX-OAHLLOKOSA-N 2 1 337.492 4.356 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000538116111 1041068728 /nfs/dbraw/zinc/06/87/28/1041068728.db2.gz DZHWNKNFWBEJFP-MJGOQNOKSA-N 2 1 328.525 4.099 20 0 EIADMP 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 1041083294 /nfs/dbraw/zinc/08/32/94/1041083294.db2.gz PKUMMOQJYBTHLZ-VVMVDLBUSA-N 2 1 340.433 4.270 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CC(C)(C)c4ccccc43)CC2)[nH+]c1 ZINC000484147753 1041137850 /nfs/dbraw/zinc/13/78/50/1041137850.db2.gz QTIPHUSLITVYGW-FQEVSTJZSA-N 2 1 335.495 4.371 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000540150167 1041199176 /nfs/dbraw/zinc/19/91/76/1041199176.db2.gz CBIUQHJIFFEVLH-JKSUJKDBSA-N 2 1 340.458 4.307 20 0 EIADMP COc1ccc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c(C)c1 ZINC000540163696 1041226825 /nfs/dbraw/zinc/22/68/25/1041226825.db2.gz HGTLTCIQDKRYPI-INIZCTEOSA-N 2 1 335.451 4.349 20 0 EIADMP CCc1ccc(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000515924606 1041255015 /nfs/dbraw/zinc/25/50/15/1041255015.db2.gz KEDUTUQMPJJCFJ-OAQYLSRUSA-N 2 1 337.511 4.036 20 0 EIADMP CCc1ccc(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000515924606 1041255031 /nfs/dbraw/zinc/25/50/31/1041255031.db2.gz KEDUTUQMPJJCFJ-OAQYLSRUSA-N 2 1 337.511 4.036 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C[C@@H]1CC2c3ccccc3C1c1ccccc12 ZINC000540194450 1041270739 /nfs/dbraw/zinc/27/07/39/1041270739.db2.gz ITZWRVHOUMJDPF-UDYOMSLQSA-N 2 1 346.518 4.214 20 0 EIADMP COCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CCCC1 ZINC000484508612 1041292982 /nfs/dbraw/zinc/29/29/82/1041292982.db2.gz PZOPMQYWSOVDFT-TZIWHRDSSA-N 2 1 344.543 4.084 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)C)C1 ZINC000540261237 1041329004 /nfs/dbraw/zinc/32/90/04/1041329004.db2.gz XIANTHRQDXOUMZ-RHSMWYFYSA-N 2 1 328.422 4.334 20 0 EIADMP CCCCn1cc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)c(C)n1 ZINC000540318198 1041363624 /nfs/dbraw/zinc/36/36/24/1041363624.db2.gz NBTPLQABPBSWCW-LAUBAEHRSA-N 2 1 346.563 4.124 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccc(F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000463141436 1041375157 /nfs/dbraw/zinc/37/51/57/1041375157.db2.gz KCGUPNLZPBZXAY-DYESRHJHSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccc(F)cc2)CC[N@H+]1Cc1ccccc1 ZINC000463141436 1041375166 /nfs/dbraw/zinc/37/51/66/1041375166.db2.gz KCGUPNLZPBZXAY-DYESRHJHSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463155555 1041387961 /nfs/dbraw/zinc/38/79/61/1041387961.db2.gz OAXCISMVKFWALT-RLLPEYFOSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000463155555 1041387969 /nfs/dbraw/zinc/38/79/69/1041387969.db2.gz OAXCISMVKFWALT-RLLPEYFOSA-N 2 1 334.507 4.433 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463188317 1041418476 /nfs/dbraw/zinc/41/84/76/1041418476.db2.gz CIFDTCISOAMZPS-RXVVDRJESA-N 2 1 338.495 4.146 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463188317 1041418482 /nfs/dbraw/zinc/41/84/82/1041418482.db2.gz CIFDTCISOAMZPS-RXVVDRJESA-N 2 1 338.495 4.146 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+]C3(Cc4ccccc4)CCC3)CC2)cc1 ZINC000538554540 1041418938 /nfs/dbraw/zinc/41/89/38/1041418938.db2.gz XQCHKDJESDDYMA-UHFFFAOYSA-N 2 1 334.507 4.406 20 0 EIADMP COc1cc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1OC ZINC000480611632 1041421732 /nfs/dbraw/zinc/42/17/32/1041421732.db2.gz OPJGOJUXXAZOIY-FUHWJXTLSA-N 2 1 348.531 4.175 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCC3(CCCC3)O2)cc1 ZINC000554816149 1041423793 /nfs/dbraw/zinc/42/37/93/1041423793.db2.gz KUZWMSAGCUNOTO-JXFKEZNVSA-N 2 1 339.483 4.323 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@H](c2ccccc2)C[C@H]1C ZINC000467554509 1041434669 /nfs/dbraw/zinc/43/46/69/1041434669.db2.gz OHSINPYAQIJJAL-XLIONFOSSA-N 2 1 346.478 4.344 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCSCc2ccc(Cl)cc2Cl)CC[N@H+]1C ZINC000540396765 1041440484 /nfs/dbraw/zinc/44/04/84/1041440484.db2.gz DLILSPOWAWAWBZ-DOMZBBRYSA-N 2 1 347.355 4.299 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCc2ccccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463248226 1041452941 /nfs/dbraw/zinc/45/29/41/1041452941.db2.gz RQHUKUACBXWZJK-WIYYLYMNSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCc2ccccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463248226 1041452943 /nfs/dbraw/zinc/45/29/43/1041452943.db2.gz RQHUKUACBXWZJK-WIYYLYMNSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)C(F)(F)F ZINC000480668810 1041461436 /nfs/dbraw/zinc/46/14/36/1041461436.db2.gz WOZCBRVWDMKCSV-NRSFXHEJSA-N 2 1 340.433 4.075 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463289839 1041489407 /nfs/dbraw/zinc/48/94/07/1041489407.db2.gz QEXRHVADPOCVGX-PKOBYXMFSA-N 2 1 328.525 4.242 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463289839 1041489415 /nfs/dbraw/zinc/48/94/15/1041489415.db2.gz QEXRHVADPOCVGX-PKOBYXMFSA-N 2 1 328.525 4.242 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C)c(Br)c2)C[C@H]1C ZINC000538718941 1041489956 /nfs/dbraw/zinc/48/99/56/1041489956.db2.gz YBRDCWWMOVARIR-GDBMZVCRSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C)c(Br)c2)C[C@H]1C ZINC000538718941 1041489963 /nfs/dbraw/zinc/48/99/63/1041489963.db2.gz YBRDCWWMOVARIR-GDBMZVCRSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(C)c(Br)c2)C[C@H]1C ZINC000538718941 1041489966 /nfs/dbraw/zinc/48/99/66/1041489966.db2.gz YBRDCWWMOVARIR-GDBMZVCRSA-N 2 1 339.321 4.062 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+]CC3CC(c4ccccc4)C3)CC2)cc1 ZINC000554923508 1041500763 /nfs/dbraw/zinc/50/07/63/1041500763.db2.gz YETOVGMJEHHLSB-UHFFFAOYSA-N 2 1 334.507 4.434 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c(OC)ccc3ccccc32)[C@@H](C)C1 ZINC000538738758 1041510718 /nfs/dbraw/zinc/51/07/18/1041510718.db2.gz XOMNFXNLWGXCPN-JXFKEZNVSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c(OC)ccc3ccccc32)[C@@H](C)C1 ZINC000538738758 1041510730 /nfs/dbraw/zinc/51/07/30/1041510730.db2.gz XOMNFXNLWGXCPN-JXFKEZNVSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c(OC)ccc3ccccc32)[C@@H](C)C1 ZINC000538738758 1041510739 /nfs/dbraw/zinc/51/07/39/1041510739.db2.gz XOMNFXNLWGXCPN-JXFKEZNVSA-N 2 1 326.484 4.011 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c(OC)ccc3ccccc32)[C@H](C)C1 ZINC000538738760 1041511046 /nfs/dbraw/zinc/51/10/46/1041511046.db2.gz XOMNFXNLWGXCPN-OXQOHEQNSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c(OC)ccc3ccccc32)[C@H](C)C1 ZINC000538738760 1041511055 /nfs/dbraw/zinc/51/10/55/1041511055.db2.gz XOMNFXNLWGXCPN-OXQOHEQNSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c(OC)ccc3ccccc32)[C@H](C)C1 ZINC000538738760 1041511064 /nfs/dbraw/zinc/51/10/64/1041511064.db2.gz XOMNFXNLWGXCPN-OXQOHEQNSA-N 2 1 326.484 4.011 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000539040592 1041616739 /nfs/dbraw/zinc/61/67/39/1041616739.db2.gz DNZHJXOMVWBMAS-LNLFQRSKSA-N 2 1 341.474 4.172 20 0 EIADMP CSCc1cccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000437093382 1041640677 /nfs/dbraw/zinc/64/06/77/1041640677.db2.gz GZAXQDNUDWBODV-UHFFFAOYSA-N 2 1 340.536 4.304 20 0 EIADMP CC(C)N(C)c1ccccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000437107427 1041650729 /nfs/dbraw/zinc/65/07/29/1041650729.db2.gz BFCGNZOGUDKIHJ-UHFFFAOYSA-N 2 1 343.559 4.418 20 0 EIADMP Fc1ccccc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000516969844 1041825462 /nfs/dbraw/zinc/82/54/62/1041825462.db2.gz KKYQUFODOBGIIY-HXUWFJFHSA-N 2 1 338.470 4.155 20 0 EIADMP Fc1ccccc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000516969844 1041825466 /nfs/dbraw/zinc/82/54/66/1041825466.db2.gz KKYQUFODOBGIIY-HXUWFJFHSA-N 2 1 338.470 4.155 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)ccc1F ZINC000301718695 1041982727 /nfs/dbraw/zinc/98/27/27/1041982727.db2.gz PUUCTDFKDFLOJC-INIZCTEOSA-N 2 1 330.447 4.007 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccccc1OC(F)F ZINC000541558866 1042000297 /nfs/dbraw/zinc/00/02/97/1042000297.db2.gz ZLJGBHLFMNIKSL-LSDHHAIUSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1OC(F)F)C[NH+](C)C ZINC000425940476 1042019902 /nfs/dbraw/zinc/01/99/02/1042019902.db2.gz HCIWBHDUQLPJMR-KGLIPLIRSA-N 2 1 336.426 4.290 20 0 EIADMP C[C@H](C[NH2+][C@@H](c1ccccc1)c1ccc(OC(F)F)cc1)C[NH+](C)C ZINC000425943696 1042033137 /nfs/dbraw/zinc/03/31/37/1042033137.db2.gz JSMKSYOVDWNTEB-BEFAXECRSA-N 2 1 348.437 4.165 20 0 EIADMP C[C@@H](NCc1cccc(OC(C)(C)C)n1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603186 1042038776 /nfs/dbraw/zinc/03/87/76/1042038776.db2.gz ORGLHWFQCXOBAK-IAGOWNOFSA-N 2 1 345.531 4.002 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541603186 1042038781 /nfs/dbraw/zinc/03/87/81/1042038781.db2.gz ORGLHWFQCXOBAK-IAGOWNOFSA-N 2 1 345.531 4.002 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603186 1042038788 /nfs/dbraw/zinc/03/87/88/1042038788.db2.gz ORGLHWFQCXOBAK-IAGOWNOFSA-N 2 1 345.531 4.002 20 0 EIADMP Cn1cc[nH+]c1CC1CC[NH+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000438119249 1042047265 /nfs/dbraw/zinc/04/72/65/1042047265.db2.gz JDUVOQSSYDOWLZ-IFMALSPDSA-N 2 1 337.511 4.185 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)C1 ZINC000438119929 1042062225 /nfs/dbraw/zinc/06/22/25/1042062225.db2.gz LAFTUKSKZIACIF-IITNATTFSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000438119929 1042062230 /nfs/dbraw/zinc/06/22/30/1042062230.db2.gz LAFTUKSKZIACIF-IITNATTFSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000438119929 1042062235 /nfs/dbraw/zinc/06/22/35/1042062235.db2.gz LAFTUKSKZIACIF-IITNATTFSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000438119929 1042062241 /nfs/dbraw/zinc/06/22/41/1042062241.db2.gz LAFTUKSKZIACIF-IITNATTFSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000438119929 1042062245 /nfs/dbraw/zinc/06/22/45/1042062245.db2.gz LAFTUKSKZIACIF-IITNATTFSA-N 2 1 338.539 4.446 20 0 EIADMP c1ccc(OCCCCC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000438121444 1042062647 /nfs/dbraw/zinc/06/26/47/1042062647.db2.gz PKEDYNLRPXFFJI-SIKLNZKXSA-N 2 1 342.527 4.184 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)Cc2ccccc2F)cc1F ZINC000438201578 1042078498 /nfs/dbraw/zinc/07/84/98/1042078498.db2.gz LJONJODRFSJBQQ-CQSZACIVSA-N 2 1 341.405 4.180 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)Cc2ccccc2F)cc1F ZINC000438201576 1042079020 /nfs/dbraw/zinc/07/90/20/1042079020.db2.gz LJONJODRFSJBQQ-AWEZNQCLSA-N 2 1 341.405 4.180 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000541909516 1042167090 /nfs/dbraw/zinc/16/70/90/1042167090.db2.gz ZBRIOAJLPPVCRQ-CQSZACIVSA-N 2 1 334.916 4.452 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000542164960 1042311484 /nfs/dbraw/zinc/31/14/84/1042311484.db2.gz HIEWKDVYUVNJLF-BLIXFSHQSA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000542164960 1042311491 /nfs/dbraw/zinc/31/14/91/1042311491.db2.gz HIEWKDVYUVNJLF-BLIXFSHQSA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000542164960 1042311497 /nfs/dbraw/zinc/31/14/97/1042311497.db2.gz HIEWKDVYUVNJLF-BLIXFSHQSA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000542164960 1042311500 /nfs/dbraw/zinc/31/15/00/1042311500.db2.gz HIEWKDVYUVNJLF-BLIXFSHQSA-N 2 1 330.491 4.096 20 0 EIADMP CCCCOc1ccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)cc1OC ZINC000506357575 1042347781 /nfs/dbraw/zinc/34/77/81/1042347781.db2.gz SSJUVRFQGRTMAG-UHFFFAOYSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc1OC ZINC000506357575 1042347793 /nfs/dbraw/zinc/34/77/93/1042347793.db2.gz SSJUVRFQGRTMAG-UHFFFAOYSA-N 2 1 348.531 4.179 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC2(CCC[N@@H+]2C)CC1 ZINC000542267118 1042365812 /nfs/dbraw/zinc/36/58/12/1042365812.db2.gz ADYSUQCCYGWTEL-AWEZNQCLSA-N 2 1 326.406 4.327 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC000542267118 1042365816 /nfs/dbraw/zinc/36/58/16/1042365816.db2.gz ADYSUQCCYGWTEL-AWEZNQCLSA-N 2 1 326.406 4.327 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]CCCNc3ccccc3)CC23CC3)cc1 ZINC000518184018 1042402556 /nfs/dbraw/zinc/40/25/56/1042402556.db2.gz VEJHCWWXPGFUJR-JOCHJYFZSA-N 2 1 349.522 4.275 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]CCCNc3ccccc3)CC23CC3)cc1 ZINC000518184018 1042402562 /nfs/dbraw/zinc/40/25/62/1042402562.db2.gz VEJHCWWXPGFUJR-JOCHJYFZSA-N 2 1 349.522 4.275 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]CCCNc3ccccc3)CC23CC3)cc1 ZINC000518184019 1042403224 /nfs/dbraw/zinc/40/32/24/1042403224.db2.gz VEJHCWWXPGFUJR-QFIPXVFZSA-N 2 1 349.522 4.275 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CCCNc3ccccc3)CC23CC3)cc1 ZINC000518184019 1042403227 /nfs/dbraw/zinc/40/32/27/1042403227.db2.gz VEJHCWWXPGFUJR-QFIPXVFZSA-N 2 1 349.522 4.275 20 0 EIADMP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000414971003 1042434742 /nfs/dbraw/zinc/43/47/42/1042434742.db2.gz LAHMCROTYHNIOC-KRWDZBQOSA-N 2 1 341.480 4.034 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+]CC3CCSCC3)CC[N@@H+]2C2CC2)cc1 ZINC000638588517 1042499594 /nfs/dbraw/zinc/49/95/94/1042499594.db2.gz ZCLHHKAMZBLBPX-UYAOXDASSA-N 2 1 330.541 4.087 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+]CC3CCSCC3)CC[N@H+]2C2CC2)cc1 ZINC000638588517 1042499597 /nfs/dbraw/zinc/49/95/97/1042499597.db2.gz ZCLHHKAMZBLBPX-UYAOXDASSA-N 2 1 330.541 4.087 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000426289009 1042513523 /nfs/dbraw/zinc/51/35/23/1042513523.db2.gz FJHMJMMQTCHPLV-YUXAGFNASA-N 2 1 344.543 4.099 20 0 EIADMP CSc1ccc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)s1 ZINC000518451594 1042527158 /nfs/dbraw/zinc/52/71/58/1042527158.db2.gz YDGFAGLZINFRMF-KRWDZBQOSA-N 2 1 346.565 4.424 20 0 EIADMP CSc1ccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)s1 ZINC000518451594 1042527162 /nfs/dbraw/zinc/52/71/62/1042527162.db2.gz YDGFAGLZINFRMF-KRWDZBQOSA-N 2 1 346.565 4.424 20 0 EIADMP CSc1ccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000518451594 1042527167 /nfs/dbraw/zinc/52/71/67/1042527167.db2.gz YDGFAGLZINFRMF-KRWDZBQOSA-N 2 1 346.565 4.424 20 0 EIADMP CSc1ccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000518451594 1042527170 /nfs/dbraw/zinc/52/71/70/1042527170.db2.gz YDGFAGLZINFRMF-KRWDZBQOSA-N 2 1 346.565 4.424 20 0 EIADMP Clc1cccc(OCCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167963895 1042546577 /nfs/dbraw/zinc/54/65/77/1042546577.db2.gz HMZKCUMGGMNQST-YQQQUEKLSA-N 2 1 348.918 4.104 20 0 EIADMP C[C@@H]([NH2+]CCCc1cccc(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492326083 1042614274 /nfs/dbraw/zinc/61/42/74/1042614274.db2.gz BBAFCNLNSXYOKN-NQIIRXRSSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2ccc3[nH]cnc3c2)cc1 ZINC000518761411 1042678954 /nfs/dbraw/zinc/67/89/54/1042678954.db2.gz ULIJMJOASULBQZ-KRWDZBQOSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2ccc3nc[nH]c3c2)cc1 ZINC000518761411 1042678956 /nfs/dbraw/zinc/67/89/56/1042678956.db2.gz ULIJMJOASULBQZ-KRWDZBQOSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2ccc3nc[nH]c3c2)cc1 ZINC000518761411 1042678957 /nfs/dbraw/zinc/67/89/57/1042678957.db2.gz ULIJMJOASULBQZ-KRWDZBQOSA-N 2 1 348.494 4.227 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1ccccc1C)C1CC1 ZINC000542464107 1042751798 /nfs/dbraw/zinc/75/17/98/1042751798.db2.gz MUXQLCNUMHCIDL-UHFFFAOYSA-N 2 1 332.451 4.049 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cnc2ccsc2c1 ZINC000309942191 1042824424 /nfs/dbraw/zinc/82/44/24/1042824424.db2.gz ISXWVDAKTBEZMB-MRXNPFEDSA-N 2 1 339.508 4.469 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000310067873 1042826962 /nfs/dbraw/zinc/82/69/62/1042826962.db2.gz CCUIKCVOFUJRII-DOTOQJQBSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000310067873 1042826965 /nfs/dbraw/zinc/82/69/65/1042826965.db2.gz CCUIKCVOFUJRII-DOTOQJQBSA-N 2 1 330.422 4.138 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1ccccc1)c1ccc(F)cc1 ZINC000177295728 1042833795 /nfs/dbraw/zinc/83/37/95/1042833795.db2.gz UDIDRPJYIZCMRE-HRAATJIYSA-N 2 1 337.442 4.346 20 0 EIADMP Cc1cc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc(C)c1O ZINC000310842007 1042846527 /nfs/dbraw/zinc/84/65/27/1042846527.db2.gz NWLHYLIDLQUMBO-NQIIRXRSSA-N 2 1 338.495 4.009 20 0 EIADMP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000493890812 1042972859 /nfs/dbraw/zinc/97/28/59/1042972859.db2.gz HMTGJMDJNPFGOK-XMSQKQJNSA-N 2 1 340.511 4.393 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)CCO1 ZINC000507791858 1042975276 /nfs/dbraw/zinc/97/52/76/1042975276.db2.gz DEELGINHOSLZLF-SESVDKBCSA-N 2 1 336.564 4.168 20 0 EIADMP Cc1nc2ccc(C[NH2+]C[C@H]3CCC[N@H+](CC(C)C)C3)cc2s1 ZINC000494170658 1043025258 /nfs/dbraw/zinc/02/52/58/1043025258.db2.gz FITQWQQODNXEGF-QGZVFWFLSA-N 2 1 331.529 4.062 20 0 EIADMP C[C@@H]1CC([NH2+]Cc2ccc(Cl)nc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168008173 1043036893 /nfs/dbraw/zinc/03/68/93/1043036893.db2.gz WIVGNAQVRLYYQW-HZPDHXFCSA-N 2 1 343.902 4.266 20 0 EIADMP CC(C)[NH+](CCN[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC001168008697 1043077597 /nfs/dbraw/zinc/07/75/97/1043077597.db2.gz FTKIJGFLVGKRGX-VTYHHJSWSA-N 2 1 345.575 4.136 20 0 EIADMP CN1CCC([N@@H+](C2CCCC2)[C@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168743179 1043086781 /nfs/dbraw/zinc/08/67/81/1043086781.db2.gz JOYOKHJDBFDYMH-SFHVURJKSA-N 2 1 332.919 4.146 20 0 EIADMP Cc1ccc(F)c(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000310095966 1043101760 /nfs/dbraw/zinc/10/17/60/1043101760.db2.gz VAQUWLPRJVABCI-LJQANCHMSA-N 2 1 326.459 4.136 20 0 EIADMP Cc1ccc(F)c(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310095966 1043101768 /nfs/dbraw/zinc/10/17/68/1043101768.db2.gz VAQUWLPRJVABCI-LJQANCHMSA-N 2 1 326.459 4.136 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000338773331 1043135132 /nfs/dbraw/zinc/13/51/32/1043135132.db2.gz FRMPCPBQLXRYSA-SFNKJDCFSA-N 2 1 341.499 4.425 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC000665249203 1043260952 /nfs/dbraw/zinc/26/09/52/1043260952.db2.gz LATGHUSGVCYSFY-GFCCVEGCSA-N 2 1 333.476 4.180 20 0 EIADMP COc1ccc(C[NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168010947 1043297924 /nfs/dbraw/zinc/29/79/24/1043297924.db2.gz LOTJLHBZHXKZEK-RMFSNUHRSA-N 2 1 338.495 4.226 20 0 EIADMP COc1cccc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000166714958 1043307844 /nfs/dbraw/zinc/30/78/44/1043307844.db2.gz QRQZWRHCYRVCIM-LEWJYISDSA-N 2 1 336.479 4.079 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)C1CCSCC1 ZINC000187246736 1043336195 /nfs/dbraw/zinc/33/61/95/1043336195.db2.gz JLHCBNXBLPTMCE-LESCRADOSA-N 2 1 338.586 4.252 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)C1CCSCC1 ZINC000187246736 1043336207 /nfs/dbraw/zinc/33/62/07/1043336207.db2.gz JLHCBNXBLPTMCE-LESCRADOSA-N 2 1 338.586 4.252 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C1CCSCC1 ZINC000187283895 1043337929 /nfs/dbraw/zinc/33/79/29/1043337929.db2.gz QYYNBDUVRHHSTB-UWVAXJGDSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C1CCSCC1 ZINC000187283895 1043337943 /nfs/dbraw/zinc/33/79/43/1043337943.db2.gz QYYNBDUVRHHSTB-UWVAXJGDSA-N 2 1 332.557 4.161 20 0 EIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccccc1 ZINC000674049648 1043351191 /nfs/dbraw/zinc/35/11/91/1043351191.db2.gz VROMDBPTQAQOFU-NHCUHLMSSA-N 2 1 330.516 4.007 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)c1 ZINC000474029120 1043441996 /nfs/dbraw/zinc/44/19/96/1043441996.db2.gz LEEKHBHTUFICGT-YPAWHYETSA-N 2 1 344.543 4.212 20 0 EIADMP Nc1ccc2c(c1)CC[C@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000665272159 1043477311 /nfs/dbraw/zinc/47/73/11/1043477311.db2.gz ZPMPOKKSJQOYJG-ADYITMSISA-N 2 1 347.506 4.041 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)C3CCC(F)(F)CC3)CC2)[nH+]1 ZINC000474033948 1043680789 /nfs/dbraw/zinc/68/07/89/1043680789.db2.gz MMOIHZBQXZUHSS-OAHLLOKOSA-N 2 1 337.458 4.162 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000543064429 1043714171 /nfs/dbraw/zinc/71/41/71/1043714171.db2.gz LUJDGBMYZOMMTP-DUFSDNGMSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000543064429 1043714174 /nfs/dbraw/zinc/71/41/74/1043714174.db2.gz LUJDGBMYZOMMTP-DUFSDNGMSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@H]([NH2+]Cc1cc2ccccc2[nH]1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000681390515 1043732378 /nfs/dbraw/zinc/73/23/78/1043732378.db2.gz NDKONQWKLCBASK-FXAWDEMLSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001168466901 1043818854 /nfs/dbraw/zinc/81/88/54/1043818854.db2.gz HIRWSPRFTJUDRX-SFHVURJKSA-N 2 1 340.486 4.053 20 0 EIADMP C[NH+]1CCC([NH2+]CC2(c3cc(C(F)(F)F)ccc3Cl)CC2)CC1 ZINC000191523461 1043824068 /nfs/dbraw/zinc/82/40/68/1043824068.db2.gz CVDNTOAQZLFYIJ-UHFFFAOYSA-N 2 1 346.824 4.074 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)CCS2 ZINC000191535764 1043824782 /nfs/dbraw/zinc/82/47/82/1043824782.db2.gz ZGNYFVITIOGBBW-VQIMIIECSA-N 2 1 348.556 4.190 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)C1CCC(F)(F)CC1 ZINC000474037287 1043831652 /nfs/dbraw/zinc/83/16/52/1043831652.db2.gz QCLDKSKRUBHZGP-INIZCTEOSA-N 2 1 336.470 4.455 20 0 EIADMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000442917289 1043889961 /nfs/dbraw/zinc/88/99/61/1043889961.db2.gz DCWFTKXTXGAQOU-ZDUSSCGKSA-N 2 1 335.904 4.024 20 0 EIADMP COc1ccc(Cl)c(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000192178694 1043890286 /nfs/dbraw/zinc/89/02/86/1043890286.db2.gz HQHKYOXSRLNJGC-CABCVRRESA-N 2 1 336.907 4.091 20 0 EIADMP COc1ccc(Cl)c(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000192178694 1043890287 /nfs/dbraw/zinc/89/02/87/1043890287.db2.gz HQHKYOXSRLNJGC-CABCVRRESA-N 2 1 336.907 4.091 20 0 EIADMP COc1ccc(Cl)c(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000192178687 1043890388 /nfs/dbraw/zinc/89/03/88/1043890388.db2.gz HQHKYOXSRLNJGC-GJZGRUSLSA-N 2 1 336.907 4.091 20 0 EIADMP COc1ccc(Cl)c(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000192178687 1043890390 /nfs/dbraw/zinc/89/03/90/1043890390.db2.gz HQHKYOXSRLNJGC-GJZGRUSLSA-N 2 1 336.907 4.091 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000674909366 1043934074 /nfs/dbraw/zinc/93/40/74/1043934074.db2.gz LCFSMUQNRCPNDS-NHCUHLMSSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000674909366 1043934083 /nfs/dbraw/zinc/93/40/83/1043934083.db2.gz LCFSMUQNRCPNDS-NHCUHLMSSA-N 2 1 336.479 4.079 20 0 EIADMP C[C@@H]1C[C@@H](n2cc3cc(C[NH3+])ccc3n2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168015203 1044074511 /nfs/dbraw/zinc/07/45/11/1044074511.db2.gz PMGFFALJBGJOBK-UPHUGPLXSA-N 2 1 348.494 4.109 20 0 EIADMP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000193973971 1044224933 /nfs/dbraw/zinc/22/49/33/1044224933.db2.gz SYSNDIKJARECGP-GOEBONIOSA-N 2 1 340.433 4.100 20 0 EIADMP Cc1cccc2[nH]cc(CC[NH2+]C3CC[NH+](Cc4ccccc4)CC3)c21 ZINC000174346108 1044264180 /nfs/dbraw/zinc/26/41/80/1044264180.db2.gz QJYXOFCIKWJELX-UHFFFAOYSA-N 2 1 347.506 4.273 20 0 EIADMP C[NH+](C)CC(C)(C)CNc1[nH+]ccc2ccn(Cc3ccccc3)c21 ZINC001168766619 1044289930 /nfs/dbraw/zinc/28/99/30/1044289930.db2.gz OFQTYUNDHWPCIO-UHFFFAOYSA-N 2 1 336.483 4.084 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]CC2CCC(C(F)(F)F)CC2)C1 ZINC000466361381 1044322574 /nfs/dbraw/zinc/32/25/74/1044322574.db2.gz UWKMVHVQYOWYAJ-CGZBRXJRSA-N 2 1 334.470 4.313 20 0 EIADMP FC(F)(F)C1CCC(C[NH2+][C@H]2CC[N@H+](CC3CCCC3)C2)CC1 ZINC000466361662 1044323057 /nfs/dbraw/zinc/32/30/57/1044323057.db2.gz BZJOPGIARWWGOZ-PREGVCBESA-N 2 1 332.454 4.209 20 0 EIADMP FC(F)(F)C1CCC(C[NH2+][C@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC000466361662 1044323074 /nfs/dbraw/zinc/32/30/74/1044323074.db2.gz BZJOPGIARWWGOZ-PREGVCBESA-N 2 1 332.454 4.209 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000675489079 1044359360 /nfs/dbraw/zinc/35/93/60/1044359360.db2.gz FTWITTOWMBUAKI-RBUKOAKNSA-N 2 1 325.500 4.222 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000675489079 1044359367 /nfs/dbraw/zinc/35/93/67/1044359367.db2.gz FTWITTOWMBUAKI-RBUKOAKNSA-N 2 1 325.500 4.222 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000675489079 1044359385 /nfs/dbraw/zinc/35/93/85/1044359385.db2.gz FTWITTOWMBUAKI-RBUKOAKNSA-N 2 1 325.500 4.222 20 0 EIADMP Cc1cccc2c1OCC[C@H]2[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC000474087311 1044435659 /nfs/dbraw/zinc/43/56/59/1044435659.db2.gz FJVONOHHJIQSFL-ZLGUVYLKSA-N 2 1 342.527 4.451 20 0 EIADMP c1ccc(C[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCCCC2)cc1 ZINC000480240054 1044446688 /nfs/dbraw/zinc/44/66/88/1044446688.db2.gz IYEHPLSBUINRNH-QFIPXVFZSA-N 2 1 326.528 4.394 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCC(C)(C)c2ccccc2)[C@@H](C)C1 ZINC000675770732 1044484370 /nfs/dbraw/zinc/48/43/70/1044484370.db2.gz YLVAVAKSBPVVMV-FPOVZHCZSA-N 2 1 346.559 4.081 20 0 EIADMP C[C@@H]1C[C@@H](n2ncc3cccc(C[NH3+])c32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168022528 1044521063 /nfs/dbraw/zinc/52/10/63/1044521063.db2.gz TXBBNVBDPWLRSE-UPHUGPLXSA-N 2 1 348.494 4.109 20 0 EIADMP c1cn(C2CCCC2)nc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443604541 1044531499 /nfs/dbraw/zinc/53/14/99/1044531499.db2.gz OQEMARMZKOPRKQ-UHFFFAOYSA-N 2 1 344.547 4.086 20 0 EIADMP CCCc1nc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cs1 ZINC000443606863 1044545119 /nfs/dbraw/zinc/54/51/19/1044545119.db2.gz YJUFBINZLSWTEQ-UHFFFAOYSA-N 2 1 335.561 4.184 20 0 EIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000675879881 1044551348 /nfs/dbraw/zinc/55/13/48/1044551348.db2.gz ACIQPRHNBNUJKQ-IRLDBZIGSA-N 2 1 344.543 4.315 20 0 EIADMP CS[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)(C)C ZINC000543411863 1044552616 /nfs/dbraw/zinc/55/26/16/1044552616.db2.gz BZWRZFFEHJLASS-YTQUADARSA-N 2 1 334.573 4.407 20 0 EIADMP Cc1ccccc1[C@@H](CC(C)C)[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000675879883 1044553760 /nfs/dbraw/zinc/55/37/60/1044553760.db2.gz ACIQPRHNBNUJKQ-RBBKRZOGSA-N 2 1 344.543 4.315 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542529915 1044565965 /nfs/dbraw/zinc/56/59/65/1044565965.db2.gz XPSMZAWWEFGTRQ-MJGOQNOKSA-N 2 1 330.516 4.216 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000542529915 1044565984 /nfs/dbraw/zinc/56/59/84/1044565984.db2.gz XPSMZAWWEFGTRQ-MJGOQNOKSA-N 2 1 330.516 4.216 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000443640881 1044584199 /nfs/dbraw/zinc/58/41/99/1044584199.db2.gz KEOJQPQJBDWDEW-INIZCTEOSA-N 2 1 340.433 4.178 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000443640881 1044584219 /nfs/dbraw/zinc/58/42/19/1044584219.db2.gz KEOJQPQJBDWDEW-INIZCTEOSA-N 2 1 340.433 4.178 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000443640881 1044584241 /nfs/dbraw/zinc/58/42/41/1044584241.db2.gz KEOJQPQJBDWDEW-INIZCTEOSA-N 2 1 340.433 4.178 20 0 EIADMP Cc1cc(F)cc(C[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC001143619169 1044652409 /nfs/dbraw/zinc/65/24/09/1044652409.db2.gz KPFCKGJDLBVRJM-SFTDATJTSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC001143619169 1044652413 /nfs/dbraw/zinc/65/24/13/1044652413.db2.gz KPFCKGJDLBVRJM-SFTDATJTSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC001143619169 1044652418 /nfs/dbraw/zinc/65/24/18/1044652418.db2.gz KPFCKGJDLBVRJM-SFTDATJTSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC001143619169 1044652433 /nfs/dbraw/zinc/65/24/33/1044652433.db2.gz KPFCKGJDLBVRJM-SFTDATJTSA-N 2 1 338.470 4.088 20 0 EIADMP FC(F)(F)c1ccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)s1 ZINC000428863871 1044770101 /nfs/dbraw/zinc/77/01/01/1044770101.db2.gz RMFXEYBTIIPKAL-UHFFFAOYSA-N 2 1 332.435 4.264 20 0 EIADMP Cc1ccc(C)c(OCCC[NH+]2CCC([NH+]3CCCCC3)CC2)c1 ZINC000613455319 1044789253 /nfs/dbraw/zinc/78/92/53/1044789253.db2.gz LZLRSLMLFMWMOV-UHFFFAOYSA-N 2 1 330.516 4.023 20 0 EIADMP CC(C)[C@H](C[NH+]1CCC(Cc2[nH+]ccn2C)CC1)c1ccccc1 ZINC000474281847 1044833029 /nfs/dbraw/zinc/83/30/29/1044833029.db2.gz FMXSCWJOEFALDJ-FQEVSTJZSA-N 2 1 325.500 4.114 20 0 EIADMP CC1(C)CC([NH2+]Cc2ccc(-c3ccccc3F)o2)CC(C)(C)[NH2+]1 ZINC000499965240 1044846101 /nfs/dbraw/zinc/84/61/01/1044846101.db2.gz SQVIQDQHQNJNQK-UHFFFAOYSA-N 2 1 330.447 4.485 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC000429263524 1044860129 /nfs/dbraw/zinc/86/01/29/1044860129.db2.gz XXCJHSSFHMYUPX-LJQANCHMSA-N 2 1 329.463 4.374 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H]1CCCc2ccc(F)cc21 ZINC000429263524 1044860131 /nfs/dbraw/zinc/86/01/31/1044860131.db2.gz XXCJHSSFHMYUPX-LJQANCHMSA-N 2 1 329.463 4.374 20 0 EIADMP COc1cc[nH+]c(N2CC[NH+]([C@@H](C)c3ccc4ccccc4c3)CC2)c1 ZINC000303282216 1044976301 /nfs/dbraw/zinc/97/63/01/1044976301.db2.gz UUQKTCVSLZQOCO-KRWDZBQOSA-N 2 1 347.462 4.127 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCSC3(CCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000922840726 1044985189 /nfs/dbraw/zinc/98/51/89/1044985189.db2.gz RJVWJYMFLONMBP-RLLQIKCJSA-N 2 1 344.568 4.447 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCSC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000922840726 1044985199 /nfs/dbraw/zinc/98/51/99/1044985199.db2.gz RJVWJYMFLONMBP-RLLQIKCJSA-N 2 1 344.568 4.447 20 0 EIADMP CCc1ccc(C[N@@H+](C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cn1 ZINC000347777719 1045104651 /nfs/dbraw/zinc/10/46/51/1045104651.db2.gz JDQVHASJEZGXAN-AVRDEDQJSA-N 2 1 337.511 4.129 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](Cc1ccccc1)c1cccs1 ZINC000347921506 1045130235 /nfs/dbraw/zinc/13/02/35/1045130235.db2.gz QKQKJWFKKQNSPN-GOSISDBHSA-N 2 1 325.481 4.217 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2noc3c2CCCC3)CC1 ZINC000158986412 1045138599 /nfs/dbraw/zinc/13/85/99/1045138599.db2.gz IKERUSXSUWFWOS-KRWDZBQOSA-N 2 1 345.531 4.030 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2noc3c2CCCC3)CC1 ZINC000158986412 1045138603 /nfs/dbraw/zinc/13/86/03/1045138603.db2.gz IKERUSXSUWFWOS-KRWDZBQOSA-N 2 1 345.531 4.030 20 0 EIADMP C([NH2+]C1CCC2(CCCCC2)CC1)C1([NH+]2CCCC2)CCOCC1 ZINC000466736998 1045148540 /nfs/dbraw/zinc/14/85/40/1045148540.db2.gz BSUPCBBMAKESIE-UHFFFAOYSA-N 2 1 334.548 4.114 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2ccc(F)cc2C)o1 ZINC000237579510 1045389374 /nfs/dbraw/zinc/38/93/74/1045389374.db2.gz PCTPKXBADIGUCK-CQSZACIVSA-N 2 1 341.430 4.325 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1cnn(C)c1 ZINC000247210522 1045843444 /nfs/dbraw/zinc/84/34/44/1045843444.db2.gz WXIFTLYPYRJPKO-DYESRHJHSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000261658764 1046132240 /nfs/dbraw/zinc/13/22/40/1046132240.db2.gz BLLDDEIDVFBFJL-YJBOKZPZSA-N 2 1 344.449 4.156 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@@](C)(C[NH3+])C3)s2)cc1 ZINC000261789761 1046151071 /nfs/dbraw/zinc/15/10/71/1046151071.db2.gz UWBBAMZQMVAHKN-IBGZPJMESA-N 2 1 329.513 4.104 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@@](C)(C[NH3+])C3)s2)cc1 ZINC000261789761 1046151087 /nfs/dbraw/zinc/15/10/87/1046151087.db2.gz UWBBAMZQMVAHKN-IBGZPJMESA-N 2 1 329.513 4.104 20 0 EIADMP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000476006311 1046195106 /nfs/dbraw/zinc/19/51/06/1046195106.db2.gz BCSIFLTXAXHIBN-IRXDYDNUSA-N 2 1 345.531 4.166 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3cc(OC)ccc3o2)c1 ZINC000125000781 1046278631 /nfs/dbraw/zinc/27/86/31/1046278631.db2.gz VPTKBIZSACRUJD-UHFFFAOYSA-N 2 1 338.451 4.183 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)[C@@H](C)c2nc3ccccc3s2)C1 ZINC000125857521 1046356314 /nfs/dbraw/zinc/35/63/14/1046356314.db2.gz JGIVLSNKGKSIEI-IXDOHACOSA-N 2 1 345.556 4.498 20 0 EIADMP CCCC[C@H](COC)Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000154203289 1046386381 /nfs/dbraw/zinc/38/63/81/1046386381.db2.gz SORMDIGSMUXDPK-HXUWFJFHSA-N 2 1 347.547 4.082 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000508762429 1046550308 /nfs/dbraw/zinc/55/03/08/1046550308.db2.gz CJCVUMPVKPUZAE-STIKNRRDSA-N 2 1 342.527 4.044 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000508762429 1046550319 /nfs/dbraw/zinc/55/03/19/1046550319.db2.gz CJCVUMPVKPUZAE-STIKNRRDSA-N 2 1 342.527 4.044 20 0 EIADMP C[C@H]([N@@H+](C)Cc1ccccc1N(C)C1CC[NH+](C)CC1)C(C)(C)C ZINC000536655869 1046602535 /nfs/dbraw/zinc/60/25/35/1046602535.db2.gz BTHLHEPXCHMRDA-KRWDZBQOSA-N 2 1 331.548 4.083 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c3ccccc23)[C@@H](C)C1 ZINC000536682575 1046646495 /nfs/dbraw/zinc/64/64/95/1046646495.db2.gz YTJIHQCDTSXIMP-JXFKEZNVSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OC)c3ccccc23)[C@@H](C)C1 ZINC000536682575 1046646514 /nfs/dbraw/zinc/64/65/14/1046646514.db2.gz YTJIHQCDTSXIMP-JXFKEZNVSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(OC)c3ccccc23)[C@@H](C)C1 ZINC000536682575 1046646527 /nfs/dbraw/zinc/64/65/27/1046646527.db2.gz YTJIHQCDTSXIMP-JXFKEZNVSA-N 2 1 326.484 4.011 20 0 EIADMP C[C@H](C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000536703789 1046704042 /nfs/dbraw/zinc/70/40/42/1046704042.db2.gz YQTJWQSGBYNGLK-LJQANCHMSA-N 2 1 337.511 4.424 20 0 EIADMP C[C@H]([NH2+]C1CC(C)(c2ccccc2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000459467895 1046704364 /nfs/dbraw/zinc/70/43/64/1046704364.db2.gz QQUSBCWKZZXLKD-RBBFLIRBSA-N 2 1 326.528 4.349 20 0 EIADMP Cc1nc(CC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)sc1C ZINC000127749829 1046722611 /nfs/dbraw/zinc/72/26/11/1046722611.db2.gz CNVJJTDHDXYMBC-AWEZNQCLSA-N 2 1 340.496 4.147 20 0 EIADMP CC[C@@H](NCC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000379636735 1046723863 /nfs/dbraw/zinc/72/38/63/1046723863.db2.gz XTBZBTZYCLBUJQ-VQIMIIECSA-N 2 1 329.463 4.172 20 0 EIADMP Cc1nc2c(n1[C@H]1CC[N@@H+](C[C@@H]3C[C@H]3c3ccccc3)C1)CCCC2 ZINC000459497071 1046725005 /nfs/dbraw/zinc/72/50/05/1046725005.db2.gz ZUUVGBRMONGBGW-UFYCRDLUSA-N 2 1 335.495 4.121 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@H+](C[C@@H]3C[C@H]3c3ccccc3)C1)CCCC2 ZINC000459497071 1046725021 /nfs/dbraw/zinc/72/50/21/1046725021.db2.gz ZUUVGBRMONGBGW-UFYCRDLUSA-N 2 1 335.495 4.121 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@@H+](C[C@@H]3C[C@H]3c3ccccc3)C1)CCCC2 ZINC000459497071 1046725030 /nfs/dbraw/zinc/72/50/30/1046725030.db2.gz ZUUVGBRMONGBGW-UFYCRDLUSA-N 2 1 335.495 4.121 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379630282 1046731653 /nfs/dbraw/zinc/73/16/53/1046731653.db2.gz PKRPOZRVBJGGCM-WSTZPKSXSA-N 2 1 326.484 4.243 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379630282 1046731669 /nfs/dbraw/zinc/73/16/69/1046731669.db2.gz PKRPOZRVBJGGCM-WSTZPKSXSA-N 2 1 326.484 4.243 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000379632373 1046732892 /nfs/dbraw/zinc/73/28/92/1046732892.db2.gz NQKMOZAYOJRDOI-BHIYHBOVSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000379632373 1046732909 /nfs/dbraw/zinc/73/29/09/1046732909.db2.gz NQKMOZAYOJRDOI-BHIYHBOVSA-N 2 1 336.470 4.455 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[N@H+](C)C[C@H]1CC[NH+](C)C1 ZINC000459528487 1046758548 /nfs/dbraw/zinc/75/85/48/1046758548.db2.gz ZIOVDGXHTRBBSW-SFHVURJKSA-N 2 1 338.495 4.054 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[N@@H+](C)C[C@H]1CC[NH+](C)C1 ZINC000459528487 1046758562 /nfs/dbraw/zinc/75/85/62/1046758562.db2.gz ZIOVDGXHTRBBSW-SFHVURJKSA-N 2 1 338.495 4.054 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[NH+](C)C[C@H]1CC[N@H+](C)C1 ZINC000459528487 1046758577 /nfs/dbraw/zinc/75/85/77/1046758577.db2.gz ZIOVDGXHTRBBSW-SFHVURJKSA-N 2 1 338.495 4.054 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[NH+](C)C[C@H]1CC[N@@H+](C)C1 ZINC000459528487 1046758588 /nfs/dbraw/zinc/75/85/88/1046758588.db2.gz ZIOVDGXHTRBBSW-SFHVURJKSA-N 2 1 338.495 4.054 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000459730171 1046865309 /nfs/dbraw/zinc/86/53/09/1046865309.db2.gz LNWYHFCAVKASNX-DCZASFAJSA-N 2 1 338.470 4.182 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000459737544 1046876255 /nfs/dbraw/zinc/87/62/55/1046876255.db2.gz RLPZZZNVIMRBKH-IBGZPJMESA-N 2 1 338.495 4.184 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536998061 1046889699 /nfs/dbraw/zinc/88/96/99/1046889699.db2.gz CYABIDFZTKQNEC-YOEHRIQHSA-N 2 1 328.422 4.334 20 0 EIADMP Clc1ccc2c(c1)[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)CCS2 ZINC000423186588 1046933773 /nfs/dbraw/zinc/93/37/73/1046933773.db2.gz LBYDBEAFYSOLFQ-KRWDZBQOSA-N 2 1 347.915 4.041 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@@H]3CCC[C@H]([NH+](C)C)C3)oc21 ZINC000537293517 1047074935 /nfs/dbraw/zinc/07/49/35/1047074935.db2.gz VQTBQIKVVMLHRM-UAGQMJEPSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@H]3CCC[C@@H]([NH+](C)C)C3)oc21 ZINC000537293516 1047076117 /nfs/dbraw/zinc/07/61/17/1047076117.db2.gz VQTBQIKVVMLHRM-BHYGNILZSA-N 2 1 330.472 4.355 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497839064 1047114768 /nfs/dbraw/zinc/11/47/68/1047114768.db2.gz FTLPMRFFWXGHGJ-UWJYYQICSA-N 2 1 330.491 4.472 20 0 EIADMP C[C@H](CC[NH2+][C@H]1CCc2nc(Cl)ccc21)[N@H+](C)Cc1ccccc1 ZINC000806141306 1047168874 /nfs/dbraw/zinc/16/88/74/1047168874.db2.gz IEHKDHURDUODOM-QAPCUYQASA-N 2 1 343.902 4.223 20 0 EIADMP C[C@H](CC[NH2+][C@H]1CCc2nc(Cl)ccc21)[N@@H+](C)Cc1ccccc1 ZINC000806141306 1047168879 /nfs/dbraw/zinc/16/88/79/1047168879.db2.gz IEHKDHURDUODOM-QAPCUYQASA-N 2 1 343.902 4.223 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@H]3CC[C@H]3C3CC3)cc2)CC1 ZINC000806158300 1047182433 /nfs/dbraw/zinc/18/24/33/1047182433.db2.gz WXYBOPZUGBCVRH-SFTDATJTSA-N 2 1 327.516 4.065 20 0 EIADMP COc1ccc(CCC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556058600 1047421468 /nfs/dbraw/zinc/42/14/68/1047421468.db2.gz ABNDWSSEBUJJAJ-UNMCSNQZSA-N 2 1 338.495 4.053 20 0 EIADMP COc1ccc(CCC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556058600 1047421481 /nfs/dbraw/zinc/42/14/81/1047421481.db2.gz ABNDWSSEBUJJAJ-UNMCSNQZSA-N 2 1 338.495 4.053 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccccc2Cl)C[C@@H]1c1ccccc1 ZINC000556062149 1047428696 /nfs/dbraw/zinc/42/86/96/1047428696.db2.gz NKDAHKBEOCVUJQ-UYAOXDASSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccccc2Cl)C[C@@H]1c1ccccc1 ZINC000556062149 1047428704 /nfs/dbraw/zinc/42/87/04/1047428704.db2.gz NKDAHKBEOCVUJQ-UYAOXDASSA-N 2 1 328.887 4.308 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3ccccc3C(F)(F)F)CC2)C1 ZINC001170119651 1047473266 /nfs/dbraw/zinc/47/32/66/1047473266.db2.gz ZJEBULXZCJTYRV-ZIAGYGMSSA-N 2 1 326.406 4.144 20 0 EIADMP C[C@H]([NH2+][C@H]1CCSC(C)(C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000897796004 1047485454 /nfs/dbraw/zinc/48/54/54/1047485454.db2.gz VUSHWYNCVIPERR-WDSOQIARSA-N 2 1 332.557 4.161 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000129725737 1047496037 /nfs/dbraw/zinc/49/60/37/1047496037.db2.gz JZQMFMKZEQMDBW-IRXDYDNUSA-N 2 1 328.422 4.349 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+](C)C2CCCCC2)CC[N@H+]1C ZINC000129861780 1047518454 /nfs/dbraw/zinc/51/84/54/1047518454.db2.gz RWYWXPRYSIXQFK-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129861780 1047518462 /nfs/dbraw/zinc/51/84/62/1047518462.db2.gz RWYWXPRYSIXQFK-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129861780 1047518469 /nfs/dbraw/zinc/51/84/69/1047518469.db2.gz RWYWXPRYSIXQFK-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCN1C ZINC000129861780 1047518478 /nfs/dbraw/zinc/51/84/78/1047518478.db2.gz RWYWXPRYSIXQFK-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCN1C ZINC000129861780 1047518490 /nfs/dbraw/zinc/51/84/90/1047518490.db2.gz RWYWXPRYSIXQFK-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@H](NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000129861780 1047518498 /nfs/dbraw/zinc/51/84/98/1047518498.db2.gz RWYWXPRYSIXQFK-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@H](NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@H+]1C ZINC000129861780 1047518506 /nfs/dbraw/zinc/51/85/06/1047518506.db2.gz RWYWXPRYSIXQFK-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@H](NCc2ccccc2C[N@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129861780 1047518515 /nfs/dbraw/zinc/51/85/15/1047518515.db2.gz RWYWXPRYSIXQFK-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1C[C@H](NCc2ccccc2C[N@@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129861780 1047518528 /nfs/dbraw/zinc/51/85/28/1047518528.db2.gz RWYWXPRYSIXQFK-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP COc1cccc(C[N@H+]2CCC3(C2)CC[NH+]([C@H]2CC[C@@H](C)C2)CC3)c1 ZINC001170136347 1047590056 /nfs/dbraw/zinc/59/00/56/1047590056.db2.gz JUMFUVWXXICUSI-QUCCMNQESA-N 2 1 342.527 4.172 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@H]1C1CCOCC1 ZINC000537511244 1047656700 /nfs/dbraw/zinc/65/67/00/1047656700.db2.gz UOLHJYJGWLCPDN-NRFANRHFSA-N 2 1 344.543 4.036 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@@H+]1CCC[C@H]1C1CCOCC1 ZINC000537511244 1047656707 /nfs/dbraw/zinc/65/67/07/1047656707.db2.gz UOLHJYJGWLCPDN-NRFANRHFSA-N 2 1 344.543 4.036 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000537511244 1047656713 /nfs/dbraw/zinc/65/67/13/1047656713.db2.gz UOLHJYJGWLCPDN-NRFANRHFSA-N 2 1 344.543 4.036 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C12CCCC2 ZINC000550665548 1047810745 /nfs/dbraw/zinc/81/07/45/1047810745.db2.gz MGCTYYAAMPUSHJ-XSDIEEQYSA-N 2 1 342.527 4.149 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C12CCCC2 ZINC000550665548 1047810748 /nfs/dbraw/zinc/81/07/48/1047810748.db2.gz MGCTYYAAMPUSHJ-XSDIEEQYSA-N 2 1 342.527 4.149 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Br)c(F)c2)CC1 ZINC000131020191 1047820726 /nfs/dbraw/zinc/82/07/26/1047820726.db2.gz XNKNGOIOZKTEEH-LBPRGKRZSA-N 2 1 343.284 4.113 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@]2(C)CC2(Cl)Cl)CC[N@H+]1Cc1ccccc1 ZINC000824775053 1047933313 /nfs/dbraw/zinc/93/33/13/1047933313.db2.gz XRDHYLLTENEGDE-PVAVHDDUSA-N 2 1 341.326 4.213 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@]2(C)CC2(Cl)Cl)CC[N@H+]1Cc1ccccc1 ZINC000824775052 1047934985 /nfs/dbraw/zinc/93/49/85/1047934985.db2.gz XRDHYLLTENEGDE-OIISXLGYSA-N 2 1 341.326 4.213 20 0 EIADMP COC1CCC(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000514953580 1048087295 /nfs/dbraw/zinc/08/72/95/1048087295.db2.gz IFEYFHCNXCTYQE-WDQDQHCCSA-N 2 1 330.516 4.007 20 0 EIADMP COC1CCC(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000514953580 1048087318 /nfs/dbraw/zinc/08/73/18/1048087318.db2.gz IFEYFHCNXCTYQE-WDQDQHCCSA-N 2 1 330.516 4.007 20 0 EIADMP Cc1cncc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000556884236 1048100738 /nfs/dbraw/zinc/10/07/38/1048100738.db2.gz HNESLWXSUKDJBL-DNVJHFABSA-N 2 1 349.522 4.170 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@@H]2CCC[C@@H]21 ZINC000556886248 1048108251 /nfs/dbraw/zinc/10/82/51/1048108251.db2.gz KDZMNKMJCSMBSV-LNLFQRSKSA-N 2 1 347.572 4.196 20 0 EIADMP CC[N@H+](CCn1cc[nH+]c1C)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000499055373 1048132350 /nfs/dbraw/zinc/13/23/50/1048132350.db2.gz MRPWWZFQTFQOEI-OAQYLSRUSA-N 2 1 337.442 4.442 20 0 EIADMP CC[N@@H+](CCn1cc[nH+]c1C)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000499055373 1048132356 /nfs/dbraw/zinc/13/23/56/1048132356.db2.gz MRPWWZFQTFQOEI-OAQYLSRUSA-N 2 1 337.442 4.442 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CC(C)(C)OC2(C)C)CC1 ZINC000556893307 1048140175 /nfs/dbraw/zinc/14/01/75/1048140175.db2.gz UEHMAOCQFRSXNY-SOAGJPPSSA-N 2 1 344.543 4.365 20 0 EIADMP CCCC(C[NH3+])(CCC)[NH2+][C@H](C)Cc1ccccc1Br ZINC001246494178 1048166471 /nfs/dbraw/zinc/16/64/71/1048166471.db2.gz FYSBTIZJJPPEJU-CQSZACIVSA-N 2 1 341.337 4.267 20 0 EIADMP CCc1cc(C[N@@H+](C2CCCC2)C2CCN(C)CC2)cc(CC)c1O ZINC001144149610 1048460296 /nfs/dbraw/zinc/46/02/96/1048460296.db2.gz JSEKWHWHCVEADX-UHFFFAOYSA-N 2 1 344.543 4.356 20 0 EIADMP Cc1cc(F)ccc1[C@@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000815553338 1048506582 /nfs/dbraw/zinc/50/65/82/1048506582.db2.gz XYVIXSGVXWJBDC-QGZVFWFLSA-N 2 1 326.459 4.449 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809752748 1048518092 /nfs/dbraw/zinc/51/80/92/1048518092.db2.gz HVCWZUAEQMGEOE-UHFFFAOYSA-N 2 1 343.418 4.326 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809752748 1048518102 /nfs/dbraw/zinc/51/81/02/1048518102.db2.gz HVCWZUAEQMGEOE-UHFFFAOYSA-N 2 1 343.418 4.326 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(SC(F)F)cc3)C2)CC1 ZINC000809754760 1048520296 /nfs/dbraw/zinc/52/02/96/1048520296.db2.gz ANKHPTJUDZVQPL-INIZCTEOSA-N 2 1 340.483 4.165 20 0 EIADMP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3cccc(C4=[NH+]CCC4)c3)c2c1 ZINC001171167738 1048614602 /nfs/dbraw/zinc/61/46/02/1048614602.db2.gz MGFLMSYOWNUQSR-INIZCTEOSA-N 2 1 331.463 4.412 20 0 EIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(F)cc1 ZINC000846145989 1048832962 /nfs/dbraw/zinc/83/29/62/1048832962.db2.gz PVQGBJOBZLCCMP-RTWAWAEBSA-N 2 1 348.506 4.146 20 0 EIADMP C[N@H+](Cc1cccc2cccnc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109859 1048854569 /nfs/dbraw/zinc/85/45/69/1048854569.db2.gz CCESCVNXHYZSKE-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cccc2cccnc21)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076109859 1048854571 /nfs/dbraw/zinc/85/45/71/1048854571.db2.gz CCESCVNXHYZSKE-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cccc2cccnc21)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076109859 1048854573 /nfs/dbraw/zinc/85/45/73/1048854573.db2.gz CCESCVNXHYZSKE-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)o1 ZINC000237098283 1048884759 /nfs/dbraw/zinc/88/47/59/1048884759.db2.gz UCKHZGCZAWEZFB-AYHJJNSGSA-N 2 1 342.458 4.499 20 0 EIADMP c1cc2c(s1)CC[NH+](CCCC[N@H+]1CCc3sccc3C1)C2 ZINC000077248307 1048998715 /nfs/dbraw/zinc/99/87/15/1048998715.db2.gz XZUFNPCMXLYSHU-UHFFFAOYSA-N 2 1 332.538 4.006 20 0 EIADMP CC(C)Cc1ccc([C@H]([NH2+][C@@H](C)C2C[NH2+]C2)c2cccs2)cc1 ZINC000817897344 1049054594 /nfs/dbraw/zinc/05/45/94/1049054594.db2.gz LFQGHAAVVMAQJQ-YWZLYKJASA-N 2 1 328.525 4.234 20 0 EIADMP Fc1ccccc1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000135257584 1049096407 /nfs/dbraw/zinc/09/64/07/1049096407.db2.gz SSFBICODDTUSFK-SEJPIABJSA-N 2 1 338.470 4.153 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCC2CC(OC(C)(C)C)C2)C[C@H]1c1ccccc1 ZINC000517226228 1049506342 /nfs/dbraw/zinc/50/63/42/1049506342.db2.gz GPEUNCDPDPLNDY-YXIVMFJDSA-N 2 1 344.543 4.395 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCC2CC(OC(C)(C)C)C2)C[C@H]1c1ccccc1 ZINC000517226228 1049506358 /nfs/dbraw/zinc/50/63/58/1049506358.db2.gz GPEUNCDPDPLNDY-YXIVMFJDSA-N 2 1 344.543 4.395 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(SC(F)(F)F)cc1 ZINC000237547036 1049599790 /nfs/dbraw/zinc/59/97/90/1049599790.db2.gz KQAGKXZFBFMRLP-GFCCVEGCSA-N 2 1 343.418 4.229 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2c(F)cccc2C1 ZINC001171439396 1049692245 /nfs/dbraw/zinc/69/22/45/1049692245.db2.gz YKEDZPQBCRVPBI-IPMKNSEASA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@@H]1CCc2c(F)cccc2C1 ZINC001171439396 1049692248 /nfs/dbraw/zinc/69/22/48/1049692248.db2.gz YKEDZPQBCRVPBI-IPMKNSEASA-N 2 1 330.491 4.022 20 0 EIADMP FC1(F)CCC[C@@H]1C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716704538 1049701802 /nfs/dbraw/zinc/70/18/02/1049701802.db2.gz GIHUGJXMZINIDQ-MANSERQUSA-N 2 1 334.454 4.065 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@H](c2ccc(Cl)cn2)C2CC2)CC1(C)C ZINC001171630363 1049761515 /nfs/dbraw/zinc/76/15/15/1049761515.db2.gz OHZHVUSMVZOEAD-KRWDZBQOSA-N 2 1 335.923 4.427 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2cc(Cl)nc(Cl)c2)CC1(C)C ZINC001171621105 1049766244 /nfs/dbraw/zinc/76/62/44/1049766244.db2.gz KGJGXTYKHOCHPJ-UHFFFAOYSA-N 2 1 330.303 4.129 20 0 EIADMP Cc1ccc(CC[C@@H](C)[NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)cc1 ZINC001171666933 1049774791 /nfs/dbraw/zinc/77/47/91/1049774791.db2.gz SGJOMJAOQGETCY-GOSISDBHSA-N 2 1 340.486 4.405 20 0 EIADMP CCC(CC)C[N@@H+](C)Cc1ccc(C[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC001171636431 1049776941 /nfs/dbraw/zinc/77/69/41/1049776941.db2.gz OGPYMDUOWMZGAU-HDICACEKSA-N 2 1 332.532 4.164 20 0 EIADMP COc1ccc([C@@H]2CCC[N@H+]2C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171637891 1049778605 /nfs/dbraw/zinc/77/86/05/1049778605.db2.gz RFFPGFWIMOVNKM-IBGZPJMESA-N 2 1 330.516 4.484 20 0 EIADMP C[C@@H]1C[C@H](NC(=[NH2+])c2cccc3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC001171733926 1049798036 /nfs/dbraw/zinc/79/80/36/1049798036.db2.gz KEAHRFUYTXSYHN-XLIONFOSSA-N 2 1 343.474 4.418 20 0 EIADMP C[C@@H]1C[C@H](NC(=[NH2+])c2cccc3ccccc32)C[N@H+]1Cc1ccccc1 ZINC001171733926 1049798045 /nfs/dbraw/zinc/79/80/45/1049798045.db2.gz KEAHRFUYTXSYHN-XLIONFOSSA-N 2 1 343.474 4.418 20 0 EIADMP Cc1cccc(Cl)c1C(=[NH2+])N[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171742647 1049802069 /nfs/dbraw/zinc/80/20/69/1049802069.db2.gz XNPQQRWGWSPZKS-WBVHZDCISA-N 2 1 341.886 4.226 20 0 EIADMP Cc1cccc(Cl)c1C(=[NH2+])N[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171742647 1049802073 /nfs/dbraw/zinc/80/20/73/1049802073.db2.gz XNPQQRWGWSPZKS-WBVHZDCISA-N 2 1 341.886 4.226 20 0 EIADMP C[C@@H]1CC([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C[C@@H](C)O1 ZINC000813789100 1049816689 /nfs/dbraw/zinc/81/66/89/1049816689.db2.gz IWJKEGUIUDKHAG-OVQSOCLTSA-N 2 1 342.527 4.118 20 0 EIADMP Oc1cccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000813790786 1049817924 /nfs/dbraw/zinc/81/79/24/1049817924.db2.gz YAQXKGLSUKHFPH-SEJPIABJSA-N 2 1 336.479 4.068 20 0 EIADMP Oc1cccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000813790786 1049817927 /nfs/dbraw/zinc/81/79/27/1049817927.db2.gz YAQXKGLSUKHFPH-SEJPIABJSA-N 2 1 336.479 4.068 20 0 EIADMP CC1(C)C[C@H](Nc2ccc(CC[NH3+])cc2)CC[N@H+]1Cc1ccccc1 ZINC001171961740 1049824581 /nfs/dbraw/zinc/82/45/81/1049824581.db2.gz AMTPLZIVIPHRGY-OAQYLSRUSA-N 2 1 337.511 4.043 20 0 EIADMP CC1(C)C[C@@H]([NH2+]C2Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001171962346 1049825264 /nfs/dbraw/zinc/82/52/64/1049825264.db2.gz COAWYPCSPPPLFJ-NRFANRHFSA-N 2 1 334.507 4.187 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001171966401 1049826405 /nfs/dbraw/zinc/82/64/05/1049826405.db2.gz VBEFQJBELLSBHQ-DOTOQJQBSA-N 2 1 342.449 4.477 20 0 EIADMP COc1ccccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171965161 1049826998 /nfs/dbraw/zinc/82/69/98/1049826998.db2.gz OLNFHKLBJQCOQW-FQEVSTJZSA-N 2 1 338.495 4.228 20 0 EIADMP COc1ccccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171965161 1049826999 /nfs/dbraw/zinc/82/69/99/1049826999.db2.gz OLNFHKLBJQCOQW-FQEVSTJZSA-N 2 1 338.495 4.228 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2cc(F)cc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171966600 1049828239 /nfs/dbraw/zinc/82/82/39/1049828239.db2.gz VTGOILNWHZNASN-FQEVSTJZSA-N 2 1 344.449 4.498 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2cc(F)cc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC001171966600 1049828245 /nfs/dbraw/zinc/82/82/45/1049828245.db2.gz VTGOILNWHZNASN-FQEVSTJZSA-N 2 1 344.449 4.498 20 0 EIADMP CC1(C)C[C@H]([NH+]2CC[C@@H](C(F)(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171987846 1049840541 /nfs/dbraw/zinc/84/05/41/1049840541.db2.gz KOOYREGVYRUNKH-IAGOWNOFSA-N 2 1 340.433 4.314 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CC[C@@H](C(F)(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171987846 1049840543 /nfs/dbraw/zinc/84/05/43/1049840543.db2.gz KOOYREGVYRUNKH-IAGOWNOFSA-N 2 1 340.433 4.314 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CC[C@@H](C(F)(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171987846 1049840545 /nfs/dbraw/zinc/84/05/45/1049840545.db2.gz KOOYREGVYRUNKH-IAGOWNOFSA-N 2 1 340.433 4.314 20 0 EIADMP CCOCC1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171986314 1049841118 /nfs/dbraw/zinc/84/11/18/1049841118.db2.gz HEXJOEJKONIIOQ-OAQYLSRUSA-N 2 1 344.543 4.178 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000245738942 1049844542 /nfs/dbraw/zinc/84/45/42/1049844542.db2.gz RFUHKMZCLCDMOQ-ALGQRKQJSA-N 2 1 344.568 4.446 20 0 EIADMP C[N@H+](C1CC(F)(F)C1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076509 1049844737 /nfs/dbraw/zinc/84/47/37/1049844737.db2.gz DTVDUEVZFASIGF-PIIMJCKOSA-N 2 1 334.454 4.302 20 0 EIADMP C[N@@H+](C1CC(F)(F)C1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076509 1049844738 /nfs/dbraw/zinc/84/47/38/1049844738.db2.gz DTVDUEVZFASIGF-PIIMJCKOSA-N 2 1 334.454 4.302 20 0 EIADMP C[NH+](C1CC(F)(F)C1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076509 1049844741 /nfs/dbraw/zinc/84/47/41/1049844741.db2.gz DTVDUEVZFASIGF-PIIMJCKOSA-N 2 1 334.454 4.302 20 0 EIADMP C[NH+](C1CC(F)(F)C1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076509 1049844744 /nfs/dbraw/zinc/84/47/44/1049844744.db2.gz DTVDUEVZFASIGF-PIIMJCKOSA-N 2 1 334.454 4.302 20 0 EIADMP CS[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000245738954 1049845008 /nfs/dbraw/zinc/84/50/08/1049845008.db2.gz RFUHKMZCLCDMOQ-SSSFQFABSA-N 2 1 344.568 4.446 20 0 EIADMP CC(C)([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccncc1 ZINC001172077401 1049846548 /nfs/dbraw/zinc/84/65/48/1049846548.db2.gz QXQIDDDCSUOZRJ-KOUNCHBCSA-N 2 1 349.522 4.492 20 0 EIADMP C[NH2+]Cc1cccc(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172084276 1049847810 /nfs/dbraw/zinc/84/78/10/1049847810.db2.gz VRQWAMNNQVPIOP-NUNAXRQHSA-N 2 1 349.522 4.404 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCO1 ZINC001172063204 1049849611 /nfs/dbraw/zinc/84/96/11/1049849611.db2.gz ABXKNBSNWPNGOL-MXEMCNAFSA-N 2 1 342.527 4.119 20 0 EIADMP FC1(F)CC(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172063058 1049849818 /nfs/dbraw/zinc/84/98/18/1049849818.db2.gz VWWMJEQYHJNPOU-LDLYASANSA-N 2 1 334.454 4.207 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCCC[C@H]1OCc1ccccc1)C2 ZINC001172098206 1049849877 /nfs/dbraw/zinc/84/98/77/1049849877.db2.gz BUXLJIZEAMZAEU-PVIWCNJMSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCCC[C@H]1OCc1ccccc1)C2 ZINC001172098206 1049849881 /nfs/dbraw/zinc/84/98/81/1049849881.db2.gz BUXLJIZEAMZAEU-PVIWCNJMSA-N 2 1 342.527 4.119 20 0 EIADMP c1cc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cs1 ZINC001172064440 1049851663 /nfs/dbraw/zinc/85/16/63/1049851663.db2.gz GBGFHMCZRLFEED-ACDBMABISA-N 2 1 326.509 4.423 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245770363 1049852757 /nfs/dbraw/zinc/85/27/57/1049852757.db2.gz XEBGOLFGCFCYGV-RSPOEFSDSA-N 2 1 340.536 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1c(Cl)cccc1Cl)C2 ZINC001172102966 1049855425 /nfs/dbraw/zinc/85/54/25/1049855425.db2.gz RBUCNPBIXQSQLY-ZSOGYDGISA-N 2 1 327.299 4.141 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Br)s1 ZINC001172103744 1049855829 /nfs/dbraw/zinc/85/58/29/1049855829.db2.gz XDUHJBGCTDZDSX-FVCCEPFGSA-N 2 1 343.334 4.177 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1ccc(Cl)cc1Cl)C2 ZINC001172102439 1049856015 /nfs/dbraw/zinc/85/60/15/1049856015.db2.gz NCGATRVRSVEUJH-MUJYYYPQSA-N 2 1 327.299 4.141 20 0 EIADMP CN(Cc1ccc(Cl)cc1Cl)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172112773 1049856343 /nfs/dbraw/zinc/85/63/43/1049856343.db2.gz FESJTKFZHUUUBZ-MUJYYYPQSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172112773 1049856344 /nfs/dbraw/zinc/85/63/44/1049856344.db2.gz FESJTKFZHUUUBZ-MUJYYYPQSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172112773 1049856345 /nfs/dbraw/zinc/85/63/45/1049856345.db2.gz FESJTKFZHUUUBZ-MUJYYYPQSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1ccc(Cl)cc1Cl)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172112773 1049856346 /nfs/dbraw/zinc/85/63/46/1049856346.db2.gz FESJTKFZHUUUBZ-MUJYYYPQSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1ccc(Cl)cc1Cl)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172112773 1049856347 /nfs/dbraw/zinc/85/63/47/1049856347.db2.gz FESJTKFZHUUUBZ-MUJYYYPQSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CC[C@@H](OCc3ccccc3)CC1)C2 ZINC001172110372 1049856879 /nfs/dbraw/zinc/85/68/79/1049856879.db2.gz LRLYPNARXJVHFH-MRWPOJJOSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CC[C@@H](OCc3ccccc3)CC1)C2 ZINC001172110372 1049856882 /nfs/dbraw/zinc/85/68/82/1049856882.db2.gz LRLYPNARXJVHFH-MRWPOJJOSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1cc(C3CC[NH2+]CC3)c3ccccc31)C2 ZINC001172120925 1049858294 /nfs/dbraw/zinc/85/82/94/1049858294.db2.gz HRMYIYPYHACMCT-BWTSREIZSA-N 2 1 337.511 4.296 20 0 EIADMP COc1ccc(CC2(C[NH2+][C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CCC2)cc1 ZINC001172110955 1049858824 /nfs/dbraw/zinc/85/88/24/1049858824.db2.gz MOZYXYLHYPPARU-OWZKRDHZSA-N 2 1 342.527 4.013 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172326877 1049879708 /nfs/dbraw/zinc/87/97/08/1049879708.db2.gz BSOGAMSJXQTCEL-DYXWJJEUSA-N 2 1 346.559 4.470 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172326877 1049879710 /nfs/dbraw/zinc/87/97/10/1049879710.db2.gz BSOGAMSJXQTCEL-DYXWJJEUSA-N 2 1 346.559 4.470 20 0 EIADMP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@@H](O)c2ccsc2)CC1 ZINC000823911396 1049884289 /nfs/dbraw/zinc/88/42/89/1049884289.db2.gz HDFGRKLDFBKFTN-QGZVFWFLSA-N 2 1 338.561 4.050 20 0 EIADMP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@H](O)c2ccsc2)CC1 ZINC000823911395 1049884391 /nfs/dbraw/zinc/88/43/91/1049884391.db2.gz HDFGRKLDFBKFTN-KRWDZBQOSA-N 2 1 338.561 4.050 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC([NH3+])(c2ccccc2Cl)CC1 ZINC001172338934 1049888832 /nfs/dbraw/zinc/88/88/32/1049888832.db2.gz ZPTRDAJAYKVULU-JKSUJKDBSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001172340467 1049889260 /nfs/dbraw/zinc/88/92/60/1049889260.db2.gz KBARCGNPTXHPAJ-RTBURBONSA-N 2 1 332.532 4.177 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001172347915 1049890995 /nfs/dbraw/zinc/89/09/95/1049890995.db2.gz GGMBHGFWEAHNSE-VNYTWHDVSA-N 2 1 332.532 4.080 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC001172347915 1049891000 /nfs/dbraw/zinc/89/10/00/1049891000.db2.gz GGMBHGFWEAHNSE-VNYTWHDVSA-N 2 1 332.532 4.080 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001172355737 1049894011 /nfs/dbraw/zinc/89/40/11/1049894011.db2.gz VVIGZIMKPNJNIS-IRFCIJBXSA-N 2 1 332.532 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001172355737 1049894018 /nfs/dbraw/zinc/89/40/18/1049894018.db2.gz VVIGZIMKPNJNIS-IRFCIJBXSA-N 2 1 332.532 4.034 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172356185 1049894458 /nfs/dbraw/zinc/89/44/58/1049894458.db2.gz XYMYHUHRNXEVIR-RZUBCFFCSA-N 2 1 344.543 4.178 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172356185 1049894464 /nfs/dbraw/zinc/89/44/64/1049894464.db2.gz XYMYHUHRNXEVIR-RZUBCFFCSA-N 2 1 344.543 4.178 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001172396479 1049907200 /nfs/dbraw/zinc/90/72/00/1049907200.db2.gz DFCJIUURFJMGCW-HXUWFJFHSA-N 2 1 329.532 4.194 20 0 EIADMP CC(C)OCC[C@@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172436704 1049912657 /nfs/dbraw/zinc/91/26/57/1049912657.db2.gz HHVGBJKSTISEAM-UYAOXDASSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)OCC[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172436704 1049912663 /nfs/dbraw/zinc/91/26/63/1049912663.db2.gz HHVGBJKSTISEAM-UYAOXDASSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)OCC[C@H](C)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172437570 1049912752 /nfs/dbraw/zinc/91/27/52/1049912752.db2.gz RKIXQVPGDRDMJT-WDSOQIARSA-N 2 1 336.495 4.101 20 0 EIADMP CC(C)OCC[C@H](C)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001172459669 1049916917 /nfs/dbraw/zinc/91/69/17/1049916917.db2.gz KPSHRPILUNLAIX-BVSLBCMMSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001172459669 1049916921 /nfs/dbraw/zinc/91/69/21/1049916921.db2.gz KPSHRPILUNLAIX-BVSLBCMMSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001172459669 1049916925 /nfs/dbraw/zinc/91/69/25/1049916925.db2.gz KPSHRPILUNLAIX-BVSLBCMMSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172466212 1049918770 /nfs/dbraw/zinc/91/87/70/1049918770.db2.gz BMDIBOJMYIDAFV-FPOVZHCZSA-N 2 1 346.559 4.328 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172466212 1049918774 /nfs/dbraw/zinc/91/87/74/1049918774.db2.gz BMDIBOJMYIDAFV-FPOVZHCZSA-N 2 1 346.559 4.328 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172466215 1049918878 /nfs/dbraw/zinc/91/88/78/1049918878.db2.gz BMDIBOJMYIDAFV-PZJWPPBQSA-N 2 1 346.559 4.328 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172466215 1049918885 /nfs/dbraw/zinc/91/88/85/1049918885.db2.gz BMDIBOJMYIDAFV-PZJWPPBQSA-N 2 1 346.559 4.328 20 0 EIADMP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@@H]1CCC[N@@H+](C)CC1 ZINC001172577002 1049932462 /nfs/dbraw/zinc/93/24/62/1049932462.db2.gz QLAKXGGTKDLWKQ-TZMCWYRMSA-N 2 1 330.850 4.013 20 0 EIADMP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC001172575651 1049942085 /nfs/dbraw/zinc/94/20/85/1049942085.db2.gz JOBGNSNWNYYBAT-UONOGXRCSA-N 2 1 344.877 4.261 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CC(C)(C)OC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001172646507 1049954735 /nfs/dbraw/zinc/95/47/35/1049954735.db2.gz BOCVJGHRPFMQAR-IEBWSBKVSA-N 2 1 344.543 4.365 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CC(C)(C)OC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC001172646507 1049954737 /nfs/dbraw/zinc/95/47/37/1049954737.db2.gz BOCVJGHRPFMQAR-IEBWSBKVSA-N 2 1 344.543 4.365 20 0 EIADMP CC(C)(C)C[N@@H+]([C@@H]1Cc2ccc(Cl)cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172711931 1049971981 /nfs/dbraw/zinc/97/19/81/1049971981.db2.gz JOMYPMSRUGFIGJ-GUDVDZBRSA-N 2 1 334.935 4.425 20 0 EIADMP Cc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000246871827 1050003996 /nfs/dbraw/zinc/00/39/96/1050003996.db2.gz DMNJQWANWBTTDJ-OALUTQOASA-N 2 1 338.495 4.067 20 0 EIADMP Cc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000246871827 1050004005 /nfs/dbraw/zinc/00/40/05/1050004005.db2.gz DMNJQWANWBTTDJ-OALUTQOASA-N 2 1 338.495 4.067 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)C1 ZINC000247003934 1050009642 /nfs/dbraw/zinc/00/96/42/1050009642.db2.gz LUAGKWYTEXZGFO-ZIAGYGMSSA-N 2 1 344.421 4.198 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)C1 ZINC000247003934 1050009652 /nfs/dbraw/zinc/00/96/52/1050009652.db2.gz LUAGKWYTEXZGFO-ZIAGYGMSSA-N 2 1 344.421 4.198 20 0 EIADMP c1cncc(-c2cccc(C[NH+]3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)c2)c1 ZINC000247062631 1050011691 /nfs/dbraw/zinc/01/16/91/1050011691.db2.gz VJURAIARAHDNKP-JTHBVZDNSA-N 2 1 347.506 4.197 20 0 EIADMP c1cncc(-c2cccc(C[NH+]3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c2)c1 ZINC000247062631 1050011693 /nfs/dbraw/zinc/01/16/93/1050011693.db2.gz VJURAIARAHDNKP-JTHBVZDNSA-N 2 1 347.506 4.197 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(F)c1 ZINC000248389221 1050052707 /nfs/dbraw/zinc/05/27/07/1050052707.db2.gz AQHHZEJOJDKOLQ-PMPSAXMXSA-N 2 1 334.479 4.138 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(F)c1 ZINC000248389221 1050052710 /nfs/dbraw/zinc/05/27/10/1050052710.db2.gz AQHHZEJOJDKOLQ-PMPSAXMXSA-N 2 1 334.479 4.138 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1Cl ZINC000248862589 1050082191 /nfs/dbraw/zinc/08/21/91/1050082191.db2.gz SFSDQAODMFBFJI-IRXDYDNUSA-N 2 1 336.907 4.235 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1Cl ZINC000248862589 1050082196 /nfs/dbraw/zinc/08/21/96/1050082196.db2.gz SFSDQAODMFBFJI-IRXDYDNUSA-N 2 1 336.907 4.235 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248894212 1050083432 /nfs/dbraw/zinc/08/34/32/1050083432.db2.gz ZMTOUURPIPFELT-NLWGTHIKSA-N 2 1 334.548 4.111 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000090046553 1050152593 /nfs/dbraw/zinc/15/25/93/1050152593.db2.gz MALQIVZUPVOWJJ-BFYDXBDKSA-N 2 1 335.561 4.052 20 0 EIADMP COCc1c(C)cc(C)c(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c1C ZINC001177299366 1050180165 /nfs/dbraw/zinc/18/01/65/1050180165.db2.gz PIYJOGSJLHIXSD-KRWDZBQOSA-N 2 1 346.559 4.360 20 0 EIADMP Cc1coc(C[NH2+]Cc2ccc(C[N@@H+]3C[C@H](C)C[C@H](C)C3)cc2)c1 ZINC001177282843 1050187766 /nfs/dbraw/zinc/18/77/66/1050187766.db2.gz OCSPKTWVOLTSER-CALCHBBNSA-N 2 1 326.484 4.356 20 0 EIADMP CO[C@@H]1CCC[C@@H]([N@@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928122 1050238173 /nfs/dbraw/zinc/23/81/73/1050238173.db2.gz IXZRQQUZHITUAG-XRXFAXGQSA-N 2 1 330.516 4.025 20 0 EIADMP COc1ccccc1[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)C1CCCC1 ZINC000091268622 1050247792 /nfs/dbraw/zinc/24/77/92/1050247792.db2.gz RXBRVCXQQCPRHY-NRFANRHFSA-N 2 1 328.500 4.143 20 0 EIADMP CC(C)c1ncc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC001177548781 1050251613 /nfs/dbraw/zinc/25/16/13/1050251613.db2.gz RGSPANQTMQINAE-GOSISDBHSA-N 2 1 343.540 4.268 20 0 EIADMP CC(C)c1ncc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC001177548781 1050251627 /nfs/dbraw/zinc/25/16/27/1050251627.db2.gz RGSPANQTMQINAE-GOSISDBHSA-N 2 1 343.540 4.268 20 0 EIADMP CCn1c2ccccc2c2cc(C[N@@H+]3CC[C@@H]([NH3+])[C@H](F)CC3)ccc21 ZINC001206185069 1050263068 /nfs/dbraw/zinc/26/30/68/1050263068.db2.gz LAUDNWNDVZYORO-RTBURBONSA-N 2 1 339.458 4.076 20 0 EIADMP CCn1c2ccccc2c2cc(C[N@H+]3CC[C@@H]([NH3+])[C@H](F)CC3)ccc21 ZINC001206185069 1050263080 /nfs/dbraw/zinc/26/30/80/1050263080.db2.gz LAUDNWNDVZYORO-RTBURBONSA-N 2 1 339.458 4.076 20 0 EIADMP CC[C@H](C[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC001177668756 1050274603 /nfs/dbraw/zinc/27/46/03/1050274603.db2.gz CNHNQGRCNOUQAM-FCHUYYIVSA-N 2 1 336.523 4.334 20 0 EIADMP CCCOC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001173092095 1050283734 /nfs/dbraw/zinc/28/37/34/1050283734.db2.gz IVVUORPUCJZCFT-NTYOPAKOSA-N 2 1 344.543 4.367 20 0 EIADMP CCCOC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001173092095 1050283737 /nfs/dbraw/zinc/28/37/37/1050283737.db2.gz IVVUORPUCJZCFT-NTYOPAKOSA-N 2 1 344.543 4.367 20 0 EIADMP CCCOC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC001173096510 1050287051 /nfs/dbraw/zinc/28/70/51/1050287051.db2.gz QAOCHVRUGAUAAI-ZXDFIECXSA-N 2 1 344.543 4.224 20 0 EIADMP CCCOC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC001173096510 1050287057 /nfs/dbraw/zinc/28/70/57/1050287057.db2.gz QAOCHVRUGAUAAI-ZXDFIECXSA-N 2 1 344.543 4.224 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H]2c2ccccc2OC)CC1 ZINC001173112658 1050309302 /nfs/dbraw/zinc/30/93/02/1050309302.db2.gz YVGOCGWRCCWNSL-AFMYVXGZSA-N 2 1 330.516 4.485 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCSC[C@H]2c2ccccc2)CC1 ZINC001173114540 1050310702 /nfs/dbraw/zinc/31/07/02/1050310702.db2.gz OGVIAEUERPWKGO-MHJFOBGBSA-N 2 1 332.557 4.430 20 0 EIADMP Cc1ccc(-c2ncc(C[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C)C3)s2)cc1 ZINC000092043710 1050311656 /nfs/dbraw/zinc/31/16/56/1050311656.db2.gz WSEJEIZJQDCDNC-IEBWSBKVSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C)C3)s2)cc1 ZINC000092043710 1050311666 /nfs/dbraw/zinc/31/16/66/1050311666.db2.gz WSEJEIZJQDCDNC-IEBWSBKVSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C)C3)s2)cc1 ZINC000092043710 1050311678 /nfs/dbraw/zinc/31/16/78/1050311678.db2.gz WSEJEIZJQDCDNC-IEBWSBKVSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C)C3)s2)cc1 ZINC000092043710 1050311694 /nfs/dbraw/zinc/31/16/94/1050311694.db2.gz WSEJEIZJQDCDNC-IEBWSBKVSA-N 2 1 341.524 4.035 20 0 EIADMP CCc1ccc(C[C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001173237248 1050395071 /nfs/dbraw/zinc/39/50/71/1050395071.db2.gz GPIMETLQGHZWRZ-WMZHIEFXSA-N 2 1 336.523 4.292 20 0 EIADMP CCSC[C@H](C)[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001173303180 1050401390 /nfs/dbraw/zinc/40/13/90/1050401390.db2.gz FKPMXAKRRRHNRG-INIZCTEOSA-N 2 1 338.586 4.178 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001178457723 1050475337 /nfs/dbraw/zinc/47/53/37/1050475337.db2.gz CGLPVPRKQIHJMJ-IEBWSBKVSA-N 2 1 330.516 4.216 20 0 EIADMP C[C@@H]1CCC[C@@H](C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)[C@@H]1C ZINC001178595459 1050503889 /nfs/dbraw/zinc/50/38/89/1050503889.db2.gz PNOOEISKIODRQO-GGPKGHCWSA-N 2 1 346.534 4.495 20 0 EIADMP Cc1cc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)cc(C)c1-c1ccc(F)cc1 ZINC001206211318 1050531157 /nfs/dbraw/zinc/53/11/57/1050531157.db2.gz NJZHDJAOCWXFKH-VQTJNVASSA-N 2 1 344.449 4.371 20 0 EIADMP Cc1cc(C[N@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)cc(C)c1-c1ccc(F)cc1 ZINC001206211318 1050531168 /nfs/dbraw/zinc/53/11/68/1050531168.db2.gz NJZHDJAOCWXFKH-VQTJNVASSA-N 2 1 344.449 4.371 20 0 EIADMP CCC[N@@H+]1C[C@@H]2C[NH+](C3CCC4(CCc5ccccc54)CC3)C[C@@H]2C1 ZINC001173690878 1050544497 /nfs/dbraw/zinc/54/44/97/1050544497.db2.gz CENHUYCRFGJCRZ-CVFDLSLPSA-N 2 1 338.539 4.087 20 0 EIADMP CCC[NH+]1C[C@@H]2C[N@H+](C3CCC4(CCc5ccccc54)CC3)C[C@@H]2C1 ZINC001173690878 1050544509 /nfs/dbraw/zinc/54/45/09/1050544509.db2.gz CENHUYCRFGJCRZ-CVFDLSLPSA-N 2 1 338.539 4.087 20 0 EIADMP CCC[NH+]1C[C@@H]2C[N@@H+](C3CCC4(CCc5ccccc54)CC3)C[C@@H]2C1 ZINC001173690878 1050544519 /nfs/dbraw/zinc/54/45/19/1050544519.db2.gz CENHUYCRFGJCRZ-CVFDLSLPSA-N 2 1 338.539 4.087 20 0 EIADMP C[NH+]1CCC([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000182234509 1050557448 /nfs/dbraw/zinc/55/74/48/1050557448.db2.gz VZZXXYXGZMYMLJ-MRXNPFEDSA-N 2 1 326.456 4.063 20 0 EIADMP C[N@H+](Cc1cccc2[nH]ccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000093337027 1050570925 /nfs/dbraw/zinc/57/09/25/1050570925.db2.gz LVBNOXXXJFINIM-LJQANCHMSA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1cccc2[nH]ccc21)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000093337027 1050570935 /nfs/dbraw/zinc/57/09/35/1050570935.db2.gz LVBNOXXXJFINIM-LJQANCHMSA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1cccc2[nH]ccc21)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000093337027 1050570948 /nfs/dbraw/zinc/57/09/48/1050570948.db2.gz LVBNOXXXJFINIM-LJQANCHMSA-N 2 1 333.479 4.122 20 0 EIADMP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2nc(C)cs2)ccc1OC ZINC000182291979 1050584695 /nfs/dbraw/zinc/58/46/95/1050584695.db2.gz KTDQOWYDMUPEDU-OAHLLOKOSA-N 2 1 347.528 4.153 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001179024645 1050602711 /nfs/dbraw/zinc/60/27/11/1050602711.db2.gz OAXCISMVKFWALT-JBJBFBLISA-N 2 1 334.507 4.433 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001179024645 1050602727 /nfs/dbraw/zinc/60/27/27/1050602727.db2.gz OAXCISMVKFWALT-JBJBFBLISA-N 2 1 334.507 4.433 20 0 EIADMP Cc1c(Cl)cccc1C[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC001179015739 1050610183 /nfs/dbraw/zinc/61/01/83/1050610183.db2.gz KYBLBPNDUXPGDW-MOPGFXCFSA-N 2 1 328.887 4.083 20 0 EIADMP COC[C@H](CC(C)(C)C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001179034367 1050621676 /nfs/dbraw/zinc/62/16/76/1050621676.db2.gz FCKNKYXZSNDFQU-PMACEKPBSA-N 2 1 344.543 4.224 20 0 EIADMP COC[C@H](CC(C)(C)C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001179034367 1050621685 /nfs/dbraw/zinc/62/16/85/1050621685.db2.gz FCKNKYXZSNDFQU-PMACEKPBSA-N 2 1 344.543 4.224 20 0 EIADMP COC[C@@H](CC(C)(C)C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001179034370 1050622281 /nfs/dbraw/zinc/62/22/81/1050622281.db2.gz FCKNKYXZSNDFQU-WOJBJXKFSA-N 2 1 344.543 4.224 20 0 EIADMP COC[C@@H](CC(C)(C)C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001179034370 1050622285 /nfs/dbraw/zinc/62/22/85/1050622285.db2.gz FCKNKYXZSNDFQU-WOJBJXKFSA-N 2 1 344.543 4.224 20 0 EIADMP Fc1ccccc1-c1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)o1 ZINC001179258650 1050663123 /nfs/dbraw/zinc/66/31/23/1050663123.db2.gz PBBVDBBYXVYSGC-QGZVFWFLSA-N 2 1 342.458 4.297 20 0 EIADMP Fc1ccccc1-c1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)o1 ZINC001179258650 1050663129 /nfs/dbraw/zinc/66/31/29/1050663129.db2.gz PBBVDBBYXVYSGC-QGZVFWFLSA-N 2 1 342.458 4.297 20 0 EIADMP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]Cc3cc(Cl)ccc3OC3CCCC3)[C@H]2C1 ZINC001179817678 1050787200 /nfs/dbraw/zinc/78/72/00/1050787200.db2.gz RMUITMBGBZKFRQ-JVPBZIDWSA-N 2 1 348.918 4.091 20 0 EIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+]Cc3cc(Cl)ccc3OC3CCCC3)[C@H]2C1 ZINC001179817678 1050787210 /nfs/dbraw/zinc/78/72/10/1050787210.db2.gz RMUITMBGBZKFRQ-JVPBZIDWSA-N 2 1 348.918 4.091 20 0 EIADMP CC(C)(C)c1ccc(CC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001179925497 1050818679 /nfs/dbraw/zinc/81/86/79/1050818679.db2.gz ROCUJSBQWQVIDE-DENIHFKCSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001179925497 1050818687 /nfs/dbraw/zinc/81/86/87/1050818687.db2.gz ROCUJSBQWQVIDE-DENIHFKCSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC001179925497 1050818695 /nfs/dbraw/zinc/81/86/95/1050818695.db2.gz ROCUJSBQWQVIDE-DENIHFKCSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC001179925497 1050818700 /nfs/dbraw/zinc/81/87/00/1050818700.db2.gz ROCUJSBQWQVIDE-DENIHFKCSA-N 2 1 340.555 4.475 20 0 EIADMP C[N@H+](Cc1cccc(Oc2ccc(F)cc2)c1)CC1CC[NH+](C)CC1 ZINC001180001986 1050845224 /nfs/dbraw/zinc/84/52/24/1050845224.db2.gz HOQQRHSNZWVWGK-UHFFFAOYSA-N 2 1 342.458 4.392 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[N@@H+](C)CCCn1ccnc1 ZINC000572563913 1050905876 /nfs/dbraw/zinc/90/58/76/1050905876.db2.gz REIMWMMKUOMKIA-QINSGFPZSA-N 2 1 337.389 4.327 20 0 EIADMP Cc1cc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)cc(C)c1O ZINC001180225163 1050919179 /nfs/dbraw/zinc/91/91/79/1050919179.db2.gz OQAUJZYSHKCFLC-LJQANCHMSA-N 2 1 344.543 4.486 20 0 EIADMP CO[C@H](C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001180350276 1050965958 /nfs/dbraw/zinc/96/59/58/1050965958.db2.gz XOTYMGOJWPLFAR-BVYCBKJFSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1c[nH+]ccc1Nc1cccc2c1C[N@@H+](C)C[C@H]2c1ccccc1 ZINC001174539260 1051032559 /nfs/dbraw/zinc/03/25/59/1051032559.db2.gz ZYAMRGYSWWXDOW-IBGZPJMESA-N 2 1 329.447 4.133 20 0 EIADMP CC(C)(C)[C@]1(C[N@H+]2CCCSCC2)CC[NH+](Cc2ccccc2)C1 ZINC001180739736 1051070233 /nfs/dbraw/zinc/07/02/33/1051070233.db2.gz GVIAHDHXLKCABX-NRFANRHFSA-N 2 1 346.584 4.364 20 0 EIADMP CC(C)(C)[C@]1(C[NH+]2CCCSCC2)CC[N@H+](Cc2ccccc2)C1 ZINC001180739736 1051070237 /nfs/dbraw/zinc/07/02/37/1051070237.db2.gz GVIAHDHXLKCABX-NRFANRHFSA-N 2 1 346.584 4.364 20 0 EIADMP CC(C)(C)[C@]1(C[NH+]2CCCSCC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001180739736 1051070247 /nfs/dbraw/zinc/07/02/47/1051070247.db2.gz GVIAHDHXLKCABX-NRFANRHFSA-N 2 1 346.584 4.364 20 0 EIADMP CC(C)[N@@H+](CC[C@@H]1CCC[NH+]1C)Cc1cccc(C(F)(F)F)c1 ZINC001190661407 1051236685 /nfs/dbraw/zinc/23/66/85/1051236685.db2.gz SEQDIYCDXGBEJX-KRWDZBQOSA-N 2 1 328.422 4.400 20 0 EIADMP CC(C)[NH+](CC[C@@H]1CCC[N@@H+]1C)Cc1cccc(C(F)(F)F)c1 ZINC001190661407 1051236698 /nfs/dbraw/zinc/23/66/98/1051236698.db2.gz SEQDIYCDXGBEJX-KRWDZBQOSA-N 2 1 328.422 4.400 20 0 EIADMP CC(C)[NH+](CC[C@@H]1CCC[N@H+]1C)Cc1cccc(C(F)(F)F)c1 ZINC001190661407 1051236710 /nfs/dbraw/zinc/23/67/10/1051236710.db2.gz SEQDIYCDXGBEJX-KRWDZBQOSA-N 2 1 328.422 4.400 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)C1 ZINC000163218180 1051240210 /nfs/dbraw/zinc/24/02/10/1051240210.db2.gz REBSPULOAJQHLZ-ZFWWWQNUSA-N 2 1 347.503 4.250 20 0 EIADMP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533891 1051249427 /nfs/dbraw/zinc/24/94/27/1051249427.db2.gz COTKAVGURZDTKZ-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533891 1051249442 /nfs/dbraw/zinc/24/94/42/1051249442.db2.gz COTKAVGURZDTKZ-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533891 1051249457 /nfs/dbraw/zinc/24/94/57/1051249457.db2.gz COTKAVGURZDTKZ-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533891 1051249473 /nfs/dbraw/zinc/24/94/73/1051249473.db2.gz COTKAVGURZDTKZ-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP CC[N@@H+](CCc1ccc(Cl)cc1)Cc1ccc(C[NH+](C)C)cc1 ZINC001175063402 1051317183 /nfs/dbraw/zinc/31/71/83/1051317183.db2.gz YRUVUXICDNVZGG-UHFFFAOYSA-N 2 1 330.903 4.466 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000154841476 1051341192 /nfs/dbraw/zinc/34/11/92/1051341192.db2.gz URXFISCUADPVFD-OAQYLSRUSA-N 2 1 326.459 4.443 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cccc3ncccc23)C1 ZINC001191048957 1051350234 /nfs/dbraw/zinc/35/02/34/1051350234.db2.gz VLVCRMHDWSLVHU-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cccc3ncccc23)C1 ZINC001191048957 1051350240 /nfs/dbraw/zinc/35/02/40/1051350240.db2.gz VLVCRMHDWSLVHU-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cccc3ncccc23)C1 ZINC001191048957 1051350245 /nfs/dbraw/zinc/35/02/45/1051350245.db2.gz VLVCRMHDWSLVHU-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)ccc1SC ZINC000268843479 1051397095 /nfs/dbraw/zinc/39/70/95/1051397095.db2.gz DHNDXJXUWVLVFG-CVEARBPZSA-N 2 1 336.545 4.188 20 0 EIADMP CO[C@@H](CC(C)C)C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191358532 1051429366 /nfs/dbraw/zinc/42/93/66/1051429366.db2.gz MMZBVIWRHYQDJR-VXKWHMMOSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@@H](CC(C)C)C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001191358532 1051429374 /nfs/dbraw/zinc/42/93/74/1051429374.db2.gz MMZBVIWRHYQDJR-VXKWHMMOSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@@H](CC(C)C)C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001191358532 1051429380 /nfs/dbraw/zinc/42/93/80/1051429380.db2.gz MMZBVIWRHYQDJR-VXKWHMMOSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2cc[nH]c2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311009192 1051453125 /nfs/dbraw/zinc/45/31/25/1051453125.db2.gz WXUZODRPQNQOLU-DYESRHJHSA-N 2 1 333.479 4.168 20 0 EIADMP Cc1nc(-c2ccc([C@@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)cc2)cs1 ZINC000774111458 1051458106 /nfs/dbraw/zinc/45/81/06/1051458106.db2.gz XAGAJIGBZWYCFQ-NZKYFMOASA-N 2 1 341.524 4.394 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCOc3cccc(C(C)(C)C)c3)CC[C@H]21 ZINC001191521351 1051472658 /nfs/dbraw/zinc/47/26/58/1051472658.db2.gz PYFYREOFWSGLPC-GHTZIAJQSA-N 2 1 344.543 4.169 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCOc3cccc(C(C)(C)C)c3)CC[C@H]21 ZINC001191521351 1051472667 /nfs/dbraw/zinc/47/26/67/1051472667.db2.gz PYFYREOFWSGLPC-GHTZIAJQSA-N 2 1 344.543 4.169 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCOc3cccc(C(C)(C)C)c3)CC[C@H]21 ZINC001191521351 1051472672 /nfs/dbraw/zinc/47/26/72/1051472672.db2.gz PYFYREOFWSGLPC-GHTZIAJQSA-N 2 1 344.543 4.169 20 0 EIADMP C/C=C/COc1ccc(CC[C@H](C)[NH2+]CC[N@@H+]2CCCC2(C)C)cc1 ZINC001182307446 1051486513 /nfs/dbraw/zinc/48/65/13/1051486513.db2.gz BAEAYVBGZQOTND-UEKDZROGSA-N 2 1 344.543 4.427 20 0 EIADMP C/C=C/COc1ccc(CC[C@H](C)[NH2+]CC[N@H+]2CCCC2(C)C)cc1 ZINC001182307446 1051486517 /nfs/dbraw/zinc/48/65/17/1051486517.db2.gz BAEAYVBGZQOTND-UEKDZROGSA-N 2 1 344.543 4.427 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)c2ccccc21 ZINC000774184610 1051507607 /nfs/dbraw/zinc/50/76/07/1051507607.db2.gz DEDDZYXLPOGKMX-YUXAGFNASA-N 2 1 342.527 4.104 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCOC3(CCCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000271503937 1051543297 /nfs/dbraw/zinc/54/32/97/1051543297.db2.gz MJUSKISVOGQVPT-GIVPXCGWSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCOC3(CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000271503937 1051543310 /nfs/dbraw/zinc/54/33/10/1051543310.db2.gz MJUSKISVOGQVPT-GIVPXCGWSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000774300336 1051544896 /nfs/dbraw/zinc/54/48/96/1051544896.db2.gz DQYCVOBYKMIRFJ-JXFKEZNVSA-N 2 1 329.532 4.454 20 0 EIADMP CC(C)(C)[C@@]1(C[NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC[N@@H+](Cc2ccccc2)C1 ZINC001182453369 1051582546 /nfs/dbraw/zinc/58/25/46/1051582546.db2.gz SIVZKAWBVNRCBL-XAPVIXHLSA-N 2 1 326.528 4.313 20 0 EIADMP CCC(CC)(C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)SC ZINC000775511592 1051659622 /nfs/dbraw/zinc/65/96/22/1051659622.db2.gz DUIDCTFIHDIIPZ-HKUYNNGSSA-N 2 1 334.573 4.408 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158099006 1051709426 /nfs/dbraw/zinc/70/94/26/1051709426.db2.gz QPGLTDHJYHYLNR-NVXWUHKLSA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000158099006 1051709444 /nfs/dbraw/zinc/70/94/44/1051709444.db2.gz QPGLTDHJYHYLNR-NVXWUHKLSA-N 2 1 343.540 4.419 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000158109823 1051712659 /nfs/dbraw/zinc/71/26/59/1051712659.db2.gz STNZCQWGZNPLOD-LSDHHAIUSA-N 2 1 348.437 4.434 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000158162354 1051721570 /nfs/dbraw/zinc/72/15/70/1051721570.db2.gz HJHWZLDLJJYTKR-IIBYNOLFSA-N 2 1 326.484 4.231 20 0 EIADMP Cc1ccc2sc(C[N@@H+](C)CCCC[NH+]3CCCCC3)nc2c1 ZINC001175687701 1051729611 /nfs/dbraw/zinc/72/96/11/1051729611.db2.gz KQRDKXUWWOHGBY-UHFFFAOYSA-N 2 1 331.529 4.303 20 0 EIADMP CC(C)O[C@H](C[N@@H+](C)CCCC[NH+]1CCCCC1)c1ccccc1 ZINC001175687641 1051729730 /nfs/dbraw/zinc/72/97/30/1051729730.db2.gz JSAARRBQGUWRLW-OAQYLSRUSA-N 2 1 332.532 4.351 20 0 EIADMP Cc1nc(C(F)(F)F)c(C[N@@H+](C)CCCC[NH+]2CCCCC2)s1 ZINC001175690120 1051730383 /nfs/dbraw/zinc/73/03/83/1051730383.db2.gz VRNKATLGCJOBMX-UHFFFAOYSA-N 2 1 349.466 4.168 20 0 EIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1csc(Br)c1 ZINC001175690186 1051731981 /nfs/dbraw/zinc/73/19/81/1051731981.db2.gz WMMUATUTLAAZKP-UHFFFAOYSA-N 2 1 345.350 4.209 20 0 EIADMP C[C@@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001183095485 1051787087 /nfs/dbraw/zinc/78/70/87/1051787087.db2.gz QFQVCZGBMOYIHX-PKOBYXMFSA-N 2 1 339.527 4.201 20 0 EIADMP FC(F)(F)C1CCC([NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)CC1 ZINC001183379005 1051840084 /nfs/dbraw/zinc/84/00/84/1051840084.db2.gz HXAAFMLJXRDFED-DQPZFDDXSA-N 2 1 332.454 4.494 20 0 EIADMP FC(F)(F)C1CCC([NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)CC1 ZINC001183379005 1051840090 /nfs/dbraw/zinc/84/00/90/1051840090.db2.gz HXAAFMLJXRDFED-DQPZFDDXSA-N 2 1 332.454 4.494 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1)[C@H]1COc2ccccc2C1 ZINC001183379234 1051840213 /nfs/dbraw/zinc/84/02/13/1051840213.db2.gz KTEVZNQFSDNHGY-DSKINZAPSA-N 2 1 342.527 4.013 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1)[C@H]1COc2ccccc2C1 ZINC001183379234 1051840217 /nfs/dbraw/zinc/84/02/17/1051840217.db2.gz KTEVZNQFSDNHGY-DSKINZAPSA-N 2 1 342.527 4.013 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)CC[N@@H+]1C ZINC000621765810 1051942792 /nfs/dbraw/zinc/94/27/92/1051942792.db2.gz FNJAWHFVKXRYNS-CJNGLKHVSA-N 2 1 326.406 4.157 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)CC[N@H+]1C ZINC000621765810 1051942799 /nfs/dbraw/zinc/94/27/99/1051942799.db2.gz FNJAWHFVKXRYNS-CJNGLKHVSA-N 2 1 326.406 4.157 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3cccc(Cl)c3)CC2)[nH+]c1 ZINC000163496894 1051990742 /nfs/dbraw/zinc/99/07/42/1051990742.db2.gz AVMUTNJLEFNFQL-HNNXBMFYSA-N 2 1 329.875 4.363 20 0 EIADMP CCC[C@@]1(COC)CCC[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001193872401 1052022442 /nfs/dbraw/zinc/02/24/42/1052022442.db2.gz NEFJWJSOJMWSDT-QFIPXVFZSA-N 2 1 344.543 4.454 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000164484169 1052031935 /nfs/dbraw/zinc/03/19/35/1052031935.db2.gz JPKZWJHVLANGEH-IBGZPJMESA-N 2 1 328.500 4.287 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cc1 ZINC000165001958 1052048361 /nfs/dbraw/zinc/04/83/61/1052048361.db2.gz IPPUPIQEFLIDHE-KNBMTAEXSA-N 2 1 344.524 4.490 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)cc1 ZINC000165001958 1052048368 /nfs/dbraw/zinc/04/83/68/1052048368.db2.gz IPPUPIQEFLIDHE-KNBMTAEXSA-N 2 1 344.524 4.490 20 0 EIADMP c1cc(C[N@H+]2CCCSC[C@H]2C2CC2)ccc1C[NH+]1CCCCC1 ZINC001176650355 1052168074 /nfs/dbraw/zinc/16/80/74/1052168074.db2.gz REURFYBCNBMUDD-NRFANRHFSA-N 2 1 344.568 4.390 20 0 EIADMP C[C@@H]1CCC[C@H](C[NH2+]c2ccc(N3CCC([NH+](C)C)CC3)cc2)C1 ZINC000774824212 1052172470 /nfs/dbraw/zinc/17/24/70/1052172470.db2.gz MAWSXPGDOUGQQL-MSOLQXFVSA-N 2 1 329.532 4.455 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000339066076 1052551653 /nfs/dbraw/zinc/55/16/53/1052551653.db2.gz FCEQNTHQKQVAJG-SJBKTWHCSA-N 2 1 344.543 4.399 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000379903737 1052565614 /nfs/dbraw/zinc/56/56/14/1052565614.db2.gz IIFFGIZEADSVOW-HBFSDRIKSA-N 2 1 326.484 4.101 20 0 EIADMP C[N@H+]1CC[C@H](N[C@H](c2cccs2)c2ccc(F)cc2)CC1(C)C ZINC000623342028 1052625624 /nfs/dbraw/zinc/62/56/24/1052625624.db2.gz BHEAZOVKVWBUBN-WMZOPIPTSA-N 2 1 332.488 4.439 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349598 1052630193 /nfs/dbraw/zinc/63/01/93/1052630193.db2.gz GFVBJKDFFPRKOM-RDJZCZTQSA-N 2 1 334.504 4.006 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349598 1052630198 /nfs/dbraw/zinc/63/01/98/1052630198.db2.gz GFVBJKDFFPRKOM-RDJZCZTQSA-N 2 1 334.504 4.006 20 0 EIADMP CCCOc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1OC ZINC000623360117 1052632500 /nfs/dbraw/zinc/63/25/00/1052632500.db2.gz VYPOJYINYHAJPS-RDJZCZTQSA-N 2 1 334.504 4.007 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1OC ZINC000623360117 1052632505 /nfs/dbraw/zinc/63/25/05/1052632505.db2.gz VYPOJYINYHAJPS-RDJZCZTQSA-N 2 1 334.504 4.007 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)CC1(C)C ZINC000623377636 1052638812 /nfs/dbraw/zinc/63/88/12/1052638812.db2.gz DJVMMLADFFFEBO-MRXNPFEDSA-N 2 1 328.422 4.100 20 0 EIADMP CO[C@@H](C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccccc1 ZINC000178458186 1052705804 /nfs/dbraw/zinc/70/58/04/1052705804.db2.gz YHSQQJFIAILUPY-KKSFZXQISA-N 2 1 335.451 4.219 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cc(Br)ccc1C ZINC000623867592 1052825694 /nfs/dbraw/zinc/82/56/94/1052825694.db2.gz FMPGFFGBQMRVDY-CYBMUJFWSA-N 2 1 336.277 4.003 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1C(F)(F)F ZINC000623995861 1052849273 /nfs/dbraw/zinc/84/92/73/1052849273.db2.gz KWUCBMOLAAQHOB-HLVVYCRESA-N 2 1 330.369 4.120 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1C(F)(F)F ZINC000623995861 1052849275 /nfs/dbraw/zinc/84/92/75/1052849275.db2.gz KWUCBMOLAAQHOB-HLVVYCRESA-N 2 1 330.369 4.120 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c2ccccc12 ZINC000624119588 1052867259 /nfs/dbraw/zinc/86/72/59/1052867259.db2.gz FNMQOZKBFSLDEJ-IRXDYDNUSA-N 2 1 326.484 4.231 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000624125007 1052868731 /nfs/dbraw/zinc/86/87/31/1052868731.db2.gz QUOXXPWTDWFLTH-QWHCGFSZSA-N 2 1 332.385 4.227 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1nccn1C ZINC000182960264 1052957504 /nfs/dbraw/zinc/95/75/04/1052957504.db2.gz INEAFRBVXFSCBN-HXUWFJFHSA-N 2 1 340.515 4.037 20 0 EIADMP C[C@@H]([NH2+]CCSc1ccc(F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185706602 1053021089 /nfs/dbraw/zinc/02/10/89/1053021089.db2.gz DKESLWHYHAKWCM-HZPDHXFCSA-N 2 1 336.520 4.160 20 0 EIADMP C[C@H]([NH2+]CCSc1ccc(F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185706621 1053021559 /nfs/dbraw/zinc/02/15/59/1053021559.db2.gz DKESLWHYHAKWCM-HOTGVXAUSA-N 2 1 336.520 4.160 20 0 EIADMP C[C@@H]([NH2+]Cc1cc(F)cc2cccnc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185722877 1053021644 /nfs/dbraw/zinc/02/16/44/1053021644.db2.gz FBDFHONQBNRCFN-NVXWUHKLSA-N 2 1 341.474 4.117 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCCNc4ccccc43)C2)cc1 ZINC000195138970 1053052750 /nfs/dbraw/zinc/05/27/50/1053052750.db2.gz HNOFEUCVUDALQA-DENIHFKCSA-N 2 1 335.495 4.045 20 0 EIADMP FC(F)(F)c1cccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000381184593 1053056956 /nfs/dbraw/zinc/05/69/56/1053056956.db2.gz LMHMFXSTXULEEL-GOSISDBHSA-N 2 1 348.412 4.317 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000381195277 1053057778 /nfs/dbraw/zinc/05/77/78/1053057778.db2.gz ZVBSNEPYWJPDKP-VSKRKVRLSA-N 2 1 344.543 4.082 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000381796054 1053097544 /nfs/dbraw/zinc/09/75/44/1053097544.db2.gz BNLINQCEQLABKV-ZGXWSNOMSA-N 2 1 348.481 4.312 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000381796053 1053097936 /nfs/dbraw/zinc/09/79/36/1053097936.db2.gz BNLINQCEQLABKV-YSTOQKLRSA-N 2 1 348.481 4.312 20 0 EIADMP C[C@@H]([NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000850466523 1053245289 /nfs/dbraw/zinc/24/52/89/1053245289.db2.gz LIFWFJAOLZKADK-VGOFRKELSA-N 2 1 349.478 4.391 20 0 EIADMP C[C@@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000850466523 1053245302 /nfs/dbraw/zinc/24/53/02/1053245302.db2.gz LIFWFJAOLZKADK-VGOFRKELSA-N 2 1 349.478 4.391 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)[C@@H](C)C2CCCCC2)cn1 ZINC000765248633 1053476513 /nfs/dbraw/zinc/47/65/13/1053476513.db2.gz AAGHCYDNCMHEII-CVEARBPZSA-N 2 1 326.488 4.270 20 0 EIADMP CC(C)([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)[C@H]1CCCCO1 ZINC000865743940 1053583358 /nfs/dbraw/zinc/58/33/58/1053583358.db2.gz KERHMOIRVNPYTN-VQTJNVASSA-N 2 1 342.527 4.121 20 0 EIADMP CC(C)([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)[C@H]1CCCCO1 ZINC000865743940 1053583368 /nfs/dbraw/zinc/58/33/68/1053583368.db2.gz KERHMOIRVNPYTN-VQTJNVASSA-N 2 1 342.527 4.121 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+]CC2(c3cccc(Cl)c3)CCC2)s1 ZINC000865777123 1053590089 /nfs/dbraw/zinc/59/00/89/1053590089.db2.gz SNNBRXAVOQOWPA-UHFFFAOYSA-N 2 1 349.931 4.070 20 0 EIADMP [NH3+]CCCCCCC[N@H+]1CCc2nc(-c3ccccc3)sc2C1 ZINC000852755151 1053610385 /nfs/dbraw/zinc/61/03/85/1053610385.db2.gz DWOPDRFPCDISOA-UHFFFAOYSA-N 2 1 329.513 4.077 20 0 EIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cc2c(ccnc2Cl)o1 ZINC000866214865 1053653776 /nfs/dbraw/zinc/65/37/76/1053653776.db2.gz HEUGQCAYIGDVEP-LLVKDONJSA-N 2 1 335.879 4.441 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)C1 ZINC000866259789 1053666989 /nfs/dbraw/zinc/66/69/89/1053666989.db2.gz GBNVVNLCWDFRAO-UONOGXRCSA-N 2 1 335.879 4.252 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)C1 ZINC000866259789 1053666998 /nfs/dbraw/zinc/66/69/98/1053666998.db2.gz GBNVVNLCWDFRAO-UONOGXRCSA-N 2 1 335.879 4.252 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)CCc2cncc3ccccc32)C1 ZINC000866260913 1053667867 /nfs/dbraw/zinc/66/78/67/1053667867.db2.gz PHORDZFIMHHLHA-RTBURBONSA-N 2 1 339.527 4.266 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000866272383 1053673039 /nfs/dbraw/zinc/67/30/39/1053673039.db2.gz NQVWOWRJHZLXCP-IMFGXOCKSA-N 2 1 343.540 4.137 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000866272383 1053673047 /nfs/dbraw/zinc/67/30/47/1053673047.db2.gz NQVWOWRJHZLXCP-IMFGXOCKSA-N 2 1 343.540 4.137 20 0 EIADMP C[C@@H]1CCCCN1c1cccc(N2C[C@@H](CC[NH3+])c3ccccc32)[nH+]1 ZINC001168544416 1053702944 /nfs/dbraw/zinc/70/29/44/1053702944.db2.gz OPMQTRPQWKYGPR-IAGOWNOFSA-N 2 1 336.483 4.045 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866372470 1053709039 /nfs/dbraw/zinc/70/90/39/1053709039.db2.gz GXFDBBBDCSNYRZ-UNMCSNQZSA-N 2 1 337.511 4.077 20 0 EIADMP CC[N@@H+](CCCc1c(F)cccc1F)Cc1ccc(C[NH+](C)C)cc1 ZINC001196624017 1053716653 /nfs/dbraw/zinc/71/66/53/1053716653.db2.gz XJPIZFMNSGSVSQ-UHFFFAOYSA-N 2 1 346.465 4.481 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386432683 1053723998 /nfs/dbraw/zinc/72/39/98/1053723998.db2.gz OOEJLXSFWDMRGI-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386432683 1053724011 /nfs/dbraw/zinc/72/40/11/1053724011.db2.gz OOEJLXSFWDMRGI-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@@]12C[NH+](CCC3CCCC3)C[C@@]1(C)C[NH+](Cc1ccccc1)C2 ZINC001196960033 1053813944 /nfs/dbraw/zinc/81/39/44/1053813944.db2.gz CDHZKJYCQVOTLF-VXKWHMMOSA-N 2 1 326.528 4.411 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386797872 1053829523 /nfs/dbraw/zinc/82/95/23/1053829523.db2.gz MFGQFWZLYGCAFY-LQWHRVPQSA-N 2 1 340.486 4.257 20 0 EIADMP Cc1[nH]c(C2CC[NH+](CCc3nsc4ccccc34)CC2)[nH+]c1C ZINC001197844352 1054003791 /nfs/dbraw/zinc/00/37/91/1054003791.db2.gz DVWIXRLQEGUGPW-UHFFFAOYSA-N 2 1 340.496 4.058 20 0 EIADMP Cc1cc(C)nc(C[N@H+]2CCC[C@H](c3cncn3C(C)(C)C)C2)c1 ZINC001198791706 1054266229 /nfs/dbraw/zinc/26/62/29/1054266229.db2.gz YEPJETMVXHJGCA-KRWDZBQOSA-N 2 1 326.488 4.030 20 0 EIADMP C[N@@H+](CCCNCc1cc(O)cc(C(F)(F)F)c1)C1CCCCC1 ZINC001198907852 1054308800 /nfs/dbraw/zinc/30/88/00/1054308800.db2.gz ICTBZSPDXJXLOS-UHFFFAOYSA-N 2 1 344.421 4.155 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1cc(O)cc(C(F)(F)F)c1)C1CCCCC1 ZINC001198907852 1054308815 /nfs/dbraw/zinc/30/88/15/1054308815.db2.gz ICTBZSPDXJXLOS-UHFFFAOYSA-N 2 1 344.421 4.155 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1cc(O)cc(C(F)(F)F)c1)C1CCCCC1 ZINC001198907852 1054308832 /nfs/dbraw/zinc/30/88/32/1054308832.db2.gz ICTBZSPDXJXLOS-UHFFFAOYSA-N 2 1 344.421 4.155 20 0 EIADMP CC[N@H+]1CCC[C@@H]1CNCc1ccc(Sc2ccccc2)cc1 ZINC001198908291 1054308890 /nfs/dbraw/zinc/30/88/90/1054308890.db2.gz OCEQMZDJACVUPT-GOSISDBHSA-N 2 1 326.509 4.412 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)CC1 ZINC000872025630 1054340334 /nfs/dbraw/zinc/34/03/34/1054340334.db2.gz QJJOWZGLWOEVQT-NHCUHLMSSA-N 2 1 344.543 4.143 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@H]3CCOC4(CCCC4)C3)C2)c1 ZINC000872029979 1054346018 /nfs/dbraw/zinc/34/60/18/1054346018.db2.gz WWNGNPLBLLIJAM-ROUUACIJSA-N 2 1 348.556 4.042 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3CCOC4(CCCC4)C3)C2)c1 ZINC000872029979 1054346041 /nfs/dbraw/zinc/34/60/41/1054346041.db2.gz WWNGNPLBLLIJAM-ROUUACIJSA-N 2 1 348.556 4.042 20 0 EIADMP Cc1cc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)cc2cccnc12 ZINC001199238915 1054369882 /nfs/dbraw/zinc/36/98/82/1054369882.db2.gz WNXMOINSOXBYAP-UHFFFAOYSA-N 2 1 345.490 4.081 20 0 EIADMP CC(C)[C@@H](C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1)[NH+]1CCC(C)CC1 ZINC001199258524 1054374713 /nfs/dbraw/zinc/37/47/13/1054374713.db2.gz KQJBEPYYQMWXRJ-BAGYTPMASA-N 2 1 343.559 4.454 20 0 EIADMP CC(C)n1c2ccccc2nc1C[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC001199336663 1054385731 /nfs/dbraw/zinc/38/57/31/1054385731.db2.gz UVYHEZNIHSKUAG-GOSISDBHSA-N 2 1 342.531 4.361 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC001199319966 1054390816 /nfs/dbraw/zinc/39/08/16/1054390816.db2.gz GJAGRXXJGCVLFZ-JQVVWYNYSA-N 2 1 328.544 4.282 20 0 EIADMP COc1cc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc(C(F)(F)F)c1 ZINC000858100738 1054415868 /nfs/dbraw/zinc/41/58/68/1054415868.db2.gz NCSZROIRESGGJK-UHFFFAOYSA-N 2 1 344.421 4.067 20 0 EIADMP C[N@@H+](Cc1ccccc1C[NH2+]Cc1ccnc(F)c1)C1CCCCC1 ZINC000858104507 1054419013 /nfs/dbraw/zinc/41/90/13/1054419013.db2.gz NCUAWSBIXGPNER-UHFFFAOYSA-N 2 1 341.474 4.275 20 0 EIADMP Cc1noc(C)c1C[N@H+]1CCCC12CC[NH+](CC1CCCCC1)CC2 ZINC001201388612 1054786635 /nfs/dbraw/zinc/78/66/35/1054786635.db2.gz BHJSYCDECCSZNN-UHFFFAOYSA-N 2 1 345.531 4.302 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CCCc1cccs1 ZINC001201450600 1054813255 /nfs/dbraw/zinc/81/32/55/1054813255.db2.gz XYCIVNXTNVAOIN-UHFFFAOYSA-N 2 1 330.541 4.429 20 0 EIADMP CC(C)=CCC[C@@H](C)C[N@@H+]1CCn2c(C[NH+](C)C(C)C)cnc2[C@@H]1C ZINC001201488097 1054817322 /nfs/dbraw/zinc/81/73/22/1054817322.db2.gz VPFUOXLCCUMVRD-MOPGFXCFSA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@@H](C)C[N@H+]1CCn2c(C[NH+](C)C(C)C)cnc2[C@@H]1C ZINC001201488097 1054817326 /nfs/dbraw/zinc/81/73/26/1054817326.db2.gz VPFUOXLCCUMVRD-MOPGFXCFSA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@@H](C)C[NH+]1CCn2c(C[N@H+](C)C(C)C)cnc2[C@@H]1C ZINC001201488097 1054817330 /nfs/dbraw/zinc/81/73/30/1054817330.db2.gz VPFUOXLCCUMVRD-MOPGFXCFSA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@@H](C)C[NH+]1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@@H]1C ZINC001201488097 1054817333 /nfs/dbraw/zinc/81/73/33/1054817333.db2.gz VPFUOXLCCUMVRD-MOPGFXCFSA-N 2 1 346.563 4.482 20 0 EIADMP CCCC[C@@H](CC)C[NH+]1CCC2(CCC[N@@H+]2Cc2ccn(C)n2)CC1 ZINC001201566413 1054850600 /nfs/dbraw/zinc/85/06/00/1054850600.db2.gz TWHVXGFFACADJS-LJQANCHMSA-N 2 1 346.563 4.067 20 0 EIADMP CCCC[C@@H](CC)C[NH+]1CCC2(CCC[N@H+]2Cc2ccn(C)n2)CC1 ZINC001201566413 1054850602 /nfs/dbraw/zinc/85/06/02/1054850602.db2.gz TWHVXGFFACADJS-LJQANCHMSA-N 2 1 346.563 4.067 20 0 EIADMP c1ccc(CC[NH+]2CCC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1 ZINC001201606056 1054861544 /nfs/dbraw/zinc/86/15/44/1054861544.db2.gz FKCNNUFDCUTEGW-QHCPKHFHSA-N 2 1 334.507 4.217 20 0 EIADMP CCCCCC[N@@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201755222 1054898030 /nfs/dbraw/zinc/89/80/30/1054898030.db2.gz UPSUUPRRYPCDPR-TYPHKJRUSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201755222 1054898033 /nfs/dbraw/zinc/89/80/33/1054898033.db2.gz UPSUUPRRYPCDPR-TYPHKJRUSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201755222 1054898041 /nfs/dbraw/zinc/89/80/41/1054898041.db2.gz UPSUUPRRYPCDPR-TYPHKJRUSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201755222 1054898042 /nfs/dbraw/zinc/89/80/42/1054898042.db2.gz UPSUUPRRYPCDPR-TYPHKJRUSA-N 2 1 329.532 4.194 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+]CC34CCC(CC3)C4)CC2)cc1 ZINC001201788356 1054920538 /nfs/dbraw/zinc/92/05/38/1054920538.db2.gz YIYYXLPAPTVXAQ-UHFFFAOYSA-N 2 1 330.491 4.003 20 0 EIADMP c1nc2cc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)ccc2s1 ZINC001201856890 1054924042 /nfs/dbraw/zinc/92/40/42/1054924042.db2.gz CRBOWKMXNQSONY-UHFFFAOYSA-N 2 1 329.513 4.041 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)s1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201947393 1054963475 /nfs/dbraw/zinc/96/34/75/1054963475.db2.gz XFXBOSZVEYFKHJ-HUUCEWRRSA-N 2 1 335.561 4.183 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)s1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001201947393 1054963491 /nfs/dbraw/zinc/96/34/91/1054963491.db2.gz XFXBOSZVEYFKHJ-HUUCEWRRSA-N 2 1 335.561 4.183 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000877189856 1055032658 /nfs/dbraw/zinc/03/26/58/1055032658.db2.gz UEKUEJWILVRZRZ-ZIAGYGMSSA-N 2 1 347.890 4.224 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000877189856 1055032674 /nfs/dbraw/zinc/03/26/74/1055032674.db2.gz UEKUEJWILVRZRZ-ZIAGYGMSSA-N 2 1 347.890 4.224 20 0 EIADMP COCC(C)(C)CC[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877803734 1055123245 /nfs/dbraw/zinc/12/32/45/1055123245.db2.gz JDMAKYZATZYEAT-AZUAARDMSA-N 2 1 330.516 4.007 20 0 EIADMP COCC(C)(C)CC[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877803734 1055123254 /nfs/dbraw/zinc/12/32/54/1055123254.db2.gz JDMAKYZATZYEAT-AZUAARDMSA-N 2 1 330.516 4.007 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(C)c(Cl)n2)cc1 ZINC000878368356 1055272467 /nfs/dbraw/zinc/27/24/67/1055272467.db2.gz BEIWPECIMOXPST-AWEZNQCLSA-N 2 1 340.858 4.388 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000623656914 1055533397 /nfs/dbraw/zinc/53/33/97/1055533397.db2.gz FMWKFQBMRXWOLV-RBFDBLARSA-N 2 1 338.442 4.013 20 0 EIADMP CSC[C@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccc(C(F)(F)F)cc1 ZINC000542847844 1056227873 /nfs/dbraw/zinc/22/78/73/1056227873.db2.gz UKYVTNSBJPPPDZ-WFASDCNBSA-N 2 1 334.451 4.039 20 0 EIADMP Clc1ccc(Cl)c(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000303908480 1056345465 /nfs/dbraw/zinc/34/54/65/1056345465.db2.gz MKBGWVIWPPHKFF-UHFFFAOYSA-N 2 1 327.299 4.301 20 0 EIADMP Brc1cccc(C2([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000180429448 1058599087 /nfs/dbraw/zinc/59/90/87/1058599087.db2.gz GLCNSMUQVVOPGN-IAGOWNOFSA-N 2 1 349.316 4.045 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000746048241 1059985084 /nfs/dbraw/zinc/98/50/84/1059985084.db2.gz ZIRNYBVCPACIEA-DYESRHJHSA-N 2 1 344.543 4.278 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(Cl)ccc1OC ZINC000191470788 1060191810 /nfs/dbraw/zinc/19/18/10/1060191810.db2.gz RYKYFOPRVBHOEG-UHFFFAOYSA-N 2 1 335.879 4.020 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(Cl)ccc1OC ZINC000191470788 1060191819 /nfs/dbraw/zinc/19/18/19/1060191819.db2.gz RYKYFOPRVBHOEG-UHFFFAOYSA-N 2 1 335.879 4.020 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)CCC[C@H]1C[NH3+] ZINC001205995737 1060511866 /nfs/dbraw/zinc/51/18/66/1060511866.db2.gz PTMFGELENJHKPF-NEPJUHHUSA-N 2 1 334.813 4.166 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)c(Cl)c1)C2 ZINC001169098955 1060637728 /nfs/dbraw/zinc/63/77/28/1060637728.db2.gz MTZWQXKZHVOKGP-CLLJXQQHSA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)c(Cl)c1)C2 ZINC001169098955 1060637739 /nfs/dbraw/zinc/63/77/39/1060637739.db2.gz MTZWQXKZHVOKGP-CLLJXQQHSA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3ccccc3)CCC(F)(F)CC1)C2 ZINC001169117108 1060646578 /nfs/dbraw/zinc/64/65/78/1060646578.db2.gz VSZJLUQWIRYCCG-NNZMDNLPSA-N 2 1 334.454 4.306 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC[C@@H]1CCc2ccccc21 ZINC001169224361 1060703115 /nfs/dbraw/zinc/70/31/15/1060703115.db2.gz IEEGWIDBGFGGEU-IBGZPJMESA-N 2 1 325.500 4.278 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC[C@@H]1CCc2ccccc21 ZINC001169224361 1060703124 /nfs/dbraw/zinc/70/31/24/1060703124.db2.gz IEEGWIDBGFGGEU-IBGZPJMESA-N 2 1 325.500 4.278 20 0 EIADMP Cc1ccccc1CCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC001169566941 1060859837 /nfs/dbraw/zinc/85/98/37/1060859837.db2.gz KUAROABLZDJOEM-OFNKIYASSA-N 2 1 336.523 4.428 20 0 EIADMP Cc1ccccc1CCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC001169566941 1060859842 /nfs/dbraw/zinc/85/98/42/1060859842.db2.gz KUAROABLZDJOEM-OFNKIYASSA-N 2 1 336.523 4.428 20 0 EIADMP c1cc(N2CCC(Nc3ccc([NH+]4CCCCC4)cc3)CC2)cc[nH+]1 ZINC000297923591 526430931 /nfs/dbraw/zinc/43/09/31/526430931.db2.gz UBDNOEKJCPXVDC-UHFFFAOYSA-N 2 1 336.483 4.153 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@H]1CCC[NH+](Cc2cccc3cc[nH]c32)CC1 ZINC000275806949 564010140 /nfs/dbraw/zinc/01/01/40/564010140.db2.gz TXVUOLQVHORPEW-NRFANRHFSA-N 2 1 348.494 4.049 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH+](Cc2cccc3cc[nH]c32)CC1 ZINC000275806949 564010141 /nfs/dbraw/zinc/01/01/41/564010141.db2.gz TXVUOLQVHORPEW-NRFANRHFSA-N 2 1 348.494 4.049 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@H+](Cc2cccc3cc[nH]c32)CC1 ZINC000275806949 564010142 /nfs/dbraw/zinc/01/01/42/564010142.db2.gz TXVUOLQVHORPEW-NRFANRHFSA-N 2 1 348.494 4.049 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@@H+](Cc2cccc3cc[nH]c32)CC1 ZINC000275806949 564010143 /nfs/dbraw/zinc/01/01/43/564010143.db2.gz TXVUOLQVHORPEW-NRFANRHFSA-N 2 1 348.494 4.049 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[NH+](Cc2cccc3[nH]ccc32)CC1 ZINC000275824828 564010170 /nfs/dbraw/zinc/01/01/70/564010170.db2.gz VAQKXHOBQYXVGS-HXUWFJFHSA-N 2 1 348.494 4.049 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[NH+](Cc2cccc3[nH]ccc32)CC1 ZINC000275824828 564010171 /nfs/dbraw/zinc/01/01/71/564010171.db2.gz VAQKXHOBQYXVGS-HXUWFJFHSA-N 2 1 348.494 4.049 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@H+](Cc2cccc3[nH]ccc32)CC1 ZINC000275824828 564010172 /nfs/dbraw/zinc/01/01/72/564010172.db2.gz VAQKXHOBQYXVGS-HXUWFJFHSA-N 2 1 348.494 4.049 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)CC1 ZINC000275824828 564010173 /nfs/dbraw/zinc/01/01/73/564010173.db2.gz VAQKXHOBQYXVGS-HXUWFJFHSA-N 2 1 348.494 4.049 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]Cc3ccc4ccccc4n3)CC2)C1 ZINC000532205410 1032075404 /nfs/dbraw/zinc/07/54/04/1032075404.db2.gz SFMXWUSOJOLCMB-UTKZUKDTSA-N 2 1 337.511 4.368 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2ccc(F)cc2)o1 ZINC000171764798 1032272205 /nfs/dbraw/zinc/27/22/05/1032272205.db2.gz BVCOCUUJILJGFU-AWEZNQCLSA-N 2 1 327.403 4.017 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529575084 1032455469 /nfs/dbraw/zinc/45/54/69/1032455469.db2.gz PTTVBMCICXBFGK-SJLPKXTDSA-N 2 1 336.470 4.312 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2)cc1 ZINC000178134635 1032529107 /nfs/dbraw/zinc/52/91/07/1032529107.db2.gz ANKMRMAMGNKVTM-HZPDHXFCSA-N 2 1 337.471 4.370 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000178706671 1032543815 /nfs/dbraw/zinc/54/38/15/1032543815.db2.gz ZBLQDNLEHAOINM-HUUCEWRRSA-N 2 1 340.496 4.302 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccc(Cl)nc1 ZINC000760172513 1032561251 /nfs/dbraw/zinc/56/12/51/1032561251.db2.gz TXJBWUUUULGTTG-OAHLLOKOSA-N 2 1 335.923 4.430 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccccc1F ZINC000180622134 1032609916 /nfs/dbraw/zinc/60/99/16/1032609916.db2.gz WVVDRAFRJVRFCT-LJQANCHMSA-N 2 1 327.447 4.239 20 0 EIADMP C[C@@H](CC[NH+](C)C)[NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000391418349 1032620037 /nfs/dbraw/zinc/62/00/37/1032620037.db2.gz JFCFCXBAIRQFBK-JTQLQIEISA-N 2 1 342.327 4.154 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1CCC(F)(F)C1 ZINC000450654881 1032624487 /nfs/dbraw/zinc/62/44/87/1032624487.db2.gz RQMWEAQCIRUGKI-QGZVFWFLSA-N 2 1 337.458 4.055 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@H]2CCCCN2C(C)C)CC1)CC1CC1 ZINC000450656843 1032624609 /nfs/dbraw/zinc/62/46/09/1032624609.db2.gz WXKLPKSAXVKNFD-JOCHJYFZSA-N 2 1 349.607 4.083 20 0 EIADMP CC[N@H+](CCC1CCN(C[C@H]2CCCC[NH+]2C(C)C)CC1)CC1CC1 ZINC000450656843 1032624618 /nfs/dbraw/zinc/62/46/18/1032624618.db2.gz WXKLPKSAXVKNFD-JOCHJYFZSA-N 2 1 349.607 4.083 20 0 EIADMP CC[N@@H+](CCC1CCN(C[C@H]2CCCC[NH+]2C(C)C)CC1)CC1CC1 ZINC000450656843 1032624628 /nfs/dbraw/zinc/62/46/28/1032624628.db2.gz WXKLPKSAXVKNFD-JOCHJYFZSA-N 2 1 349.607 4.083 20 0 EIADMP CC[NH+](CCC1CCN(C[C@H]2CCCC[N@@H+]2C(C)C)CC1)CC1CC1 ZINC000450656843 1032624638 /nfs/dbraw/zinc/62/46/38/1032624638.db2.gz WXKLPKSAXVKNFD-JOCHJYFZSA-N 2 1 349.607 4.083 20 0 EIADMP CC[NH+](CCC1CCN(C[C@H]2CCCC[N@H+]2C(C)C)CC1)CC1CC1 ZINC000450656843 1032624650 /nfs/dbraw/zinc/62/46/50/1032624650.db2.gz WXKLPKSAXVKNFD-JOCHJYFZSA-N 2 1 349.607 4.083 20 0 EIADMP CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000429581004 1032780325 /nfs/dbraw/zinc/78/03/25/1032780325.db2.gz RUEVDFVRJGWJFE-INIZCTEOSA-N 2 1 339.483 4.191 20 0 EIADMP Cc1cc(C)cc(OCCC[NH+]2CCC([NH+]3CCCCC3)CC2)c1 ZINC000510076168 1019098719 /nfs/dbraw/zinc/09/87/19/1019098719.db2.gz BTRDDJBFDSQIPQ-UHFFFAOYSA-N 2 1 330.516 4.023 20 0 EIADMP C[C@@H](c1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)cc1)C(F)(F)F ZINC000660661335 1032830593 /nfs/dbraw/zinc/83/05/93/1032830593.db2.gz CHIBTHAKEVSHST-MAUKXSAKSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[N@H+]2CCC[C@]3(CC[NH+](C)C3)C2)cc1)C(F)(F)F ZINC000660661335 1032830599 /nfs/dbraw/zinc/83/05/99/1032830599.db2.gz CHIBTHAKEVSHST-MAUKXSAKSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[NH+]2CCC[C@]3(CC[N@H+](C)C3)C2)cc1)C(F)(F)F ZINC000660661335 1032830602 /nfs/dbraw/zinc/83/06/02/1032830602.db2.gz CHIBTHAKEVSHST-MAUKXSAKSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[NH+]2CCC[C@]3(CC[N@@H+](C)C3)C2)cc1)C(F)(F)F ZINC000660661335 1032830603 /nfs/dbraw/zinc/83/06/03/1032830603.db2.gz CHIBTHAKEVSHST-MAUKXSAKSA-N 2 1 340.433 4.270 20 0 EIADMP CCc1nc(C(C)C)ccc1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000579846676 1019592710 /nfs/dbraw/zinc/59/27/10/1019592710.db2.gz BWVDVLIZMVOSAD-IBGZPJMESA-N 2 1 329.532 4.218 20 0 EIADMP CCc1nc(C(C)C)ccc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000579846676 1019592720 /nfs/dbraw/zinc/59/27/20/1019592720.db2.gz BWVDVLIZMVOSAD-IBGZPJMESA-N 2 1 329.532 4.218 20 0 EIADMP CC/C=C\CC[NH+]1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001208727500 1019630687 /nfs/dbraw/zinc/63/06/87/1019630687.db2.gz MZQQARBGEVLUSG-PLNGDYQASA-N 2 1 327.516 4.114 20 0 EIADMP CCc1nc([C@H](C)N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000274892554 1019840000 /nfs/dbraw/zinc/84/00/00/1019840000.db2.gz JSALVMWAGPBBNE-BQFCYCMXSA-N 2 1 343.540 4.267 20 0 EIADMP CC[N@@H+](CCCCC(F)(F)F)CC1CCN(c2ccccn2)CC1 ZINC000154723577 1019978927 /nfs/dbraw/zinc/97/89/27/1019978927.db2.gz SRTHDZXMXSPPGW-UHFFFAOYSA-N 2 1 343.437 4.353 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2coc(-c3ccccc3F)n2)CC1 ZINC000625137752 1019988704 /nfs/dbraw/zinc/98/87/04/1019988704.db2.gz HIMHCTAKEJJJIB-UHFFFAOYSA-N 2 1 345.462 4.033 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cccnc1Cl ZINC000154855464 1020059415 /nfs/dbraw/zinc/05/94/15/1020059415.db2.gz BVAUWYQMSWHWOB-OAHLLOKOSA-N 2 1 331.891 4.426 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cccnc1Cl ZINC000154855464 1020059425 /nfs/dbraw/zinc/05/94/25/1020059425.db2.gz BVAUWYQMSWHWOB-OAHLLOKOSA-N 2 1 331.891 4.426 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)cc1 ZINC000180774088 1020175266 /nfs/dbraw/zinc/17/52/66/1020175266.db2.gz UYOKQIGRLKFFDY-UHFFFAOYSA-N 2 1 336.435 4.423 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](COC)c2cccc(Cl)c2)c1 ZINC000579891511 1020485291 /nfs/dbraw/zinc/48/52/91/1020485291.db2.gz VGLVKKGHXZRKOS-HXUWFJFHSA-N 2 1 346.902 4.269 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000398172921 1020514914 /nfs/dbraw/zinc/51/49/14/1020514914.db2.gz IGWVBDGHPDVTFL-KGVIQGDOSA-N 2 1 338.495 4.256 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547831560 1020780312 /nfs/dbraw/zinc/78/03/12/1020780312.db2.gz ACPRCCVYUZNZTO-FKVLARQCSA-N 2 1 344.543 4.080 20 0 EIADMP Cc1ccccc1[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)C(C)(C)C ZINC000655721288 1020915693 /nfs/dbraw/zinc/91/56/93/1020915693.db2.gz MMAVLFAZDVXCCT-TZIWHRDSSA-N 2 1 344.543 4.315 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)C(C)(C)C)c1 ZINC000655720815 1020917031 /nfs/dbraw/zinc/91/70/31/1020917031.db2.gz HAXYTUFZWXDZPS-LEWJYISDSA-N 2 1 344.543 4.315 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc3[nH]ccc3c2)[C@H]1c1cccs1 ZINC000655742633 1020930687 /nfs/dbraw/zinc/93/06/87/1020930687.db2.gz AWZXFZCVMNLMIU-XLIONFOSSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc3[nH]ccc3c2)[C@H]1c1cccs1 ZINC000655742633 1020930689 /nfs/dbraw/zinc/93/06/89/1020930689.db2.gz AWZXFZCVMNLMIU-XLIONFOSSA-N 2 1 339.508 4.402 20 0 EIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CCCO3)CC1)CC2 ZINC000655756719 1020943146 /nfs/dbraw/zinc/94/31/46/1020943146.db2.gz WUGYURVYYGTJHN-UNMCSNQZSA-N 2 1 342.527 4.030 20 0 EIADMP CCC[NH+]1CCC([NH2+]C2(c3cccc(OC(F)(F)F)c3)CC2)CC1 ZINC000655845420 1021009277 /nfs/dbraw/zinc/00/92/77/1021009277.db2.gz FIRNGNCQXMPAPL-UHFFFAOYSA-N 2 1 342.405 4.038 20 0 EIADMP CC(C)[NH+]1CCC([NH2+]C2(c3cccc(OC(F)(F)F)c3)CC2)CC1 ZINC000655845438 1021011365 /nfs/dbraw/zinc/01/13/65/1021011365.db2.gz GHVYABAGVLZVOJ-UHFFFAOYSA-N 2 1 342.405 4.037 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)[C@@H]1CCCCO1 ZINC000655847156 1021011792 /nfs/dbraw/zinc/01/17/92/1021011792.db2.gz RLQTXFOCKCXWMK-ACRUOGEOSA-N 2 1 342.527 4.121 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)[C@@H]1CCCCO1 ZINC000655847156 1021011800 /nfs/dbraw/zinc/01/18/00/1021011800.db2.gz RLQTXFOCKCXWMK-ACRUOGEOSA-N 2 1 342.527 4.121 20 0 EIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CCCCO1 ZINC000655850669 1021016764 /nfs/dbraw/zinc/01/67/64/1021016764.db2.gz YJJVKOVFKAMJNS-CUUWFGFTSA-N 2 1 342.527 4.119 20 0 EIADMP Cc1[nH+]cc(CNc2ccccc2C[N@H+](C)C2CCCCC2)n1C ZINC000579973666 1021062173 /nfs/dbraw/zinc/06/21/73/1021062173.db2.gz GZOMKRYTPJTWQC-UHFFFAOYSA-N 2 1 326.488 4.105 20 0 EIADMP Cc1[nH+]cc(CNc2ccccc2C[N@@H+](C)C2CCCCC2)n1C ZINC000579973666 1021062190 /nfs/dbraw/zinc/06/21/90/1021062190.db2.gz GZOMKRYTPJTWQC-UHFFFAOYSA-N 2 1 326.488 4.105 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000340466005 1021069051 /nfs/dbraw/zinc/06/90/51/1021069051.db2.gz KHFFKUFMLNFWLY-NRFANRHFSA-N 2 1 338.495 4.400 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000683690505 1021098894 /nfs/dbraw/zinc/09/88/94/1021098894.db2.gz LXCNRXJQOCVLDR-REWPJTCUSA-N 2 1 349.522 4.435 20 0 EIADMP Cc1ccncc1CCC[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000584496446 1021330179 /nfs/dbraw/zinc/33/01/79/1021330179.db2.gz DSVRDBQJQDJYCU-HXUWFJFHSA-N 2 1 343.559 4.299 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000570425256 1021433696 /nfs/dbraw/zinc/43/36/96/1021433696.db2.gz OAXCISMVKFWALT-PVSGBFIBSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000570425256 1021433714 /nfs/dbraw/zinc/43/37/14/1021433714.db2.gz OAXCISMVKFWALT-PVSGBFIBSA-N 2 1 334.507 4.433 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c(C)o1 ZINC000310074145 1021587970 /nfs/dbraw/zinc/58/79/70/1021587970.db2.gz FLRCARBSYLIXGZ-XLIONFOSSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c(C)o1 ZINC000310074145 1021587986 /nfs/dbraw/zinc/58/79/86/1021587986.db2.gz FLRCARBSYLIXGZ-XLIONFOSSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c(C)o1 ZINC000310074140 1021590139 /nfs/dbraw/zinc/59/01/39/1021590139.db2.gz FLRCARBSYLIXGZ-FXAWDEMLSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c(C)o1 ZINC000310074140 1021590160 /nfs/dbraw/zinc/59/01/60/1021590160.db2.gz FLRCARBSYLIXGZ-FXAWDEMLSA-N 2 1 326.484 4.459 20 0 EIADMP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179090 1021741738 /nfs/dbraw/zinc/74/17/38/1021741738.db2.gz CKWMODOIKKCNBH-AEFFLSMTSA-N 2 1 333.545 4.107 20 0 EIADMP C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179090 1021741754 /nfs/dbraw/zinc/74/17/54/1021741754.db2.gz CKWMODOIKKCNBH-AEFFLSMTSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179090 1021741775 /nfs/dbraw/zinc/74/17/75/1021741775.db2.gz CKWMODOIKKCNBH-AEFFLSMTSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179090 1021741793 /nfs/dbraw/zinc/74/17/93/1021741793.db2.gz CKWMODOIKKCNBH-AEFFLSMTSA-N 2 1 333.545 4.107 20 0 EIADMP C[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cncc(F)c1 ZINC000414148608 1021977058 /nfs/dbraw/zinc/97/70/58/1021977058.db2.gz RYMPYPDTYWCBKA-FCRQHZQGSA-N 2 1 339.458 4.067 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cncc(F)c1 ZINC000414148608 1021977099 /nfs/dbraw/zinc/97/70/99/1021977099.db2.gz RYMPYPDTYWCBKA-FCRQHZQGSA-N 2 1 339.458 4.067 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2cc3ccccc3[nH]2)CC1 ZINC000683927593 1021988488 /nfs/dbraw/zinc/98/84/88/1021988488.db2.gz MJDCMWUPKLFQBF-UHFFFAOYSA-N 2 1 333.479 4.231 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]CC[C@H]3CCC[N@@H+](C)C3)oc21 ZINC000414199449 1022105279 /nfs/dbraw/zinc/10/52/79/1022105279.db2.gz XBBOVPBWQIZPGU-JKSUJKDBSA-N 2 1 330.472 4.214 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000414202825 1022123921 /nfs/dbraw/zinc/12/39/21/1022123921.db2.gz ZGTPHSNWUGHIHE-GJZGRUSLSA-N 2 1 344.421 4.010 20 0 EIADMP CC(C)(C)c1ccncc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000414226584 1022210675 /nfs/dbraw/zinc/21/06/75/1022210675.db2.gz JXOZTIFYVBBITM-UHFFFAOYSA-N 2 1 329.532 4.266 20 0 EIADMP CO[C@](C)([C@@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000414249796 1022310789 /nfs/dbraw/zinc/31/07/89/1022310789.db2.gz XINUBNHKNBESPJ-MTWWTJSRSA-N 2 1 344.543 4.223 20 0 EIADMP COc1ccc(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c2ccccc12 ZINC000580677399 1022366571 /nfs/dbraw/zinc/36/65/71/1022366571.db2.gz NOFOVXGSBUJXHQ-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CC2 ZINC000134313593 1022649975 /nfs/dbraw/zinc/64/99/75/1022649975.db2.gz YWBCFUISXMKDCD-ZBEGNZNMSA-N 2 1 325.283 4.055 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CC2 ZINC000134313593 1022649984 /nfs/dbraw/zinc/64/99/84/1022649984.db2.gz YWBCFUISXMKDCD-ZBEGNZNMSA-N 2 1 325.283 4.055 20 0 EIADMP CC1([NH3+])CC[NH+](C/C=C/c2ccc(OCc3ccccc3)cc2)CC1 ZINC000647531044 1022698638 /nfs/dbraw/zinc/69/86/38/1022698638.db2.gz YKQJILQUIIPUND-VMPITWQZSA-N 2 1 336.479 4.092 20 0 EIADMP CC[C@H](OCC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001167443279 1022807274 /nfs/dbraw/zinc/80/72/74/1022807274.db2.gz RDSJKIJLSZJUQM-RTWAWAEBSA-N 2 1 330.516 4.105 20 0 EIADMP CC[C@H](OCC[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001167443279 1022807276 /nfs/dbraw/zinc/80/72/76/1022807276.db2.gz RDSJKIJLSZJUQM-RTWAWAEBSA-N 2 1 330.516 4.105 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3cc(N)ccc32)C[C@@H]1c1ccccc1 ZINC000423369636 1022860659 /nfs/dbraw/zinc/86/06/59/1022860659.db2.gz SUBYGKHTHQEKMK-KSEOMHKRSA-N 2 1 335.495 4.071 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3cc(N)ccc32)C[C@@H]1c1ccccc1 ZINC000423369636 1022860661 /nfs/dbraw/zinc/86/06/61/1022860661.db2.gz SUBYGKHTHQEKMK-KSEOMHKRSA-N 2 1 335.495 4.071 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000311066159 1022864338 /nfs/dbraw/zinc/86/43/38/1022864338.db2.gz YDGHYKQIIYHNNI-PGRDOPGGSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548154385 1022871456 /nfs/dbraw/zinc/87/14/56/1022871456.db2.gz NZNDNIVPHMBIEU-BULFRSBZSA-N 2 1 335.495 4.033 20 0 EIADMP Fc1ccc2c(c1)[C@H]([N@@H+]1CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C1)CCC2 ZINC000510377668 1022962826 /nfs/dbraw/zinc/96/28/26/1022962826.db2.gz WLKQPGGEKZZSIG-ORYQWCPZSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([N@H+]1CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C1)CCC2 ZINC000510377668 1022962842 /nfs/dbraw/zinc/96/28/42/1022962842.db2.gz WLKQPGGEKZZSIG-ORYQWCPZSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH+]1CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C1)CCC2 ZINC000510377668 1022962862 /nfs/dbraw/zinc/96/28/62/1022962862.db2.gz WLKQPGGEKZZSIG-ORYQWCPZSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH+]1CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C1)CCC2 ZINC000510377668 1022962869 /nfs/dbraw/zinc/96/28/69/1022962869.db2.gz WLKQPGGEKZZSIG-ORYQWCPZSA-N 2 1 328.475 4.152 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000584581446 1023038216 /nfs/dbraw/zinc/03/82/16/1023038216.db2.gz VNRAMWUDGAKDEF-XJUOHMSHSA-N 2 1 349.522 4.081 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000584581446 1023038226 /nfs/dbraw/zinc/03/82/26/1023038226.db2.gz VNRAMWUDGAKDEF-XJUOHMSHSA-N 2 1 349.522 4.081 20 0 EIADMP Cc1ccccc1SC[C@@H](C)C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC001167457586 1023098649 /nfs/dbraw/zinc/09/86/49/1023098649.db2.gz FXWIEXUNKHSYHR-HKUYNNGSSA-N 2 1 332.557 4.141 20 0 EIADMP CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000473307874 1033106314 /nfs/dbraw/zinc/10/63/14/1033106314.db2.gz DVVWSWSNVBESKL-PXNSSMCTSA-N 2 1 345.531 4.024 20 0 EIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](C(c2ccccc2)c2ccccc2)C1 ZINC000549140104 1023368961 /nfs/dbraw/zinc/36/89/61/1023368961.db2.gz ZFSBLKWZJDUZFA-HXUWFJFHSA-N 2 1 334.507 4.440 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000549140104 1023368968 /nfs/dbraw/zinc/36/89/68/1023368968.db2.gz ZFSBLKWZJDUZFA-HXUWFJFHSA-N 2 1 334.507 4.440 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000549140104 1023368978 /nfs/dbraw/zinc/36/89/78/1023368978.db2.gz ZFSBLKWZJDUZFA-HXUWFJFHSA-N 2 1 334.507 4.440 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3c2CCCN3)CC[N@H+]1Cc1ccccc1 ZINC000415046478 1023409469 /nfs/dbraw/zinc/40/94/69/1023409469.db2.gz ZTYLDQFIAXMZEM-NQIIRXRSSA-N 2 1 349.522 4.187 20 0 EIADMP Brc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC000415075703 1023421821 /nfs/dbraw/zinc/42/18/21/1023421821.db2.gz BYFPQVJZYXVDJI-ZWKOTPCHSA-N 2 1 345.284 4.032 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]Cc3ccccc3OC3CCC3)CC[NH2+]2)cc1 ZINC000415090443 1023432351 /nfs/dbraw/zinc/43/23/51/1023432351.db2.gz OUKHZILLHDSRJB-FPOVZHCZSA-N 2 1 336.479 4.201 20 0 EIADMP CSc1cc(C)ccc1C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415085912 1023435312 /nfs/dbraw/zinc/43/53/12/1023435312.db2.gz RABQSZALTJMZBW-OALUTQOASA-N 2 1 326.509 4.300 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500076996 1023484252 /nfs/dbraw/zinc/48/42/52/1023484252.db2.gz VVPQDPXBAIKMFR-CVEARBPZSA-N 2 1 342.449 4.473 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075193 1023485132 /nfs/dbraw/zinc/48/51/32/1023485132.db2.gz OOSYAWYCRPPOLI-CABCVRRESA-N 2 1 328.422 4.083 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075193 1023485142 /nfs/dbraw/zinc/48/51/42/1023485142.db2.gz OOSYAWYCRPPOLI-CABCVRRESA-N 2 1 328.422 4.083 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075193 1023485148 /nfs/dbraw/zinc/48/51/48/1023485148.db2.gz OOSYAWYCRPPOLI-CABCVRRESA-N 2 1 328.422 4.083 20 0 EIADMP Cc1ccc(OC2CC[NH+](CC[C@H]3CCCC[N@@H+]3C)CC2)cc1C ZINC000472752453 1023502527 /nfs/dbraw/zinc/50/25/27/1023502527.db2.gz PRBCORPVTCIALI-LJQANCHMSA-N 2 1 330.516 4.021 20 0 EIADMP c1cc(-c2nc(C[N@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cs2)cs1 ZINC000656786979 1023536374 /nfs/dbraw/zinc/53/63/74/1023536374.db2.gz YVOKIOBOSAQASP-HNNXBMFYSA-N 2 1 347.553 4.083 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398028269 1023650866 /nfs/dbraw/zinc/65/08/66/1023650866.db2.gz DEHRFTWRIWFEMI-HMFYCAOWSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398028269 1023650869 /nfs/dbraw/zinc/65/08/69/1023650869.db2.gz DEHRFTWRIWFEMI-HMFYCAOWSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1cscn1 ZINC000581737912 1023658810 /nfs/dbraw/zinc/65/88/10/1023658810.db2.gz WEHQICVRNBCLHV-ZLPCBKJTSA-N 2 1 329.513 4.237 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(c2c[nH]c3ccccc23)CC1 ZINC000472856027 1023742008 /nfs/dbraw/zinc/74/20/08/1023742008.db2.gz WQJBZRNCRAJVNU-SFHVURJKSA-N 2 1 325.500 4.222 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2cccc(Oc3ccccn3)c2)CC1 ZINC000891560966 1023780899 /nfs/dbraw/zinc/78/08/99/1023780899.db2.gz HWBFMWNKOZQNMS-UHFFFAOYSA-N 2 1 339.483 4.179 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2cccc(Oc3ccccn3)c2)CC1 ZINC000891560966 1023780903 /nfs/dbraw/zinc/78/09/03/1023780903.db2.gz HWBFMWNKOZQNMS-UHFFFAOYSA-N 2 1 339.483 4.179 20 0 EIADMP Cc1c([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cnn1C(C)C ZINC000364467973 1023804265 /nfs/dbraw/zinc/80/42/65/1023804265.db2.gz WSROPOXYKFETSX-LRQRDZAKSA-N 2 1 340.515 4.116 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000647198467 1023870684 /nfs/dbraw/zinc/87/06/84/1023870684.db2.gz HGCQTAPEAUTZAA-AZUAARDMSA-N 2 1 335.495 4.238 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000647198467 1023870685 /nfs/dbraw/zinc/87/06/85/1023870685.db2.gz HGCQTAPEAUTZAA-AZUAARDMSA-N 2 1 335.495 4.238 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]CCC[C@H]3CCCCO3)CC23CC3)cc1 ZINC000647201800 1023885186 /nfs/dbraw/zinc/88/51/86/1023885186.db2.gz ANVBJSKPENWUDH-LEWJYISDSA-N 2 1 342.527 4.123 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CCC[C@H]3CCCCO3)CC23CC3)cc1 ZINC000647201800 1023885188 /nfs/dbraw/zinc/88/51/88/1023885188.db2.gz ANVBJSKPENWUDH-LEWJYISDSA-N 2 1 342.527 4.123 20 0 EIADMP Cc1nc(-c2ccc([C@@H](C)[NH2+]CCCn3cc[nH+]c3C)cc2)cs1 ZINC000341599146 1023922658 /nfs/dbraw/zinc/92/26/58/1023922658.db2.gz TWROGEGDEGHOOO-CQSZACIVSA-N 2 1 340.496 4.364 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)CCCOc1ccc(Cl)c(C)c1 ZINC000510689955 1024233117 /nfs/dbraw/zinc/23/31/17/1024233117.db2.gz YFOKMKBXEMGVJQ-MRXNPFEDSA-N 2 1 349.906 4.381 20 0 EIADMP Cc1cccc([C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000510696134 1024241468 /nfs/dbraw/zinc/24/14/68/1024241468.db2.gz QALCQHGTNWGAMP-VGSWGCGISA-N 2 1 338.470 4.297 20 0 EIADMP Cc1cccc([C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000510696134 1024241487 /nfs/dbraw/zinc/24/14/87/1024241487.db2.gz QALCQHGTNWGAMP-VGSWGCGISA-N 2 1 338.470 4.297 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cc(O)cc(F)c2)CC1 ZINC000473130215 1024337325 /nfs/dbraw/zinc/33/73/25/1024337325.db2.gz ASEWDGVCSKIOGU-INIZCTEOSA-N 2 1 334.479 4.008 20 0 EIADMP CCSc1cccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000473138872 1024381572 /nfs/dbraw/zinc/38/15/72/1024381572.db2.gz HGCCRADDZDMVMT-FXAWDEMLSA-N 2 1 330.541 4.247 20 0 EIADMP CCSc1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000473138872 1024381589 /nfs/dbraw/zinc/38/15/89/1024381589.db2.gz HGCCRADDZDMVMT-FXAWDEMLSA-N 2 1 330.541 4.247 20 0 EIADMP CCSc1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000473138872 1024381608 /nfs/dbraw/zinc/38/16/08/1024381608.db2.gz HGCCRADDZDMVMT-FXAWDEMLSA-N 2 1 330.541 4.247 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)CC1 ZINC000510739937 1024382185 /nfs/dbraw/zinc/38/21/85/1024382185.db2.gz YZKMWUZAZYODFB-AWEZNQCLSA-N 2 1 328.422 4.100 20 0 EIADMP COc1ccccc1[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)C1CCCC1 ZINC000091268620 1024550599 /nfs/dbraw/zinc/55/05/99/1024550599.db2.gz RXBRVCXQQCPRHY-OAQYLSRUSA-N 2 1 328.500 4.143 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000091313921 1024561841 /nfs/dbraw/zinc/56/18/41/1024561841.db2.gz JGDVQSLYCGIDCH-MRXNPFEDSA-N 2 1 325.378 4.197 20 0 EIADMP c1coc(-c2cc(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)no2)c1 ZINC000048562843 1024651388 /nfs/dbraw/zinc/65/13/88/1024651388.db2.gz NCGWHHLHMNZXIQ-UHFFFAOYSA-N 2 1 343.471 4.023 20 0 EIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347858 1024688986 /nfs/dbraw/zinc/68/89/86/1024688986.db2.gz NGVKBXAPAJGLOC-GDAAHCPNSA-N 2 1 336.907 4.009 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000348835690 1024722157 /nfs/dbraw/zinc/72/21/57/1024722157.db2.gz AVRCSSOZFISROU-HRAATJIYSA-N 2 1 332.451 4.159 20 0 EIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccccc1OC(F)F ZINC000164674538 1024783879 /nfs/dbraw/zinc/78/38/79/1024783879.db2.gz ROJPLXZPNQHWHX-MRXNPFEDSA-N 2 1 337.414 4.314 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)ccc1SC ZINC000164675443 1024786367 /nfs/dbraw/zinc/78/63/67/1024786367.db2.gz HQYKFRWVWOAUFD-AWEZNQCLSA-N 2 1 333.501 4.053 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cc[nH+]c3c(O)cccc23)C1 ZINC000684575013 1024828184 /nfs/dbraw/zinc/82/81/84/1024828184.db2.gz IZRMWAWKYAIKLM-DLBZAZTESA-N 2 1 339.483 4.031 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000548483355 1024830232 /nfs/dbraw/zinc/83/02/32/1024830232.db2.gz NPJZKVMHVJGIBO-XKGZKEIXSA-N 2 1 342.552 4.488 20 0 EIADMP CS[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000548486105 1024836380 /nfs/dbraw/zinc/83/63/80/1024836380.db2.gz NUSRTGGYACPLJY-BHIYHBOVSA-N 2 1 334.573 4.264 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510967777 1024869881 /nfs/dbraw/zinc/86/98/81/1024869881.db2.gz NFQLLUKTGNDOSV-GHTZIAJQSA-N 2 1 337.511 4.341 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510967777 1024869890 /nfs/dbraw/zinc/86/98/90/1024869890.db2.gz NFQLLUKTGNDOSV-GHTZIAJQSA-N 2 1 337.511 4.341 20 0 EIADMP CCOc1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1OCC ZINC000535811985 1024960399 /nfs/dbraw/zinc/96/03/99/1024960399.db2.gz RWOVSBMZZRFUOR-UHFFFAOYSA-N 2 1 348.531 4.036 20 0 EIADMP CCC1([NH3+])CC[NH+]([C@H](C)c2sc(Cc3ccccc3)nc2C)CC1 ZINC000925757695 1024961418 /nfs/dbraw/zinc/96/14/18/1024961418.db2.gz VZEYUMSSNLYEAP-MRXNPFEDSA-N 2 1 343.540 4.307 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+]CC(C3CCC3)C3CCC3)CC2)cc1 ZINC000707721470 1024997725 /nfs/dbraw/zinc/99/77/25/1024997725.db2.gz FZTQOUMFIQNICJ-UHFFFAOYSA-N 2 1 326.528 4.457 20 0 EIADMP CC[C@H]([NH2+]CC1CC[NH+](Cc2csc(C)n2)CC1)c1cccs1 ZINC000161721501 1025068221 /nfs/dbraw/zinc/06/82/21/1025068221.db2.gz IPYCUGCHUSKIFY-KRWDZBQOSA-N 2 1 349.569 4.466 20 0 EIADMP c1c(C2CC[NH2+]CC2)n[nH]c1C1CC[NH+](CCCC2CCCC2)CC1 ZINC000662326699 1025080355 /nfs/dbraw/zinc/08/03/55/1025080355.db2.gz AKCSRINTIWDPLY-UHFFFAOYSA-N 2 1 344.547 4.027 20 0 EIADMP C[NH+]1CCC([C@H]2CCN(c3cc[nH+]c4cc(Cl)ccc43)C2)CC1 ZINC000535911415 1025298948 /nfs/dbraw/zinc/29/89/48/1025298948.db2.gz XFCVLKVNQDURHC-HNNXBMFYSA-N 2 1 329.875 4.056 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc2ccncc2s1 ZINC000663463802 1025392077 /nfs/dbraw/zinc/39/20/77/1025392077.db2.gz BRZVAFHGHKPBGD-GOEBONIOSA-N 2 1 329.513 4.069 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000663478481 1025469392 /nfs/dbraw/zinc/46/93/92/1025469392.db2.gz RENAFAOTWRLTKD-RDJZCZTQSA-N 2 1 342.449 4.465 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001167826148 1025620785 /nfs/dbraw/zinc/62/07/85/1025620785.db2.gz NCTXMMUODRSHKU-HXUWFJFHSA-N 3 1 345.575 4.093 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(N(C)Cc2ccccc2)CC1 ZINC001167826148 1025620794 /nfs/dbraw/zinc/62/07/94/1025620794.db2.gz NCTXMMUODRSHKU-HXUWFJFHSA-N 2 1 345.575 4.093 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H](Sc2ccncc2)C1 ZINC001167826943 1025629176 /nfs/dbraw/zinc/62/91/76/1025629176.db2.gz SDMRAAGPEFDRGV-PKOBYXMFSA-N 2 1 335.561 4.149 20 0 EIADMP C[C@@H]([NH3+])C[NH2+][C@H](C)c1ccc(-c2ccccc2Br)s1 ZINC000643527108 1025692782 /nfs/dbraw/zinc/69/27/82/1025692782.db2.gz DDOAXZNROGSVQG-GHMZBOCLSA-N 2 1 339.302 4.175 20 0 EIADMP CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)[C@H](C)CCC[NH+](CC)CC ZINC001167835292 1025835374 /nfs/dbraw/zinc/83/53/74/1025835374.db2.gz RBOJGSXQGMSUTF-QUCCMNQESA-N 2 1 332.532 4.480 20 0 EIADMP CC(C)Oc1cccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000236825020 1025837585 /nfs/dbraw/zinc/83/75/85/1025837585.db2.gz HRBXGIZBQOFFBC-UHFFFAOYSA-N 2 1 330.516 4.361 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H](c2cccc(OC)c2)C1 ZINC001167839555 1025853162 /nfs/dbraw/zinc/85/31/62/1025853162.db2.gz ABJCKCYVLTVXBF-QUCCMNQESA-N 2 1 332.532 4.385 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H](Cc2cccc(OC)c2)C1 ZINC001167841621 1025886251 /nfs/dbraw/zinc/88/62/51/1025886251.db2.gz NEKYNVCMKZZVFX-FPOVZHCZSA-N 2 1 346.559 4.460 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1cncs1 ZINC000157629909 1025889901 /nfs/dbraw/zinc/88/99/01/1025889901.db2.gz IUSUXLSPIFRHLC-CVEARBPZSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1cncs1 ZINC000157629909 1025889904 /nfs/dbraw/zinc/88/99/04/1025889904.db2.gz IUSUXLSPIFRHLC-CVEARBPZSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+][C@@H](c2ccccc2F)C2CCCC2)CCCO1 ZINC000432420124 1025898193 /nfs/dbraw/zinc/89/81/93/1025898193.db2.gz IYVIVNZMTWAMQW-LAUBAEHRSA-N 2 1 348.506 4.148 20 0 EIADMP CC(C)Oc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167968600 1025904317 /nfs/dbraw/zinc/90/43/17/1025904317.db2.gz SSPCQFNOBUVGBA-SEJPIABJSA-N 2 1 342.527 4.011 20 0 EIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1cc(F)ccc1F ZINC001167968591 1025906706 /nfs/dbraw/zinc/90/67/06/1025906706.db2.gz SIIFWJWRBXEMAJ-KRXYWNSISA-N 2 1 334.454 4.411 20 0 EIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cc(F)ccc1F ZINC001167968591 1025906725 /nfs/dbraw/zinc/90/67/25/1025906725.db2.gz SIIFWJWRBXEMAJ-KRXYWNSISA-N 2 1 334.454 4.411 20 0 EIADMP CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C12CCC2 ZINC000344082728 1025974492 /nfs/dbraw/zinc/97/44/92/1025974492.db2.gz ZOMYSKSZMRPCKW-CWFSZBLJSA-N 2 1 339.483 4.179 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(Cl)cc1Cl ZINC000344089038 1025990533 /nfs/dbraw/zinc/99/05/33/1025990533.db2.gz LKGRBGSUKLPBPM-BLLLJJGKSA-N 2 1 338.282 4.493 20 0 EIADMP C[N@H+]1CCC[C@@H](CNc2[nH+]ccc3[nH]ccc32)[C@H]1c1cccs1 ZINC000663660331 1026063623 /nfs/dbraw/zinc/06/36/23/1026063623.db2.gz MBTLFTLPVWLIHX-GUYCJALGSA-N 2 1 326.469 4.119 20 0 EIADMP c1ccc([C@@H](CC2CCC2)[NH2+]CC2([NH+]3CCCC3)CCOCC2)cc1 ZINC000344175669 1026094124 /nfs/dbraw/zinc/09/41/24/1026094124.db2.gz SMTLFWZAUVFZTI-OAQYLSRUSA-N 2 1 342.527 4.153 20 0 EIADMP [NH2+]=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cccc2ccccc21 ZINC001167974311 1026173390 /nfs/dbraw/zinc/17/33/90/1026173390.db2.gz VMYUHZBTSLEPRT-YQQQUEKLSA-N 2 1 333.479 4.160 20 0 EIADMP CC(C)(C)c1cnc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)s1 ZINC000279198487 1026194974 /nfs/dbraw/zinc/19/49/74/1026194974.db2.gz USRVWNMYLLONDY-UHFFFAOYSA-N 2 1 343.540 4.326 20 0 EIADMP CC(C)[C@H](C[N@@H+](C)C1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000375670147 1026207094 /nfs/dbraw/zinc/20/70/94/1026207094.db2.gz ZSOSOSQKNJGTKJ-QFIPXVFZSA-N 2 1 344.543 4.001 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(CC2=Cc3ccccc3OC2)C1 ZINC000512192739 1026345538 /nfs/dbraw/zinc/34/55/38/1026345538.db2.gz BUEFTMLBGBGJEH-OALUTQOASA-N 2 1 340.511 4.049 20 0 EIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CCO2 ZINC001167981778 1026368695 /nfs/dbraw/zinc/36/86/95/1026368695.db2.gz JQPKWHUZXXBIEH-PHSGOXPASA-N 2 1 346.902 4.159 20 0 EIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)CCO2 ZINC001167981778 1026368707 /nfs/dbraw/zinc/36/87/07/1026368707.db2.gz JQPKWHUZXXBIEH-PHSGOXPASA-N 2 1 346.902 4.159 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCCC(C)(C)CC3)CC2)oc1C ZINC000657372434 1026368820 /nfs/dbraw/zinc/36/88/20/1026368820.db2.gz SPPLYLVJUBBFEG-IBGZPJMESA-N 2 1 347.547 4.452 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3ccc(Cl)s3)CC2)[nH+]c1 ZINC000163469215 1026373814 /nfs/dbraw/zinc/37/38/14/1026373814.db2.gz SEDDROIIOYQFJZ-CYBMUJFWSA-N 2 1 335.904 4.425 20 0 EIADMP C[C@H](Cc1ccc(O)cc1)[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000511095819 1026390079 /nfs/dbraw/zinc/39/00/79/1026390079.db2.gz XHRJHKSRFHVXPO-MSOLQXFVSA-N 2 1 338.495 4.138 20 0 EIADMP COCc1csc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000657396011 1026475657 /nfs/dbraw/zinc/47/56/57/1026475657.db2.gz DKCLWIUOJDSDDN-AWEZNQCLSA-N 2 1 341.480 4.239 20 0 EIADMP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)cs2)cs1 ZINC000152425326 1026542832 /nfs/dbraw/zinc/54/28/32/1026542832.db2.gz JGYSWIYSQSFGFW-GXTWGEPZSA-N 2 1 347.553 4.315 20 0 EIADMP Cc1cccc2[nH]c(C[NH2+][C@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)cc21 ZINC000657428869 1026629688 /nfs/dbraw/zinc/62/96/88/1026629688.db2.gz CQLSRBFZCNQMFZ-IAGOWNOFSA-N 2 1 325.500 4.219 20 0 EIADMP Cc1ccc2cc(C[NH2+][C@@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)[nH]c2c1 ZINC000657429846 1026640959 /nfs/dbraw/zinc/64/09/59/1026640959.db2.gz LMEDEXIBHHNPJC-WMZOPIPTSA-N 2 1 325.500 4.219 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)s1 ZINC000163539044 1026759398 /nfs/dbraw/zinc/75/93/98/1026759398.db2.gz IVGCEHOBWRWFGY-OAHLLOKOSA-N 2 1 329.513 4.334 20 0 EIADMP C[C@@H](CNc1cc[nH+]c2cc(F)ccc12)[N@H+]1CCc2sccc2C1 ZINC000500461719 1026772763 /nfs/dbraw/zinc/77/27/63/1026772763.db2.gz XQSOXTHJGRRBGR-ZDUSSCGKSA-N 2 1 341.455 4.294 20 0 EIADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+][C@H]1CCCc2cccnc21 ZINC000684958876 1026895876 /nfs/dbraw/zinc/89/58/76/1026895876.db2.gz YUASGSIJEIGGPV-OPYAIIAOSA-N 2 1 349.522 4.205 20 0 EIADMP Cc1cc(N2CCC([NH2+]CCCC3CCCCC3)CC2)nc(C)[nH+]1 ZINC000582692817 1026949477 /nfs/dbraw/zinc/94/94/77/1026949477.db2.gz JRZVJDQMYHBQBV-UHFFFAOYSA-N 2 1 330.520 4.012 20 0 EIADMP Cc1ccccc1-c1cnc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)o1 ZINC000075713463 1027058577 /nfs/dbraw/zinc/05/85/77/1027058577.db2.gz MSOHAXAMOJYCCC-UHFFFAOYSA-N 2 1 341.499 4.202 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCOc2c(C)cc(C)cc21 ZINC000164684559 1027087701 /nfs/dbraw/zinc/08/77/01/1027087701.db2.gz FAKOLYNFZJUILM-IBGZPJMESA-N 2 1 327.472 4.092 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CC2([NH+](C)C)CCCCC2)cc1OC ZINC000474484559 1027120215 /nfs/dbraw/zinc/12/02/15/1027120215.db2.gz KUTGCCJCHFPODC-IAGOWNOFSA-N 2 1 348.531 4.050 20 0 EIADMP Cc1ccc2[nH+]ccc(N[C@@H](C[NH+]3CCOCC3)c3ccccc3)c2c1 ZINC000302155480 1027233414 /nfs/dbraw/zinc/23/34/14/1027233414.db2.gz MLJLARAJTOKRNN-QFIPXVFZSA-N 2 1 347.462 4.029 20 0 EIADMP CC[N@H+](Cc1ccncc1)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168038908 1027313407 /nfs/dbraw/zinc/31/34/07/1027313407.db2.gz AAYHCVIKXITOFS-OALUTQOASA-N 2 1 337.511 4.345 20 0 EIADMP CC[N@@H+](Cc1ccncc1)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168038908 1027313415 /nfs/dbraw/zinc/31/34/15/1027313415.db2.gz AAYHCVIKXITOFS-OALUTQOASA-N 2 1 337.511 4.345 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cccc3[nH]ccc32)CC1 ZINC000116368058 1027337414 /nfs/dbraw/zinc/33/74/14/1027337414.db2.gz ARDHGMAIYFSVLS-KRWDZBQOSA-N 2 1 333.479 4.483 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H](C)C3C(C)(C)C3(C)C)CC2)oc1C ZINC000474718172 1027436292 /nfs/dbraw/zinc/43/62/92/1027436292.db2.gz FAWMVMFHKZGMKE-OAHLLOKOSA-N 2 1 347.547 4.164 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000441331240 1027468019 /nfs/dbraw/zinc/46/80/19/1027468019.db2.gz NMXPITKARPHRJM-HOCLYGCPSA-N 2 1 326.431 4.155 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC000441331240 1027468034 /nfs/dbraw/zinc/46/80/34/1027468034.db2.gz NMXPITKARPHRJM-HOCLYGCPSA-N 2 1 326.431 4.155 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC000441331240 1027468050 /nfs/dbraw/zinc/46/80/50/1027468050.db2.gz NMXPITKARPHRJM-HOCLYGCPSA-N 2 1 326.431 4.155 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)C1CCSCC1 ZINC000474803260 1027524532 /nfs/dbraw/zinc/52/45/32/1027524532.db2.gz ZGLUKMGNTQCIDV-UWVAXJGDSA-N 2 1 332.557 4.018 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)C1CCSCC1 ZINC000474803260 1027524545 /nfs/dbraw/zinc/52/45/45/1027524545.db2.gz ZGLUKMGNTQCIDV-UWVAXJGDSA-N 2 1 332.557 4.018 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cc(F)ccc1F ZINC000112524278 1027580417 /nfs/dbraw/zinc/58/04/17/1027580417.db2.gz NOYMOOGEJVEIPH-HNNXBMFYSA-N 2 1 330.422 4.411 20 0 EIADMP CC(C)CCOc1ccc(C[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000475565289 1027647009 /nfs/dbraw/zinc/64/70/09/1027647009.db2.gz LFQOAAFTXJBAMJ-UHFFFAOYSA-N 2 1 330.516 4.218 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000520460119 1028046223 /nfs/dbraw/zinc/04/62/23/1028046223.db2.gz XUCYOUUHUYTUOZ-ZQDZILKHSA-N 2 1 326.937 4.213 20 0 EIADMP CC[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccc(F)cc1 ZINC000523386627 1028056984 /nfs/dbraw/zinc/05/69/84/1028056984.db2.gz AINLNTULRUVHJI-OAQYLSRUSA-N 2 1 326.459 4.315 20 0 EIADMP CC[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccc(F)cc1 ZINC000523386627 1028057002 /nfs/dbraw/zinc/05/70/02/1028057002.db2.gz AINLNTULRUVHJI-OAQYLSRUSA-N 2 1 326.459 4.315 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000346188945 1028296276 /nfs/dbraw/zinc/29/62/76/1028296276.db2.gz YNRUWINBPZBRQB-OAQYLSRUSA-N 2 1 347.466 4.088 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000346205022 1028330687 /nfs/dbraw/zinc/33/06/87/1028330687.db2.gz QAKRBTJUXGIRQL-LJQANCHMSA-N 2 1 336.439 4.286 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)C1CCC(F)CC1 ZINC000657743857 1028335197 /nfs/dbraw/zinc/33/51/97/1028335197.db2.gz KYGHENMWORJIBD-QHGAOEGBSA-N 2 1 332.507 4.200 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cccnc1Cl ZINC000162912022 1028553078 /nfs/dbraw/zinc/55/30/78/1028553078.db2.gz MNAKUYXIGIIODH-OAHLLOKOSA-N 2 1 329.875 4.182 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)cc1 ZINC000127136621 1028739544 /nfs/dbraw/zinc/73/95/44/1028739544.db2.gz TUMTYXKWULWHLT-LPHOPBHVSA-N 2 1 339.483 4.323 20 0 EIADMP CC(C)C[C@H](C[N@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1)c1ccccc1 ZINC000650707697 1028834280 /nfs/dbraw/zinc/83/42/80/1028834280.db2.gz LAIKJXQJALFBMG-CBPXPLCBSA-N 2 1 344.543 4.035 20 0 EIADMP FC1(F)CCC([NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC000657771849 1028891298 /nfs/dbraw/zinc/89/12/98/1028891298.db2.gz HHNHMSVAPPAUOG-GOSISDBHSA-N 2 1 348.481 4.456 20 0 EIADMP Clc1ccc(OCCC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000524594818 1029099894 /nfs/dbraw/zinc/09/98/94/1029099894.db2.gz WZKKRBNYAFSNNK-SFHVURJKSA-N 2 1 336.907 4.059 20 0 EIADMP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000278396776 1029101423 /nfs/dbraw/zinc/10/14/23/1029101423.db2.gz NDTVDHNOTOLAGP-MRXNPFEDSA-N 2 1 341.474 4.051 20 0 EIADMP CCc1nc(C)c([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)s1 ZINC000157514314 1029115574 /nfs/dbraw/zinc/11/55/74/1029115574.db2.gz PREDSGMLTREYCZ-CQSZACIVSA-N 2 1 335.561 4.462 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC[N@@H+]1C ZINC000157766410 1029221799 /nfs/dbraw/zinc/22/17/99/1029221799.db2.gz GLUXMVAHZSAEBA-SLEUVZQESA-N 2 1 343.298 4.279 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC[N@H+]1C ZINC000157766410 1029221817 /nfs/dbraw/zinc/22/18/17/1029221817.db2.gz GLUXMVAHZSAEBA-SLEUVZQESA-N 2 1 343.298 4.279 20 0 EIADMP COc1cc([C@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)ccc1SC ZINC000131215174 1029293489 /nfs/dbraw/zinc/29/34/89/1029293489.db2.gz JFOPAWGYIQDROB-HNNXBMFYSA-N 2 1 336.545 4.188 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@@H]3CCCc4occc43)C2)c1 ZINC000192785532 1029386202 /nfs/dbraw/zinc/38/62/02/1029386202.db2.gz HLDHEGANXGXYTB-MAUKXSAKSA-N 2 1 330.497 4.220 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3CCCc4occc43)C2)c1 ZINC000192785532 1029386218 /nfs/dbraw/zinc/38/62/18/1029386218.db2.gz HLDHEGANXGXYTB-MAUKXSAKSA-N 2 1 330.497 4.220 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCCc4occc43)C2)c1 ZINC000192785507 1029386532 /nfs/dbraw/zinc/38/65/32/1029386532.db2.gz HLDHEGANXGXYTB-CRAIPNDOSA-N 2 1 330.497 4.220 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CCCc4occc43)C2)c1 ZINC000192785507 1029386547 /nfs/dbraw/zinc/38/65/47/1029386547.db2.gz HLDHEGANXGXYTB-CRAIPNDOSA-N 2 1 330.497 4.220 20 0 EIADMP C[C@H](CCc1ccsc1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475265289 1029475047 /nfs/dbraw/zinc/47/50/47/1029475047.db2.gz IAKYENKSBAKLTK-YLJYHZDGSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)OCc1ccccc1 ZINC000475313368 1029526245 /nfs/dbraw/zinc/52/62/45/1029526245.db2.gz PDYWFZLWAWGFBN-SFHLNBCPSA-N 2 1 344.543 4.224 20 0 EIADMP CC(C)C[NH+]1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000536205766 1029581405 /nfs/dbraw/zinc/58/14/05/1029581405.db2.gz XMEFGRYWOHSDAP-UHFFFAOYSA-N 2 1 328.422 4.258 20 0 EIADMP CC(C)C[NH+]1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000536205766 1029581416 /nfs/dbraw/zinc/58/14/16/1029581416.db2.gz XMEFGRYWOHSDAP-UHFFFAOYSA-N 2 1 328.422 4.258 20 0 EIADMP COC[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CCCC1 ZINC000446830784 1029595800 /nfs/dbraw/zinc/59/58/00/1029595800.db2.gz WVZNOPDKOOQLOH-LAUBAEHRSA-N 2 1 330.516 4.007 20 0 EIADMP C[N@@H+](CCCSc1ccccc1Cl)C[C@@H]1CCC[NH+](C)C1 ZINC000525488188 1029653443 /nfs/dbraw/zinc/65/34/43/1029653443.db2.gz FQMHIYUCKRRMEV-OAHLLOKOSA-N 2 1 326.937 4.096 20 0 EIADMP C[NH+](CCCSc1ccccc1Cl)C[C@@H]1CCC[N@H+](C)C1 ZINC000525488188 1029653445 /nfs/dbraw/zinc/65/34/45/1029653445.db2.gz FQMHIYUCKRRMEV-OAHLLOKOSA-N 2 1 326.937 4.096 20 0 EIADMP C[NH+](CCCSc1ccccc1Cl)C[C@@H]1CCC[N@@H+](C)C1 ZINC000525488188 1029653449 /nfs/dbraw/zinc/65/34/49/1029653449.db2.gz FQMHIYUCKRRMEV-OAHLLOKOSA-N 2 1 326.937 4.096 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cc2cnccc2o1 ZINC000657839673 1029732944 /nfs/dbraw/zinc/73/29/44/1029732944.db2.gz YJQALDRHKRUTQW-BBWFWOEESA-N 2 1 329.488 4.237 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000657840120 1029755781 /nfs/dbraw/zinc/75/57/81/1029755781.db2.gz MGTNJZLLVVUNOZ-FGTMMUONSA-N 2 1 340.433 4.243 20 0 EIADMP Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c2cc(F)ccc2[nH+]1 ZINC000301667442 1029784201 /nfs/dbraw/zinc/78/42/01/1029784201.db2.gz MHBVKAWVZZYYBU-SJORKVTESA-N 2 1 327.447 4.134 20 0 EIADMP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000081578982 1029805110 /nfs/dbraw/zinc/80/51/10/1029805110.db2.gz BCNGPHKXTYHYNY-GJZGRUSLSA-N 2 1 326.431 4.013 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000081578982 1029805111 /nfs/dbraw/zinc/80/51/11/1029805111.db2.gz BCNGPHKXTYHYNY-GJZGRUSLSA-N 2 1 326.431 4.013 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000081578982 1029805113 /nfs/dbraw/zinc/80/51/13/1029805113.db2.gz BCNGPHKXTYHYNY-GJZGRUSLSA-N 2 1 326.431 4.013 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000081578982 1029805114 /nfs/dbraw/zinc/80/51/14/1029805114.db2.gz BCNGPHKXTYHYNY-GJZGRUSLSA-N 2 1 326.431 4.013 20 0 EIADMP Cc1cc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c2cc(F)ccc2[nH+]1 ZINC000301793064 1029809343 /nfs/dbraw/zinc/80/93/43/1029809343.db2.gz RQKBFVPMNMBWAL-QRWLVFNGSA-N 2 1 339.458 4.135 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000708525636 1029812813 /nfs/dbraw/zinc/81/28/13/1029812813.db2.gz WTWGNUQRWUBCHO-YJBOKZPZSA-N 2 1 346.877 4.337 20 0 EIADMP c1c[nH]c([C@H]2CCC[N@H+](Cc3ccccc3OC3CCCC3)C2)n1 ZINC000092071549 1029898937 /nfs/dbraw/zinc/89/89/37/1029898937.db2.gz XQEBQJZKPZQFLU-KRWDZBQOSA-N 2 1 325.456 4.111 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1ccc(F)cn1 ZINC000092739139 1029931446 /nfs/dbraw/zinc/93/14/46/1029931446.db2.gz FAVFYQFERZQTQI-SJORKVTESA-N 2 1 341.474 4.303 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCSc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183183515 1029989786 /nfs/dbraw/zinc/98/97/86/1029989786.db2.gz UDTWLPJFSYPALN-TXPKVOOTSA-N 2 1 330.541 4.466 20 0 EIADMP CC[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1OC ZINC000183187505 1029992038 /nfs/dbraw/zinc/99/20/38/1029992038.db2.gz UNTAPTLJWLZMII-SQGPQFPESA-N 2 1 330.516 4.389 20 0 EIADMP Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C3CCC3)C1)CCC2 ZINC000183187736 1029994871 /nfs/dbraw/zinc/99/48/71/1029994871.db2.gz DHDHOQQKKDMISZ-YSVLISHTSA-N 2 1 333.545 4.072 20 0 EIADMP C[C@H](C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874928 1030090294 /nfs/dbraw/zinc/09/02/94/1030090294.db2.gz RSMXODSGCRGHPK-WRWLIDTKSA-N 2 1 332.919 4.392 20 0 EIADMP C[C@H](C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874928 1030090311 /nfs/dbraw/zinc/09/03/11/1030090311.db2.gz RSMXODSGCRGHPK-WRWLIDTKSA-N 2 1 332.919 4.392 20 0 EIADMP C[C@H](C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874928 1030090322 /nfs/dbraw/zinc/09/03/22/1030090322.db2.gz RSMXODSGCRGHPK-WRWLIDTKSA-N 2 1 332.919 4.392 20 0 EIADMP C[C@H](C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874927 1030092883 /nfs/dbraw/zinc/09/28/83/1030092883.db2.gz RSMXODSGCRGHPK-SYNHAJSKSA-N 2 1 332.919 4.392 20 0 EIADMP C[C@H](C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874927 1030092900 /nfs/dbraw/zinc/09/29/00/1030092900.db2.gz RSMXODSGCRGHPK-SYNHAJSKSA-N 2 1 332.919 4.392 20 0 EIADMP C[C@H](C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874927 1030092920 /nfs/dbraw/zinc/09/29/20/1030092920.db2.gz RSMXODSGCRGHPK-SYNHAJSKSA-N 2 1 332.919 4.392 20 0 EIADMP FC(F)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000525985506 1030170415 /nfs/dbraw/zinc/17/04/15/1030170415.db2.gz WVFGMOFIUXKSAD-IBGZPJMESA-N 2 1 344.449 4.278 20 0 EIADMP FC1(F)CCC([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000447577528 1030205332 /nfs/dbraw/zinc/20/53/32/1030205332.db2.gz AKLJDXZMSMXKRW-REPLKXPHSA-N 2 1 334.454 4.350 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000526119007 1030288245 /nfs/dbraw/zinc/28/82/45/1030288245.db2.gz KUWMGCVVUFQNNA-SJORKVTESA-N 2 1 346.515 4.493 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000526119007 1030288264 /nfs/dbraw/zinc/28/82/64/1030288264.db2.gz KUWMGCVVUFQNNA-SJORKVTESA-N 2 1 346.515 4.493 20 0 EIADMP C[N@H+](Cc1ccc2occc2c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000685417749 1030294925 /nfs/dbraw/zinc/29/49/25/1030294925.db2.gz TTZRKMDFQSYANT-FQEVSTJZSA-N 2 1 334.463 4.387 20 0 EIADMP C[NH+](Cc1ccc2occc2c1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685417749 1030294946 /nfs/dbraw/zinc/29/49/46/1030294946.db2.gz TTZRKMDFQSYANT-FQEVSTJZSA-N 2 1 334.463 4.387 20 0 EIADMP C[NH+](Cc1ccc2occc2c1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000685417749 1030294973 /nfs/dbraw/zinc/29/49/73/1030294973.db2.gz TTZRKMDFQSYANT-FQEVSTJZSA-N 2 1 334.463 4.387 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000392489851 1030303116 /nfs/dbraw/zinc/30/31/16/1030303116.db2.gz SRUINYLMAVODCI-SJORKVTESA-N 2 1 326.484 4.492 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000392489851 1030303131 /nfs/dbraw/zinc/30/31/31/1030303131.db2.gz SRUINYLMAVODCI-SJORKVTESA-N 2 1 326.484 4.492 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cnc2ccccc2c1 ZINC000685456700 1030334811 /nfs/dbraw/zinc/33/48/11/1030334811.db2.gz KPRNXAICDAIYIC-UHFFFAOYSA-N 2 1 333.479 4.319 20 0 EIADMP COc1cc(C[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)ccc1C ZINC000447823199 1030347209 /nfs/dbraw/zinc/34/72/09/1030347209.db2.gz TWFTWJPBJODZTM-UHFFFAOYSA-N 2 1 338.495 4.066 20 0 EIADMP C([C@@H]1CCC2(CCCC2)O1)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000530410443 1030382688 /nfs/dbraw/zinc/38/26/88/1030382688.db2.gz SOSOOMKJSPFJDI-UXHICEINSA-N 2 1 334.548 4.066 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@H]1CCCSCC1 ZINC000657907116 1030454253 /nfs/dbraw/zinc/45/42/53/1030454253.db2.gz GTJZGQOJIRYUSN-KVPLUYHFSA-N 2 1 332.557 4.018 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](CC[C@@H](C)OCc2ccccc2)CC1 ZINC000530496358 1030473705 /nfs/dbraw/zinc/47/37/05/1030473705.db2.gz BHHZEMHVRFUNSA-LJQANCHMSA-N 2 1 332.532 4.034 20 0 EIADMP C[C@@H](CCSc1ccccc1)[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000431609797 1030488575 /nfs/dbraw/zinc/48/85/75/1030488575.db2.gz XKEDUCBBWRPRFI-KRWDZBQOSA-N 2 1 343.540 4.246 20 0 EIADMP CC[C@@H]1C[C@H]([NH2+]CC2([NH2+][C@H](C)c3ccccc3)CCCC2)CCO1 ZINC000648456722 1030504202 /nfs/dbraw/zinc/50/42/02/1030504202.db2.gz HVYJEXAKUAAAON-MISYRCLQSA-N 2 1 330.516 4.197 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccnn1C1CCC1 ZINC000925205978 1030584080 /nfs/dbraw/zinc/58/40/80/1030584080.db2.gz KVIHBIAKBBRQKQ-MRXNPFEDSA-N 2 1 330.520 4.056 20 0 EIADMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cnn1C(C)(C)C ZINC000191328358 1030616792 /nfs/dbraw/zinc/61/67/92/1030616792.db2.gz ZZVPANPSRNECTO-HNNXBMFYSA-N 2 1 332.536 4.004 20 0 EIADMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cnn1C(C)C ZINC000191325725 1030617201 /nfs/dbraw/zinc/61/72/01/1030617201.db2.gz MBGSLERZSIJHSX-MRXNPFEDSA-N 2 1 332.536 4.220 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCOc2cccc3ccccc32)CCN1C ZINC000530666366 1030621650 /nfs/dbraw/zinc/62/16/50/1030621650.db2.gz UVVGMLFIWSWFHE-HKUYNNGSSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCOc2cccc3ccccc32)CC[N@@H+]1C ZINC000530666366 1030621667 /nfs/dbraw/zinc/62/16/67/1030621667.db2.gz UVVGMLFIWSWFHE-HKUYNNGSSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCOc2cccc3ccccc32)CC[N@H+]1C ZINC000530666366 1030621681 /nfs/dbraw/zinc/62/16/81/1030621681.db2.gz UVVGMLFIWSWFHE-HKUYNNGSSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)CCCOc2cccc3ccccc32)CC[NH+]1C ZINC000530666366 1030621692 /nfs/dbraw/zinc/62/16/92/1030621692.db2.gz UVVGMLFIWSWFHE-HKUYNNGSSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCOc2cccc3ccccc32)CC[NH+]1C ZINC000530666366 1030621709 /nfs/dbraw/zinc/62/17/09/1030621709.db2.gz UVVGMLFIWSWFHE-HKUYNNGSSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H](CC1CCOCC1)[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000685665253 1030662957 /nfs/dbraw/zinc/66/29/57/1030662957.db2.gz ZWTBYODIVNWVFH-DENIHFKCSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2ccccc2n1 ZINC000398109846 1030701650 /nfs/dbraw/zinc/70/16/50/1030701650.db2.gz CPLUTDVYPDDFOV-PGRDOPGGSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000398179863 1030730289 /nfs/dbraw/zinc/73/02/89/1030730289.db2.gz WUURNDQBGOEJMI-UWJYYQICSA-N 2 1 333.479 4.168 20 0 EIADMP c1coc(-c2ncc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)s2)c1 ZINC000193069530 1030731335 /nfs/dbraw/zinc/73/13/35/1030731335.db2.gz GENJLLHDIOKIKD-UHFFFAOYSA-N 2 1 345.512 4.147 20 0 EIADMP Cn1ncc(C2CC2)c1C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000658213535 1030893043 /nfs/dbraw/zinc/89/30/43/1030893043.db2.gz SQGFYPWFLVOPQP-UHFFFAOYSA-N 2 1 346.563 4.066 20 0 EIADMP Cc1ccncc1[C@@H](C)[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658320003 1030981312 /nfs/dbraw/zinc/98/13/12/1030981312.db2.gz LPPXBLLDTCDEFJ-TZIWHRDSSA-N 2 1 349.522 4.343 20 0 EIADMP c1[nH+]c(C2CCN(c3nccc4ccccc43)CC2)n2c1CCCC2 ZINC000527989207 1031017362 /nfs/dbraw/zinc/01/73/62/1031017362.db2.gz AGIANESJSCTGHH-UHFFFAOYSA-N 2 1 332.451 4.152 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCSc2ccc(Cl)cc2)[C@@H](C)C1 ZINC001167686156 1031030567 /nfs/dbraw/zinc/03/05/67/1031030567.db2.gz OICXACFCFZZISX-WMLDXEAASA-N 2 1 326.937 4.094 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCSc2ccc(Cl)cc2)[C@@H](C)C1 ZINC001167686156 1031030586 /nfs/dbraw/zinc/03/05/86/1031030586.db2.gz OICXACFCFZZISX-WMLDXEAASA-N 2 1 326.937 4.094 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCSc2ccc(Cl)cc2)[C@@H](C)C1 ZINC001167686156 1031030605 /nfs/dbraw/zinc/03/06/05/1031030605.db2.gz OICXACFCFZZISX-WMLDXEAASA-N 2 1 326.937 4.094 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cccc3cccnc32)C[C@H]1c1ccccc1 ZINC000340213239 1031188718 /nfs/dbraw/zinc/18/87/18/1031188718.db2.gz VDTBZFZNZFNWFT-RTWAWAEBSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2cccc3cccnc32)C[C@H]1c1ccccc1 ZINC000340213239 1031188738 /nfs/dbraw/zinc/18/87/38/1031188738.db2.gz VDTBZFZNZFNWFT-RTWAWAEBSA-N 2 1 331.463 4.160 20 0 EIADMP COCC[C@H](N[C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccc(C)o1 ZINC000340355242 1031203639 /nfs/dbraw/zinc/20/36/39/1031203639.db2.gz NXLSDKCHWMRPEW-SLFFLAALSA-N 2 1 342.483 4.091 20 0 EIADMP COCC[C@H](N[C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccc(C)o1 ZINC000340355242 1031203665 /nfs/dbraw/zinc/20/36/65/1031203665.db2.gz NXLSDKCHWMRPEW-SLFFLAALSA-N 2 1 342.483 4.091 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000532477060 1031206835 /nfs/dbraw/zinc/20/68/35/1031206835.db2.gz MPKQUSUOBDUGEJ-WWMYMODYSA-N 2 1 342.552 4.391 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@H]1C ZINC000532589644 1031322062 /nfs/dbraw/zinc/32/20/62/1031322062.db2.gz ROVIOMMRJWFCJD-APWZRJJASA-N 2 1 330.516 4.119 20 0 EIADMP CCN1CC[C@H]([N@H+](C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@H]1C ZINC000532589644 1031322079 /nfs/dbraw/zinc/32/20/79/1031322079.db2.gz ROVIOMMRJWFCJD-APWZRJJASA-N 2 1 330.516 4.119 20 0 EIADMP CCN1CC[C@H]([N@@H+](C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@H]1C ZINC000532589644 1031322098 /nfs/dbraw/zinc/32/20/98/1031322098.db2.gz ROVIOMMRJWFCJD-APWZRJJASA-N 2 1 330.516 4.119 20 0 EIADMP CC1CCC([N@@H+]2C[C@@H]3CCC[C@H]([NH+](C)Cc4ccccn4)[C@H]3C2)CC1 ZINC001168216972 1031324503 /nfs/dbraw/zinc/32/45/03/1031324503.db2.gz GOVBCIWFZVIOQW-ZNNJNLSUSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([N@H+]2C[C@@H]3CCC[C@H]([NH+](C)Cc4ccccn4)[C@H]3C2)CC1 ZINC001168216972 1031324522 /nfs/dbraw/zinc/32/45/22/1031324522.db2.gz GOVBCIWFZVIOQW-ZNNJNLSUSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([NH+]2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)CC1 ZINC001168216972 1031324540 /nfs/dbraw/zinc/32/45/40/1031324540.db2.gz GOVBCIWFZVIOQW-ZNNJNLSUSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([NH+]2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)CC1 ZINC001168216972 1031324555 /nfs/dbraw/zinc/32/45/55/1031324555.db2.gz GOVBCIWFZVIOQW-ZNNJNLSUSA-N 2 1 341.543 4.193 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cc3cccnc3o2)CC1 ZINC000449038148 1031375712 /nfs/dbraw/zinc/37/57/12/1031375712.db2.gz RXBITQALKOWGSL-QGZVFWFLSA-N 2 1 341.499 4.304 20 0 EIADMP Clc1ccc(C[C@H]2CCC[C@H]2[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000449071473 1031422131 /nfs/dbraw/zinc/42/21/31/1031422131.db2.gz NYIYDNSDLNVTOK-OXQOHEQNSA-N 2 1 332.919 4.268 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3cc4cccnc4o3)cc2)C1 ZINC000449073829 1031428135 /nfs/dbraw/zinc/42/81/35/1031428135.db2.gz AHOLKTSNWRNMGV-QGZVFWFLSA-N 2 1 349.478 4.350 20 0 EIADMP CSCC1CCC([NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000449128018 1031463052 /nfs/dbraw/zinc/46/30/52/1031463052.db2.gz XJKTXFMAXDXPAK-NYLDSWQDSA-N 2 1 346.584 4.062 20 0 EIADMP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000531678115 1031470393 /nfs/dbraw/zinc/47/03/93/1031470393.db2.gz VRROQNAPIHJLCV-OPAMFIHVSA-N 2 1 338.470 4.313 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)c1 ZINC000123913700 1031492646 /nfs/dbraw/zinc/49/26/46/1031492646.db2.gz FAZSWWPAVZOLEF-HXUWFJFHSA-N 2 1 342.458 4.281 20 0 EIADMP Cc1cccc(CC[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1 ZINC000449159992 1031501021 /nfs/dbraw/zinc/50/10/21/1031501021.db2.gz KEGCUCZBTCJQNU-UYAOXDASSA-N 2 1 328.525 4.272 20 0 EIADMP Cc1cccc(CC[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1 ZINC000449159992 1031501034 /nfs/dbraw/zinc/50/10/34/1031501034.db2.gz KEGCUCZBTCJQNU-UYAOXDASSA-N 2 1 328.525 4.272 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C[C@H]1CCCO1)C1CCC(C)CC1 ZINC000124465036 1031532306 /nfs/dbraw/zinc/53/23/06/1031532306.db2.gz GPNFBOPXCDUPQU-LYBXBRPPSA-N 2 1 333.520 4.031 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C[C@H]1CCCO1)C1CCC(C)CC1 ZINC000124465036 1031532319 /nfs/dbraw/zinc/53/23/19/1031532319.db2.gz GPNFBOPXCDUPQU-LYBXBRPPSA-N 2 1 333.520 4.031 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)cc(F)c1 ZINC000449232838 1031564160 /nfs/dbraw/zinc/56/41/60/1031564160.db2.gz JGOXTYFLVQFORB-PMPSAXMXSA-N 2 1 336.470 4.311 20 0 EIADMP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C(C)(C)C ZINC000453111154 1031604698 /nfs/dbraw/zinc/60/46/98/1031604698.db2.gz DWTPWGLBDNFHME-GOSISDBHSA-N 2 1 335.536 4.308 20 0 EIADMP CCC[C@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C(C)(C)C ZINC000453111165 1031605123 /nfs/dbraw/zinc/60/51/23/1031605123.db2.gz DWTPWGLBDNFHME-SFHVURJKSA-N 2 1 335.536 4.308 20 0 EIADMP CC[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453184459 1031688657 /nfs/dbraw/zinc/68/86/57/1031688657.db2.gz ZZHTURGNDMOUHT-CBQOVEMMSA-N 2 1 337.511 4.423 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453256133 1031779649 /nfs/dbraw/zinc/77/96/49/1031779649.db2.gz QQBARDLRMJOYEQ-UNMCSNQZSA-N 2 1 337.511 4.425 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453256131 1031779891 /nfs/dbraw/zinc/77/98/91/1031779891.db2.gz QQBARDLRMJOYEQ-IRLDBZIGSA-N 2 1 337.511 4.425 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000119235230 1031837545 /nfs/dbraw/zinc/83/75/45/1031837545.db2.gz ZCXITMRMDPUOEC-UHFFFAOYSA-N 2 1 325.378 4.123 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000119235230 1031837549 /nfs/dbraw/zinc/83/75/49/1031837549.db2.gz ZCXITMRMDPUOEC-UHFFFAOYSA-N 2 1 325.378 4.123 20 0 EIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CCC[NH+](C)C ZINC000531931832 1031838851 /nfs/dbraw/zinc/83/88/51/1031838851.db2.gz WBGCGVJWCONZMO-LBPRGKRZSA-N 2 1 337.920 4.374 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+]CCC3=CCCCC3)CC2)cc1 ZINC000531935077 1031843363 /nfs/dbraw/zinc/84/33/63/1031843363.db2.gz MLVNJFMTTVOFPK-UHFFFAOYSA-N 2 1 330.491 4.313 20 0 EIADMP CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000132221335 1031907698 /nfs/dbraw/zinc/90/76/98/1031907698.db2.gz HHKVVTNIMNWHTF-INIZCTEOSA-N 2 1 335.451 4.430 20 0 EIADMP CCC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531972393 1031909345 /nfs/dbraw/zinc/90/93/45/1031909345.db2.gz OBLIUZGOOVTXOM-RHSMWYFYSA-N 2 1 328.422 4.478 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000531993447 1031960902 /nfs/dbraw/zinc/96/09/02/1031960902.db2.gz REIDHIUROASVGN-NPFVIJTESA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000531993447 1031960910 /nfs/dbraw/zinc/96/09/10/1031960910.db2.gz REIDHIUROASVGN-NPFVIJTESA-N 2 1 338.470 4.313 20 0 EIADMP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)c1 ZINC000453397467 1031966270 /nfs/dbraw/zinc/96/62/70/1031966270.db2.gz JLUHOZONFVCWPQ-CQSZACIVSA-N 2 1 326.431 4.121 20 0 EIADMP COc1ccc2cc([C@@H](C)[NH2+]CCCC[N@@H+](C)C3CC3)ccc2c1 ZINC000453443333 1031970217 /nfs/dbraw/zinc/97/02/17/1031970217.db2.gz YRUODZHKAHDMOQ-MRXNPFEDSA-N 2 1 326.484 4.373 20 0 EIADMP CC(C)(C)c1cccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001168264685 1032026834 /nfs/dbraw/zinc/02/68/34/1032026834.db2.gz LTKYTYDHUCOSQM-NQIIRXRSSA-N 2 1 326.528 4.433 20 0 EIADMP CC(C)(C)c1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001168264685 1032026851 /nfs/dbraw/zinc/02/68/51/1032026851.db2.gz LTKYTYDHUCOSQM-NQIIRXRSSA-N 2 1 326.528 4.433 20 0 EIADMP CC(C)(C)c1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001168264685 1032026867 /nfs/dbraw/zinc/02/68/67/1032026867.db2.gz LTKYTYDHUCOSQM-NQIIRXRSSA-N 2 1 326.528 4.433 20 0 EIADMP C[C@H]([NH2+]CCc1c(F)cccc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000544424368 1032055032 /nfs/dbraw/zinc/05/50/32/1032055032.db2.gz LGDLBJZRLUBRJV-LSDHHAIUSA-N 2 1 338.898 4.264 20 0 EIADMP C[N@@H+](CCCOc1ccc2ccccc2c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512569909 1033382651 /nfs/dbraw/zinc/38/26/51/1033382651.db2.gz RHURTFWHMZOXSR-WCRBZPEASA-N 2 1 338.495 4.166 20 0 EIADMP C[NH+](CCCOc1ccc2ccccc2c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000512569909 1033382659 /nfs/dbraw/zinc/38/26/59/1033382659.db2.gz RHURTFWHMZOXSR-WCRBZPEASA-N 2 1 338.495 4.166 20 0 EIADMP C[NH+](CCCOc1ccc2ccccc2c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000512569909 1033382675 /nfs/dbraw/zinc/38/26/75/1033382675.db2.gz RHURTFWHMZOXSR-WCRBZPEASA-N 2 1 338.495 4.166 20 0 EIADMP C[N@@H+](Cc1ccc(-c2ccsc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512583146 1033428677 /nfs/dbraw/zinc/42/86/77/1033428677.db2.gz QZWDVOAEEQVZFI-YOFSQIOKSA-N 2 1 326.509 4.472 20 0 EIADMP C[NH+](Cc1ccc(-c2ccsc2)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000512583146 1033428695 /nfs/dbraw/zinc/42/86/95/1033428695.db2.gz QZWDVOAEEQVZFI-YOFSQIOKSA-N 2 1 326.509 4.472 20 0 EIADMP C[NH+](Cc1ccc(-c2ccsc2)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000512583146 1033428715 /nfs/dbraw/zinc/42/87/15/1033428715.db2.gz QZWDVOAEEQVZFI-YOFSQIOKSA-N 2 1 326.509 4.472 20 0 EIADMP FC1(F)CCC([NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000512632312 1033557044 /nfs/dbraw/zinc/55/70/44/1033557044.db2.gz YZSBOIQZBGAPKD-MISYRCLQSA-N 2 1 348.481 4.455 20 0 EIADMP c1ccc(C[N@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C2CC2)nc1 ZINC000411448447 1033893901 /nfs/dbraw/zinc/89/39/01/1033893901.db2.gz RIRKXDBIEYLUSK-UHFFFAOYSA-N 2 1 335.495 4.232 20 0 EIADMP C[C@@H]1[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCC12CCOCC2 ZINC000411527754 1033966046 /nfs/dbraw/zinc/96/60/46/1033966046.db2.gz QXXRKLWYTSWXMK-IBGZPJMESA-N 2 1 342.527 4.064 20 0 EIADMP C[C@@H](NCCC[N@H+]1CCCC[C@@H]1C)c1ccccc1OC(F)F ZINC000320373539 1034395537 /nfs/dbraw/zinc/39/55/37/1034395537.db2.gz UJNAFFSIHRJNQY-LSDHHAIUSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccccc1OC(F)F ZINC000320373539 1034395550 /nfs/dbraw/zinc/39/55/50/1034395550.db2.gz UJNAFFSIHRJNQY-LSDHHAIUSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccccc1OC(F)F ZINC000320373539 1034395565 /nfs/dbraw/zinc/39/55/65/1034395565.db2.gz UJNAFFSIHRJNQY-LSDHHAIUSA-N 2 1 326.431 4.203 20 0 EIADMP c1ccc(C(CC[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000246525060 1034721710 /nfs/dbraw/zinc/72/17/10/1034721710.db2.gz KVWMXYLAHDLPIP-YADHBBJMSA-N 2 1 334.507 4.425 20 0 EIADMP Clc1ccc2[nH+]ccc(NC[C@@H](c3ccco3)[NH+]3CCCC3)c2c1 ZINC000513602902 1035056352 /nfs/dbraw/zinc/05/63/52/1035056352.db2.gz KPJILEOLYACCSK-SFHVURJKSA-N 2 1 341.842 4.152 20 0 EIADMP C[C@H](c1ccc(F)cc1)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501043965 1035355656 /nfs/dbraw/zinc/35/56/56/1035355656.db2.gz FHXBUQYGVIIHDK-MRXNPFEDSA-N 2 1 327.447 4.130 20 0 EIADMP Cc1cc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)ccc1Br ZINC000501166592 1035391435 /nfs/dbraw/zinc/39/14/35/1035391435.db2.gz YUGGELRNNXGZQT-UHFFFAOYSA-N 2 1 339.321 4.062 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501384134 1035436178 /nfs/dbraw/zinc/43/61/78/1035436178.db2.gz WRWVEMQVKNAFDD-YOUFYPILSA-N 2 1 329.532 4.065 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000501408072 1035440612 /nfs/dbraw/zinc/44/06/12/1035440612.db2.gz TXJQPTJSMYJFAH-RVSUXWIQSA-N 2 1 338.417 4.325 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(C(F)(F)F)c(C)c1 ZINC000414440492 1035459384 /nfs/dbraw/zinc/45/93/84/1035459384.db2.gz HRYCPLGBRWDSRQ-UHFFFAOYSA-N 2 1 325.378 4.041 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(C(F)(F)F)c(C)c1 ZINC000414440492 1035459389 /nfs/dbraw/zinc/45/93/89/1035459389.db2.gz HRYCPLGBRWDSRQ-UHFFFAOYSA-N 2 1 325.378 4.041 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SC(F)F)cc2)C1 ZINC000151137085 1035509214 /nfs/dbraw/zinc/50/92/14/1035509214.db2.gz WJAHMMKECJIULY-KBPBESRZSA-N 2 1 328.472 4.384 20 0 EIADMP CCSC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000594991628 1035520888 /nfs/dbraw/zinc/52/08/88/1035520888.db2.gz JWPJNGSPMMSFEO-SFHVURJKSA-N 2 1 330.541 4.059 20 0 EIADMP CCSC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000594991628 1035520923 /nfs/dbraw/zinc/52/09/23/1035520923.db2.gz JWPJNGSPMMSFEO-SFHVURJKSA-N 2 1 330.541 4.059 20 0 EIADMP CCSC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000594991626 1035521014 /nfs/dbraw/zinc/52/10/14/1035521014.db2.gz JWPJNGSPMMSFEO-GOSISDBHSA-N 2 1 330.541 4.059 20 0 EIADMP CCSC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000594991626 1035521055 /nfs/dbraw/zinc/52/10/55/1035521055.db2.gz JWPJNGSPMMSFEO-GOSISDBHSA-N 2 1 330.541 4.059 20 0 EIADMP C[C@H](C[N@H+]1CCC[C@@H]([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501951052 1035751596 /nfs/dbraw/zinc/75/15/96/1035751596.db2.gz OBQYKHKYSRXORP-RHSMWYFYSA-N 2 1 328.422 4.225 20 0 EIADMP C[N@H+](Cc1ccc(-c2ccccc2Cl)o1)CC1CC[NH+](C)CC1 ZINC000513730290 1035844917 /nfs/dbraw/zinc/84/49/17/1035844917.db2.gz XJWBCPVHVAQBQZ-UHFFFAOYSA-N 2 1 332.875 4.374 20 0 EIADMP Cc1ccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000485467042 1035903661 /nfs/dbraw/zinc/90/36/61/1035903661.db2.gz OMMNZRQVOAJEMQ-UHFFFAOYSA-N 2 1 334.507 4.483 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CCCC[C@@H]([NH+]4CCCC4)C3)c2c1 ZINC000513739830 1036048612 /nfs/dbraw/zinc/04/86/12/1036048612.db2.gz NANULTJDFUDUKL-MRXNPFEDSA-N 2 1 329.875 4.343 20 0 EIADMP C[N@H+](Cc1cc(F)cc(Cl)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000485705324 1036182149 /nfs/dbraw/zinc/18/21/49/1036182149.db2.gz OHFLESZRSNUZLS-UHFFFAOYSA-N 2 1 347.865 4.223 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccc3[nH]ccc3c2)CC1 ZINC000571776359 1036249573 /nfs/dbraw/zinc/24/95/73/1036249573.db2.gz ZBSUFGTXQPUMKU-KRWDZBQOSA-N 2 1 333.479 4.483 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+]CCC3CCCCCC3)CC2)oc1C ZINC000571806346 1036255773 /nfs/dbraw/zinc/25/57/73/1036255773.db2.gz CSQGOKMHRKFIOS-UHFFFAOYSA-N 2 1 347.547 4.454 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000502699173 1036521550 /nfs/dbraw/zinc/52/15/50/1036521550.db2.gz XMMPUJWYZLAFAR-BVYCBKJFSA-N 2 1 344.543 4.356 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@H+](C)[C@@H]2CCCC[C@H]2c2ccccc2)s1 ZINC000414535012 1036564252 /nfs/dbraw/zinc/56/42/52/1036564252.db2.gz VYRZTDZVOQIZBP-RBUKOAKNSA-N 2 1 343.540 4.363 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@@H+](C)[C@@H]2CCCC[C@H]2c2ccccc2)s1 ZINC000414535012 1036564271 /nfs/dbraw/zinc/56/42/71/1036564271.db2.gz VYRZTDZVOQIZBP-RBUKOAKNSA-N 2 1 343.540 4.363 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000502723869 1036583324 /nfs/dbraw/zinc/58/33/24/1036583324.db2.gz RZINJQFLCBFOSQ-DXIQSLLYSA-N 2 1 344.543 4.356 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486479362 1036728051 /nfs/dbraw/zinc/72/80/51/1036728051.db2.gz VFVYEWZFCSNSIK-AWDZXFJFSA-N 2 1 334.507 4.290 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)CCCOc1ccc2ccccc2c1 ZINC000503064176 1036888783 /nfs/dbraw/zinc/88/87/83/1036888783.db2.gz QBVVOMFWMPIASG-UHFFFAOYSA-N 2 1 337.467 4.136 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)CCCOc1ccc2ccccc2c1 ZINC000503064176 1036888789 /nfs/dbraw/zinc/88/87/89/1036888789.db2.gz QBVVOMFWMPIASG-UHFFFAOYSA-N 2 1 337.467 4.136 20 0 EIADMP CCCC[N@@H+](CCCN1CC[NH+](C(C)C)CC1)[C@H](C)c1ccc(C)o1 ZINC000669688943 1036892232 /nfs/dbraw/zinc/89/22/32/1036892232.db2.gz GGASWIXUOBEAFH-HXUWFJFHSA-N 2 1 349.563 4.167 20 0 EIADMP CC[N@@H+](CCO[C@@H]1CCCC[C@H]1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999653 1036917938 /nfs/dbraw/zinc/91/79/38/1036917938.db2.gz QIMFCIVCMWQDNE-WIYYLYMNSA-N 2 1 332.532 4.165 20 0 EIADMP CC[N@@H+](CCCOc1ccccc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999348 1036918245 /nfs/dbraw/zinc/91/82/45/1036918245.db2.gz ANIMGZCWVNIFCC-UHFFFAOYSA-N 2 1 326.484 4.039 20 0 EIADMP CCOc1ccc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cc1F ZINC000486990715 1036936807 /nfs/dbraw/zinc/93/68/07/1036936807.db2.gz QVLXUPLZURGQSY-UHFFFAOYSA-N 2 1 344.474 4.354 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271812518 1037020463 /nfs/dbraw/zinc/02/04/63/1037020463.db2.gz BAYILPDKMBTMGX-ZDUSSCGKSA-N 2 1 345.487 4.170 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271842565 1037030238 /nfs/dbraw/zinc/03/02/38/1037030238.db2.gz HEFGNJANJCOYEI-OAHLLOKOSA-N 2 1 341.524 4.339 20 0 EIADMP COc1ccccc1-c1ccc([C@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000271868078 1037041053 /nfs/dbraw/zinc/04/10/53/1037041053.db2.gz LWGUHTCFYQMMPJ-KRWDZBQOSA-N 2 1 336.479 4.275 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000271867010 1037041389 /nfs/dbraw/zinc/04/13/89/1037041389.db2.gz LSMOULNSPCTIJP-QGZVFWFLSA-N 2 1 339.508 4.039 20 0 EIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000271866949 1037042563 /nfs/dbraw/zinc/04/25/63/1037042563.db2.gz LPYDMWJUKRMALD-ZDUSSCGKSA-N 2 1 344.446 4.254 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CCO1 ZINC000272009905 1037079005 /nfs/dbraw/zinc/07/90/05/1037079005.db2.gz LSVVMQGFIRVGFL-PDGJWGCVSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CCO1 ZINC000272009905 1037079021 /nfs/dbraw/zinc/07/90/21/1037079021.db2.gz LSVVMQGFIRVGFL-PDGJWGCVSA-N 2 1 344.543 4.080 20 0 EIADMP FCCCCC[NH+]1CCCC2(CCC[N@H+](CCCCCF)C2)C1 ZINC000572984161 1037087764 /nfs/dbraw/zinc/08/77/64/1037087764.db2.gz QZTUPDCSXWPKHG-UHFFFAOYSA-N 2 1 330.507 4.444 20 0 EIADMP Cn1c[nH+]cc1CCC[NH2+]C1(c2c(Cl)cccc2Cl)CCC1 ZINC000572972272 1037088484 /nfs/dbraw/zinc/08/84/84/1037088484.db2.gz TXCUKNASEXDDNJ-UHFFFAOYSA-N 2 1 338.282 4.329 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000272298515 1037153935 /nfs/dbraw/zinc/15/39/35/1037153935.db2.gz CQSNDLYVCGUPSE-FQEVSTJZSA-N 2 1 327.447 4.337 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(-c3ccc(F)cc3)no2)CC1 ZINC000590786388 1037167944 /nfs/dbraw/zinc/16/79/44/1037167944.db2.gz VDFCOONVIJRAKJ-UHFFFAOYSA-N 2 1 345.462 4.033 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000569860855 1037181234 /nfs/dbraw/zinc/18/12/34/1037181234.db2.gz MSSZQMDBIDHUDI-FDFHNCONSA-N 2 1 344.543 4.084 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)s1 ZINC000272419339 1037183386 /nfs/dbraw/zinc/18/33/86/1037183386.db2.gz NATYPDVVJZRJFA-LDLYASANSA-N 2 1 341.524 4.045 20 0 EIADMP COc1ccc(C)cc1C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000590819113 1037185191 /nfs/dbraw/zinc/18/51/91/1037185191.db2.gz SBHSNCHEKQYOCY-LJQANCHMSA-N 2 1 330.516 4.092 20 0 EIADMP COc1ccc(C)cc1C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000590819113 1037185199 /nfs/dbraw/zinc/18/51/99/1037185199.db2.gz SBHSNCHEKQYOCY-LJQANCHMSA-N 2 1 330.516 4.092 20 0 EIADMP COCC[C@@H]([NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccco1 ZINC000272536347 1037217176 /nfs/dbraw/zinc/21/71/76/1037217176.db2.gz JXAXVJXMHKDYAQ-HNAYVOBHSA-N 2 1 339.439 4.202 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(Cl)nc2)CC1 ZINC000057844127 1037272111 /nfs/dbraw/zinc/27/21/11/1037272111.db2.gz ANIIHPMPXQYUBS-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(Cl)nc2)CC1 ZINC000057844127 1037272129 /nfs/dbraw/zinc/27/21/29/1037272129.db2.gz ANIIHPMPXQYUBS-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP CC(C)c1ccc(C[NH+]2CCC([N@H+](C)CCCO)CC2)c(C(C)C)c1 ZINC000604388960 1037369916 /nfs/dbraw/zinc/36/99/16/1037369916.db2.gz LRXDAGZTIPNRST-UHFFFAOYSA-N 2 1 346.559 4.212 20 0 EIADMP CC(C)c1ccc(C[NH+]2CCC([N@@H+](C)CCCO)CC2)c(C(C)C)c1 ZINC000604388960 1037369933 /nfs/dbraw/zinc/36/99/33/1037369933.db2.gz LRXDAGZTIPNRST-UHFFFAOYSA-N 2 1 346.559 4.212 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C[C@@H](C)C[NH+]3CCCCC3)s2)cc1 ZINC000604415133 1037382681 /nfs/dbraw/zinc/38/26/81/1037382681.db2.gz UZYJBCOFLXSHKO-QGZVFWFLSA-N 2 1 343.540 4.330 20 0 EIADMP CC[NH+](CC)CC1CC[NH+](Cc2ccc(Br)s2)CC1 ZINC000488272035 1037468197 /nfs/dbraw/zinc/46/81/97/1037468197.db2.gz ZVDMFGUXQUHWQE-UHFFFAOYSA-N 2 1 345.350 4.064 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)CS1 ZINC000488443208 1037587365 /nfs/dbraw/zinc/58/73/65/1037587365.db2.gz GBHCYMLENCFRKE-UOVPBQLFSA-N 2 1 338.586 4.251 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CS1 ZINC000488443208 1037587373 /nfs/dbraw/zinc/58/73/73/1037587373.db2.gz GBHCYMLENCFRKE-UOVPBQLFSA-N 2 1 338.586 4.251 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CS[C@@H](C(C)C)C2)cc1 ZINC000488427693 1037587518 /nfs/dbraw/zinc/58/75/18/1037587518.db2.gz XYGDJSFQFLTUCR-POZUXBRTSA-N 2 1 329.513 4.361 20 0 EIADMP Cc1ccc(CCC[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)cc1 ZINC000503410483 1037742990 /nfs/dbraw/zinc/74/29/90/1037742990.db2.gz BBAHWPBLWJNGMX-FQEVSTJZSA-N 2 1 337.511 4.340 20 0 EIADMP C[C@H](NC(C)(C)C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422733043 1037809394 /nfs/dbraw/zinc/80/93/94/1037809394.db2.gz QLWLXHJNNKYTJB-ZIBCJSCZSA-N 2 1 343.559 4.016 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000414690886 1037833081 /nfs/dbraw/zinc/83/30/81/1037833081.db2.gz AXIFKXRPEDTUOG-XIRDDKMYSA-N 2 1 343.540 4.499 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCCc3cc(OC(F)F)ccc32)c2ccccc21 ZINC000422835012 1037843018 /nfs/dbraw/zinc/84/30/18/1037843018.db2.gz XWWNJRYUTBTWAG-QRVBRYPASA-N 2 1 344.405 4.400 20 0 EIADMP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000422818962 1037844963 /nfs/dbraw/zinc/84/49/63/1037844963.db2.gz LULDDIQZPKLGMM-BRSBDYLESA-N 2 1 340.433 4.438 20 0 EIADMP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000422854969 1037846693 /nfs/dbraw/zinc/84/66/93/1037846693.db2.gz BNYLTAPPZRQWLB-AAEUAGOBSA-N 2 1 332.517 4.015 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)cc1OC ZINC000422891846 1037852484 /nfs/dbraw/zinc/85/24/84/1037852484.db2.gz LROLOKBQLDMQMX-JVPBZIDWSA-N 2 1 340.467 4.279 20 0 EIADMP CCN(CC)[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)c1ccsc1 ZINC000422868785 1037855404 /nfs/dbraw/zinc/85/54/04/1037855404.db2.gz WAUGUVVCDYFZMO-UAFMIMERSA-N 2 1 349.588 4.031 20 0 EIADMP CCOc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc2)cc1 ZINC000422939221 1037875750 /nfs/dbraw/zinc/87/57/50/1037875750.db2.gz HZBCGWQRQWPQHA-XQXKNUKBSA-N 2 1 336.479 4.047 20 0 EIADMP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]C1CC(c2ccc(F)c(Cl)c2)C1 ZINC000423094864 1037952512 /nfs/dbraw/zinc/95/25/12/1037952512.db2.gz CXCWWUBUCLDGQJ-QXBFMWRISA-N 2 1 346.877 4.273 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1)c1c[nH+]ccc1N ZINC000423096156 1037953766 /nfs/dbraw/zinc/95/37/66/1037953766.db2.gz HAFXCIRXDUYOGO-DRZSPHRISA-N 2 1 336.266 4.398 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1c[nH+]ccc1N ZINC000423103017 1037962951 /nfs/dbraw/zinc/96/29/51/1037962951.db2.gz XGWXKIXOQVIDHO-WHOFXGATSA-N 2 1 335.373 4.110 20 0 EIADMP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423125919 1037977206 /nfs/dbraw/zinc/97/72/06/1037977206.db2.gz IMMHZPPTEPZQCR-HSALFYBXSA-N 2 1 344.886 4.067 20 0 EIADMP CC[C@H](C[NH2+][C@H](c1ccc(OC)cc1)[C@@H]1CCC[NH2+]1)CC(F)(F)F ZINC000423174915 1038029474 /nfs/dbraw/zinc/02/94/74/1038029474.db2.gz DAPCRHYZNUFUFU-RRQGHBQHSA-N 2 1 344.421 4.057 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000503951586 1038043239 /nfs/dbraw/zinc/04/32/39/1038043239.db2.gz FXNFZTUSRCLBFV-AVRDEDQJSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000503951586 1038043253 /nfs/dbraw/zinc/04/32/53/1038043253.db2.gz FXNFZTUSRCLBFV-AVRDEDQJSA-N 2 1 347.506 4.211 20 0 EIADMP c1ccc(C[C@H]([NH2+]CCC[NH2+]Cc2cccnc2)c2ccccc2)cc1 ZINC000423192419 1038045035 /nfs/dbraw/zinc/04/50/35/1038045035.db2.gz VFNINDANNAZHIY-QHCPKHFHSA-N 2 1 345.490 4.135 20 0 EIADMP Clc1cccc([C@@H]2CC[C@@H]([NH2+]CCC[NH2+]Cc3cccnc3)C2)c1 ZINC000423191782 1038047192 /nfs/dbraw/zinc/04/71/92/1038047192.db2.gz TYPBVVVFUXXWPC-UYAOXDASSA-N 2 1 343.902 4.141 20 0 EIADMP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423194007 1038049146 /nfs/dbraw/zinc/04/91/46/1038049146.db2.gz XXWFMYPOADAYQJ-VNQPRFMTSA-N 2 1 349.931 4.058 20 0 EIADMP Fc1ccc([C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423215516 1038057599 /nfs/dbraw/zinc/05/75/99/1038057599.db2.gz QRUTTYFPUAPALP-KSFYIVLOSA-N 2 1 349.453 4.053 20 0 EIADMP Fc1ccc([C@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2ccc(Cl)cc2)cc1 ZINC000423218143 1038061420 /nfs/dbraw/zinc/06/14/20/1038061420.db2.gz VCFAFIKZDFCHOH-IFXJQAMLSA-N 2 1 332.850 4.158 20 0 EIADMP C[N@@H+](CCCOc1cccc(C(C)(C)C)c1)C[C@H]1CCC[NH+](C)C1 ZINC000607358495 1038078475 /nfs/dbraw/zinc/07/84/75/1038078475.db2.gz PGUNULQIPFHEAM-SFHVURJKSA-N 2 1 332.532 4.027 20 0 EIADMP C[NH+](CCCOc1cccc(C(C)(C)C)c1)C[C@H]1CCC[N@H+](C)C1 ZINC000607358495 1038078511 /nfs/dbraw/zinc/07/85/11/1038078511.db2.gz PGUNULQIPFHEAM-SFHVURJKSA-N 2 1 332.532 4.027 20 0 EIADMP C[NH+](CCCOc1cccc(C(C)(C)C)c1)C[C@H]1CCC[N@@H+](C)C1 ZINC000607358495 1038078533 /nfs/dbraw/zinc/07/85/33/1038078533.db2.gz PGUNULQIPFHEAM-SFHVURJKSA-N 2 1 332.532 4.027 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1csc(-c2ccccc2F)n1 ZINC000423277790 1038104467 /nfs/dbraw/zinc/10/44/67/1038104467.db2.gz ORXFPEWYOYTDEQ-HEHGZKQESA-N 2 1 333.476 4.117 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCCOc3c(Cl)cc(C)cc32)CC1 ZINC000489554066 1038112703 /nfs/dbraw/zinc/11/27/03/1038112703.db2.gz FHHBPGUHWGXZKE-GOSISDBHSA-N 2 1 336.907 4.326 20 0 EIADMP CS[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000593653870 1038119867 /nfs/dbraw/zinc/11/98/67/1038119867.db2.gz CKLMUMWQRIWYIL-VAMGGRTRSA-N 2 1 344.568 4.447 20 0 EIADMP CS[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000593653870 1038119887 /nfs/dbraw/zinc/11/98/87/1038119887.db2.gz CKLMUMWQRIWYIL-VAMGGRTRSA-N 2 1 344.568 4.447 20 0 EIADMP CCCC[C@H](C[NH3+])[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000423303545 1038130132 /nfs/dbraw/zinc/13/01/32/1038130132.db2.gz XFUABXYSXCBAMF-MOPGFXCFSA-N 2 1 331.891 4.126 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc2c1CCCN2 ZINC000423422164 1038211706 /nfs/dbraw/zinc/21/17/06/1038211706.db2.gz YKFWFZVBRHMVBX-AVRDEDQJSA-N 2 1 349.522 4.045 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000423444784 1038225702 /nfs/dbraw/zinc/22/57/02/1038225702.db2.gz MCXAKZSBEREZHE-AVRDEDQJSA-N 2 1 349.522 4.045 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423512027 1038270174 /nfs/dbraw/zinc/27/01/74/1038270174.db2.gz UFQIKIJLTMIGEE-JTSKRJEESA-N 3 1 348.494 4.312 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000490070176 1038330557 /nfs/dbraw/zinc/33/05/57/1038330557.db2.gz WRCXGXISGHLADO-SJORKVTESA-N 2 1 347.572 4.076 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000490070176 1038330566 /nfs/dbraw/zinc/33/05/66/1038330566.db2.gz WRCXGXISGHLADO-SJORKVTESA-N 2 1 347.572 4.076 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000490070176 1038330582 /nfs/dbraw/zinc/33/05/82/1038330582.db2.gz WRCXGXISGHLADO-SJORKVTESA-N 2 1 347.572 4.076 20 0 EIADMP C[C@@H](O)[C@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1ccccc1 ZINC000658355918 1038340249 /nfs/dbraw/zinc/34/02/49/1038340249.db2.gz IQKQUUZYOVBTMP-XLIONFOSSA-N 2 1 346.559 4.377 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1cccc(F)c1)c1cccc(Cl)c1 ZINC000490165546 1038364986 /nfs/dbraw/zinc/36/49/86/1038364986.db2.gz XSXHGEOTMPYMNP-IBGZPJMESA-N 2 1 343.833 4.363 20 0 EIADMP CC[N@H+]1CC[C@H](CN[C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000490168564 1038367599 /nfs/dbraw/zinc/36/75/99/1038367599.db2.gz XJWDOVWJSQMGBJ-FOIQADDNSA-N 2 1 346.877 4.500 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000490173615 1038370011 /nfs/dbraw/zinc/37/00/11/1038370011.db2.gz XATYQKXZGHAAPF-LJQANCHMSA-N 2 1 325.843 4.224 20 0 EIADMP C[C@H](c1ccccc1Br)[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000490296173 1038453615 /nfs/dbraw/zinc/45/36/15/1038453615.db2.gz DAIDTGWHCNMIOH-OLZOCXBDSA-N 2 1 334.261 4.113 20 0 EIADMP Cc1cc(N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)c2ccccc2[nH+]1 ZINC000608092969 1038603419 /nfs/dbraw/zinc/60/34/19/1038603419.db2.gz ZWOLCPMFBLRWKK-LJQANCHMSA-N 2 1 331.463 4.254 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H](Cc1ccncc1)c1cccs1 ZINC000424266222 1038762459 /nfs/dbraw/zinc/76/24/59/1038762459.db2.gz WPYQMWFMOSTQSA-PKOBYXMFSA-N 2 1 343.540 4.281 20 0 EIADMP CO[C@H]1C[C@H]2C[C@H]([NH2+]C3CC[NH+]([C@H](C)c4ccccc4)CC3)C[C@H]2C1 ZINC000424315679 1038800996 /nfs/dbraw/zinc/80/09/96/1038800996.db2.gz PQXWKFPSWODNRB-ZTCOWCNDSA-N 2 1 342.527 4.005 20 0 EIADMP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000480758673 1038801132 /nfs/dbraw/zinc/80/11/32/1038801132.db2.gz NRWBESLRUYPHRP-RDTXWAMCSA-N 2 1 326.509 4.353 20 0 EIADMP c1ccc(CC[C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000480763300 1038803792 /nfs/dbraw/zinc/80/37/92/1038803792.db2.gz MJCOBARYOHFAJA-NZQKXSOJSA-N 2 1 334.507 4.434 20 0 EIADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](CC(C)C)c2ccccc2C)CC1 ZINC000480783084 1038805127 /nfs/dbraw/zinc/80/51/27/1038805127.db2.gz YNEGKIYWZAIORA-QFIPXVFZSA-N 2 1 345.575 4.090 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000480772775 1038809469 /nfs/dbraw/zinc/80/94/69/1038809469.db2.gz GOTWPMAUYRBWQB-GDBMZVCRSA-N 2 1 338.948 4.285 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCOc2ccc(C)cc2)cc1 ZINC000539076308 1038825286 /nfs/dbraw/zinc/82/52/86/1038825286.db2.gz PWLCLRIYZXCNTH-QGZVFWFLSA-N 2 1 335.451 4.219 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]C[C@@H](Cc2ccccc2)C(F)(F)F)CC1 ZINC000555003427 1038825961 /nfs/dbraw/zinc/82/59/61/1038825961.db2.gz YQFMKMOAVFJCKM-MRXNPFEDSA-N 2 1 342.449 4.260 20 0 EIADMP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000504906340 1038846538 /nfs/dbraw/zinc/84/65/38/1038846538.db2.gz WVCDQJSVIWMDGP-XSYGEPLQSA-N 2 1 330.516 4.022 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000504927757 1038858041 /nfs/dbraw/zinc/85/80/41/1038858041.db2.gz UESBNPCWUKTUSI-KBPBESRZSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000504926310 1038858090 /nfs/dbraw/zinc/85/80/90/1038858090.db2.gz HWNZODOSUZOXCJ-JONQDZQNSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1c(F)cccc1F ZINC000480898883 1038866606 /nfs/dbraw/zinc/86/66/06/1038866606.db2.gz OEVRLNLJTOIYHI-LSDHHAIUSA-N 2 1 348.437 4.317 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccc(F)cc1)C1CCCC1 ZINC000539217825 1038888564 /nfs/dbraw/zinc/88/85/64/1038888564.db2.gz NLILVAAOJPXVII-QRWLVFNGSA-N 2 1 329.463 4.488 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[N@@H+]1C ZINC000537615493 1038894614 /nfs/dbraw/zinc/89/46/14/1038894614.db2.gz WEEFGGHKBIBXNL-YOEHRIQHSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[N@H+]1C ZINC000537615493 1038894617 /nfs/dbraw/zinc/89/46/17/1038894617.db2.gz WEEFGGHKBIBXNL-YOEHRIQHSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[NH+]1C ZINC000537615493 1038894619 /nfs/dbraw/zinc/89/46/19/1038894619.db2.gz WEEFGGHKBIBXNL-YOEHRIQHSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[NH+]1C ZINC000537615493 1038894626 /nfs/dbraw/zinc/89/46/26/1038894626.db2.gz WEEFGGHKBIBXNL-YOEHRIQHSA-N 2 1 332.488 4.469 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCC[N@@H+]2C)cc1OCC ZINC000539269213 1038905033 /nfs/dbraw/zinc/90/50/33/1038905033.db2.gz CAWSSLQGGLLHGU-WMZOPIPTSA-N 2 1 334.504 4.009 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCC[N@H+]2C)cc1OCC ZINC000539269213 1038905058 /nfs/dbraw/zinc/90/50/58/1038905058.db2.gz CAWSSLQGGLLHGU-WMZOPIPTSA-N 2 1 334.504 4.009 20 0 EIADMP CC[C@H](Cc1ccccc1)[NH2+]CC1([NH+]2CCC(OC)CC2)CCCC1 ZINC000462107499 1038909182 /nfs/dbraw/zinc/90/91/82/1038909182.db2.gz AJMLEJLWLJLCSO-HXUWFJFHSA-N 2 1 344.543 4.021 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2cccc(Br)c21 ZINC000119706878 1038993986 /nfs/dbraw/zinc/99/39/86/1038993986.db2.gz ZNGGJANLINMNIY-YVEFUNNKSA-N 2 1 349.316 4.214 20 0 EIADMP c1ccc(CC(Cc2ccccc2)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000378931083 1039039082 /nfs/dbraw/zinc/03/90/82/1039039082.db2.gz YIYROVRNYOVJIR-GGAORHGYSA-N 2 1 334.507 4.057 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC[N@@H+]1C ZINC000552043412 1039063521 /nfs/dbraw/zinc/06/35/21/1039063521.db2.gz LVAHWQDGHUGHOR-SRCQZFHVSA-N 2 1 342.405 4.109 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC[N@H+]1C ZINC000552043412 1039063542 /nfs/dbraw/zinc/06/35/42/1039063542.db2.gz LVAHWQDGHUGHOR-SRCQZFHVSA-N 2 1 342.405 4.109 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCC[C@H]1Cc1ccccc1 ZINC000481191183 1039099898 /nfs/dbraw/zinc/09/98/98/1039099898.db2.gz MUMCXAFGBHDGHO-SFTDATJTSA-N 2 1 325.500 4.363 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)[C@H]2CCC[C@@H]21 ZINC000552052888 1039106967 /nfs/dbraw/zinc/10/69/67/1039106967.db2.gz IUMLOVMOTVXYCR-PMPSAXMXSA-N 2 1 326.937 4.187 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000481298471 1039237655 /nfs/dbraw/zinc/23/76/55/1039237655.db2.gz INBDZTSAJOQWME-LAUBAEHRSA-N 2 1 344.449 4.180 20 0 EIADMP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+][C@@H](C[NH3+])C1CCCCC1 ZINC000414833973 1039278285 /nfs/dbraw/zinc/27/82/85/1039278285.db2.gz GBLBUZXNPPQJKV-JXFKEZNVSA-N 2 1 345.531 4.024 20 0 EIADMP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+][C@H](C[NH3+])C1CCCCC1 ZINC000414833978 1039280171 /nfs/dbraw/zinc/28/01/71/1039280171.db2.gz GBLBUZXNPPQJKV-OXQOHEQNSA-N 2 1 345.531 4.024 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](Cc2ccccc2)c2sccc2C)C1 ZINC000481314191 1039284278 /nfs/dbraw/zinc/28/42/78/1039284278.db2.gz BNPWDZBOPYSXCH-RBUKOAKNSA-N 2 1 328.525 4.272 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](CCc2ccccc2)Cc2ccccc2)C1 ZINC000481324775 1039296976 /nfs/dbraw/zinc/29/69/76/1039296976.db2.gz RXLGEGRTTKDYGV-DHIUTWEWSA-N 2 1 336.523 4.162 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cccc(OC3CCCC3)c2)C[C@@H]1C ZINC000537634897 1039342141 /nfs/dbraw/zinc/34/21/41/1039342141.db2.gz YIJWXQGPPRYHIS-PKOBYXMFSA-N 2 1 330.516 4.313 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(OC3CCCC3)c2)C[C@@H]1C ZINC000537634897 1039342175 /nfs/dbraw/zinc/34/21/75/1039342175.db2.gz YIJWXQGPPRYHIS-PKOBYXMFSA-N 2 1 330.516 4.313 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(OC3CCCC3)c2)C[C@@H]1C ZINC000537634897 1039342190 /nfs/dbraw/zinc/34/21/90/1039342190.db2.gz YIJWXQGPPRYHIS-PKOBYXMFSA-N 2 1 330.516 4.313 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](C[C@@H]3CCCC(F)(F)C3)C2)CC1 ZINC000513882637 1039343062 /nfs/dbraw/zinc/34/30/62/1039343062.db2.gz MYLNQFIQCCADMP-MSOLQXFVSA-N 2 1 328.491 4.256 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(Br)cc1 ZINC000157421818 1039591765 /nfs/dbraw/zinc/59/17/65/1039591765.db2.gz LXWMPXBOUSZSKG-GOPGUHFVSA-N 2 1 331.257 4.245 20 0 EIADMP c1ccc(CC(Cc2ccccc2)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000122852402 1039801948 /nfs/dbraw/zinc/80/19/48/1039801948.db2.gz BLULXJPGLRRAEK-UHFFFAOYSA-N 2 1 334.507 4.057 20 0 EIADMP FC(F)(F)CCCC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434670083 1039803288 /nfs/dbraw/zinc/80/32/88/1039803288.db2.gz OOPGOQXEAJRSRW-UHFFFAOYSA-N 2 1 329.410 4.131 20 0 EIADMP C[C@H](c1ccc(F)cc1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434689074 1039812477 /nfs/dbraw/zinc/81/24/77/1039812477.db2.gz SSOSIFOSHRPMHL-OAHLLOKOSA-N 2 1 327.447 4.299 20 0 EIADMP C[C@H](COc1cccc(F)c1)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000551008627 1039861772 /nfs/dbraw/zinc/86/17/72/1039861772.db2.gz YLIHBXHXVGQXAU-PBEJRMEISA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](COc1cccc(F)c1)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000551008627 1039861780 /nfs/dbraw/zinc/86/17/80/1039861780.db2.gz YLIHBXHXVGQXAU-PBEJRMEISA-N 2 1 342.458 4.018 20 0 EIADMP Cc1cccc(C)c1OCC[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000551013214 1039876492 /nfs/dbraw/zinc/87/64/92/1039876492.db2.gz GVXIAUWJKFJCRC-SFTDATJTSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1cccc(C)c1OCC[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000551013214 1039876495 /nfs/dbraw/zinc/87/64/95/1039876495.db2.gz GVXIAUWJKFJCRC-SFTDATJTSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1ccc(OCCC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551029569 1039886350 /nfs/dbraw/zinc/88/63/50/1039886350.db2.gz KCUJOOBLRJDYPF-UNMCSNQZSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1ccc(OCCC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551029569 1039886352 /nfs/dbraw/zinc/88/63/52/1039886352.db2.gz KCUJOOBLRJDYPF-UNMCSNQZSA-N 2 1 338.495 4.189 20 0 EIADMP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1ccccc1OCc1ccccc1 ZINC000481956887 1039913747 /nfs/dbraw/zinc/91/37/47/1039913747.db2.gz DZPZXAXJNDIZSH-ROUUACIJSA-N 2 1 326.484 4.256 20 0 EIADMP Fc1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000482117247 1040015571 /nfs/dbraw/zinc/01/55/71/1040015571.db2.gz CFYYPEDEADZPKH-MGPUTAFESA-N 2 1 344.499 4.376 20 0 EIADMP Fc1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000482117247 1040015586 /nfs/dbraw/zinc/01/55/86/1040015586.db2.gz CFYYPEDEADZPKH-MGPUTAFESA-N 2 1 344.499 4.376 20 0 EIADMP CSc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551174777 1040017255 /nfs/dbraw/zinc/01/72/55/1040017255.db2.gz DAIKOORIQDXPQY-FPOVZHCZSA-N 2 1 340.536 4.376 20 0 EIADMP CSc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551174777 1040017276 /nfs/dbraw/zinc/01/72/76/1040017276.db2.gz DAIKOORIQDXPQY-FPOVZHCZSA-N 2 1 340.536 4.376 20 0 EIADMP CCO[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccccc1 ZINC000551174997 1040018765 /nfs/dbraw/zinc/01/87/65/1040018765.db2.gz DXBBAXBMINPPBH-FDFHNCONSA-N 2 1 338.495 4.189 20 0 EIADMP CCO[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccccc1 ZINC000551174997 1040018783 /nfs/dbraw/zinc/01/87/83/1040018783.db2.gz DXBBAXBMINPPBH-FDFHNCONSA-N 2 1 338.495 4.189 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000551175566 1040018988 /nfs/dbraw/zinc/01/89/88/1040018988.db2.gz MTYKFPLPLPEVBW-QEMIJWRASA-N 2 1 330.516 4.007 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000551175566 1040019008 /nfs/dbraw/zinc/01/90/08/1040019008.db2.gz MTYKFPLPLPEVBW-QEMIJWRASA-N 2 1 330.516 4.007 20 0 EIADMP CC1=CCC[C@@H](C)[C@H]1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000435057818 1040035499 /nfs/dbraw/zinc/03/54/99/1040035499.db2.gz CPBSXWLIWJJWBT-XLIONFOSSA-N 2 1 327.516 4.391 20 0 EIADMP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000551267688 1040128000 /nfs/dbraw/zinc/12/80/00/1040128000.db2.gz SLEAXSPUKYIQAD-IRXDYDNUSA-N 2 1 339.527 4.298 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1OC(F)F ZINC000482331045 1040179370 /nfs/dbraw/zinc/17/93/70/1040179370.db2.gz VLRHBSDHGGUXFG-WBVHZDCISA-N 2 1 340.458 4.449 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1OC(F)F ZINC000482331045 1040179386 /nfs/dbraw/zinc/17/93/86/1040179386.db2.gz VLRHBSDHGGUXFG-WBVHZDCISA-N 2 1 340.458 4.449 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(OC(F)F)cc1 ZINC000482328903 1040181542 /nfs/dbraw/zinc/18/15/42/1040181542.db2.gz IVLIDVYIAYJZSV-QAPCUYQASA-N 2 1 340.458 4.449 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccs1 ZINC000482443012 1040251699 /nfs/dbraw/zinc/25/16/99/1040251699.db2.gz FCYNTBQBECHXDS-RBUKOAKNSA-N 2 1 328.525 4.353 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1F ZINC000482459760 1040267588 /nfs/dbraw/zinc/26/75/88/1040267588.db2.gz OMFOSNPKVFPARB-HKUYNNGSSA-N 2 1 326.459 4.041 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1F ZINC000482459760 1040267605 /nfs/dbraw/zinc/26/76/05/1040267605.db2.gz OMFOSNPKVFPARB-HKUYNNGSSA-N 2 1 326.459 4.041 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)s1 ZINC000482462790 1040272294 /nfs/dbraw/zinc/27/22/94/1040272294.db2.gz XMIQLEIDEPGICQ-HKUYNNGSSA-N 2 1 328.525 4.272 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)C1(C)C ZINC000539497143 1040486302 /nfs/dbraw/zinc/48/63/02/1040486302.db2.gz XQJDQAJIWZGALS-LSTHTHJFSA-N 2 1 330.516 4.005 20 0 EIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000539500226 1040490726 /nfs/dbraw/zinc/49/07/26/1040490726.db2.gz VCCSMAYZGQBXQB-JKSUJKDBSA-N 2 1 326.484 4.439 20 0 EIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000539500226 1040490728 /nfs/dbraw/zinc/49/07/28/1040490728.db2.gz VCCSMAYZGQBXQB-JKSUJKDBSA-N 2 1 326.484 4.439 20 0 EIADMP C[N@H+](CCCC[NH+]1CCCCC1)Cc1coc(-c2cccs2)n1 ZINC000640531321 1040491012 /nfs/dbraw/zinc/49/10/12/1040491012.db2.gz ODIZVDMYMBWMJD-UHFFFAOYSA-N 2 1 333.501 4.101 20 0 EIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1coc(-c2cccs2)n1 ZINC000640531321 1040491018 /nfs/dbraw/zinc/49/10/18/1040491018.db2.gz ODIZVDMYMBWMJD-UHFFFAOYSA-N 2 1 333.501 4.101 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+](C)CCCn2cc[nH+]c2C)cc1 ZINC000668167308 1040587913 /nfs/dbraw/zinc/58/79/13/1040587913.db2.gz ZUVCMLGKEJCDOY-UHFFFAOYSA-N 2 1 340.496 4.146 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+](C)CCCn2cc[nH+]c2C)cc1 ZINC000668167308 1040587926 /nfs/dbraw/zinc/58/79/26/1040587926.db2.gz ZUVCMLGKEJCDOY-UHFFFAOYSA-N 2 1 340.496 4.146 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)C1 ZINC000435742446 1040596841 /nfs/dbraw/zinc/59/68/41/1040596841.db2.gz NMMVJGFXELBHPM-BFYDXBDKSA-N 2 1 332.454 4.494 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000539610336 1040607361 /nfs/dbraw/zinc/60/73/61/1040607361.db2.gz WLINRYDIPYYXMG-NKGKWGDASA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000539610336 1040607367 /nfs/dbraw/zinc/60/73/67/1040607367.db2.gz WLINRYDIPYYXMG-NKGKWGDASA-N 2 1 340.433 4.414 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(CC)cc2)[C@H](C)C1 ZINC000479876915 1040740846 /nfs/dbraw/zinc/74/08/46/1040740846.db2.gz VJCIZYFQVPBEGG-OPYAIIAOSA-N 2 1 332.532 4.037 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(F)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000539816872 1040809288 /nfs/dbraw/zinc/80/92/88/1040809288.db2.gz BKSUWNBVUFUJND-LRDDRELGSA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(F)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000539816872 1040809291 /nfs/dbraw/zinc/80/92/91/1040809291.db2.gz BKSUWNBVUFUJND-LRDDRELGSA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(F)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000539816872 1040809295 /nfs/dbraw/zinc/80/92/95/1040809295.db2.gz BKSUWNBVUFUJND-LRDDRELGSA-N 2 1 332.385 4.007 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(OC)c3ccccc23)C1 ZINC000539821754 1040813963 /nfs/dbraw/zinc/81/39/63/1040813963.db2.gz LECWWBFJUZDFKT-QGZVFWFLSA-N 2 1 326.484 4.012 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(OC)c3ccccc23)C1 ZINC000539821754 1040813967 /nfs/dbraw/zinc/81/39/67/1040813967.db2.gz LECWWBFJUZDFKT-QGZVFWFLSA-N 2 1 326.484 4.012 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(OC)c3ccccc23)C1 ZINC000539821754 1040813968 /nfs/dbraw/zinc/81/39/68/1040813968.db2.gz LECWWBFJUZDFKT-QGZVFWFLSA-N 2 1 326.484 4.012 20 0 EIADMP COc1ccc2ccccc2c1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000539819514 1040814953 /nfs/dbraw/zinc/81/49/53/1040814953.db2.gz FCOQCJCCNNMUAG-LJQANCHMSA-N 2 1 338.495 4.299 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cccc(OCc3ccccc3)c2)CC[N@@H+]1C ZINC000539838099 1040819015 /nfs/dbraw/zinc/81/90/15/1040819015.db2.gz IRKRVTFGHQCICV-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cccc(OCc3ccccc3)c2)CC[N@H+]1C ZINC000539838099 1040819023 /nfs/dbraw/zinc/81/90/23/1040819023.db2.gz IRKRVTFGHQCICV-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2cccc(OCc3ccccc3)c2)CC[NH+]1C ZINC000539838099 1040819025 /nfs/dbraw/zinc/81/90/25/1040819025.db2.gz IRKRVTFGHQCICV-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cccc(OCc3ccccc3)c2)CC[NH+]1C ZINC000539838099 1040819028 /nfs/dbraw/zinc/81/90/28/1040819028.db2.gz IRKRVTFGHQCICV-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP CSc1ccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000539830614 1040824795 /nfs/dbraw/zinc/82/47/95/1040824795.db2.gz IOSGFQKDSVALQG-FQEVSTJZSA-N 2 1 340.536 4.362 20 0 EIADMP CSc1ccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000539830614 1040824799 /nfs/dbraw/zinc/82/47/99/1040824799.db2.gz IOSGFQKDSVALQG-FQEVSTJZSA-N 2 1 340.536 4.362 20 0 EIADMP CSc1ccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000539830614 1040824802 /nfs/dbraw/zinc/82/48/02/1040824802.db2.gz IOSGFQKDSVALQG-FQEVSTJZSA-N 2 1 340.536 4.362 20 0 EIADMP Fc1ccc2c(c1)CC[C@@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001168432274 1040840439 /nfs/dbraw/zinc/84/04/39/1040840439.db2.gz MSHDRKPRMQCGKK-OAQYLSRUSA-N 2 1 342.502 4.023 20 0 EIADMP Fc1ccc2c(c1)CC[C@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001168432273 1040840669 /nfs/dbraw/zinc/84/06/69/1040840669.db2.gz MSHDRKPRMQCGKK-NRFANRHFSA-N 2 1 342.502 4.023 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(F)c(F)c1 ZINC000537842542 1040848180 /nfs/dbraw/zinc/84/81/80/1040848180.db2.gz ZQXYWUAQMOKNFJ-UHFFFAOYSA-N 2 1 345.437 4.098 20 0 EIADMP Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000539864340 1040848786 /nfs/dbraw/zinc/84/87/86/1040848786.db2.gz YHVZEYXPMLUISU-KRWDZBQOSA-N 2 1 344.528 4.360 20 0 EIADMP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000539864340 1040848790 /nfs/dbraw/zinc/84/87/90/1040848790.db2.gz YHVZEYXPMLUISU-KRWDZBQOSA-N 2 1 344.528 4.360 20 0 EIADMP CC[N@@H+](Cc1sccc1OC)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000539862912 1040848913 /nfs/dbraw/zinc/84/89/13/1040848913.db2.gz QFUAQMYIXRHCNN-SFHVURJKSA-N 2 1 344.524 4.101 20 0 EIADMP CC[N@H+](Cc1sccc1OC)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000539862912 1040848915 /nfs/dbraw/zinc/84/89/15/1040848915.db2.gz QFUAQMYIXRHCNN-SFHVURJKSA-N 2 1 344.524 4.101 20 0 EIADMP CC[NH+](Cc1sccc1OC)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539862912 1040848918 /nfs/dbraw/zinc/84/89/18/1040848918.db2.gz QFUAQMYIXRHCNN-SFHVURJKSA-N 2 1 344.524 4.101 20 0 EIADMP CC[NH+](Cc1sccc1OC)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539862912 1040848923 /nfs/dbraw/zinc/84/89/23/1040848923.db2.gz QFUAQMYIXRHCNN-SFHVURJKSA-N 2 1 344.524 4.101 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000483472224 1040869608 /nfs/dbraw/zinc/86/96/08/1040869608.db2.gz JXRLRQRQQOEODL-FRFSOERESA-N 2 1 342.405 4.062 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000483472224 1040869615 /nfs/dbraw/zinc/86/96/15/1040869615.db2.gz JXRLRQRQQOEODL-FRFSOERESA-N 2 1 342.405 4.062 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCOc3cccc4ccccc43)CC[C@@H]21 ZINC000483485339 1040874303 /nfs/dbraw/zinc/87/43/03/1040874303.db2.gz RQPXRQZARCKAHI-FPOVZHCZSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCOc3cccc4ccccc43)CC[C@@H]21 ZINC000483485339 1040874310 /nfs/dbraw/zinc/87/43/10/1040874310.db2.gz RQPXRQZARCKAHI-FPOVZHCZSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCOc3cccc4ccccc43)CC[C@@H]21 ZINC000483485339 1040874318 /nfs/dbraw/zinc/87/43/18/1040874318.db2.gz RQPXRQZARCKAHI-FPOVZHCZSA-N 2 1 338.495 4.025 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CCc1ccc(Oc2ccc(F)cc2)cc1 ZINC000537938876 1040899910 /nfs/dbraw/zinc/89/99/10/1040899910.db2.gz UUEVICWWFTXIIJ-HRAATJIYSA-N 2 1 342.458 4.090 20 0 EIADMP C[C@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000903160615 1040927132 /nfs/dbraw/zinc/92/71/32/1040927132.db2.gz RZMHVBILXVLOSN-RGSBRZDASA-N 2 1 344.568 4.161 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000537964911 1040933369 /nfs/dbraw/zinc/93/33/69/1040933369.db2.gz KGLPODONKJGHIU-VXGBXAGGSA-N 2 1 326.271 4.485 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCC2)CC[N@H+]1C ZINC000537964480 1040938405 /nfs/dbraw/zinc/93/84/05/1040938405.db2.gz RYNOQPCATQMHGK-DZGCQCFKSA-N 2 1 341.326 4.487 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H](c3cccnc3)C3CC3)CC2)C1 ZINC000537947836 1040941012 /nfs/dbraw/zinc/94/10/12/1040941012.db2.gz LSGJGKZZOPDRDP-MAODMQOUSA-N 2 1 327.516 4.165 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)c1ccc2c(c1)COC2)[N@@H+](C)Cc1ccccc1 ZINC000483672075 1040961532 /nfs/dbraw/zinc/96/15/32/1040961532.db2.gz PPUYZLPVPHLNLJ-QZTJIDSGSA-N 2 1 338.495 4.278 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)[C@H](C)C1 ZINC000537989800 1040963770 /nfs/dbraw/zinc/96/37/70/1040963770.db2.gz FCLMZIYQTIDAFK-XMSQKQJNSA-N 2 1 338.495 4.086 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3c(cccc3F)[nH]2)c1 ZINC000436229208 1040977832 /nfs/dbraw/zinc/97/78/32/1040977832.db2.gz DLSFTVJJOSKCIR-UHFFFAOYSA-N 2 1 339.458 4.437 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)c1ccccn1 ZINC000898523032 1040978763 /nfs/dbraw/zinc/97/87/63/1040978763.db2.gz XLSSUQWYBOFJTM-NRDMVMEKSA-N 2 1 335.495 4.033 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000483734613 1040985875 /nfs/dbraw/zinc/98/58/75/1040985875.db2.gz WERCEWPDBOMWPZ-IMJJTQAJSA-N 2 1 326.937 4.283 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000483734613 1040985892 /nfs/dbraw/zinc/98/58/92/1040985892.db2.gz WERCEWPDBOMWPZ-IMJJTQAJSA-N 2 1 326.937 4.283 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(SCC(F)F)cc1 ZINC000483735970 1040990901 /nfs/dbraw/zinc/99/09/01/1040990901.db2.gz XOWGQNLGAYOVEB-IPYPFGDCSA-N 2 1 328.472 4.177 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(SCC(F)F)cc1 ZINC000483735970 1040990922 /nfs/dbraw/zinc/99/09/22/1040990922.db2.gz XOWGQNLGAYOVEB-IPYPFGDCSA-N 2 1 328.472 4.177 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000483729138 1040997270 /nfs/dbraw/zinc/99/72/70/1040997270.db2.gz OLWXYLCKDDCTBF-LQWHRVPQSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000483729138 1040997297 /nfs/dbraw/zinc/99/72/97/1040997297.db2.gz OLWXYLCKDDCTBF-LQWHRVPQSA-N 2 1 338.495 4.399 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000480147766 1041005835 /nfs/dbraw/zinc/00/58/35/1041005835.db2.gz KYTYJCBSJRAXIG-AWEZNQCLSA-N 2 1 347.503 4.394 20 0 EIADMP COCC[NH+]1CCC([NH2+][C@H](C)c2ccc(Cl)c3ccccc32)CC1 ZINC000462844888 1041029851 /nfs/dbraw/zinc/02/98/51/1041029851.db2.gz JSCKOSTXKKYIPC-OAHLLOKOSA-N 2 1 346.902 4.255 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000436306941 1041051352 /nfs/dbraw/zinc/05/13/52/1041051352.db2.gz QCFBOHSOHMNLFQ-FDTGPBLFSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H](C1CC1)[NH+](C)C ZINC000462889224 1041051162 /nfs/dbraw/zinc/05/11/62/1041051162.db2.gz RNWZCZBPCCIJKO-MGPUTAFESA-N 2 1 327.516 4.154 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000436306941 1041051369 /nfs/dbraw/zinc/05/13/69/1041051369.db2.gz QCFBOHSOHMNLFQ-FDTGPBLFSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000436306943 1041051906 /nfs/dbraw/zinc/05/19/06/1041051906.db2.gz QCFBOHSOHMNLFQ-QGQQZZQASA-N 2 1 334.507 4.433 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000436306943 1041051926 /nfs/dbraw/zinc/05/19/26/1041051926.db2.gz QCFBOHSOHMNLFQ-QGQQZZQASA-N 2 1 334.507 4.433 20 0 EIADMP C[N@H+]1CCC[C@H](CNc2cc[nH+]c3ccccc23)[C@@H]1c1cccs1 ZINC000462880165 1041062748 /nfs/dbraw/zinc/06/27/48/1041062748.db2.gz AYCYIJGZNYDHIW-FOIQADDNSA-N 2 1 337.492 4.213 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(OCC(F)(F)F)cc1 ZINC000538163078 1041106226 /nfs/dbraw/zinc/10/62/26/1041106226.db2.gz PVHRFOXCJHKESP-GOEBONIOSA-N 2 1 344.421 4.153 20 0 EIADMP c1ccc(CC[C@@H](Cc2ccccc2)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000480256409 1041121626 /nfs/dbraw/zinc/12/16/26/1041121626.db2.gz CRRZLHCVVINAFC-QHCPKHFHSA-N 2 1 348.534 4.447 20 0 EIADMP CCc1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)nc1 ZINC000515805898 1041127813 /nfs/dbraw/zinc/12/78/13/1041127813.db2.gz KSFNTXBXSBHECB-UHFFFAOYSA-N 2 1 349.522 4.132 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2cc[nH+]c3ccsc32)C1 ZINC000484146081 1041136863 /nfs/dbraw/zinc/13/68/63/1041136863.db2.gz TUTMGENXRLLYES-HOTGVXAUSA-N 2 1 329.513 4.387 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cc[nH+]c3ccsc32)C1 ZINC000484146081 1041136883 /nfs/dbraw/zinc/13/68/83/1041136883.db2.gz TUTMGENXRLLYES-HOTGVXAUSA-N 2 1 329.513 4.387 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1cccs1 ZINC000540162344 1041222944 /nfs/dbraw/zinc/22/29/44/1041222944.db2.gz BRNKLSPMHOHKAD-YLJYHZDGSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1cccs1 ZINC000540162344 1041222962 /nfs/dbraw/zinc/22/29/62/1041222962.db2.gz BRNKLSPMHOHKAD-YLJYHZDGSA-N 2 1 328.525 4.181 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)cc1 ZINC000540164405 1041228486 /nfs/dbraw/zinc/22/84/86/1041228486.db2.gz SBIRQKVQMLQFIC-FDMHNHSTSA-N 2 1 343.474 4.417 20 0 EIADMP CC(C)[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000538406112 1041302959 /nfs/dbraw/zinc/30/29/59/1041302959.db2.gz PPKJVDBDNSBFPI-QGZVFWFLSA-N 2 1 326.406 4.254 20 0 EIADMP Cc1ccc([C@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)o1 ZINC000484496305 1041303337 /nfs/dbraw/zinc/30/33/37/1041303337.db2.gz HGGIDRGDQFUQRD-ONFYXGJMSA-N 2 1 326.484 4.395 20 0 EIADMP Cc1ccc([C@H](C)[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)o1 ZINC000484496305 1041303352 /nfs/dbraw/zinc/30/33/52/1041303352.db2.gz HGGIDRGDQFUQRD-ONFYXGJMSA-N 2 1 326.484 4.395 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667677213 1041318224 /nfs/dbraw/zinc/31/82/24/1041318224.db2.gz LXTXTLJCVUNOJX-GOSISDBHSA-N 2 1 343.540 4.282 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667677213 1041318237 /nfs/dbraw/zinc/31/82/37/1041318237.db2.gz LXTXTLJCVUNOJX-GOSISDBHSA-N 2 1 343.540 4.282 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667677213 1041318251 /nfs/dbraw/zinc/31/82/51/1041318251.db2.gz LXTXTLJCVUNOJX-GOSISDBHSA-N 2 1 343.540 4.282 20 0 EIADMP COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000538408209 1041325560 /nfs/dbraw/zinc/32/55/60/1041325560.db2.gz SZHHEKBJFVZTOO-GOSISDBHSA-N 2 1 336.907 4.287 20 0 EIADMP Fc1ccc2c(c1)CC[C@@H]2[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463113427 1041340560 /nfs/dbraw/zinc/34/05/60/1041340560.db2.gz OVJUJRJWQFYDIA-QFIPXVFZSA-N 2 1 338.470 4.110 20 0 EIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1nc2ccccc2n1C ZINC000540312854 1041372134 /nfs/dbraw/zinc/37/21/34/1041372134.db2.gz DUFVDBPOTOLELL-FGTMMUONSA-N 2 1 342.531 4.125 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000463164544 1041381072 /nfs/dbraw/zinc/38/10/72/1041381072.db2.gz UKGLMQYTQAYZIB-BVYCBKJFSA-N 2 1 334.507 4.359 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000463164544 1041381081 /nfs/dbraw/zinc/38/10/81/1041381081.db2.gz UKGLMQYTQAYZIB-BVYCBKJFSA-N 2 1 334.507 4.359 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000463194978 1041410485 /nfs/dbraw/zinc/41/04/85/1041410485.db2.gz XRJIQWGTOXKTKO-HMXCVIKNSA-N 2 1 332.532 4.080 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000463194978 1041410492 /nfs/dbraw/zinc/41/04/92/1041410492.db2.gz XRJIQWGTOXKTKO-HMXCVIKNSA-N 2 1 332.532 4.080 20 0 EIADMP Cc1c(C)n(C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccc(C[NH3+])cc12 ZINC001167961053 1041411414 /nfs/dbraw/zinc/41/14/14/1041411414.db2.gz DQWPXVWITHVMRX-YOFSQIOKSA-N 2 1 337.511 4.295 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cnc2ccsc2c1 ZINC000480601050 1041412713 /nfs/dbraw/zinc/41/27/13/1041412713.db2.gz NJGQNWWIWBYHFB-OAGGEKHMSA-N 2 1 331.529 4.315 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)CCC2 ZINC000480612199 1041423915 /nfs/dbraw/zinc/42/39/15/1041423915.db2.gz OCCNKNBYHXUHJF-JKSUJKDBSA-N 2 1 335.561 4.185 20 0 EIADMP COc1cc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1OC ZINC000480615271 1041424995 /nfs/dbraw/zinc/42/49/95/1041424995.db2.gz RJIVUKVWIWPNBP-MSOLQXFVSA-N 2 1 348.531 4.317 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc(F)c(F)c(F)c1 ZINC000480630603 1041434485 /nfs/dbraw/zinc/43/44/85/1041434485.db2.gz KOSYQUUAICONBP-KBPBESRZSA-N 2 1 328.422 4.409 20 0 EIADMP CCc1nc2c(s1)[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)CCC2 ZINC000480635081 1041448715 /nfs/dbraw/zinc/44/87/15/1041448715.db2.gz VNQCFUSMPGBVKH-CVEARBPZSA-N 2 1 335.561 4.327 20 0 EIADMP C[N@@H+]1CC[C@@H]2CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC000516221093 1041457158 /nfs/dbraw/zinc/45/71/58/1041457158.db2.gz OGIBKTARSPUBIY-DNQXCXABSA-N 2 1 348.534 4.114 20 0 EIADMP C[N@H+]1CC[C@@H]2CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC000516221093 1041457166 /nfs/dbraw/zinc/45/71/66/1041457166.db2.gz OGIBKTARSPUBIY-DNQXCXABSA-N 2 1 348.534 4.114 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@H+](CC(Cc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC000516221093 1041457171 /nfs/dbraw/zinc/45/71/71/1041457171.db2.gz OGIBKTARSPUBIY-DNQXCXABSA-N 2 1 348.534 4.114 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@@H+](CC(Cc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC000516221093 1041457176 /nfs/dbraw/zinc/45/71/76/1041457176.db2.gz OGIBKTARSPUBIY-DNQXCXABSA-N 2 1 348.534 4.114 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)C(F)(F)F ZINC000480668809 1041461538 /nfs/dbraw/zinc/46/15/38/1041461538.db2.gz WOZCBRVWDMKCSV-LAVFITLUSA-N 2 1 340.433 4.075 20 0 EIADMP CC(C)[C@@H](CC(F)(F)F)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463279447 1041468170 /nfs/dbraw/zinc/46/81/70/1041468170.db2.gz PWRXMIUKMWEERX-GOSISDBHSA-N 2 1 342.449 4.260 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2c(F)cccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000401998635 1041473929 /nfs/dbraw/zinc/47/39/29/1041473929.db2.gz DGDVMFGZWCGHSV-SJLPKXTDSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2c(F)cccc2F)CC[N@H+]1Cc1ccccc1 ZINC000401998635 1041473936 /nfs/dbraw/zinc/47/39/36/1041473936.db2.gz DGDVMFGZWCGHSV-SJLPKXTDSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2c(F)cccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000401998636 1041474238 /nfs/dbraw/zinc/47/42/38/1041474238.db2.gz DGDVMFGZWCGHSV-WMZOPIPTSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2c(F)cccc2F)CC[N@H+]1Cc1ccccc1 ZINC000401998636 1041474241 /nfs/dbraw/zinc/47/42/41/1041474241.db2.gz DGDVMFGZWCGHSV-WMZOPIPTSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]([NH2+]C1(Cc2ccccc2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000480692502 1041475934 /nfs/dbraw/zinc/47/59/34/1041475934.db2.gz ASDBOOZMTQCQNQ-DENIHFKCSA-N 2 1 334.507 4.262 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C)c(Br)c2)C[C@@H]1C ZINC000538718942 1041489182 /nfs/dbraw/zinc/48/91/82/1041489182.db2.gz YBRDCWWMOVARIR-GOEBONIOSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C)c(Br)c2)C[C@@H]1C ZINC000538718942 1041489188 /nfs/dbraw/zinc/48/91/88/1041489188.db2.gz YBRDCWWMOVARIR-GOEBONIOSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(C)c(Br)c2)C[C@@H]1C ZINC000538718942 1041489192 /nfs/dbraw/zinc/48/91/92/1041489192.db2.gz YBRDCWWMOVARIR-GOEBONIOSA-N 2 1 339.321 4.062 20 0 EIADMP Fc1cccc(F)c1-c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)o1 ZINC000538719542 1041490471 /nfs/dbraw/zinc/49/04/71/1041490471.db2.gz RNFZQPBJTAHCDT-HNNXBMFYSA-N 2 1 346.421 4.143 20 0 EIADMP Fc1cccc(F)c1-c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)o1 ZINC000538719542 1041490477 /nfs/dbraw/zinc/49/04/77/1041490477.db2.gz RNFZQPBJTAHCDT-HNNXBMFYSA-N 2 1 346.421 4.143 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc(C2CC2)s1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000538704671 1041496716 /nfs/dbraw/zinc/49/67/16/1041496716.db2.gz VTZKZYYHOUOBFC-QAPCUYQASA-N 2 1 341.524 4.021 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc(C2CC2)s1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000538704671 1041496723 /nfs/dbraw/zinc/49/67/23/1041496723.db2.gz VTZKZYYHOUOBFC-QAPCUYQASA-N 2 1 341.524 4.021 20 0 EIADMP C[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538731488 1041502463 /nfs/dbraw/zinc/50/24/63/1041502463.db2.gz PGEYQDXHYOLBLN-ACIOBRDBSA-N 2 1 334.507 4.244 20 0 EIADMP C[NH+](C[C@@H]1C[C@@H]1c1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000538731488 1041502478 /nfs/dbraw/zinc/50/24/78/1041502478.db2.gz PGEYQDXHYOLBLN-ACIOBRDBSA-N 2 1 334.507 4.244 20 0 EIADMP C[NH+](C[C@@H]1C[C@@H]1c1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000538731488 1041502487 /nfs/dbraw/zinc/50/24/87/1041502487.db2.gz PGEYQDXHYOLBLN-ACIOBRDBSA-N 2 1 334.507 4.244 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@@H](C)C1 ZINC000538738081 1041511420 /nfs/dbraw/zinc/51/14/20/1041511420.db2.gz XIQIWUQQKYQSQO-DOTOQJQBSA-N 2 1 340.458 4.067 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@@H](C)C1 ZINC000538738081 1041511428 /nfs/dbraw/zinc/51/14/28/1041511428.db2.gz XIQIWUQQKYQSQO-DOTOQJQBSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@@H](C)C1 ZINC000538738081 1041511438 /nfs/dbraw/zinc/51/14/38/1041511438.db2.gz XIQIWUQQKYQSQO-DOTOQJQBSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@@H](C)C1 ZINC000538738081 1041511446 /nfs/dbraw/zinc/51/14/46/1041511446.db2.gz XIQIWUQQKYQSQO-DOTOQJQBSA-N 2 1 340.458 4.067 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@H]21 ZINC000538799218 1041541336 /nfs/dbraw/zinc/54/13/36/1041541336.db2.gz URBUTZRBHMMBOC-VQIMIIECSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@H]21 ZINC000538799218 1041541340 /nfs/dbraw/zinc/54/13/40/1041541340.db2.gz URBUTZRBHMMBOC-VQIMIIECSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@H]21 ZINC000538799218 1041541346 /nfs/dbraw/zinc/54/13/46/1041541346.db2.gz URBUTZRBHMMBOC-VQIMIIECSA-N 2 1 328.431 4.002 20 0 EIADMP Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000924673417 1041545992 /nfs/dbraw/zinc/54/59/92/1041545992.db2.gz IXTPBENGCGJCPO-INIZCTEOSA-N 2 1 341.499 4.374 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000540607289 1041559563 /nfs/dbraw/zinc/55/95/63/1041559563.db2.gz MCPBMULMMGNOMV-QAPCUYQASA-N 2 1 339.310 4.481 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)[C@H](C)C1 ZINC000437073872 1041624560 /nfs/dbraw/zinc/62/45/60/1041624560.db2.gz HOMIJMQEDIWFMD-RHSMWYFYSA-N 2 1 340.433 4.057 20 0 EIADMP C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)CCCc1c[nH+]cn1C ZINC000516580949 1041655334 /nfs/dbraw/zinc/65/53/34/1041655334.db2.gz XNXIEFHWOCMNPZ-LBPRGKRZSA-N 2 1 326.271 4.353 20 0 EIADMP C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)CCCc1c[nH+]cn1C ZINC000516580949 1041655341 /nfs/dbraw/zinc/65/53/41/1041655341.db2.gz XNXIEFHWOCMNPZ-LBPRGKRZSA-N 2 1 326.271 4.353 20 0 EIADMP C[C@@H]([NH2+]CCc1ccc(F)cc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000516802128 1041763685 /nfs/dbraw/zinc/76/36/85/1041763685.db2.gz LSPNPISOOLLEDR-APWZRJJASA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H](Cc1ccsc1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000541234372 1041859511 /nfs/dbraw/zinc/85/95/11/1041859511.db2.gz DXGODMGBKMCXES-XLIONFOSSA-N 2 1 328.525 4.133 20 0 EIADMP C[C@H](Cc1ccsc1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000541234372 1041859512 /nfs/dbraw/zinc/85/95/12/1041859512.db2.gz DXGODMGBKMCXES-XLIONFOSSA-N 2 1 328.525 4.133 20 0 EIADMP C[C@H](Cc1ccsc1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000541234372 1041859516 /nfs/dbraw/zinc/85/95/16/1041859516.db2.gz DXGODMGBKMCXES-XLIONFOSSA-N 2 1 328.525 4.133 20 0 EIADMP C[C@H](NCc1cccc(OC(C)(C)C)n1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603185 1042038995 /nfs/dbraw/zinc/03/89/95/1042038995.db2.gz ORGLHWFQCXOBAK-DLBZAZTESA-N 2 1 345.531 4.002 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541603185 1042038999 /nfs/dbraw/zinc/03/89/99/1042038999.db2.gz ORGLHWFQCXOBAK-DLBZAZTESA-N 2 1 345.531 4.002 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603185 1042039001 /nfs/dbraw/zinc/03/90/01/1042039001.db2.gz ORGLHWFQCXOBAK-DLBZAZTESA-N 2 1 345.531 4.002 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](CCOc2ccc(C(C)C)c(C)c2)C1 ZINC000464769883 1042149465 /nfs/dbraw/zinc/14/94/65/1042149465.db2.gz BAFRCCMBFTUWGR-IBGZPJMESA-N 2 1 332.532 4.161 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCOc2ccc(C(C)C)c(C)c2)C1 ZINC000464769883 1042149472 /nfs/dbraw/zinc/14/94/72/1042149472.db2.gz BAFRCCMBFTUWGR-IBGZPJMESA-N 2 1 332.532 4.161 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+]([C@@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000464778309 1042159899 /nfs/dbraw/zinc/15/98/99/1042159899.db2.gz NQYYEIYNSUSEAI-LSDHHAIUSA-N 2 1 344.421 4.310 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+]([C@@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000464778309 1042159908 /nfs/dbraw/zinc/15/99/08/1042159908.db2.gz NQYYEIYNSUSEAI-LSDHHAIUSA-N 2 1 344.421 4.310 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CC[C@H]3[C@@H](CCCN3C3CC3)C1)CC2 ZINC000542212123 1042338881 /nfs/dbraw/zinc/33/88/81/1042338881.db2.gz FQGRZSJWVBXBRT-RYGJVYDSSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@@H+]1CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C1)CC2 ZINC000542212123 1042338885 /nfs/dbraw/zinc/33/88/85/1042338885.db2.gz FQGRZSJWVBXBRT-RYGJVYDSSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C1)CC2 ZINC000542212123 1042338890 /nfs/dbraw/zinc/33/88/90/1042338890.db2.gz FQGRZSJWVBXBRT-RYGJVYDSSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CC[C@@H]3[C@H](CCCN3C3CC3)C1)CC2 ZINC000542212121 1042339638 /nfs/dbraw/zinc/33/96/38/1042339638.db2.gz FQGRZSJWVBXBRT-CDHQVMDDSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@@H+]1CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C1)CC2 ZINC000542212121 1042339644 /nfs/dbraw/zinc/33/96/44/1042339644.db2.gz FQGRZSJWVBXBRT-CDHQVMDDSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C1)CC2 ZINC000542212121 1042339650 /nfs/dbraw/zinc/33/96/50/1042339650.db2.gz FQGRZSJWVBXBRT-CDHQVMDDSA-N 2 1 330.903 4.276 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000426289007 1042513937 /nfs/dbraw/zinc/51/39/37/1042513937.db2.gz FJHMJMMQTCHPLV-STZQEDGTSA-N 2 1 344.543 4.099 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccncc1 ZINC000173931268 1042630366 /nfs/dbraw/zinc/63/03/66/1042630366.db2.gz VJZAOXZMVVYRPW-OTWHNJEPSA-N 2 1 337.511 4.410 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccccc2OC(F)(F)F)C1 ZINC000518765546 1042675886 /nfs/dbraw/zinc/67/58/86/1042675886.db2.gz LFNANLHZTACJHK-OAHLLOKOSA-N 2 1 344.421 4.187 20 0 EIADMP Fc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000309704193 1042818613 /nfs/dbraw/zinc/81/86/13/1042818613.db2.gz HDIAEZCQFSHNHD-INIZCTEOSA-N 2 1 332.850 4.091 20 0 EIADMP Fc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000309704193 1042818617 /nfs/dbraw/zinc/81/86/17/1042818617.db2.gz HDIAEZCQFSHNHD-INIZCTEOSA-N 2 1 332.850 4.091 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311145900 1042853622 /nfs/dbraw/zinc/85/36/22/1042853622.db2.gz ZLARZIMBKPEGNL-NBCNXNJRSA-N 2 1 338.470 4.313 20 0 EIADMP CC(C)Oc1ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1Cl ZINC000493367851 1042901028 /nfs/dbraw/zinc/90/10/28/1042901028.db2.gz WBMFYIWTMYBVTO-FUHWJXTLSA-N 2 1 336.907 4.043 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccccc2F)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168006334 1043001183 /nfs/dbraw/zinc/00/11/83/1043001183.db2.gz NGLQBQVYLWRGFF-RMFSNUHRSA-N 2 1 340.486 4.399 20 0 EIADMP Cc1nc2ccc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)cc2s1 ZINC000494078960 1043014453 /nfs/dbraw/zinc/01/44/53/1043014453.db2.gz MQAFPHVABPFUGP-UHFFFAOYSA-N 2 1 343.540 4.491 20 0 EIADMP C[C@H]([NH2+]Cc1ccnc2ccccc12)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000388842126 1043062356 /nfs/dbraw/zinc/06/23/56/1043062356.db2.gz YFOLSSDRRPBLHW-RXVVDRJESA-N 2 1 345.490 4.235 20 0 EIADMP COCCC1(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CCCCC1 ZINC000185224861 1043164884 /nfs/dbraw/zinc/16/48/84/1043164884.db2.gz SDJCYNFRNZFOLL-UHFFFAOYSA-N 2 1 344.543 4.228 20 0 EIADMP Oc1cc(F)cc(C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)c1 ZINC000185532252 1043195014 /nfs/dbraw/zinc/19/50/14/1043195014.db2.gz IXQABIFOVBSBSW-UHFFFAOYSA-N 2 1 342.458 4.197 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C[C@@H]3CCC[C@@H](C)C3)CC2)cs1 ZINC000507933413 1043201778 /nfs/dbraw/zinc/20/17/78/1043201778.db2.gz CJBVEYGGORRWEA-SJLPKXTDSA-N 2 1 349.588 4.333 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)oc21 ZINC000166024277 1043275860 /nfs/dbraw/zinc/27/58/60/1043275860.db2.gz IELZANHCUWXTCZ-USXIJHARSA-N 2 1 328.456 4.109 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)oc21 ZINC000166024277 1043275869 /nfs/dbraw/zinc/27/58/69/1043275869.db2.gz IELZANHCUWXTCZ-USXIJHARSA-N 2 1 328.456 4.109 20 0 EIADMP Cc1cccnc1[C@H]1CCC[C@H]([NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)C1 ZINC000665252180 1043283743 /nfs/dbraw/zinc/28/37/43/1043283743.db2.gz JFHHIFQACFFRQY-FNAHDJPLSA-N 2 1 349.522 4.152 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)C1CCSCC1 ZINC000187122165 1043329585 /nfs/dbraw/zinc/32/95/85/1043329585.db2.gz GWUCORRZDFNTMC-HZPDHXFCSA-N 2 1 338.586 4.081 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCSCC1 ZINC000187122165 1043329586 /nfs/dbraw/zinc/32/95/86/1043329586.db2.gz GWUCORRZDFNTMC-HZPDHXFCSA-N 2 1 338.586 4.081 20 0 EIADMP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000674045617 1043345373 /nfs/dbraw/zinc/34/53/73/1043345373.db2.gz JALTULAHXGPJLL-FFZOFVMBSA-N 2 1 347.522 4.024 20 0 EIADMP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000674045617 1043345385 /nfs/dbraw/zinc/34/53/85/1043345385.db2.gz JALTULAHXGPJLL-FFZOFVMBSA-N 2 1 347.522 4.024 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc2ccccc2c1 ZINC000674049511 1043350337 /nfs/dbraw/zinc/35/03/37/1043350337.db2.gz PMUFPWXOQHSRON-JTSKRJEESA-N 2 1 338.495 4.134 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc2ccccc2c1 ZINC000674049512 1043350768 /nfs/dbraw/zinc/35/07/68/1043350768.db2.gz PMUFPWXOQHSRON-VGOFRKELSA-N 2 1 338.495 4.134 20 0 EIADMP Cc1cscc1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000494448262 1043489931 /nfs/dbraw/zinc/48/99/31/1043489931.db2.gz FJLVDSWIAOSEGE-OWZKRDHZSA-N 2 1 326.509 4.342 20 0 EIADMP FC(F)(F)c1ccc(CCC[N@H+]2CCC[C@H](c3ncc[nH]3)C2)cc1 ZINC000674233766 1043496604 /nfs/dbraw/zinc/49/66/04/1043496604.db2.gz QUSXJNCRXILHBT-HNNXBMFYSA-N 2 1 337.389 4.241 20 0 EIADMP FC(F)(F)c1ccc(CCC[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc1 ZINC000674233769 1043497820 /nfs/dbraw/zinc/49/78/20/1043497820.db2.gz QUSXJNCRXILHBT-OAHLLOKOSA-N 2 1 337.389 4.241 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000674305332 1043573263 /nfs/dbraw/zinc/57/32/63/1043573263.db2.gz HLJLUXFJGCJIAM-MAUKXSAKSA-N 2 1 342.449 4.300 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000674305332 1043573271 /nfs/dbraw/zinc/57/32/71/1043573271.db2.gz HLJLUXFJGCJIAM-MAUKXSAKSA-N 2 1 342.449 4.300 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000674305332 1043573276 /nfs/dbraw/zinc/57/32/76/1043573276.db2.gz HLJLUXFJGCJIAM-MAUKXSAKSA-N 2 1 342.449 4.300 20 0 EIADMP C[N@@H+](CCCc1ccsc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000543032334 1043594695 /nfs/dbraw/zinc/59/46/95/1043594695.db2.gz LOJLKKYJYBNCPO-HXUWFJFHSA-N 2 1 328.525 4.135 20 0 EIADMP CC[C@H]1C[N@@H+](CCCCn2ccnc2C)CC[C@H]1c1ccccc1 ZINC000442394525 1043670659 /nfs/dbraw/zinc/67/06/59/1043670659.db2.gz SHOSLCGPXOTZGE-PZJWPPBQSA-N 2 1 325.500 4.487 20 0 EIADMP CC[C@H]1C[N@H+](CCCCn2cc[nH+]c2C)CC[C@H]1c1ccccc1 ZINC000442394525 1043670671 /nfs/dbraw/zinc/67/06/71/1043670671.db2.gz SHOSLCGPXOTZGE-PZJWPPBQSA-N 2 1 325.500 4.487 20 0 EIADMP CC[C@H]1C[N@@H+](CCCCn2cc[nH+]c2C)CC[C@H]1c1ccccc1 ZINC000442394525 1043670680 /nfs/dbraw/zinc/67/06/80/1043670680.db2.gz SHOSLCGPXOTZGE-PZJWPPBQSA-N 2 1 325.500 4.487 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)C3CCC(F)(F)CC3)CC2)[nH+]1 ZINC000474033947 1043679538 /nfs/dbraw/zinc/67/95/38/1043679538.db2.gz MMOIHZBQXZUHSS-HNNXBMFYSA-N 2 1 337.458 4.162 20 0 EIADMP C[NH+](C/C=C\C[N@@H+](C)CCc1cccs1)CCc1cccs1 ZINC000255659443 1043698206 /nfs/dbraw/zinc/69/82/06/1043698206.db2.gz UZKAQPHOBVPZJB-ARJAWSKDSA-N 2 1 334.554 4.015 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2ccccc2[nH]1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000681390519 1043731381 /nfs/dbraw/zinc/73/13/81/1043731381.db2.gz NDKONQWKLCBASK-XLIONFOSSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2ccccc2[nH]1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000681390521 1043731489 /nfs/dbraw/zinc/73/14/89/1043731489.db2.gz NDKONQWKLCBASK-YLJYHZDGSA-N 2 1 333.479 4.168 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C(C)(C)Cc1ccc(C(F)(F)F)cc1 ZINC000442774410 1043830695 /nfs/dbraw/zinc/83/06/95/1043830695.db2.gz FAVPNFJIECXPKW-UHFFFAOYSA-N 2 1 339.405 4.211 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCC(C(F)F)CC2)cc1F ZINC000442788573 1043839666 /nfs/dbraw/zinc/83/96/66/1043839666.db2.gz CLRMNHHDYHRTQU-UHFFFAOYSA-N 2 1 337.389 4.233 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000442789837 1043841102 /nfs/dbraw/zinc/84/11/02/1043841102.db2.gz HUQZYOFYFXAZQF-HJZRJOMTSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000442789837 1043841104 /nfs/dbraw/zinc/84/11/04/1043841104.db2.gz HUQZYOFYFXAZQF-HJZRJOMTSA-N 2 1 336.470 4.311 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442829244 1043858373 /nfs/dbraw/zinc/85/83/73/1043858373.db2.gz UJKWAAVFNUKVRJ-AEFFLSMTSA-N 2 1 338.417 4.193 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442829245 1043859651 /nfs/dbraw/zinc/85/96/51/1043859651.db2.gz UJKWAAVFNUKVRJ-FUHWJXTLSA-N 2 1 338.417 4.193 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cnn(C(C)C)c2)CC1)CC(C)C ZINC000521942355 1044093996 /nfs/dbraw/zinc/09/39/96/1044093996.db2.gz ISSSOSYYRRAHLK-UHFFFAOYSA-N 2 1 334.552 4.044 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC000522011696 1044151321 /nfs/dbraw/zinc/15/13/21/1044151321.db2.gz QONTUKLTJOXGOA-QFIPXVFZSA-N 2 1 331.463 4.000 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC000522011696 1044151328 /nfs/dbraw/zinc/15/13/28/1044151328.db2.gz QONTUKLTJOXGOA-QFIPXVFZSA-N 2 1 331.463 4.000 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2(c3ccncc3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168017991 1044319733 /nfs/dbraw/zinc/31/97/33/1044319733.db2.gz YJUOOQRWEDLDMA-RMFSNUHRSA-N 2 1 335.495 4.102 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2(c3ccncc3)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168017991 1044319749 /nfs/dbraw/zinc/31/97/49/1044319749.db2.gz YJUOOQRWEDLDMA-RMFSNUHRSA-N 2 1 335.495 4.102 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCC23CCOCC3)cc1 ZINC000367086045 1044364329 /nfs/dbraw/zinc/36/43/29/1044364329.db2.gz JGIGOIRYZBUKJG-JXFKEZNVSA-N 2 1 339.483 4.181 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@](C)(O)CCC(C)C)cc1 ZINC000348035231 1044369380 /nfs/dbraw/zinc/36/93/80/1044369380.db2.gz DDJCSKIUEKJMJN-OXJNMPFZSA-N 2 1 329.488 4.019 20 0 EIADMP CCOc1ccc(C[N@H+](CCCCn2cc[nH+]c2C)C(C)C)cc1 ZINC000348076893 1044378949 /nfs/dbraw/zinc/37/89/49/1044378949.db2.gz IQOKAIDBJMYYFJ-UHFFFAOYSA-N 2 1 329.488 4.281 20 0 EIADMP CCOc1ccc(C[N@@H+](CCCCn2cc[nH+]c2C)C(C)C)cc1 ZINC000348076893 1044378970 /nfs/dbraw/zinc/37/89/70/1044378970.db2.gz IQOKAIDBJMYYFJ-UHFFFAOYSA-N 2 1 329.488 4.281 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)Cc1ccccc1 ZINC000542518627 1044450258 /nfs/dbraw/zinc/45/02/58/1044450258.db2.gz YAQCJYSMFXEDPK-OFNKIYASSA-N 2 1 336.523 4.019 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1 ZINC000494880546 1044468000 /nfs/dbraw/zinc/46/80/00/1044468000.db2.gz SNLZLVMODBMLOP-OPYAIIAOSA-N 2 1 348.506 4.148 20 0 EIADMP c1ccc2c(c1)CSC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000675782309 1044495168 /nfs/dbraw/zinc/49/51/68/1044495168.db2.gz DQNYIHGWKRUJKB-HXUWFJFHSA-N 2 1 330.541 4.361 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000443583898 1044495600 /nfs/dbraw/zinc/49/56/00/1044495600.db2.gz QXWJOEDWPLRKMM-KPOBHBOGSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000443583898 1044495611 /nfs/dbraw/zinc/49/56/11/1044495611.db2.gz QXWJOEDWPLRKMM-KPOBHBOGSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000443583898 1044495626 /nfs/dbraw/zinc/49/56/26/1044495626.db2.gz QXWJOEDWPLRKMM-KPOBHBOGSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000443583898 1044495633 /nfs/dbraw/zinc/49/56/33/1044495633.db2.gz QXWJOEDWPLRKMM-KPOBHBOGSA-N 2 1 330.903 4.276 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000177813918 1044511368 /nfs/dbraw/zinc/51/13/68/1044511368.db2.gz AUJBTEVOZPLMSN-RHSMWYFYSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000177813918 1044511381 /nfs/dbraw/zinc/51/13/81/1044511381.db2.gz AUJBTEVOZPLMSN-RHSMWYFYSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC[NH+]1C ZINC000177813918 1044511394 /nfs/dbraw/zinc/51/13/94/1044511394.db2.gz AUJBTEVOZPLMSN-RHSMWYFYSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC[NH+]1C ZINC000177813918 1044511410 /nfs/dbraw/zinc/51/14/10/1044511410.db2.gz AUJBTEVOZPLMSN-RHSMWYFYSA-N 2 1 328.422 4.053 20 0 EIADMP CCC[C@H](CCc1ccccc1)[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000675881423 1044552251 /nfs/dbraw/zinc/55/22/51/1044552251.db2.gz LCZQCDJWUIRSJE-IFMALSPDSA-N 2 1 344.543 4.021 20 0 EIADMP C(=C/c1ccncc1)\C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000494963876 1044560283 /nfs/dbraw/zinc/56/02/83/1044560283.db2.gz KGHHNCICSNLYRS-WAWJGKILSA-N 2 1 347.506 4.083 20 0 EIADMP C(=C/c1ccncc1)\C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000494963876 1044560300 /nfs/dbraw/zinc/56/03/00/1044560300.db2.gz KGHHNCICSNLYRS-WAWJGKILSA-N 2 1 347.506 4.083 20 0 EIADMP C(=C/c1ccncc1)\C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000494963876 1044560320 /nfs/dbraw/zinc/56/03/20/1044560320.db2.gz KGHHNCICSNLYRS-WAWJGKILSA-N 2 1 347.506 4.083 20 0 EIADMP C(=C/c1ccncc1)\C[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000494963876 1044560327 /nfs/dbraw/zinc/56/03/27/1044560327.db2.gz KGHHNCICSNLYRS-WAWJGKILSA-N 2 1 347.506 4.083 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000494967772 1044565320 /nfs/dbraw/zinc/56/53/20/1044565320.db2.gz IVXJYVSJIXJWSD-HXUWFJFHSA-N 2 1 344.861 4.420 20 0 EIADMP Cc1ccccc1[C@H]([NH2+]CCc1c[nH+]cn1C)[C@H]1CCC[C@H](C)C1 ZINC001168724417 1044599492 /nfs/dbraw/zinc/59/94/92/1044599492.db2.gz WCBBJAYPNAXICG-DJPFJPOOSA-N 2 1 325.500 4.428 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000443658960 1044646739 /nfs/dbraw/zinc/64/67/39/1044646739.db2.gz OMWAELMAUFEAQA-RHSMWYFYSA-N 2 1 328.422 4.176 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000443658960 1044646758 /nfs/dbraw/zinc/64/67/58/1044646758.db2.gz OMWAELMAUFEAQA-RHSMWYFYSA-N 2 1 328.422 4.176 20 0 EIADMP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)C1CCSCC1 ZINC000250104774 1044672861 /nfs/dbraw/zinc/67/28/61/1044672861.db2.gz RXKYLTVZANMGKX-IIMDRIAPSA-N 2 1 346.584 4.264 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]CCC[N@H+]3CCCC[C@@H]3C)s2)cc1 ZINC000522382732 1044688391 /nfs/dbraw/zinc/68/83/91/1044688391.db2.gz LIBYOYOREWSGNV-KRWDZBQOSA-N 2 1 343.540 4.473 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]CCC[N@@H+]3CCCC[C@@H]3C)s2)cc1 ZINC000522382732 1044688399 /nfs/dbraw/zinc/68/83/99/1044688399.db2.gz LIBYOYOREWSGNV-KRWDZBQOSA-N 2 1 343.540 4.473 20 0 EIADMP C[N@@H+](CCCCc1cccc(C(F)(F)F)c1)C[C@H]1CCC[NH+](C)C1 ZINC000474152102 1044698002 /nfs/dbraw/zinc/69/80/02/1044698002.db2.gz GSYWQTNZGLYWGS-QGZVFWFLSA-N 2 1 342.449 4.302 20 0 EIADMP C[NH+](CCCCc1cccc(C(F)(F)F)c1)C[C@H]1CCC[N@H+](C)C1 ZINC000474152102 1044698009 /nfs/dbraw/zinc/69/80/09/1044698009.db2.gz GSYWQTNZGLYWGS-QGZVFWFLSA-N 2 1 342.449 4.302 20 0 EIADMP C[NH+](CCCCc1cccc(C(F)(F)F)c1)C[C@H]1CCC[N@@H+](C)C1 ZINC000474152102 1044698016 /nfs/dbraw/zinc/69/80/16/1044698016.db2.gz GSYWQTNZGLYWGS-QGZVFWFLSA-N 2 1 342.449 4.302 20 0 EIADMP c1ccc([C@@H]2CC[N@@H+]2Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000676413570 1044736033 /nfs/dbraw/zinc/73/60/33/1044736033.db2.gz DDUUUPNWQMLPSV-QFIPXVFZSA-N 2 1 336.479 4.108 20 0 EIADMP c1ccc([C@H]2C[C@@H]([NH2+][C@@H]3CCC[C@]34CCCO4)CC[N@H+]2C2CC2)cc1 ZINC000895681776 1044851324 /nfs/dbraw/zinc/85/13/24/1044851324.db2.gz WNNRSOKNCYIFEI-PDGJWGCVSA-N 2 1 340.511 4.046 20 0 EIADMP c1ccc([C@H]2C[C@@H]([NH2+][C@@H]3CCC[C@]34CCCO4)CC[N@@H+]2C2CC2)cc1 ZINC000895681776 1044851328 /nfs/dbraw/zinc/85/13/28/1044851328.db2.gz WNNRSOKNCYIFEI-PDGJWGCVSA-N 2 1 340.511 4.046 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836939 1044982412 /nfs/dbraw/zinc/98/24/12/1044982412.db2.gz FIBCOBMCMXYNCX-NEWSRXKRSA-N 2 1 330.541 4.057 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836939 1044982421 /nfs/dbraw/zinc/98/24/21/1044982421.db2.gz FIBCOBMCMXYNCX-NEWSRXKRSA-N 2 1 330.541 4.057 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+]C1CC(c2cccc(Br)c2)C1 ZINC000232653163 1044983764 /nfs/dbraw/zinc/98/37/64/1044983764.db2.gz LSZCVYMRXBXVFP-UHFFFAOYSA-N 2 1 339.321 4.015 20 0 EIADMP CC[C@H](C[NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1)[NH+]1CCCC1 ZINC000474478248 1045020551 /nfs/dbraw/zinc/02/05/51/1045020551.db2.gz OQMBEHLGYNNQKJ-HRCADAONSA-N 2 1 331.529 4.252 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](CCSc3ccccc3)C2)CC1 ZINC000303673293 1045052936 /nfs/dbraw/zinc/05/29/36/1045052936.db2.gz HBDKRNACANSUNW-IBGZPJMESA-N 2 1 332.557 4.223 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCSc3ccccc3)C2)CC1 ZINC000303673293 1045052944 /nfs/dbraw/zinc/05/29/44/1045052944.db2.gz HBDKRNACANSUNW-IBGZPJMESA-N 2 1 332.557 4.223 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000923480071 1045132236 /nfs/dbraw/zinc/13/22/36/1045132236.db2.gz DULRNROEFBNKEI-UONOGXRCSA-N 2 1 333.863 4.035 20 0 EIADMP c1cc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]CC4)CC3)cs2)co1 ZINC000923505798 1045139595 /nfs/dbraw/zinc/13/95/95/1045139595.db2.gz CIWPDTMPMPQTJP-OAHLLOKOSA-N 2 1 345.512 4.005 20 0 EIADMP C[C@H]([NH2+]Cc1scnc1C1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487567672 1045227213 /nfs/dbraw/zinc/22/72/13/1045227213.db2.gz YJPUMVZNOLODDQ-MAUKXSAKSA-N 2 1 341.524 4.021 20 0 EIADMP C[C@H]([NH2+]Cc1scnc1C1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487567672 1045227226 /nfs/dbraw/zinc/22/72/26/1045227226.db2.gz YJPUMVZNOLODDQ-MAUKXSAKSA-N 2 1 341.524 4.021 20 0 EIADMP C[C@@H]([NH2+]Cc1scnc1C1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487567670 1045228593 /nfs/dbraw/zinc/22/85/93/1045228593.db2.gz YJPUMVZNOLODDQ-CRAIPNDOSA-N 2 1 341.524 4.021 20 0 EIADMP C[C@@H]([NH2+]Cc1scnc1C1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487567670 1045228604 /nfs/dbraw/zinc/22/86/04/1045228604.db2.gz YJPUMVZNOLODDQ-CRAIPNDOSA-N 2 1 341.524 4.021 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)c2ccc(F)cc2)CC1 ZINC000495652211 1045270473 /nfs/dbraw/zinc/27/04/73/1045270473.db2.gz BIGJTPVFBIGPDL-KRWDZBQOSA-N 2 1 326.459 4.449 20 0 EIADMP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000161655744 1045307868 /nfs/dbraw/zinc/30/78/68/1045307868.db2.gz XJMPTKVKZHEKCW-OZVIIMIRSA-N 2 1 325.283 4.197 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000495728074 1045316126 /nfs/dbraw/zinc/31/61/26/1045316126.db2.gz WCUDFFWKQFZUEQ-HOTGVXAUSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000495728074 1045316132 /nfs/dbraw/zinc/31/61/32/1045316132.db2.gz WCUDFFWKQFZUEQ-HOTGVXAUSA-N 2 1 332.488 4.450 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]Cc3cccc4cc[nH]c43)C2)c1 ZINC000236592307 1045360762 /nfs/dbraw/zinc/36/07/62/1045360762.db2.gz OQJDZUGGOUJYPC-MRXNPFEDSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]Cc3cccc4cc[nH]c43)C2)c1 ZINC000236592307 1045360767 /nfs/dbraw/zinc/36/07/67/1045360767.db2.gz OQJDZUGGOUJYPC-MRXNPFEDSA-N 2 1 339.508 4.231 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1F ZINC000237410162 1045383725 /nfs/dbraw/zinc/38/37/25/1045383725.db2.gz VPZOSECVWQZCCH-QGZVFWFLSA-N 2 1 326.459 4.449 20 0 EIADMP C[N@H+](CC1CCC(F)(F)CC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000459386044 1045727208 /nfs/dbraw/zinc/72/72/08/1045727208.db2.gz XWDCHEXRQYHIPT-UHFFFAOYSA-N 2 1 336.470 4.408 20 0 EIADMP C[N@@H+](CC1CCC(F)(F)CC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000459386044 1045727222 /nfs/dbraw/zinc/72/72/22/1045727222.db2.gz XWDCHEXRQYHIPT-UHFFFAOYSA-N 2 1 336.470 4.408 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)cc1 ZINC000768230541 1045761319 /nfs/dbraw/zinc/76/13/19/1045761319.db2.gz RGBPOUXGFCHVAV-UHFFFAOYSA-N 2 1 336.401 4.399 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1cccc(F)c1 ZINC000398050261 1045826720 /nfs/dbraw/zinc/82/67/20/1045826720.db2.gz XICDCJDPPBXVGM-LLGFUMIMSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1cccc(F)c1 ZINC000398050261 1045826722 /nfs/dbraw/zinc/82/67/22/1045826722.db2.gz XICDCJDPPBXVGM-LLGFUMIMSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCCCCOc2ccc(Cl)cc2)CC[N@H+]1C ZINC000769418086 1045954439 /nfs/dbraw/zinc/95/44/39/1045954439.db2.gz TXKYLQFKIWMIBN-WMZOPIPTSA-N 2 1 338.923 4.352 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000161612944 1046007507 /nfs/dbraw/zinc/00/75/07/1046007507.db2.gz BTFUURMQZUDJHZ-KEYYUXOJSA-N 2 1 340.433 4.055 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cccc(O)c1Cl ZINC000328352666 1046110934 /nfs/dbraw/zinc/11/09/34/1046110934.db2.gz NIWFHHLHYJXUAG-UHFFFAOYSA-N 2 1 332.875 4.177 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000769969237 1046112736 /nfs/dbraw/zinc/11/27/36/1046112736.db2.gz QDSPTPFKGUHUSX-HNNXBMFYSA-N 2 1 336.545 4.452 20 0 EIADMP COc1ccsc1[C@@H](C)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000769969240 1046112786 /nfs/dbraw/zinc/11/27/86/1046112786.db2.gz QDSPTPFKGUHUSX-OAHLLOKOSA-N 2 1 336.545 4.452 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000261896127 1046163844 /nfs/dbraw/zinc/16/38/44/1046163844.db2.gz VAUQAPFXRCAALB-UZLBHIALSA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000261896127 1046163854 /nfs/dbraw/zinc/16/38/54/1046163854.db2.gz VAUQAPFXRCAALB-UZLBHIALSA-N 2 1 343.540 4.419 20 0 EIADMP CC1(C)CC([NH2+]Cc2ccc(-c3ccncc3)cc2F)CC(C)(C)[NH2+]1 ZINC000162410400 1046203140 /nfs/dbraw/zinc/20/31/40/1046203140.db2.gz BCMUBUFLENTCDT-UHFFFAOYSA-N 2 1 341.474 4.287 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CC(C)(C)OC2(C)C)CC1 ZINC000125176086 1046290809 /nfs/dbraw/zinc/29/08/09/1046290809.db2.gz VLODVMLGVFQSCA-LPHOPBHVSA-N 2 1 330.516 4.148 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508715813 1046381598 /nfs/dbraw/zinc/38/15/98/1046381598.db2.gz XZKKVGXJZCHKKW-FHMICOROSA-N 2 1 346.518 4.073 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCCC[C@@H]3C(C)C)CC2)oc1C ZINC000162744939 1046493867 /nfs/dbraw/zinc/49/38/67/1046493867.db2.gz YOBDTQKQDLFBNS-UXHICEINSA-N 2 1 347.547 4.308 20 0 EIADMP c1sc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1-c1ccccc1 ZINC000536659133 1046614548 /nfs/dbraw/zinc/61/45/48/1046614548.db2.gz HCTLIQGBWYADJA-QGZVFWFLSA-N 2 1 326.509 4.333 20 0 EIADMP c1sc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1-c1ccccc1 ZINC000536659133 1046614552 /nfs/dbraw/zinc/61/45/52/1046614552.db2.gz HCTLIQGBWYADJA-QGZVFWFLSA-N 2 1 326.509 4.333 20 0 EIADMP Cn1cncc1CC[N@H+]1CCCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000459418305 1046642159 /nfs/dbraw/zinc/64/21/59/1046642159.db2.gz ZSJDYKPRIAUGMC-KRWDZBQOSA-N 2 1 337.389 4.209 20 0 EIADMP C[C@H](c1ccc2c(c1)CCC2)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000459417061 1046643929 /nfs/dbraw/zinc/64/39/29/1046643929.db2.gz ROSRLGQQWDKYFY-VSDWSMLSSA-N 2 1 349.522 4.256 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c3ccccc23)[C@H](C)C1 ZINC000536682578 1046646165 /nfs/dbraw/zinc/64/61/65/1046646165.db2.gz YTJIHQCDTSXIMP-UZLBHIALSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OC)c3ccccc23)[C@H](C)C1 ZINC000536682578 1046646175 /nfs/dbraw/zinc/64/61/75/1046646175.db2.gz YTJIHQCDTSXIMP-UZLBHIALSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(OC)c3ccccc23)[C@H](C)C1 ZINC000536682578 1046646187 /nfs/dbraw/zinc/64/61/87/1046646187.db2.gz YTJIHQCDTSXIMP-UZLBHIALSA-N 2 1 326.484 4.011 20 0 EIADMP Cc1ccc(C[N@H+](CCCn2cc[nH+]c2C)Cc2ccco2)s1 ZINC000127318132 1046647249 /nfs/dbraw/zinc/64/72/49/1046647249.db2.gz QOSMJWSTAJNUNR-UHFFFAOYSA-N 2 1 329.469 4.247 20 0 EIADMP Cc1ccc(C[N@@H+](CCCn2cc[nH+]c2C)Cc2ccco2)s1 ZINC000127318132 1046647262 /nfs/dbraw/zinc/64/72/62/1046647262.db2.gz QOSMJWSTAJNUNR-UHFFFAOYSA-N 2 1 329.469 4.247 20 0 EIADMP CN(CC[C@H]1CCCC[N@H+]1C)Cc1cnc(-c2ccccc2)s1 ZINC000536677826 1046665042 /nfs/dbraw/zinc/66/50/42/1046665042.db2.gz MDEYLBSEHWWCDG-QGZVFWFLSA-N 2 1 329.513 4.116 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(OC(F)F)c(Cl)c2)[C@H](C)C1 ZINC000536678537 1046665468 /nfs/dbraw/zinc/66/54/68/1046665468.db2.gz CASQGRBTSJJWQA-IUODEOHRSA-N 2 1 346.849 4.104 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)[C@H](C)C1 ZINC000536678537 1046665480 /nfs/dbraw/zinc/66/54/80/1046665480.db2.gz CASQGRBTSJJWQA-IUODEOHRSA-N 2 1 346.849 4.104 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)[C@H](C)C1 ZINC000536678537 1046665489 /nfs/dbraw/zinc/66/54/89/1046665489.db2.gz CASQGRBTSJJWQA-IUODEOHRSA-N 2 1 346.849 4.104 20 0 EIADMP C[C@@H](C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000536703788 1046704854 /nfs/dbraw/zinc/70/48/54/1046704854.db2.gz YQTJWQSGBYNGLK-IBGZPJMESA-N 2 1 337.511 4.424 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379618870 1046708985 /nfs/dbraw/zinc/70/89/85/1046708985.db2.gz AULDSWBTRGOMNB-LAUBAEHRSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)CC[N@H+]1Cc1ccccc1 ZINC000379618870 1046708999 /nfs/dbraw/zinc/70/89/99/1046708999.db2.gz AULDSWBTRGOMNB-LAUBAEHRSA-N 2 1 333.479 4.311 20 0 EIADMP CCOc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379656075 1046759440 /nfs/dbraw/zinc/75/94/40/1046759440.db2.gz NXSNMKJTWLSNSY-WIYYLYMNSA-N 2 1 338.495 4.228 20 0 EIADMP CCOc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379656075 1046759457 /nfs/dbraw/zinc/75/94/57/1046759457.db2.gz NXSNMKJTWLSNSY-WIYYLYMNSA-N 2 1 338.495 4.228 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCCC(F)(F)C3)CC2)cc1 ZINC000536851126 1046822111 /nfs/dbraw/zinc/82/21/11/1046822111.db2.gz JCSIAHYBUFIMFF-GOSISDBHSA-N 2 1 340.433 4.000 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC000536856461 1046826015 /nfs/dbraw/zinc/82/60/15/1046826015.db2.gz FCSLNQZRVWZAJA-STQMWFEESA-N 2 1 325.909 4.153 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc2ccccc2c1 ZINC000536859342 1046826509 /nfs/dbraw/zinc/82/65/09/1046826509.db2.gz RZNWUVUMFNCUKQ-OTWHNJEPSA-N 2 1 340.511 4.380 20 0 EIADMP CC(C)C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccs1 ZINC000536858765 1046826912 /nfs/dbraw/zinc/82/69/12/1046826912.db2.gz RROCLULKLLAEJZ-KSZLIROESA-N 2 1 338.561 4.314 20 0 EIADMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cnn1C(C)C ZINC000786906464 1046880257 /nfs/dbraw/zinc/88/02/57/1046880257.db2.gz ZXURTFUEBHVDQC-QGZVFWFLSA-N 2 1 346.563 4.468 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](COc1ccccc1F)C(C)(C)C ZINC000537290568 1047073400 /nfs/dbraw/zinc/07/34/00/1047073400.db2.gz POKDERZBINUNGI-LJQANCHMSA-N 2 1 347.478 4.194 20 0 EIADMP CCO[C@@H]1C[C@@H]([NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)C12CCC2 ZINC000537293478 1047076331 /nfs/dbraw/zinc/07/63/31/1047076331.db2.gz UPJLKQBWSUXMIV-DUXKGJEZSA-N 2 1 342.527 4.149 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000537302979 1047084242 /nfs/dbraw/zinc/08/42/42/1047084242.db2.gz AMRQRMIVZFBCGM-IBGZPJMESA-N 2 1 326.509 4.192 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccccc3)CC2)cs1 ZINC000129497167 1047405407 /nfs/dbraw/zinc/40/54/07/1047405407.db2.gz CWEGELGJVVUHKQ-INIZCTEOSA-N 2 1 343.540 4.268 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCCn2ccc3ccccc32)C[C@@H]1c1ccccc1 ZINC000556052954 1047417432 /nfs/dbraw/zinc/41/74/32/1047417432.db2.gz LDMKZOXMQAOAJW-JTHBVZDNSA-N 2 1 347.506 4.457 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCn2ccc3ccccc32)C[C@@H]1c1ccccc1 ZINC000556052954 1047417434 /nfs/dbraw/zinc/41/74/34/1047417434.db2.gz LDMKZOXMQAOAJW-JTHBVZDNSA-N 2 1 347.506 4.457 20 0 EIADMP Cc1ccccc1O[C@H](C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556094120 1047446336 /nfs/dbraw/zinc/44/63/36/1047446336.db2.gz QPZWVOVOCSSWIQ-HMXCVIKNSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1ccccc1O[C@H](C)C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556094120 1047446339 /nfs/dbraw/zinc/44/63/39/1047446339.db2.gz QPZWVOVOCSSWIQ-HMXCVIKNSA-N 2 1 338.495 4.187 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)C[C@H](C)O1 ZINC000556155042 1047498297 /nfs/dbraw/zinc/49/82/97/1047498297.db2.gz QLBQZJBMKKFWHH-DCXXXQMHSA-N 2 1 330.516 4.107 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1ccncc1F ZINC000556235739 1047599702 /nfs/dbraw/zinc/59/97/02/1047599702.db2.gz GTDFTCVXINKQGG-SJORKVTESA-N 2 1 341.474 4.446 20 0 EIADMP C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000898322424 1047616603 /nfs/dbraw/zinc/61/66/03/1047616603.db2.gz KZRGPLZIMLCPAU-WTOYTKOKSA-N 2 1 335.495 4.033 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCc4c3cccc4O)CC2)C1 ZINC000130428392 1047707384 /nfs/dbraw/zinc/70/73/84/1047707384.db2.gz PPRWTDXVBFBIID-WRWLIDTKSA-N 2 1 328.500 4.012 20 0 EIADMP Cc1cccc(O[C@H](C)C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550666090 1047810517 /nfs/dbraw/zinc/81/05/17/1047810517.db2.gz UQPDQSWAOYQUKT-CBQOVEMMSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1cccc(O[C@H](C)C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550666090 1047810518 /nfs/dbraw/zinc/81/05/18/1047810518.db2.gz UQPDQSWAOYQUKT-CBQOVEMMSA-N 2 1 338.495 4.187 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cccc(Cl)n2)CC1 ZINC000763434332 1047813399 /nfs/dbraw/zinc/81/33/99/1047813399.db2.gz WBGXIVMDGPLCAG-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccc(Cl)n2)CC1 ZINC000763434332 1047813400 /nfs/dbraw/zinc/81/34/00/1047813400.db2.gz WBGXIVMDGPLCAG-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2(Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000550701165 1047819505 /nfs/dbraw/zinc/81/95/05/1047819505.db2.gz STEZTFZBQUEVAB-YADHBBJMSA-N 2 1 334.507 4.434 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000550701165 1047819507 /nfs/dbraw/zinc/81/95/07/1047819507.db2.gz STEZTFZBQUEVAB-YADHBBJMSA-N 2 1 334.507 4.434 20 0 EIADMP Clc1cc(Cl)c2c(c1)CC[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)C2 ZINC001171066156 1047937935 /nfs/dbraw/zinc/93/79/35/1047937935.db2.gz HPHFFGCGOASQMP-HNNXBMFYSA-N 2 1 339.310 4.067 20 0 EIADMP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC4(CC[N@@H+](Cc5ccoc5)C4)CC3)C[C@@H]21 ZINC001170749440 1048039220 /nfs/dbraw/zinc/03/92/20/1048039220.db2.gz FCGIZISTRNXDQF-LDLYASANSA-N 2 1 328.500 4.002 20 0 EIADMP COC1CCC(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000514953579 1048086842 /nfs/dbraw/zinc/08/68/42/1048086842.db2.gz IFEYFHCNXCTYQE-OPWVIFHQSA-N 2 1 330.516 4.007 20 0 EIADMP COC1CCC(CC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000514953579 1048086858 /nfs/dbraw/zinc/08/68/58/1048086858.db2.gz IFEYFHCNXCTYQE-OPWVIFHQSA-N 2 1 330.516 4.007 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H]2CCC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000556890741 1048131932 /nfs/dbraw/zinc/13/19/32/1048131932.db2.gz RQUCCLGEJLYEIC-RNJTYBCJSA-N 2 1 340.433 4.271 20 0 EIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170764037 1048160759 /nfs/dbraw/zinc/16/07/59/1048160759.db2.gz FNRPZNUJFGOFCX-OWZKRDHZSA-N 2 1 330.491 4.157 20 0 EIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170764037 1048160765 /nfs/dbraw/zinc/16/07/65/1048160765.db2.gz FNRPZNUJFGOFCX-OWZKRDHZSA-N 2 1 330.491 4.157 20 0 EIADMP [NH3+][C@@H]1CCc2c3ccccc3n(-c3cccc(C4=[NH+]CCC4)c3)c2C1 ZINC001171099653 1048184010 /nfs/dbraw/zinc/18/40/10/1048184010.db2.gz OVTBBPOZSXXTPZ-MRXNPFEDSA-N 2 1 329.447 4.029 20 0 EIADMP CCc1ccc(-c2nc(C[N@@H+](C)C3CCC([NH3+])CC3)cs2)cc1 ZINC000844220471 1048225804 /nfs/dbraw/zinc/22/58/04/1048225804.db2.gz DRMXKHFREXUYLI-UHFFFAOYSA-N 2 1 329.513 4.074 20 0 EIADMP C(=C\c1ccccc1)\C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499136337 1048331436 /nfs/dbraw/zinc/33/14/36/1048331436.db2.gz QMSQLGKQPZZYMG-XBPVEPMDSA-N 2 1 332.491 4.485 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCOC2CCCCC2)C3)cc1 ZINC000499147823 1048355119 /nfs/dbraw/zinc/35/51/19/1048355119.db2.gz QTWSIFAEBHATIJ-MZADTFQBSA-N 2 1 342.527 4.121 20 0 EIADMP Oc1cccc2c1CC[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499153566 1048362482 /nfs/dbraw/zinc/36/24/82/1048362482.db2.gz RVFXRCBDDJZJFB-NXWNEQKCSA-N 2 1 348.490 4.165 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171139218 1048416818 /nfs/dbraw/zinc/41/68/18/1048416818.db2.gz JWYUFSRSEDCNHS-CJNGLKHVSA-N 2 1 341.326 4.172 20 0 EIADMP COc1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1Cl ZINC000809738164 1048510448 /nfs/dbraw/zinc/51/04/48/1048510448.db2.gz RTYOLRGORWNMFX-UHFFFAOYSA-N 2 1 332.875 4.042 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765053 1048525913 /nfs/dbraw/zinc/52/59/13/1048525913.db2.gz KSAVMGINNBJHAK-WFASDCNBSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765053 1048525926 /nfs/dbraw/zinc/52/59/26/1048525926.db2.gz KSAVMGINNBJHAK-WFASDCNBSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765053 1048525935 /nfs/dbraw/zinc/52/59/35/1048525935.db2.gz KSAVMGINNBJHAK-WFASDCNBSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765053 1048525946 /nfs/dbraw/zinc/52/59/46/1048525946.db2.gz KSAVMGINNBJHAK-WFASDCNBSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@]2(C)C[C@]2(F)Cl)CC[N@@H+]1Cc1ccccc1 ZINC000846030260 1048796196 /nfs/dbraw/zinc/79/61/96/1048796196.db2.gz ABCXSGPOCRZZHF-NXWXRZEISA-N 2 1 338.898 4.334 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@]2(C)C[C@]2(F)Cl)CC[N@H+]1Cc1ccccc1 ZINC000846030260 1048796212 /nfs/dbraw/zinc/79/62/12/1048796212.db2.gz ABCXSGPOCRZZHF-NXWXRZEISA-N 2 1 338.898 4.334 20 0 EIADMP Clc1cc2cccnc2c(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000075834315 1048799562 /nfs/dbraw/zinc/79/95/62/1048799562.db2.gz OCBJVKNBIRFATQ-MRXNPFEDSA-N 2 1 343.902 4.196 20 0 EIADMP Clc1cc2cccnc2c(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000075834315 1048799578 /nfs/dbraw/zinc/79/95/78/1048799578.db2.gz OCBJVKNBIRFATQ-MRXNPFEDSA-N 2 1 343.902 4.196 20 0 EIADMP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@@H+](CCCCCC[NH3+])C1 ZINC000846220940 1048844265 /nfs/dbraw/zinc/84/42/65/1048844265.db2.gz ZXBIOLDGFXECJA-GOSISDBHSA-N 2 1 342.531 4.316 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H](C[NH3+])C2CCCC2)ccc1SC(F)F ZINC000817980498 1049078624 /nfs/dbraw/zinc/07/86/24/1049078624.db2.gz CBJULTWCJDEGDJ-FZMZJTMJSA-N 2 1 344.471 4.178 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1ccc2c(c1)OCCCO2)C(C)C ZINC000348093964 1049423746 /nfs/dbraw/zinc/42/37/46/1049423746.db2.gz VQDKIMUDKMMXEK-KRWDZBQOSA-N 2 1 334.504 4.007 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccc2c(c1)CCO2 ZINC000773079756 1049569838 /nfs/dbraw/zinc/56/98/38/1049569838.db2.gz YVNXBFMWAAPUND-XLIONFOSSA-N 2 1 330.516 4.030 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389389 1049601474 /nfs/dbraw/zinc/60/14/74/1049601474.db2.gz STKBZOJBHIFBSU-FHWLQOOXSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389389 1049601491 /nfs/dbraw/zinc/60/14/91/1049601491.db2.gz STKBZOJBHIFBSU-FHWLQOOXSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389389 1049601506 /nfs/dbraw/zinc/60/15/06/1049601506.db2.gz STKBZOJBHIFBSU-FHWLQOOXSA-N 2 1 348.481 4.161 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)cc3cccnc32)[C@H](C)C1 ZINC000081096714 1049625559 /nfs/dbraw/zinc/62/55/59/1049625559.db2.gz FJRCTWKZTARRIK-RDTXWAMCSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)cc3cccnc32)[C@H](C)C1 ZINC000081096714 1049625562 /nfs/dbraw/zinc/62/55/62/1049625562.db2.gz FJRCTWKZTARRIK-RDTXWAMCSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)cc3cccnc32)[C@H](C)C1 ZINC000081096714 1049625567 /nfs/dbraw/zinc/62/55/67/1049625567.db2.gz FJRCTWKZTARRIK-RDTXWAMCSA-N 2 1 331.891 4.050 20 0 EIADMP Fc1cccc2c1CC[C@H](N1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001171421103 1049658796 /nfs/dbraw/zinc/65/87/96/1049658796.db2.gz CLHIRPOORNSGNI-IBGZPJMESA-N 2 1 342.502 4.023 20 0 EIADMP Fc1cccc2c1CC[C@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001171421103 1049658806 /nfs/dbraw/zinc/65/88/06/1049658806.db2.gz CLHIRPOORNSGNI-IBGZPJMESA-N 2 1 342.502 4.023 20 0 EIADMP Fc1cccc2c1CC[C@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001171421103 1049658811 /nfs/dbraw/zinc/65/88/11/1049658811.db2.gz CLHIRPOORNSGNI-IBGZPJMESA-N 2 1 342.502 4.023 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2c(F)cccc2C1 ZINC001171439395 1049692770 /nfs/dbraw/zinc/69/27/70/1049692770.db2.gz YKEDZPQBCRVPBI-GBESFXJTSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@@H]1CCc2c(F)cccc2C1 ZINC001171439395 1049692774 /nfs/dbraw/zinc/69/27/74/1049692774.db2.gz YKEDZPQBCRVPBI-GBESFXJTSA-N 2 1 330.491 4.022 20 0 EIADMP FC1(F)CCC[C@@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000716629299 1049700969 /nfs/dbraw/zinc/70/09/69/1049700969.db2.gz YFYJBWDGYJSGDB-MANSERQUSA-N 2 1 334.454 4.207 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)cc3cccnc32)[C@@H](C)C1 ZINC000245416665 1049712841 /nfs/dbraw/zinc/71/28/41/1049712841.db2.gz FJRCTWKZTARRIK-KBXCAEBGSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)cc3cccnc32)[C@@H](C)C1 ZINC000245416665 1049712857 /nfs/dbraw/zinc/71/28/57/1049712857.db2.gz FJRCTWKZTARRIK-KBXCAEBGSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)cc3cccnc32)[C@@H](C)C1 ZINC000245416665 1049712875 /nfs/dbraw/zinc/71/28/75/1049712875.db2.gz FJRCTWKZTARRIK-KBXCAEBGSA-N 2 1 331.891 4.050 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)cc3cccnc32)[C@@H](C)C1 ZINC000245416666 1049713583 /nfs/dbraw/zinc/71/35/83/1049713583.db2.gz FJRCTWKZTARRIK-KSSFIOAISA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)cc3cccnc32)[C@@H](C)C1 ZINC000245416666 1049713596 /nfs/dbraw/zinc/71/35/96/1049713596.db2.gz FJRCTWKZTARRIK-KSSFIOAISA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)cc3cccnc32)[C@@H](C)C1 ZINC000245416666 1049713616 /nfs/dbraw/zinc/71/36/16/1049713616.db2.gz FJRCTWKZTARRIK-KSSFIOAISA-N 2 1 331.891 4.050 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171471825 1049728584 /nfs/dbraw/zinc/72/85/84/1049728584.db2.gz KPPKIBYUZYRJCC-KZNAEPCWSA-N 2 1 336.470 4.050 20 0 EIADMP CCC(CC)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cccc(F)c2C1 ZINC001170975629 1049729908 /nfs/dbraw/zinc/72/99/08/1049729908.db2.gz YEASFUVOIWDTJE-WDSOQIARSA-N 2 1 332.507 4.444 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc3ccccc3)C1)C2 ZINC001171551556 1049753294 /nfs/dbraw/zinc/75/32/94/1049753294.db2.gz QEMPQVNZFGECDU-JTHBVZDNSA-N 2 1 348.534 4.354 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@@H+](C)C[C@H]1CC[NH+](Cc3ccccc3)C1)C2 ZINC001171573512 1049760707 /nfs/dbraw/zinc/76/07/07/1049760707.db2.gz IYVKHQYLIGSPFI-FYYLOGMGSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH+](C)C[C@H]1CC[N@H+](Cc3ccccc3)C1)C2 ZINC001171573512 1049760711 /nfs/dbraw/zinc/76/07/11/1049760711.db2.gz IYVKHQYLIGSPFI-FYYLOGMGSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH+](C)C[C@H]1CC[N@@H+](Cc3ccccc3)C1)C2 ZINC001171573512 1049760718 /nfs/dbraw/zinc/76/07/18/1049760718.db2.gz IYVKHQYLIGSPFI-FYYLOGMGSA-N 2 1 348.534 4.306 20 0 EIADMP COc1ccccc1[C@@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)C1CC1 ZINC001171631307 1049761499 /nfs/dbraw/zinc/76/14/99/1049761499.db2.gz YEXUMCDHKQDWFP-IBGZPJMESA-N 2 1 330.516 4.387 20 0 EIADMP C[NH+]1C(C)(C)CC([N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171629710 1049761718 /nfs/dbraw/zinc/76/17/18/1049761718.db2.gz DFZGQXLDARXUDK-SAABIXHNSA-N 3 1 335.580 4.152 20 0 EIADMP CN1C(C)(C)CC([N@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171629710 1049761723 /nfs/dbraw/zinc/76/17/23/1049761723.db2.gz DFZGQXLDARXUDK-SAABIXHNSA-N 2 1 335.580 4.152 20 0 EIADMP CN1C(C)(C)CC([N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171629710 1049761729 /nfs/dbraw/zinc/76/17/29/1049761729.db2.gz DFZGQXLDARXUDK-SAABIXHNSA-N 2 1 335.580 4.152 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCOc3ccc(Cl)cc32)CC1(C)C ZINC001171628719 1049762126 /nfs/dbraw/zinc/76/21/26/1049762126.db2.gz HSKOBSHUPPUXGL-MRXNPFEDSA-N 2 1 336.907 4.405 20 0 EIADMP Cc1ccc(CC[C@@H](C)N(c2cccc(C)[nH+]2)C2CC[NH2+]CC2)cc1 ZINC001171683091 1049777745 /nfs/dbraw/zinc/77/77/45/1049777745.db2.gz ZCZSFCYVJZRDQP-LJQANCHMSA-N 2 1 337.511 4.278 20 0 EIADMP COc1ccccc1[C@H]1CCC[N@H+]1C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171638505 1049778732 /nfs/dbraw/zinc/77/87/32/1049778732.db2.gz ZSUMWZIEKATDDF-GOSISDBHSA-N 2 1 330.516 4.484 20 0 EIADMP C[NH+]1C(C)(C)CC([N@H+]2CCC[C@@H](Oc3ccccc3)C2)CC1(C)C ZINC001171636457 1049779831 /nfs/dbraw/zinc/77/98/31/1049779831.db2.gz DSRZTUKTEHUPDA-LJQANCHMSA-N 2 1 330.516 4.181 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171731437 1049786407 /nfs/dbraw/zinc/78/64/07/1049786407.db2.gz BCAYVCOJERKCFZ-KAGYGMCKSA-N 2 1 349.522 4.258 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)[C@@H]2Cc3cccc(F)c3C2)CC1 ZINC001171785515 1049804059 /nfs/dbraw/zinc/80/40/59/1049804059.db2.gz OMWCBMGDLCJGSA-VAMGGRTRSA-N 2 1 338.470 4.065 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCc2ccccc2F)CC[N@H+]1Cc1ccccc1 ZINC001171963296 1049825834 /nfs/dbraw/zinc/82/58/34/1049825834.db2.gz HMSDNDGKMLSGLU-HXUWFJFHSA-N 2 1 340.486 4.401 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC001171964750 1049826242 /nfs/dbraw/zinc/82/62/42/1049826242.db2.gz MUTNCYUCOWUOEA-OAQYLSRUSA-N 2 1 340.486 4.401 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC001171964747 1049826585 /nfs/dbraw/zinc/82/65/85/1049826585.db2.gz MUTNCYUCOWUOEA-NRFANRHFSA-N 2 1 340.486 4.401 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2ccc(Cl)nc2)CC[N@@H+]1Cc1ccccc1 ZINC001171965211 1049826897 /nfs/dbraw/zinc/82/68/97/1049826897.db2.gz OXAQAMISKKQMHN-SFHVURJKSA-N 2 1 343.902 4.268 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2ccc(Cl)nc2)CC[N@H+]1Cc1ccccc1 ZINC001171965211 1049826899 /nfs/dbraw/zinc/82/68/99/1049826899.db2.gz OXAQAMISKKQMHN-SFHVURJKSA-N 2 1 343.902 4.268 20 0 EIADMP CC(C)[N@H+](C1CCOCC1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171991473 1049832931 /nfs/dbraw/zinc/83/29/31/1049832931.db2.gz XUHPDQPHELHIFX-NRFANRHFSA-N 2 1 344.543 4.319 20 0 EIADMP CC(C)[N@@H+](C1CCOCC1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171991473 1049832932 /nfs/dbraw/zinc/83/29/32/1049832932.db2.gz XUHPDQPHELHIFX-NRFANRHFSA-N 2 1 344.543 4.319 20 0 EIADMP CC(C)[NH+](C1CCOCC1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171991473 1049832933 /nfs/dbraw/zinc/83/29/33/1049832933.db2.gz XUHPDQPHELHIFX-NRFANRHFSA-N 2 1 344.543 4.319 20 0 EIADMP CC(C)[NH+](C1CCOCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171991473 1049832935 /nfs/dbraw/zinc/83/29/35/1049832935.db2.gz XUHPDQPHELHIFX-NRFANRHFSA-N 2 1 344.543 4.319 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2CCc3ncccc32)CC[N@H+]1Cc1ccccc1 ZINC001171977188 1049837068 /nfs/dbraw/zinc/83/70/68/1049837068.db2.gz YCEKTBGYEMBUJN-RXVVDRJESA-N 2 1 335.495 4.102 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2ccc3ncoc3c2)CC[N@H+]1Cc1ccccc1 ZINC001171977093 1049837520 /nfs/dbraw/zinc/83/75/20/1049837520.db2.gz XFWWJOSTDIEVJS-LJQANCHMSA-N 2 1 349.478 4.361 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C(C)(C)O1 ZINC000245720029 1049838652 /nfs/dbraw/zinc/83/86/52/1049838652.db2.gz OOQTYJZGAFMGEI-YRPNKDGESA-N 2 1 342.527 4.118 20 0 EIADMP CC1(C)C[C@@H]([NH+]2C[C@H]3[C@H](CC3(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171981038 1049838801 /nfs/dbraw/zinc/83/88/01/1049838801.db2.gz JXSOCQXMPSMXJS-SQNIBIBYSA-N 2 1 334.454 4.017 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2C[C@H]3[C@H](CC3(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171981038 1049838805 /nfs/dbraw/zinc/83/88/05/1049838805.db2.gz JXSOCQXMPSMXJS-SQNIBIBYSA-N 2 1 334.454 4.017 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171981038 1049838806 /nfs/dbraw/zinc/83/88/06/1049838806.db2.gz JXSOCQXMPSMXJS-SQNIBIBYSA-N 2 1 334.454 4.017 20 0 EIADMP CSC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172076133 1049844838 /nfs/dbraw/zinc/84/48/38/1049844838.db2.gz VOLVMSGAWZSJFY-ACDBMABISA-N 2 1 344.568 4.400 20 0 EIADMP CO[C@@H]1CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172076427 1049844979 /nfs/dbraw/zinc/84/49/79/1049844979.db2.gz YMXXYPSAOGUMMB-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP CO[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172076427 1049844983 /nfs/dbraw/zinc/84/49/83/1049844983.db2.gz YMXXYPSAOGUMMB-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP CO[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172076427 1049844984 /nfs/dbraw/zinc/84/49/84/1049844984.db2.gz YMXXYPSAOGUMMB-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP Cc1cc2c(cn1)CN([C@H]1C[C@H]3CCC[C@@H](C1)[N@@H+]3Cc1ccccc1)C2 ZINC001172082885 1049847585 /nfs/dbraw/zinc/84/75/85/1049847585.db2.gz NAZSVDZTYCPTFQ-JKHIJQBDSA-N 2 1 347.506 4.291 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCO1 ZINC001172063207 1049849961 /nfs/dbraw/zinc/84/99/61/1049849961.db2.gz ABXKNBSNWPNGOL-XSDIEEQYSA-N 2 1 342.527 4.119 20 0 EIADMP Cc1cccnc1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172064534 1049851827 /nfs/dbraw/zinc/85/18/27/1049851827.db2.gz GYRIMTPVILYRAI-WKCHPHFGSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1cccnc1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172064534 1049851831 /nfs/dbraw/zinc/85/18/31/1049851831.db2.gz GYRIMTPVILYRAI-WKCHPHFGSA-N 2 1 335.495 4.065 20 0 EIADMP FC(F)(F)CC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067232 1049851940 /nfs/dbraw/zinc/85/19/40/1049851940.db2.gz LXXQMCHYXBVDFG-BJWYYQGGSA-N 2 1 326.406 4.114 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccn1)C1CCCCC1)C2 ZINC001172128076 1049852402 /nfs/dbraw/zinc/85/24/02/1049852402.db2.gz NYOIHDNAMMORKP-WKCHPHFGSA-N 2 1 327.516 4.232 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccn1)C1CCCCC1)C2 ZINC001172128076 1049852405 /nfs/dbraw/zinc/85/24/05/1049852405.db2.gz NYOIHDNAMMORKP-WKCHPHFGSA-N 2 1 327.516 4.232 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+](Cc1ccccn1)C1CCCCC1)C2 ZINC001172128076 1049852408 /nfs/dbraw/zinc/85/24/08/1049852408.db2.gz NYOIHDNAMMORKP-WKCHPHFGSA-N 2 1 327.516 4.232 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+](Cc1ccccn1)C1CCCCC1)C2 ZINC001172128076 1049852410 /nfs/dbraw/zinc/85/24/10/1049852410.db2.gz NYOIHDNAMMORKP-WKCHPHFGSA-N 2 1 327.516 4.232 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](CCCCCCO)Cc1ccccc1)C2 ZINC001172127468 1049853292 /nfs/dbraw/zinc/85/32/92/1049853292.db2.gz IYFQZENPRLZLPH-ZBYYUNFXSA-N 2 1 344.543 4.057 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](CCCCCCO)Cc1ccccc1)C2 ZINC001172127468 1049853294 /nfs/dbraw/zinc/85/32/94/1049853294.db2.gz IYFQZENPRLZLPH-ZBYYUNFXSA-N 2 1 344.543 4.057 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+](CCCCCCO)Cc1ccccc1)C2 ZINC001172127468 1049853297 /nfs/dbraw/zinc/85/32/97/1049853297.db2.gz IYFQZENPRLZLPH-ZBYYUNFXSA-N 2 1 344.543 4.057 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+](CCCCCCO)Cc1ccccc1)C2 ZINC001172127468 1049853298 /nfs/dbraw/zinc/85/32/98/1049853298.db2.gz IYFQZENPRLZLPH-ZBYYUNFXSA-N 2 1 344.543 4.057 20 0 EIADMP C[C@H]1OC2(CC[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CC2)c2ccccc21 ZINC001172133961 1049854598 /nfs/dbraw/zinc/85/45/98/1049854598.db2.gz UUGCNAIWIKHFIE-YRXWBPOGSA-N 2 1 340.511 4.084 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(C(=O)c3ccccc3)cc1)C2 ZINC001172101922 1049855928 /nfs/dbraw/zinc/85/59/28/1049855928.db2.gz IFZYVMNGYGQUCZ-KOUNCHBCSA-N 2 1 348.490 4.023 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(c3ccc(F)cc3F)CC1)C2 ZINC001172129480 1049858504 /nfs/dbraw/zinc/85/85/04/1049858504.db2.gz AWGCJPVHDUXAMC-PIIMJCKOSA-N 2 1 334.454 4.160 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(c3ccc(F)cc3F)CC1)C2 ZINC001172129480 1049858507 /nfs/dbraw/zinc/85/85/07/1049858507.db2.gz AWGCJPVHDUXAMC-PIIMJCKOSA-N 2 1 334.454 4.160 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(CC3CC3)CCC(F)(F)CC1)C2 ZINC001172111243 1049858574 /nfs/dbraw/zinc/85/85/74/1049858574.db2.gz OQQAVVWEMQMAEE-BJWYYQGGSA-N 2 1 326.475 4.340 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(CC3CC3)CCC(F)(F)CC1)C2 ZINC001172111243 1049858576 /nfs/dbraw/zinc/85/85/76/1049858576.db2.gz OQQAVVWEMQMAEE-BJWYYQGGSA-N 2 1 326.475 4.340 20 0 EIADMP COc1cccc([C@@H]2CCCC[N@@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172124241 1049859916 /nfs/dbraw/zinc/85/99/16/1049859916.db2.gz JTGJLQZFFFBPMS-PXCRPINLSA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@@H]2CCCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172124241 1049859918 /nfs/dbraw/zinc/85/99/18/1049859918.db2.gz JTGJLQZFFFBPMS-PXCRPINLSA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@@H]2CCCC[NH+]2[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172124241 1049859922 /nfs/dbraw/zinc/85/99/22/1049859922.db2.gz JTGJLQZFFFBPMS-PXCRPINLSA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@@H]2CCCC[NH+]2[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172124241 1049859924 /nfs/dbraw/zinc/85/99/24/1049859924.db2.gz JTGJLQZFFFBPMS-PXCRPINLSA-N 2 1 328.500 4.238 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCc3c(cccc3C(F)(F)F)C1)C2 ZINC001172123533 1049859985 /nfs/dbraw/zinc/85/99/85/1049859985.db2.gz DUVMIJWIKREUOR-ZSHCYNCHSA-N 2 1 338.417 4.079 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCc3c(cccc3C(F)(F)F)C1)C2 ZINC001172123533 1049859988 /nfs/dbraw/zinc/85/99/88/1049859988.db2.gz DUVMIJWIKREUOR-ZSHCYNCHSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCc3c(cccc3C(F)(F)F)C1)C2 ZINC001172123533 1049859996 /nfs/dbraw/zinc/85/99/96/1049859996.db2.gz DUVMIJWIKREUOR-ZSHCYNCHSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCc3c(cccc3C(F)(F)F)C1)C2 ZINC001172123533 1049859997 /nfs/dbraw/zinc/85/99/97/1049859997.db2.gz DUVMIJWIKREUOR-ZSHCYNCHSA-N 2 1 338.417 4.079 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCc3ccc(C(F)(F)F)cc3C1)C2 ZINC001172124216 1049860506 /nfs/dbraw/zinc/86/05/06/1049860506.db2.gz JNQPZJLAOGCIAF-BCDXTJNWSA-N 2 1 338.417 4.079 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCc3ccc(C(F)(F)F)cc3C1)C2 ZINC001172124216 1049860508 /nfs/dbraw/zinc/86/05/08/1049860508.db2.gz JNQPZJLAOGCIAF-BCDXTJNWSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCc3ccc(C(F)(F)F)cc3C1)C2 ZINC001172124216 1049860512 /nfs/dbraw/zinc/86/05/12/1049860512.db2.gz JNQPZJLAOGCIAF-BCDXTJNWSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCc3ccc(C(F)(F)F)cc3C1)C2 ZINC001172124216 1049860515 /nfs/dbraw/zinc/86/05/15/1049860515.db2.gz JNQPZJLAOGCIAF-BCDXTJNWSA-N 2 1 338.417 4.079 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2c(Cl)cccc2C1 ZINC001171031396 1049876201 /nfs/dbraw/zinc/87/62/01/1049876201.db2.gz WLVWRHLVJKGAMS-BZSNNMDCSA-N 2 1 334.935 4.425 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C[C@H]1C ZINC001172375052 1049884828 /nfs/dbraw/zinc/88/48/28/1049884828.db2.gz BSPJXIGMVIFUHO-HMFYCAOWSA-N 2 1 326.528 4.334 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C[C@H]1C ZINC001172375052 1049884832 /nfs/dbraw/zinc/88/48/32/1049884832.db2.gz BSPJXIGMVIFUHO-HMFYCAOWSA-N 2 1 326.528 4.334 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1CCC2(C[C@@H]([N@@H+](C)Cc3ccco3)CO2)CC1 ZINC001172402923 1049899158 /nfs/dbraw/zinc/89/91/58/1049899158.db2.gz PSRIQKLDUMVNBS-RTBURBONSA-N 2 1 348.531 4.160 20 0 EIADMP CC[C@H](CC(C)C)[N@@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001172407118 1049899315 /nfs/dbraw/zinc/89/93/15/1049899315.db2.gz NFRKDORYPSIGFB-PDGJWGCVSA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001172407118 1049899318 /nfs/dbraw/zinc/89/93/18/1049899318.db2.gz NFRKDORYPSIGFB-PDGJWGCVSA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001172407118 1049899321 /nfs/dbraw/zinc/89/93/21/1049899321.db2.gz NFRKDORYPSIGFB-PDGJWGCVSA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001172407118 1049899324 /nfs/dbraw/zinc/89/93/24/1049899324.db2.gz NFRKDORYPSIGFB-PDGJWGCVSA-N 2 1 343.559 4.439 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccccn1 ZINC000246068727 1049901223 /nfs/dbraw/zinc/90/12/23/1049901223.db2.gz ZDBXKPMCAWAMNK-CEXWTWQISA-N 2 1 337.511 4.410 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172455590 1049915819 /nfs/dbraw/zinc/91/58/19/1049915819.db2.gz UJBSFTWZEPADIM-UVUJQTEASA-N 2 1 344.543 4.223 20 0 EIADMP CC[NH+]1CCC([N@H+](C)[C@@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172574763 1049941927 /nfs/dbraw/zinc/94/19/27/1049941927.db2.gz SOMCVNXQKCZVIT-ZDUSSCGKSA-N 2 1 344.877 4.355 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)[C@@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172574763 1049941930 /nfs/dbraw/zinc/94/19/30/1049941930.db2.gz SOMCVNXQKCZVIT-ZDUSSCGKSA-N 2 1 344.877 4.355 20 0 EIADMP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+](C2CCC3(CCCC3)CC2)CC1 ZINC001172729939 1049969202 /nfs/dbraw/zinc/96/92/02/1049969202.db2.gz OHGNATILXHKHMS-HXUWFJFHSA-N 2 1 334.548 4.065 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2C[C@@H](c3ccccc3)C2(C)C)cn1 ZINC000181012249 1049977515 /nfs/dbraw/zinc/97/75/15/1049977515.db2.gz ONYHJGJCUAZPLE-VQTJNVASSA-N 2 1 346.478 4.248 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3OC)cc2)C1 ZINC000246902580 1050005550 /nfs/dbraw/zinc/00/55/50/1050005550.db2.gz FWKAEEXJTUXSQM-MSOLQXFVSA-N 2 1 338.495 4.355 20 0 EIADMP CCOCCC[N@H+]1CC[C@H](N[C@@H](C)c2ccc(Cl)s2)[C@@H](C)C1 ZINC000247088463 1050013386 /nfs/dbraw/zinc/01/33/86/1050013386.db2.gz PGVWWSNWJWBKNV-KKUMJFAQSA-N 2 1 344.952 4.189 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(Cl)s2)[C@@H](C)C1 ZINC000247088463 1050013393 /nfs/dbraw/zinc/01/33/93/1050013393.db2.gz PGVWWSNWJWBKNV-KKUMJFAQSA-N 2 1 344.952 4.189 20 0 EIADMP C[C@@H]1C[C@@H](N[C@H](COc2ccccc2F)c2ccccc2)CC[N@H+]1C ZINC000247161612 1050016558 /nfs/dbraw/zinc/01/65/58/1050016558.db2.gz XUHMXRLUOFNMBL-IMFGXOCKSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](COc2ccccc2F)c2ccccc2)CCN1C ZINC000247161612 1050016560 /nfs/dbraw/zinc/01/65/60/1050016560.db2.gz XUHMXRLUOFNMBL-IMFGXOCKSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccncc1 ZINC000247396946 1050023304 /nfs/dbraw/zinc/02/33/04/1050023304.db2.gz HHOBQLUNJLYZFJ-CEXWTWQISA-N 2 1 337.511 4.410 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000249163589 1050093662 /nfs/dbraw/zinc/09/36/62/1050093662.db2.gz ZXQGROWEKLXDSQ-KURKYZTESA-N 2 1 340.433 4.219 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)CCCS2 ZINC000249181285 1050094317 /nfs/dbraw/zinc/09/43/17/1050094317.db2.gz IIFXFDGMSHGQPO-LPHOPBHVSA-N 2 1 348.556 4.332 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1cccc(O)c1 ZINC000249588563 1050102635 /nfs/dbraw/zinc/10/26/35/1050102635.db2.gz OSRRLZCQGGDWCB-ZWKOTPCHSA-N 2 1 338.495 4.475 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc3ccccc3)C1)CC2 ZINC001172825425 1050166288 /nfs/dbraw/zinc/16/62/88/1050166288.db2.gz GXKYYGRURNLFIJ-ZJSXRUAMSA-N 2 1 348.534 4.354 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)[C@@H](C)C1)CC2 ZINC001172825364 1050166709 /nfs/dbraw/zinc/16/67/09/1050166709.db2.gz GLUVZEQILGDFHR-IEXUWNMDSA-N 2 1 348.534 4.495 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)[C@@H](C)C1)CC2 ZINC001172825364 1050166711 /nfs/dbraw/zinc/16/67/11/1050166711.db2.gz GLUVZEQILGDFHR-IEXUWNMDSA-N 2 1 348.534 4.495 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828153 1050166930 /nfs/dbraw/zinc/16/69/30/1050166930.db2.gz IPRRGCNJDTXLJH-CEMLEFRQSA-N 2 1 326.528 4.367 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH+]1CCC([N@@H+](C)Cc3ccccc3)CC1)CC2 ZINC001172830117 1050169611 /nfs/dbraw/zinc/16/96/11/1050169611.db2.gz FXDFQFUCNCRAFF-DEOSSOPVSA-N 2 1 348.534 4.449 20 0 EIADMP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC001172876081 1050216016 /nfs/dbraw/zinc/21/60/16/1050216016.db2.gz VZSSATJYUCOIDV-GJZGRUSLSA-N 2 1 326.937 4.142 20 0 EIADMP CO[C@H]1CCC[C@@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001172922263 1050236883 /nfs/dbraw/zinc/23/68/83/1050236883.db2.gz GMXLSBDRIXULET-OKDVXBPUSA-N 2 1 342.527 4.072 20 0 EIADMP CCCOC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001173092097 1050285904 /nfs/dbraw/zinc/28/59/04/1050285904.db2.gz IVVUORPUCJZCFT-YOLZPYMBSA-N 2 1 344.543 4.367 20 0 EIADMP CCCOC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001173092097 1050285910 /nfs/dbraw/zinc/28/59/10/1050285910.db2.gz IVVUORPUCJZCFT-YOLZPYMBSA-N 2 1 344.543 4.367 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000252696001 1050289424 /nfs/dbraw/zinc/28/94/24/1050289424.db2.gz BAMQUSNITUXUDE-UHOSZYNNSA-N 2 1 328.525 4.413 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000252696001 1050289437 /nfs/dbraw/zinc/28/94/37/1050289437.db2.gz BAMQUSNITUXUDE-UHOSZYNNSA-N 2 1 328.525 4.413 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H]2c2ccccc2OC)CC1 ZINC001173112660 1050309346 /nfs/dbraw/zinc/30/93/46/1050309346.db2.gz YVGOCGWRCCWNSL-QLOJAFMTSA-N 2 1 330.516 4.485 20 0 EIADMP c1cncc(-c2cccc(C[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)c2)c1 ZINC000092066483 1050314237 /nfs/dbraw/zinc/31/42/37/1050314237.db2.gz VJURAIARAHDNKP-GGAORHGYSA-N 2 1 347.506 4.197 20 0 EIADMP c1cncc(-c2cccc(C[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)c2)c1 ZINC000092066483 1050314248 /nfs/dbraw/zinc/31/42/48/1050314248.db2.gz VJURAIARAHDNKP-GGAORHGYSA-N 2 1 347.506 4.197 20 0 EIADMP c1cncc(-c2cccc(C[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2)c1 ZINC000092066483 1050314263 /nfs/dbraw/zinc/31/42/63/1050314263.db2.gz VJURAIARAHDNKP-GGAORHGYSA-N 2 1 347.506 4.197 20 0 EIADMP C[C@@H]1CCCC[C@@H]1CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001177860134 1050318164 /nfs/dbraw/zinc/31/81/64/1050318164.db2.gz RMLREGNFDYWCCW-TZIWHRDSSA-N 2 1 328.544 4.500 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(F)cc2F)[C@H]1c1cccs1 ZINC001177920847 1050328510 /nfs/dbraw/zinc/32/85/10/1050328510.db2.gz XGGLHODVPQTFAY-KDOFPFPSSA-N 2 1 336.451 4.199 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(F)cc2F)[C@H]1c1cccs1 ZINC001177920847 1050328519 /nfs/dbraw/zinc/32/85/19/1050328519.db2.gz XGGLHODVPQTFAY-KDOFPFPSSA-N 2 1 336.451 4.199 20 0 EIADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c(C)c1 ZINC001177920120 1050328540 /nfs/dbraw/zinc/32/85/40/1050328540.db2.gz QOWRSFDKPXFVTA-YLJYHZDGSA-N 2 1 344.524 4.238 20 0 EIADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c(C)c1 ZINC001177920120 1050328552 /nfs/dbraw/zinc/32/85/52/1050328552.db2.gz QOWRSFDKPXFVTA-YLJYHZDGSA-N 2 1 344.524 4.238 20 0 EIADMP Cc1nn(C(C)C)c(C)c1C[NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1 ZINC001177961733 1050332706 /nfs/dbraw/zinc/33/27/06/1050332706.db2.gz MDTBJYKDVBKIIJ-KRWDZBQOSA-N 2 1 342.531 4.081 20 0 EIADMP Cc1nn(C(C)C)c(C)c1C[NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC001177961733 1050332719 /nfs/dbraw/zinc/33/27/19/1050332719.db2.gz MDTBJYKDVBKIIJ-KRWDZBQOSA-N 2 1 342.531 4.081 20 0 EIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2cccc(OC)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173271849 1050392277 /nfs/dbraw/zinc/39/22/77/1050392277.db2.gz RMIPXAIPMTYXTP-LEAZDLGRSA-N 2 1 330.516 4.346 20 0 EIADMP CCSC[C@H](C)[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001173299051 1050400908 /nfs/dbraw/zinc/40/09/08/1050400908.db2.gz AIIGQEFRPFWKIF-WMZOPIPTSA-N 2 1 336.545 4.098 20 0 EIADMP CCSC[C@H](C)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001173306369 1050404249 /nfs/dbraw/zinc/40/42/49/1050404249.db2.gz TYUONFRNQPHAMP-SFHVURJKSA-N 2 1 332.557 4.116 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2ccc(F)cc2F)C[N@H+]1Cc1ccccc1 ZINC001178207951 1050404568 /nfs/dbraw/zinc/40/45/68/1050404568.db2.gz JKLCUJDGELSWEZ-FUHWJXTLSA-N 2 1 344.449 4.355 20 0 EIADMP CC[C@H]1CC[C@@H]([NH+]2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)C1 ZINC001173278991 1050408456 /nfs/dbraw/zinc/40/84/56/1050408456.db2.gz NVMAZKALAOKVRT-AZUAARDMSA-N 2 1 341.543 4.337 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2ccoc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001178330262 1050437474 /nfs/dbraw/zinc/43/74/74/1050437474.db2.gz ALMSVPXXIXCOGO-DYESRHJHSA-N 2 1 334.463 4.433 20 0 EIADMP Cc1cc(N2CC[NH+](Cc3ccccc3F)CC2)c2ccccc2[nH+]1 ZINC001203345944 1050448509 /nfs/dbraw/zinc/44/85/09/1050448509.db2.gz DNKNWZAORZRYJX-UHFFFAOYSA-N 2 1 335.426 4.005 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCSc4ccccc43)C2)cc1 ZINC000253355641 1050454936 /nfs/dbraw/zinc/45/49/36/1050454936.db2.gz UIUPMCIFKFYCKM-QUCCMNQESA-N 2 1 338.520 4.335 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001178457724 1050475566 /nfs/dbraw/zinc/47/55/66/1050475566.db2.gz CGLPVPRKQIHJMJ-MJGOQNOKSA-N 2 1 330.516 4.216 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CCC([NH+]2CCC2)CC1 ZINC001173549015 1050485624 /nfs/dbraw/zinc/48/56/24/1050485624.db2.gz FYMUYMCFUNQZPP-AWEZNQCLSA-N 2 1 341.326 4.485 20 0 EIADMP CC(C)(C[N@@H+]1CCCC[C@](F)(CN)C1)Sc1ccc(Cl)cc1 ZINC001206337665 1050520716 /nfs/dbraw/zinc/52/07/16/1050520716.db2.gz VEAVUEQQAIAQRI-KRWDZBQOSA-N 2 1 344.927 4.364 20 0 EIADMP CC(C)(C[N@H+]1CCCC[C@](F)(CN)C1)Sc1ccc(Cl)cc1 ZINC001206337665 1050520726 /nfs/dbraw/zinc/52/07/26/1050520726.db2.gz VEAVUEQQAIAQRI-KRWDZBQOSA-N 2 1 344.927 4.364 20 0 EIADMP c1c2cnccc2oc1C[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC001178868878 1050574479 /nfs/dbraw/zinc/57/44/79/1050574479.db2.gz XXYNSPUPDNLXDR-IBGZPJMESA-N 2 1 349.478 4.220 20 0 EIADMP c1c2cnccc2oc1C[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC001178868878 1050574501 /nfs/dbraw/zinc/57/45/01/1050574501.db2.gz XXYNSPUPDNLXDR-IBGZPJMESA-N 2 1 349.478 4.220 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3nc(Cl)ccc3s2)C[C@@H]1C ZINC001204236525 1050614830 /nfs/dbraw/zinc/61/48/30/1050614830.db2.gz HVJZJFPMJRXJAF-QWHCGFSZSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc3nc(Cl)ccc3s2)C[C@@H]1C ZINC001204236525 1050614836 /nfs/dbraw/zinc/61/48/36/1050614836.db2.gz HVJZJFPMJRXJAF-QWHCGFSZSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc3nc(Cl)ccc3s2)C[C@@H]1C ZINC001204236525 1050614841 /nfs/dbraw/zinc/61/48/41/1050614841.db2.gz HVJZJFPMJRXJAF-QWHCGFSZSA-N 2 1 337.920 4.254 20 0 EIADMP CC[N@H+](CCC[NH2+]Cc1ccc(OC)c(Cl)c1)C1CCCCC1 ZINC001179090927 1050628327 /nfs/dbraw/zinc/62/83/27/1050628327.db2.gz KBFQAXWMXLHXDZ-UHFFFAOYSA-N 2 1 338.923 4.483 20 0 EIADMP CC[N@@H+](CCC[NH2+]Cc1ccc(OC)c(Cl)c1)C1CCCCC1 ZINC001179090927 1050628335 /nfs/dbraw/zinc/62/83/35/1050628335.db2.gz KBFQAXWMXLHXDZ-UHFFFAOYSA-N 2 1 338.923 4.483 20 0 EIADMP CC[N@@H+](CCC[NH2+][C@@H]1CCc2ccc(OC)cc2C1)C1CCCCC1 ZINC001179090990 1050630129 /nfs/dbraw/zinc/63/01/29/1050630129.db2.gz MVLUQULHJWRAJG-HXUWFJFHSA-N 2 1 344.543 4.187 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)C1CCCC1 ZINC001180301651 1050943979 /nfs/dbraw/zinc/94/39/79/1050943979.db2.gz OUDFYHZMGVUPNG-AGOPTVSRSA-N 2 1 326.528 4.455 20 0 EIADMP CC[C@@H]1C[N@H+](C[C@@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)CCO1 ZINC001180540011 1051027887 /nfs/dbraw/zinc/02/78/87/1051027887.db2.gz FKTXUWFYFRVGHF-IFMALSPDSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@@H]1C[N@@H+](C[C@@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)CCO1 ZINC001180540011 1051027898 /nfs/dbraw/zinc/02/78/98/1051027898.db2.gz FKTXUWFYFRVGHF-IFMALSPDSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@@H]1C[NH+](C[C@@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)CCO1 ZINC001180540011 1051027906 /nfs/dbraw/zinc/02/79/06/1051027906.db2.gz FKTXUWFYFRVGHF-IFMALSPDSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@@H]1C[NH+](C[C@@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC001180540011 1051027912 /nfs/dbraw/zinc/02/79/12/1051027912.db2.gz FKTXUWFYFRVGHF-IFMALSPDSA-N 2 1 344.543 4.036 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cnccc2C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000414224367 1051179164 /nfs/dbraw/zinc/17/91/64/1051179164.db2.gz HQAQWGWHPLIZSP-TZIWHRDSSA-N 2 1 337.511 4.304 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2cnccc2C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000414224367 1051179172 /nfs/dbraw/zinc/17/91/72/1051179172.db2.gz HQAQWGWHPLIZSP-TZIWHRDSSA-N 2 1 337.511 4.304 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775388774 1051187993 /nfs/dbraw/zinc/18/79/93/1051187993.db2.gz TVIZAXSSTPSNNB-DYVFJYSZSA-N 2 1 340.483 4.310 20 0 EIADMP C[C@@H](CCOCc1ccccc1)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001181276820 1051196467 /nfs/dbraw/zinc/19/64/67/1051196467.db2.gz RQKBHDJMIWVGDA-UGKGYDQZSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC[N@@H+]1C ZINC000775393149 1051199917 /nfs/dbraw/zinc/19/99/17/1051199917.db2.gz LNHQCZMULJIFDY-SUYBPPKGSA-N 2 1 340.483 4.451 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC[N@H+]1C ZINC000775393149 1051199927 /nfs/dbraw/zinc/19/99/27/1051199927.db2.gz LNHQCZMULJIFDY-SUYBPPKGSA-N 2 1 340.483 4.451 20 0 EIADMP CCSc1cccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC001181488183 1051237805 /nfs/dbraw/zinc/23/78/05/1051237805.db2.gz SAOJGASRSIKKQU-UHFFFAOYSA-N 2 1 328.525 4.492 20 0 EIADMP Cc1cccc(CCC[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC001190651646 1051245237 /nfs/dbraw/zinc/24/52/37/1051245237.db2.gz OVXCPYRRULLHRW-QFIPXVFZSA-N 2 1 328.544 4.372 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2cc[nH]c2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311009196 1051453604 /nfs/dbraw/zinc/45/36/04/1051453604.db2.gz WXUZODRPQNQOLU-UTKZUKDTSA-N 2 1 333.479 4.168 20 0 EIADMP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311188771 1051470730 /nfs/dbraw/zinc/47/07/30/1051470730.db2.gz DJWVWNJTRNVTPU-ICSRJNTNSA-N 2 1 338.495 4.176 20 0 EIADMP CC1(C)C(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1(C)C ZINC000716674267 1051500306 /nfs/dbraw/zinc/50/03/06/1051500306.db2.gz XAOUHSXPEYKUCH-OTWHNJEPSA-N 2 1 326.528 4.311 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000775490375 1051574578 /nfs/dbraw/zinc/57/45/78/1051574578.db2.gz WQDSGNOVRIZTMU-LVCYWYKZSA-N 2 1 340.486 4.429 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)c(C(F)(F)F)c1 ZINC000157679495 1051663521 /nfs/dbraw/zinc/66/35/21/1051663521.db2.gz DXFIXBGARPDTJK-HIFRSBDPSA-N 2 1 344.421 4.065 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)c(C(F)(F)F)c1 ZINC000157679495 1051663529 /nfs/dbraw/zinc/66/35/29/1051663529.db2.gz DXFIXBGARPDTJK-HIFRSBDPSA-N 2 1 344.421 4.065 20 0 EIADMP C[C@@H]1SCC[C@@H]1[NH2+]C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001182726495 1051689037 /nfs/dbraw/zinc/68/90/37/1051689037.db2.gz UBWVZDNFWOZPGK-HFSMHLIXSA-N 2 1 346.584 4.408 20 0 EIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC001206541392 1051709496 /nfs/dbraw/zinc/70/94/96/1051709496.db2.gz HAVZFMFMTAXHHW-KRWDZBQOSA-N 2 1 328.422 4.089 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NC[C@H]2CC[N@H+]2C2CCCCC2)CC1 ZINC001182918238 1051746622 /nfs/dbraw/zinc/74/66/22/1051746622.db2.gz KMLSZNISQLRKIH-QIJUGHKUSA-N 2 1 347.591 4.026 20 0 EIADMP C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001183093923 1051785325 /nfs/dbraw/zinc/78/53/25/1051785325.db2.gz HAORXWSGVHPCMQ-AZUAARDMSA-N 2 1 328.544 4.454 20 0 EIADMP C[C@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001183095482 1051787286 /nfs/dbraw/zinc/78/72/86/1051787286.db2.gz QFQVCZGBMOYIHX-IEBWSBKVSA-N 2 1 339.527 4.201 20 0 EIADMP CC1([NH+]2CCCC2)CC[NH+](Cc2cccc(CC3CCC3)c2)CC1 ZINC001183226945 1051807997 /nfs/dbraw/zinc/80/79/97/1051807997.db2.gz MFBKDSZHXQOWHJ-UHFFFAOYSA-N 2 1 326.528 4.480 20 0 EIADMP C[N@@H+](CC[C@@H]1C[C@H]1C1CC1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001192909092 1051830148 /nfs/dbraw/zinc/83/01/48/1051830148.db2.gz CGGWBGDBGTWDSF-CTNGQTDRSA-N 2 1 327.516 4.056 20 0 EIADMP CCc1ccccc1CC[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175972355 1051855081 /nfs/dbraw/zinc/85/50/81/1051855081.db2.gz AOJOUIMBHCXRFA-BJKOFHAPSA-N 2 1 348.534 4.245 20 0 EIADMP CCc1ccccc1CC[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175972355 1051855087 /nfs/dbraw/zinc/85/50/87/1051855087.db2.gz AOJOUIMBHCXRFA-BJKOFHAPSA-N 2 1 348.534 4.245 20 0 EIADMP CCc1ccccc1CC[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175972355 1051855090 /nfs/dbraw/zinc/85/50/90/1051855090.db2.gz AOJOUIMBHCXRFA-BJKOFHAPSA-N 2 1 348.534 4.245 20 0 EIADMP C[C@@H](CC(C)(C)c1ccccc1)[NH2+][C@H](CC[NH+](C)C)c1cccnc1 ZINC001183919774 1051928585 /nfs/dbraw/zinc/92/85/85/1051928585.db2.gz PKMRJJOYQIAOBX-GHTZIAJQSA-N 2 1 339.527 4.420 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)CC[N@@H+]1C ZINC000621765809 1051942613 /nfs/dbraw/zinc/94/26/13/1051942613.db2.gz FNJAWHFVKXRYNS-BBRMVZONSA-N 2 1 326.406 4.157 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)CC[N@H+]1C ZINC000621765809 1051942619 /nfs/dbraw/zinc/94/26/19/1051942619.db2.gz FNJAWHFVKXRYNS-BBRMVZONSA-N 2 1 326.406 4.157 20 0 EIADMP CCc1ccc(CC[N@@H+]2C[C@@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001176261399 1051987771 /nfs/dbraw/zinc/98/77/71/1051987771.db2.gz AAJRVHWDSYQMEN-RPWUZVMVSA-N 2 1 348.534 4.245 20 0 EIADMP CCc1ccc(CC[NH+]2C[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001176261399 1051987773 /nfs/dbraw/zinc/98/77/73/1051987773.db2.gz AAJRVHWDSYQMEN-RPWUZVMVSA-N 2 1 348.534 4.245 20 0 EIADMP CCc1ccc(CC[NH+]2C[C@@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001176261399 1051987779 /nfs/dbraw/zinc/98/77/79/1051987779.db2.gz AAJRVHWDSYQMEN-RPWUZVMVSA-N 2 1 348.534 4.245 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3cc4ccccc4o3)CC2)[nH+]c1 ZINC000163534729 1051995845 /nfs/dbraw/zinc/99/58/45/1051995845.db2.gz NWKYBLMVBGUGJL-INIZCTEOSA-N 2 1 335.451 4.456 20 0 EIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](C)C[C@@H]12 ZINC001184386273 1052001496 /nfs/dbraw/zinc/00/14/96/1052001496.db2.gz AMWFWTLGJPVKGC-ULLYJBBUSA-N 2 1 334.507 4.214 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+](Cc1ccccc1)Cc1ccccc1)c1cn[nH]c1 ZINC000340544294 1052568790 /nfs/dbraw/zinc/56/87/90/1052568790.db2.gz UKHCDJKGTVHCIE-LJQANCHMSA-N 2 1 348.494 4.153 20 0 EIADMP c1cc(C[NH2+]CCC[NH+](Cc2ccccc2)Cc2ccccc2)c[nH]1 ZINC000344773582 1052618049 /nfs/dbraw/zinc/61/80/49/1052618049.db2.gz OQMIDGTWNGQCIG-UHFFFAOYSA-N 2 1 333.479 4.197 20 0 EIADMP COc1cc([C@@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348637 1052629302 /nfs/dbraw/zinc/62/93/02/1052629302.db2.gz FIHOIIMJFARUEN-SJLPKXTDSA-N 2 1 348.531 4.253 20 0 EIADMP COc1cc([C@@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348637 1052629309 /nfs/dbraw/zinc/62/93/09/1052629309.db2.gz FIHOIIMJFARUEN-SJLPKXTDSA-N 2 1 348.531 4.253 20 0 EIADMP C[C@@H](C[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000623503875 1052668184 /nfs/dbraw/zinc/66/81/84/1052668184.db2.gz RFACSZBYBDEXGN-BBRMVZONSA-N 2 1 328.422 4.271 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000623503876 1052668312 /nfs/dbraw/zinc/66/83/12/1052668312.db2.gz RFACSZBYBDEXGN-CJNGLKHVSA-N 2 1 328.422 4.271 20 0 EIADMP C[N@H+]1CC[C@@H](NC2(c3ccc(OC(F)(F)F)cc3)CC2)CC1(C)C ZINC000623535394 1052674811 /nfs/dbraw/zinc/67/48/11/1052674811.db2.gz YFRSYEDGFSVFOB-CQSZACIVSA-N 2 1 342.405 4.037 20 0 EIADMP CN1CC[C@@H]([NH2+]C2(c3ccc(OC(F)(F)F)cc3)CC2)CC1(C)C ZINC000623535394 1052674812 /nfs/dbraw/zinc/67/48/12/1052674812.db2.gz YFRSYEDGFSVFOB-CQSZACIVSA-N 2 1 342.405 4.037 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]C2(c3ccc(OC(F)(F)F)cc3)CC2)CC1(C)C ZINC000623535394 1052674814 /nfs/dbraw/zinc/67/48/14/1052674814.db2.gz YFRSYEDGFSVFOB-CQSZACIVSA-N 2 1 342.405 4.037 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]C2(c3ccc(OC(F)(F)F)cc3)CC2)CC1(C)C ZINC000623535394 1052674816 /nfs/dbraw/zinc/67/48/16/1052674816.db2.gz YFRSYEDGFSVFOB-CQSZACIVSA-N 2 1 342.405 4.037 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)ccc1OCCC(C)C ZINC000177901157 1052693477 /nfs/dbraw/zinc/69/34/77/1052693477.db2.gz NSRHRRAVZVMZRL-LNLFQRSKSA-N 2 1 348.531 4.253 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1OCCC(C)C ZINC000177901157 1052693478 /nfs/dbraw/zinc/69/34/78/1052693478.db2.gz NSRHRRAVZVMZRL-LNLFQRSKSA-N 2 1 348.531 4.253 20 0 EIADMP CO[C@H](C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccccc1 ZINC000178458202 1052705891 /nfs/dbraw/zinc/70/58/91/1052705891.db2.gz YHSQQJFIAILUPY-IIBYNOLFSA-N 2 1 335.451 4.219 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000178707734 1052711092 /nfs/dbraw/zinc/71/10/92/1052711092.db2.gz RFLTZDHNXCPGFC-STQMWFEESA-N 2 1 341.377 4.077 20 0 EIADMP Cc1ccc(Br)cc1[C@H](C)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000623866014 1052825813 /nfs/dbraw/zinc/82/58/13/1052825813.db2.gz IJSORYRKXMLZGK-BPUTZDHNSA-N 2 1 337.305 4.035 20 0 EIADMP c1nc2c(s1)CCC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000623855160 1052826823 /nfs/dbraw/zinc/82/68/23/1052826823.db2.gz RORAFDHNNXFPFG-SFHVURJKSA-N 2 1 341.524 4.296 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(F)cc1C(F)(F)F ZINC000623898787 1052831385 /nfs/dbraw/zinc/83/13/85/1052831385.db2.gz QYZRCDPQSBOWRL-GFCCVEGCSA-N 2 1 343.368 4.480 20 0 EIADMP Cc1ccc(Br)cc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000623996146 1052849167 /nfs/dbraw/zinc/84/91/67/1052849167.db2.gz VBDZNAGGGPLBGI-WWTUQBGBSA-N 2 1 337.305 4.033 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000624125008 1052868131 /nfs/dbraw/zinc/86/81/31/1052868131.db2.gz QUOXXPWTDWFLTH-STQMWFEESA-N 2 1 332.385 4.227 20 0 EIADMP Cc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c2ccccc2n1 ZINC000185694700 1053020549 /nfs/dbraw/zinc/02/05/49/1053020549.db2.gz MEMZAHOUNBGOPK-ZWKOTPCHSA-N 2 1 337.511 4.286 20 0 EIADMP C[C@@H]([NH2+]CCSc1ccccc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185706708 1053021060 /nfs/dbraw/zinc/02/10/60/1053021060.db2.gz JJEFSPWWSXWCRU-CVEARBPZSA-N 2 1 336.520 4.160 20 0 EIADMP Cc1cc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)s1 ZINC000381862460 1053107283 /nfs/dbraw/zinc/10/72/83/1053107283.db2.gz JAUMRKJKSPTQCJ-APWZRJJASA-N 2 1 328.525 4.365 20 0 EIADMP C[C@H]([NH2+]Cc1cc(Cl)cs1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382062854 1053137967 /nfs/dbraw/zinc/13/79/67/1053137967.db2.gz PYXCHVBJSWHZOZ-HOCLYGCPSA-N 2 1 334.916 4.402 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@H]3CCCC34CC4)cc2)CC1 ZINC000850456713 1053233204 /nfs/dbraw/zinc/23/32/04/1053233204.db2.gz HBVFDEPZLGRXMJ-FQEVSTJZSA-N 2 1 327.516 4.209 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cnn(-c2ccccc2)c1 ZINC000764960055 1053398331 /nfs/dbraw/zinc/39/83/31/1053398331.db2.gz CBYBRKQUXZKJQA-OALUTQOASA-N 2 1 340.515 4.035 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cnn(-c2ccccc2)c1 ZINC000764960057 1053399636 /nfs/dbraw/zinc/39/96/36/1053399636.db2.gz CBYBRKQUXZKJQA-RTBURBONSA-N 2 1 340.515 4.035 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)cs1 ZINC000339072188 1053476175 /nfs/dbraw/zinc/47/61/75/1053476175.db2.gz UQOGSYJIWKPCHE-ZOCIIQOWSA-N 2 1 341.524 4.396 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)[C@H](C)C2CCCCC2)cn1 ZINC000765248636 1053476143 /nfs/dbraw/zinc/47/61/43/1053476143.db2.gz AAGHCYDNCMHEII-HOTGVXAUSA-N 2 1 326.488 4.270 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](CC2CC2)c2ccccc2)cn1 ZINC000765250261 1053476380 /nfs/dbraw/zinc/47/63/80/1053476380.db2.gz IGDMJTYOZAWZDG-HXUWFJFHSA-N 2 1 332.451 4.207 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cnn(-c3ccccc3)c2C)CC1 ZINC000765438973 1053547221 /nfs/dbraw/zinc/54/72/21/1053547221.db2.gz JJYSDSDOWNMLMV-KRWDZBQOSA-N 2 1 340.515 4.096 20 0 EIADMP Fc1cccc2c1SCC[C@H]2[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000853239139 1053655611 /nfs/dbraw/zinc/65/56/11/1053655611.db2.gz ATHQDANHRUPJMJ-CRAIPNDOSA-N 2 1 334.504 4.074 20 0 EIADMP Fc1cccc2c1SCC[C@H]2[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000853239139 1053655614 /nfs/dbraw/zinc/65/56/14/1053655614.db2.gz ATHQDANHRUPJMJ-CRAIPNDOSA-N 2 1 334.504 4.074 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CCc2cccnc2)c1 ZINC000866245829 1053663092 /nfs/dbraw/zinc/66/30/92/1053663092.db2.gz BZVOZIGAEMGIFF-GOSISDBHSA-N 2 1 325.500 4.033 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000866272390 1053673180 /nfs/dbraw/zinc/67/31/80/1053673180.db2.gz NQVWOWRJHZLXCP-YVWKXTFCSA-N 2 1 343.540 4.137 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000866272390 1053673184 /nfs/dbraw/zinc/67/31/84/1053673184.db2.gz NQVWOWRJHZLXCP-YVWKXTFCSA-N 2 1 343.540 4.137 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000866281407 1053676886 /nfs/dbraw/zinc/67/68/86/1053676886.db2.gz HTYBNRFKIZIFIF-XQBPLPMBSA-N 2 1 337.511 4.045 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000866281407 1053676894 /nfs/dbraw/zinc/67/68/94/1053676894.db2.gz HTYBNRFKIZIFIF-XQBPLPMBSA-N 2 1 337.511 4.045 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc2c(ccnc2Cl)o1 ZINC000866392355 1053713879 /nfs/dbraw/zinc/71/38/79/1053713879.db2.gz AQFMHBJZWQCBQR-ZFWWWQNUSA-N 2 1 347.890 4.254 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc2c(ccnc2Cl)o1 ZINC000866392355 1053713893 /nfs/dbraw/zinc/71/38/93/1053713893.db2.gz AQFMHBJZWQCBQR-ZFWWWQNUSA-N 2 1 347.890 4.254 20 0 EIADMP FC(F)(F)c1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000386455769 1053731257 /nfs/dbraw/zinc/73/12/57/1053731257.db2.gz RYUZVZIOURDVMB-GOSISDBHSA-N 2 1 348.412 4.317 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C2CCC2)[C@H]2CCOC2)cc1 ZINC000866512140 1053762955 /nfs/dbraw/zinc/76/29/55/1053762955.db2.gz ZXSBEFWVDQTWPR-ZRCAFCQKSA-N 2 1 339.483 4.037 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386612536 1053802313 /nfs/dbraw/zinc/80/23/13/1053802313.db2.gz KQHGRCAASPCOBQ-QUCCMNQESA-N 2 1 338.495 4.004 20 0 EIADMP Cc1ccccc1OCCC[N@@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001196936794 1053808925 /nfs/dbraw/zinc/80/89/25/1053808925.db2.gz URXHYNOHPVLKGT-NRFANRHFSA-N 2 1 344.543 4.350 20 0 EIADMP CCC(C)(C)CC[N@H+]1CC[C@@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856599656 1054091934 /nfs/dbraw/zinc/09/19/34/1054091934.db2.gz MPWIMWCBAVISCC-HXUWFJFHSA-N 2 1 347.547 4.201 20 0 EIADMP CCC(C)(C)CC[NH+]1CC[C@@H](Oc2ccnc(C[N@H+](C)C(C)C)c2)C1 ZINC000856599656 1054091948 /nfs/dbraw/zinc/09/19/48/1054091948.db2.gz MPWIMWCBAVISCC-HXUWFJFHSA-N 2 1 347.547 4.201 20 0 EIADMP CCC(C)(C)CC[NH+]1CC[C@@H](Oc2ccnc(C[N@@H+](C)C(C)C)c2)C1 ZINC000856599656 1054091961 /nfs/dbraw/zinc/09/19/61/1054091961.db2.gz MPWIMWCBAVISCC-HXUWFJFHSA-N 2 1 347.547 4.201 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc2ccccc21 ZINC001198450231 1054146595 /nfs/dbraw/zinc/14/65/95/1054146595.db2.gz MFZWNNHUOWFXDQ-INIZCTEOSA-N 2 1 337.467 4.484 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc2ccccc21 ZINC001198450234 1054147410 /nfs/dbraw/zinc/14/74/10/1054147410.db2.gz MFZWNNHUOWFXDQ-MRXNPFEDSA-N 2 1 337.467 4.484 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccn(C)n1 ZINC000542670289 1054188253 /nfs/dbraw/zinc/18/82/53/1054188253.db2.gz JBWULFXDOAPWJE-FXAWDEMLSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1ccn(C)n1 ZINC000542670289 1054188261 /nfs/dbraw/zinc/18/82/61/1054188261.db2.gz JBWULFXDOAPWJE-FXAWDEMLSA-N 2 1 340.515 4.035 20 0 EIADMP CCCc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC001199118234 1054352940 /nfs/dbraw/zinc/35/29/40/1054352940.db2.gz KDXNJDGMASLHGS-UHFFFAOYSA-N 2 1 336.523 4.436 20 0 EIADMP C[N@@H+](CCCCCC[NH3+])Cc1nc(-c2c(F)cccc2F)cs1 ZINC000872155565 1054412921 /nfs/dbraw/zinc/41/29/21/1054412921.db2.gz QEFHZCSVXNHWKA-UHFFFAOYSA-N 2 1 339.455 4.039 20 0 EIADMP CC[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCO1 ZINC001199630291 1054435052 /nfs/dbraw/zinc/43/50/52/1054435052.db2.gz VKTKJEHVTOKXOB-RBBKRZOGSA-N 2 1 344.543 4.498 20 0 EIADMP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1F ZINC000873262118 1054517916 /nfs/dbraw/zinc/51/79/16/1054517916.db2.gz JZUQKTRCXUEAGL-VIFPVBQESA-N 2 1 342.245 4.145 20 0 EIADMP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H](C)c1ccc(C(F)(F)F)nc1 ZINC000873297503 1054525190 /nfs/dbraw/zinc/52/51/90/1054525190.db2.gz XSGMZSVDXOPNFI-YDHLFZDLSA-N 2 1 329.410 4.062 20 0 EIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(C)nc1Cl ZINC000859996424 1054757593 /nfs/dbraw/zinc/75/75/93/1054757593.db2.gz BKXIFHLWNJMDDY-UHFFFAOYSA-N 2 1 331.891 4.127 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(C)nc1Cl ZINC000859996424 1054757607 /nfs/dbraw/zinc/75/76/07/1054757607.db2.gz BKXIFHLWNJMDDY-UHFFFAOYSA-N 2 1 331.891 4.127 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2cccc(F)c2)C[N@H+]1Cc1ccccc1 ZINC001201492556 1054818363 /nfs/dbraw/zinc/81/83/63/1054818363.db2.gz RJRIQKQDHLBWOC-XLIONFOSSA-N 2 1 326.459 4.216 20 0 EIADMP CCCC[C@@H](CC)C[NH+]1CCC2(CCC[N@H+]2Cc2cnn(C)c2)CC1 ZINC001201559547 1054848756 /nfs/dbraw/zinc/84/87/56/1054848756.db2.gz LFXAUYRXHMMPPZ-LJQANCHMSA-N 2 1 346.563 4.067 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)s1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201947391 1054962246 /nfs/dbraw/zinc/96/22/46/1054962246.db2.gz XFXBOSZVEYFKHJ-CABCVRRESA-N 2 1 335.561 4.183 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)s1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001201947391 1054962260 /nfs/dbraw/zinc/96/22/60/1054962260.db2.gz XFXBOSZVEYFKHJ-CABCVRRESA-N 2 1 335.561 4.183 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cccc(Br)c1 ZINC000173441701 1055004137 /nfs/dbraw/zinc/00/41/37/1055004137.db2.gz YOHPXMNOBYVRNM-CYBMUJFWSA-N 2 1 336.277 4.085 20 0 EIADMP COc1ccc(C2(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCCCC2)cc1 ZINC000166311092 1055045311 /nfs/dbraw/zinc/04/53/11/1055045311.db2.gz IODYYAFGDVXJHP-VQTJNVASSA-N 2 1 342.527 4.114 20 0 EIADMP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC000877733349 1055112079 /nfs/dbraw/zinc/11/20/79/1055112079.db2.gz RYCIXAVCMBNNNL-QSAZIKIQSA-N 2 1 344.480 4.096 20 0 EIADMP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC000877733349 1055112083 /nfs/dbraw/zinc/11/20/83/1055112083.db2.gz RYCIXAVCMBNNNL-QSAZIKIQSA-N 2 1 344.480 4.096 20 0 EIADMP FC(F)(F)CCC[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001202444050 1055176398 /nfs/dbraw/zinc/17/63/98/1055176398.db2.gz COAPXRUNKSPPMH-ROUUACIJSA-N 2 1 340.433 4.173 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001202444050 1055176403 /nfs/dbraw/zinc/17/64/03/1055176403.db2.gz COAPXRUNKSPPMH-ROUUACIJSA-N 2 1 340.433 4.173 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001202444050 1055176409 /nfs/dbraw/zinc/17/64/09/1055176409.db2.gz COAPXRUNKSPPMH-ROUUACIJSA-N 2 1 340.433 4.173 20 0 EIADMP c1nc(C[NH+]2CCC3(CC2)CC[NH+](Cc2ccccc2)CC3)cs1 ZINC000878817263 1055401117 /nfs/dbraw/zinc/40/11/17/1055401117.db2.gz RIBDFRHPEWZULL-UHFFFAOYSA-N 2 1 341.524 4.021 20 0 EIADMP C[C@H](Cc1ccsc1)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000542776145 1055973519 /nfs/dbraw/zinc/97/35/19/1055973519.db2.gz VDNLQTFQORFZME-HLIPFELVSA-N 2 1 328.525 4.179 20 0 EIADMP C[C@H](Cc1ccsc1)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000542776146 1055974177 /nfs/dbraw/zinc/97/41/77/1055974177.db2.gz VDNLQTFQORFZME-MBOZVWFJSA-N 2 1 328.525 4.179 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000474710957 1055997211 /nfs/dbraw/zinc/99/72/11/1055997211.db2.gz JZUPHWQZICZLLK-NJINODPHSA-N 2 1 334.470 4.454 20 0 EIADMP CSC[C@@H]([NH2+][C@H](C)CC[NH+](C)C)c1ccc(C(F)(F)F)cc1 ZINC000542847840 1056227244 /nfs/dbraw/zinc/22/72/44/1056227244.db2.gz UKYVTNSBJPPPDZ-IUODEOHRSA-N 2 1 334.451 4.039 20 0 EIADMP C[N@@H+](Cc1cccc2cnccc21)C1CCN(Cc2ccccc2)CC1 ZINC000183264639 1059967890 /nfs/dbraw/zinc/96/78/90/1059967890.db2.gz FEFJMJSOKSOKML-UHFFFAOYSA-N 2 1 345.490 4.331 20 0 EIADMP C[N@H+](Cc1cccc2cnccc21)C1CC[NH+](Cc2ccccc2)CC1 ZINC000183264639 1059967923 /nfs/dbraw/zinc/96/79/23/1059967923.db2.gz FEFJMJSOKSOKML-UHFFFAOYSA-N 2 1 345.490 4.331 20 0 EIADMP C[N@@H+](Cc1cccc2cnccc21)C1CC[NH+](Cc2ccccc2)CC1 ZINC000183264639 1059967954 /nfs/dbraw/zinc/96/79/54/1059967954.db2.gz FEFJMJSOKSOKML-UHFFFAOYSA-N 2 1 345.490 4.331 20 0 EIADMP CCCC[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccccc1 ZINC000746047699 1059980955 /nfs/dbraw/zinc/98/09/55/1059980955.db2.gz PUIXKIYAYAQADY-RTWAWAEBSA-N 2 1 330.516 4.151 20 0 EIADMP Cc1nc(C)c([C@@H](C)[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000379737954 1060258611 /nfs/dbraw/zinc/25/86/11/1060258611.db2.gz CRMVDNLARQSITM-FOIQADDNSA-N 2 1 343.540 4.323 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3cccc(Br)c3)CCC1)C2 ZINC001169099763 1060636379 /nfs/dbraw/zinc/63/63/79/1060636379.db2.gz VGTIXYAQLYVBTH-OSYLJGHBSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCCc3ccc(Br)cc31)C2 ZINC001169082347 1060641565 /nfs/dbraw/zinc/64/15/65/1060641565.db2.gz YRWLNMBMBHGLDI-KYHPRHEASA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CCCc3ccc(Br)cc31)C2 ZINC001169082341 1060642327 /nfs/dbraw/zinc/64/23/27/1060642327.db2.gz YRWLNMBMBHGLDI-CUSZFKRNSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(CCCc3ccccc3)CC1)C2 ZINC001169126746 1060651881 /nfs/dbraw/zinc/65/18/81/1060651881.db2.gz XEPJKAOEGWTFOW-ZBYYUNFXSA-N 2 1 326.528 4.347 20 0 EIADMP Cc1cc(C(F)(F)F)cc(N[C@@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)[nH+]1 ZINC001169137303 1060653722 /nfs/dbraw/zinc/65/37/22/1060653722.db2.gz KRQXWCGWKZLIAA-CZUORRHYSA-N 2 1 329.410 4.364 20 0 EIADMP C[C@@H](c1cccc(Br)c1)[N@@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169162478 1060672925 /nfs/dbraw/zinc/67/29/25/1060672925.db2.gz TZKBJVHQKJIXTQ-SJWGOKEGSA-N 2 1 337.305 4.067 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2cccc(NC(=O)OC(C)(C)C)c2)CC1 ZINC001169222072 1060699389 /nfs/dbraw/zinc/69/93/89/1060699389.db2.gz ZTAHAAGMIHEMOV-HNNXBMFYSA-N 2 1 347.503 4.169 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@@H](C)C3)C[C@@H]2C)CC1 ZINC001169233950 1060704867 /nfs/dbraw/zinc/70/48/67/1060704867.db2.gz YRCMSQTYZSKORT-CQXMTJGFSA-N 3 1 349.607 4.019 20 0 EIADMP CC[NH+]1CCC([NH+]2CCC(c3ccccc3C(F)(F)F)CC2)CC1 ZINC001169265002 1060709976 /nfs/dbraw/zinc/70/99/76/1060709976.db2.gz KIGPMKQSAUNVMF-UHFFFAOYSA-N 2 1 340.433 4.369 20 0 EIADMP C[C@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)CCC[C@@H]1C[NH3+] ZINC001206013212 1060862691 /nfs/dbraw/zinc/86/26/91/1060862691.db2.gz QIVIPSVBQFYZPO-WDEREUQCSA-N 2 1 335.706 4.454 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c(C)o1 ZINC000767363774 1061212263 /nfs/dbraw/zinc/21/22/63/1061212263.db2.gz WYKIAYUJHDXIEN-MRXNPFEDSA-N 2 1 326.484 4.418 20 0 EIADMP COc1ccc2c[nH+]c(N3CCCC[C@@H]3CC[NH+]3CCCC3)cc2c1 ZINC001165050614 721973512 /nfs/dbraw/zinc/97/35/12/721973512.db2.gz ZSBYAFHWJQUBQZ-LJQANCHMSA-N 2 1 339.483 4.088 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188303 1032077030 /nfs/dbraw/zinc/07/70/30/1032077030.db2.gz CTDPQNUXXFUXKW-XMSQKQJNSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188303 1032077016 /nfs/dbraw/zinc/07/70/16/1032077016.db2.gz CTDPQNUXXFUXKW-XMSQKQJNSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(F)cc1 ZINC000532213622 1032093702 /nfs/dbraw/zinc/09/37/02/1032093702.db2.gz LBCAWQNVVCOLAV-KGVIQGDOSA-N 2 1 340.486 4.429 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(F)cc1 ZINC000532213622 1032093718 /nfs/dbraw/zinc/09/37/18/1032093718.db2.gz LBCAWQNVVCOLAV-KGVIQGDOSA-N 2 1 340.486 4.429 20 0 EIADMP COc1ccc(CCC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000532212278 1032095008 /nfs/dbraw/zinc/09/50/08/1032095008.db2.gz BDQHEHUOVCUITA-KRWDZBQOSA-N 2 1 349.478 4.473 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2c(F)cccc2F)CCCC1 ZINC000532219073 1032096763 /nfs/dbraw/zinc/09/67/63/1032096763.db2.gz KVGJJKXGTVTGDY-RKVPGOIHSA-N 2 1 336.470 4.095 20 0 EIADMP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000532225970 1032104468 /nfs/dbraw/zinc/10/44/68/1032104468.db2.gz GIPOACTXIFXJGR-PZJWPPBQSA-N 2 1 344.543 4.284 20 0 EIADMP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000532226267 1032105278 /nfs/dbraw/zinc/10/52/78/1032105278.db2.gz RQZGUQQWKHFPKP-RTBURBONSA-N 2 1 328.525 4.272 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc3c(c2)CC(C)(C)O3)C1 ZINC000729678960 1032128678 /nfs/dbraw/zinc/12/86/78/1032128678.db2.gz YIUYZORGKRSIDT-KRWDZBQOSA-N 2 1 330.516 4.002 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000178703082 1032544486 /nfs/dbraw/zinc/54/44/86/1032544486.db2.gz CIWZXSMVMCLSCV-STQMWFEESA-N 2 1 325.378 4.197 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@H](C)c3ccccc3Cl)CC2)nc(C)[nH+]1 ZINC000178695206 1032544583 /nfs/dbraw/zinc/54/45/83/1032544583.db2.gz VVCVFZFMYXPTQT-CQSZACIVSA-N 2 1 344.890 4.066 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000683108323 1018835239 /nfs/dbraw/zinc/83/52/39/1018835239.db2.gz BPQXJIZNJGCTKU-UFYCRDLUSA-N 2 1 332.557 4.018 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000430153505 1018881838 /nfs/dbraw/zinc/88/18/38/1018881838.db2.gz YKIUTYASICHIHX-QWSHFYNQSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH+]1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000430153505 1018881842 /nfs/dbraw/zinc/88/18/42/1018881842.db2.gz YKIUTYASICHIHX-QWSHFYNQSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000430153505 1018881845 /nfs/dbraw/zinc/88/18/45/1018881845.db2.gz YKIUTYASICHIHX-QWSHFYNQSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000430153505 1018881849 /nfs/dbraw/zinc/88/18/49/1018881849.db2.gz YKIUTYASICHIHX-QWSHFYNQSA-N 2 1 338.417 4.136 20 0 EIADMP Cc1cccc([C@@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2cccc(F)c2)c1 ZINC000643547867 1018930877 /nfs/dbraw/zinc/93/08/77/1018930877.db2.gz KAQYGXRDKYOTQC-LEWJYISDSA-N 2 1 338.470 4.488 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)o1 ZINC000432790115 1032805248 /nfs/dbraw/zinc/80/52/48/1032805248.db2.gz VOKBCCADUUVOQI-MRXNPFEDSA-N 2 1 330.447 4.310 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)o1 ZINC000432790115 1032805253 /nfs/dbraw/zinc/80/52/53/1032805253.db2.gz VOKBCCADUUVOQI-MRXNPFEDSA-N 2 1 330.447 4.310 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(OC)ccc2Cl)CC1 ZINC001167077736 1019568772 /nfs/dbraw/zinc/56/87/72/1019568772.db2.gz MZHXIBLRXBZXLP-UHFFFAOYSA-N 2 1 338.923 4.293 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cccc(OC(F)(F)F)c2)CC1 ZINC001204432850 1019838416 /nfs/dbraw/zinc/83/84/16/1019838416.db2.gz SDUZXLSXUJPNTP-UHFFFAOYSA-N 2 1 344.421 4.137 20 0 EIADMP CCc1nc([C@H](C)N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000274892558 1019839488 /nfs/dbraw/zinc/83/94/88/1019839488.db2.gz JSALVMWAGPBBNE-SOLBZPMBSA-N 2 1 343.540 4.267 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)c1 ZINC000180786049 1020179849 /nfs/dbraw/zinc/17/98/49/1020179849.db2.gz ASTLXWCGOLGSKF-UHFFFAOYSA-N 2 1 336.435 4.423 20 0 EIADMP FC(F)(F)c1ccc2c(N[C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc[nH+]c2c1 ZINC000443677834 1020207575 /nfs/dbraw/zinc/20/75/75/1020207575.db2.gz ZPYZJBSAZVFLGR-KGLIPLIRSA-N 2 1 335.373 4.292 20 0 EIADMP FC(F)(F)c1ccc2c(N[C@@H]3CC[N@H+]4CCC[C@H]4C3)cc[nH+]c2c1 ZINC000443677834 1020207580 /nfs/dbraw/zinc/20/75/80/1020207580.db2.gz ZPYZJBSAZVFLGR-KGLIPLIRSA-N 2 1 335.373 4.292 20 0 EIADMP CC[C@H](CC(F)(F)F)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547830239 1020775728 /nfs/dbraw/zinc/77/57/28/1020775728.db2.gz KLSCIUISJUWKSL-HYVNUMGLSA-N 2 1 328.422 4.218 20 0 EIADMP CC(C)(C)[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccccc1 ZINC000655688118 1020895411 /nfs/dbraw/zinc/89/54/11/1020895411.db2.gz LVFIJAYAPWEPIB-VQTJNVASSA-N 2 1 330.516 4.007 20 0 EIADMP Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C1 ZINC000376132114 1021544263 /nfs/dbraw/zinc/54/42/63/1021544263.db2.gz LGZLNQOQNXFCNN-WSCSCYJOSA-N 2 1 327.516 4.021 20 0 EIADMP Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)C1 ZINC000376132114 1021544276 /nfs/dbraw/zinc/54/42/76/1021544276.db2.gz LGZLNQOQNXFCNN-WSCSCYJOSA-N 2 1 327.516 4.021 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(OC)cc2C)c1 ZINC000414083595 1021822328 /nfs/dbraw/zinc/82/23/28/1021822328.db2.gz WIZMHSLHFNHTTI-QGZVFWFLSA-N 2 1 326.484 4.306 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC000398017869 1021898283 /nfs/dbraw/zinc/89/82/83/1021898283.db2.gz IIXQUYISKOXQAP-FDDCHVKYSA-N 2 1 334.507 4.176 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]Cc3cc4ccccc4[nH]3)C2)c1 ZINC000683927049 1021990760 /nfs/dbraw/zinc/99/07/60/1021990760.db2.gz PSFIHQRAUXPDSN-MRXNPFEDSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]Cc3cc4ccccc4[nH]3)C2)c1 ZINC000683927049 1021990771 /nfs/dbraw/zinc/99/07/71/1021990771.db2.gz PSFIHQRAUXPDSN-MRXNPFEDSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]Cc3cc4ccccc4[nH]3)C2)c1 ZINC000683927047 1021991453 /nfs/dbraw/zinc/99/14/53/1021991453.db2.gz PSFIHQRAUXPDSN-INIZCTEOSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]Cc3cc4ccccc4[nH]3)C2)c1 ZINC000683927047 1021991467 /nfs/dbraw/zinc/99/14/67/1021991467.db2.gz PSFIHQRAUXPDSN-INIZCTEOSA-N 2 1 339.508 4.231 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000414170380 1022020336 /nfs/dbraw/zinc/02/03/36/1022020336.db2.gz BYYWSLMPMFOGJZ-JTSKRJEESA-N 2 1 349.478 4.239 20 0 EIADMP C/C(=C\c1ccccc1)C[N@H+](C)C1CCN(CCc2ccncc2)CC1 ZINC000377863184 1022059568 /nfs/dbraw/zinc/05/95/68/1022059568.db2.gz DACJLOOAQQXEOQ-CZIZESTLSA-N 2 1 349.522 4.124 20 0 EIADMP COc1ccc([C@H]([NH2+]CC[C@H]2CCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000414199435 1022106261 /nfs/dbraw/zinc/10/62/61/1022106261.db2.gz XAUHQFMPDFKMPA-XMSQKQJNSA-N 2 1 338.495 4.106 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)sc1C ZINC000892579606 1022300282 /nfs/dbraw/zinc/30/02/82/1022300282.db2.gz BQCLNSMXRRRTQB-HNNXBMFYSA-N 2 1 343.540 4.424 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)sc1C ZINC000892579606 1022300301 /nfs/dbraw/zinc/30/03/01/1022300301.db2.gz BQCLNSMXRRRTQB-HNNXBMFYSA-N 2 1 343.540 4.424 20 0 EIADMP C[C@]1(C[NH2+]Cc2cccc3[nH]ccc32)CC[N@@H+](Cc2ccccc2)C1 ZINC000310940637 1022676583 /nfs/dbraw/zinc/67/65/83/1022676583.db2.gz WAPMIJIMYZVXIW-JOCHJYFZSA-N 2 1 333.479 4.170 20 0 EIADMP c1csc(-c2ncc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)s2)c1 ZINC000647544100 1022796910 /nfs/dbraw/zinc/79/69/10/1022796910.db2.gz WTOIPUGDAVEINL-LSDHHAIUSA-N 2 1 347.553 4.083 20 0 EIADMP Clc1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c2ncccc12 ZINC000647543836 1022797912 /nfs/dbraw/zinc/79/79/12/1022797912.db2.gz SRFKPSBBSHAPRI-JKSUJKDBSA-N 2 1 343.902 4.100 20 0 EIADMP C[C@@H]([NH2+]CCc1c(F)cccc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000402101121 1022801351 /nfs/dbraw/zinc/80/13/51/1022801351.db2.gz VGCRZWLMUXDAJU-SJLPKXTDSA-N 2 1 344.449 4.008 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H]4CCC[C@@H]43)cc2)cs1 ZINC000581326323 1023025091 /nfs/dbraw/zinc/02/50/91/1023025091.db2.gz TWKUHOPVVGUNGE-GGPKGHCWSA-N 2 1 341.524 4.081 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000584581445 1023037648 /nfs/dbraw/zinc/03/76/48/1023037648.db2.gz VNRAMWUDGAKDEF-QZNHQXDQSA-N 2 1 349.522 4.081 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCN(c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000584581445 1023037664 /nfs/dbraw/zinc/03/76/64/1023037664.db2.gz VNRAMWUDGAKDEF-QZNHQXDQSA-N 2 1 349.522 4.081 20 0 EIADMP CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000473307877 1033105737 /nfs/dbraw/zinc/10/57/37/1033105737.db2.gz DVVWSWSNVBESKL-YLJYHZDGSA-N 2 1 345.531 4.024 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1cncc(F)c1 ZINC000156191641 1023137911 /nfs/dbraw/zinc/13/79/11/1023137911.db2.gz ILVWQLCTZKDODH-SJORKVTESA-N 2 1 341.474 4.446 20 0 EIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000310140053 1023142468 /nfs/dbraw/zinc/14/24/68/1023142468.db2.gz CBUNRBMGOOIFPI-FQEVSTJZSA-N 2 1 326.459 4.136 20 0 EIADMP COc1cc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)ccc1SC ZINC000376594370 1023148449 /nfs/dbraw/zinc/14/84/49/1023148449.db2.gz DRNPIKKWHDSJLU-OOHWJJMZSA-N 2 1 334.529 4.085 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000376612312 1023234166 /nfs/dbraw/zinc/23/41/66/1023234166.db2.gz VAXVXLAEDOSKRV-URLQWDBASA-N 2 1 345.462 4.176 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000376672598 1023254652 /nfs/dbraw/zinc/25/46/52/1023254652.db2.gz OJELGPNBPZUIOD-SIKLNZKXSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C[C@H](C)O1 ZINC000581501311 1023310309 /nfs/dbraw/zinc/31/03/09/1023310309.db2.gz QXPKIEPNPLZKIS-PXIKZMAHSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C[C@H](C)O1 ZINC000581501311 1023310314 /nfs/dbraw/zinc/31/03/14/1023310314.db2.gz QXPKIEPNPLZKIS-PXIKZMAHSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@H]([NH2+]CCc1nsc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000660255324 1023389510 /nfs/dbraw/zinc/38/95/10/1023389510.db2.gz BAHHSGGXZQOSBJ-JKSUJKDBSA-N 2 1 343.540 4.081 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(OC(C)(C)C)CC1 ZINC000511640086 1023432222 /nfs/dbraw/zinc/43/22/22/1023432222.db2.gz KFASSULSZHDLNW-UHFFFAOYSA-N 2 1 346.559 4.424 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)CCCC1 ZINC000415094467 1023438685 /nfs/dbraw/zinc/43/86/85/1023438685.db2.gz XPJQTGISCNYBGH-VQTJNVASSA-N 2 1 330.516 4.056 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@H]1c1ccccc1 ZINC000581621799 1023440359 /nfs/dbraw/zinc/44/03/59/1023440359.db2.gz HGAOZWZIEBGCFV-FPOVZHCZSA-N 2 1 338.495 4.269 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@H]1c1ccccc1 ZINC000581621799 1023440363 /nfs/dbraw/zinc/44/03/63/1023440363.db2.gz HGAOZWZIEBGCFV-FPOVZHCZSA-N 2 1 338.495 4.269 20 0 EIADMP CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000415100269 1023444637 /nfs/dbraw/zinc/44/46/37/1023444637.db2.gz HUMIFGBOZKTVKT-ULQDDVLXSA-N 2 1 328.504 4.018 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000415121015 1023452262 /nfs/dbraw/zinc/45/22/62/1023452262.db2.gz YSKPEYXAAKBRNR-LIVBEALHSA-N 2 1 330.422 4.151 20 0 EIADMP C[C@H](C[N@@H+](C)CC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000500065110 1023479104 /nfs/dbraw/zinc/47/91/04/1023479104.db2.gz AVRPXSZPKJFLEA-CQSZACIVSA-N 2 1 328.422 4.083 20 0 EIADMP Cc1ccc(OC2CC[NH+](CC[C@@H]3CCCC[N@@H+]3C)CC2)cc1C ZINC000472752452 1023502106 /nfs/dbraw/zinc/50/21/06/1023502106.db2.gz PRBCORPVTCIALI-IBGZPJMESA-N 2 1 330.516 4.021 20 0 EIADMP FC1(F)CC[C@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000564958705 1023532092 /nfs/dbraw/zinc/53/20/92/1023532092.db2.gz JJCVEJLPBFZFRX-ZWKOTPCHSA-N 2 1 334.454 4.209 20 0 EIADMP FC1(F)CC[C@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000564958705 1023532103 /nfs/dbraw/zinc/53/21/03/1023532103.db2.gz JJCVEJLPBFZFRX-ZWKOTPCHSA-N 2 1 334.454 4.209 20 0 EIADMP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)C1 ZINC000684369838 1023540841 /nfs/dbraw/zinc/54/08/41/1023540841.db2.gz BYKOLPKQRJCXQU-DUXKGJEZSA-N 2 1 330.516 4.108 20 0 EIADMP Cc1n[nH]cc1C1CC[NH+]([C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000377632568 1023648257 /nfs/dbraw/zinc/64/82/57/1023648257.db2.gz SYRAFZGIQXJMSZ-INIZCTEOSA-N 2 1 349.482 4.153 20 0 EIADMP CC[C@@H](Cc1cccs1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000684410401 1023661442 /nfs/dbraw/zinc/66/14/42/1023661442.db2.gz XPGGXCXUAWJJDX-MOPGFXCFSA-N 2 1 328.525 4.181 20 0 EIADMP CCc1nc2cc(C[NH2+][C@@H]3C[C@H]([NH3+])c4ccccc43)ccc2n1C1CC1 ZINC000581800389 1023723403 /nfs/dbraw/zinc/72/34/03/1023723403.db2.gz GNXNFYUHOAQDOJ-RBUKOAKNSA-N 2 1 346.478 4.168 20 0 EIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccccc1Br ZINC000020143287 1023738351 /nfs/dbraw/zinc/73/83/51/1023738351.db2.gz RVMMZEATBJMKDG-GFCCVEGCSA-N 2 1 339.321 4.409 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)o1 ZINC000377750835 1023742086 /nfs/dbraw/zinc/74/20/86/1023742086.db2.gz WTCJWEDELPJKBG-IAGOWNOFSA-N 2 1 328.431 4.111 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000510468759 1023776851 /nfs/dbraw/zinc/77/68/51/1023776851.db2.gz GYTTZLUQQZBRSO-UHFFFAOYSA-N 2 1 332.385 4.151 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000510468759 1023776848 /nfs/dbraw/zinc/77/68/48/1023776848.db2.gz GYTTZLUQQZBRSO-UHFFFAOYSA-N 2 1 332.385 4.151 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]C2CCC(F)(F)CC2)C[N@H+]1Cc1ccccc1 ZINC000647196190 1023851026 /nfs/dbraw/zinc/85/10/26/1023851026.db2.gz RSAXFDRKKHQWMB-SJLPKXTDSA-N 2 1 336.470 4.455 20 0 EIADMP CSC[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(C(F)(F)F)cc1 ZINC000581903437 1023856390 /nfs/dbraw/zinc/85/63/90/1023856390.db2.gz BLUJUVRUFXTDBG-OAHLLOKOSA-N 2 1 348.478 4.287 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](CC(F)(F)F)c1ccccc1 ZINC000341582809 1023889885 /nfs/dbraw/zinc/88/98/85/1023889885.db2.gz HCILQLPAJYRMEP-INIZCTEOSA-N 2 1 325.378 4.255 20 0 EIADMP Cc1nc(-c2ccc([C@@H](C)[NH2+]CC[C@H]3CCC[N@H+]3C)cc2)cs1 ZINC000341588624 1023895429 /nfs/dbraw/zinc/89/54/29/1023895429.db2.gz BXJBIMBPUBSSLY-RDTXWAMCSA-N 2 1 329.513 4.253 20 0 EIADMP Cc1nc(C)c(CC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)s1 ZINC000157950797 1023913411 /nfs/dbraw/zinc/91/34/11/1023913411.db2.gz SROFGPFYLLLXSY-CYBMUJFWSA-N 2 1 340.496 4.147 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Br)c1 ZINC000130225672 1023932177 /nfs/dbraw/zinc/93/21/77/1023932177.db2.gz YTXFOVKGNLZJLO-BBWFWOEESA-N 2 1 337.305 4.117 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1C(F)(F)F ZINC000131766848 1023970881 /nfs/dbraw/zinc/97/08/81/1023970881.db2.gz IFDAJTRZXYREGR-FFHGMXDLSA-N 2 1 326.406 4.371 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1C(F)(F)F ZINC000131766848 1023970895 /nfs/dbraw/zinc/97/08/95/1023970895.db2.gz IFDAJTRZXYREGR-FFHGMXDLSA-N 2 1 326.406 4.371 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2cc(-c3ccc(OC)cc3)cs2)[C@@H](C)C1 ZINC000468875893 1024090528 /nfs/dbraw/zinc/09/05/28/1024090528.db2.gz FVRLAIMYTCSMFV-YWZLYKJASA-N 2 1 344.524 4.244 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000510683425 1024229788 /nfs/dbraw/zinc/22/97/88/1024229788.db2.gz FVYSFJYSYGNDND-FHLIZLRMSA-N 2 1 340.433 4.243 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000510683425 1024229801 /nfs/dbraw/zinc/22/98/01/1024229801.db2.gz FVYSFJYSYGNDND-FHLIZLRMSA-N 2 1 340.433 4.243 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@H]([NH3+])[C@@H](C)C3)s2)cc1 ZINC000430950048 1024269509 /nfs/dbraw/zinc/26/95/09/1024269509.db2.gz PPHIMICNLXDAGA-KSSFIOAISA-N 2 1 329.513 4.103 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@H]([NH3+])[C@@H](C)C3)s2)cc1 ZINC000430950048 1024269535 /nfs/dbraw/zinc/26/95/35/1024269535.db2.gz PPHIMICNLXDAGA-KSSFIOAISA-N 2 1 329.513 4.103 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341696902 1024337822 /nfs/dbraw/zinc/33/78/22/1024337822.db2.gz MFSOCVSTZVBHIR-QAPCUYQASA-N 2 1 336.907 4.264 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341696902 1024337839 /nfs/dbraw/zinc/33/78/39/1024337839.db2.gz MFSOCVSTZVBHIR-QAPCUYQASA-N 2 1 336.907 4.264 20 0 EIADMP Cc1cccc(NC[C@@H]2CC[N@H+](Cc3cc4c(ccc(C)c4C)[nH]3)C2)[nH+]1 ZINC000473141262 1024423303 /nfs/dbraw/zinc/42/33/03/1024423303.db2.gz NKOABUPWQCKZFO-SFHVURJKSA-N 2 1 348.494 4.422 20 0 EIADMP Cc1cccc(NC[C@@H]2CC[N@@H+](Cc3cc4c(ccc(C)c4C)[nH]3)C2)[nH+]1 ZINC000473141262 1024423336 /nfs/dbraw/zinc/42/33/36/1024423336.db2.gz NKOABUPWQCKZFO-SFHVURJKSA-N 2 1 348.494 4.422 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](CNCc2ccc(Sc3ccccn3)o2)C1 ZINC000510874854 1024698532 /nfs/dbraw/zinc/69/85/32/1024698532.db2.gz QQQHDUPPFYFYPX-INIZCTEOSA-N 2 1 345.512 4.036 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+]Cc2csc(Cl)c2Cl)cc1 ZINC000432245730 1024748431 /nfs/dbraw/zinc/74/84/31/1024748431.db2.gz JLKRMFWLUIZXLX-UHFFFAOYSA-N 2 1 329.296 4.406 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481310 1024825597 /nfs/dbraw/zinc/82/55/97/1024825597.db2.gz MWFKQSDJOWAXQU-LVCYWYKZSA-N 2 1 337.511 4.205 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccn2CCC(C)C)c1 ZINC000236879791 1024837024 /nfs/dbraw/zinc/83/70/24/1024837024.db2.gz YQJALTQLTZWKSQ-UHFFFAOYSA-N 2 1 327.516 4.276 20 0 EIADMP Brc1ccc2c(c1)[C@@H]([NH2+]C1CC([NH+]3CCCCC3)C1)CC2 ZINC000510948833 1024863545 /nfs/dbraw/zinc/86/35/45/1024863545.db2.gz JGHCLBIAUHCYHA-HTWSVDAQSA-N 2 1 349.316 4.043 20 0 EIADMP C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295634 1025045977 /nfs/dbraw/zinc/04/59/77/1025045977.db2.gz VYYDMTBTTWHOLV-VQIMIIECSA-N 2 1 339.483 4.114 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2csc(Cc3ccccc3)n2)[C@@H]1CCC[NH3+] ZINC000662311692 1025062745 /nfs/dbraw/zinc/06/27/45/1025062745.db2.gz CYGDAGYFFWUZPX-VQIMIIECSA-N 2 1 343.540 4.073 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccnc3ccccc23)C1 ZINC000535825429 1025073242 /nfs/dbraw/zinc/07/32/42/1025073242.db2.gz DYOWQYBFBGKSDB-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccnc3ccccc23)C1 ZINC000535825429 1025073252 /nfs/dbraw/zinc/07/32/52/1025073252.db2.gz DYOWQYBFBGKSDB-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccnc3ccccc23)C1 ZINC000535825429 1025073261 /nfs/dbraw/zinc/07/32/61/1025073261.db2.gz DYOWQYBFBGKSDB-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccnc3ccccc23)C1 ZINC000535825429 1025073272 /nfs/dbraw/zinc/07/32/72/1025073272.db2.gz DYOWQYBFBGKSDB-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP COCCC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1 ZINC000663465248 1025387943 /nfs/dbraw/zinc/38/79/43/1025387943.db2.gz IUTILJYPQAACOD-NQIIRXRSSA-N 2 1 348.506 4.005 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc1Cl ZINC000663467354 1025399377 /nfs/dbraw/zinc/39/93/77/1025399377.db2.gz DZNBDXODMCLFLT-GDBMZVCRSA-N 2 1 336.907 4.121 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+]Cc2ncc(Cl)s2)C[N@H+]1Cc1ccccc1 ZINC000472037151 1025460307 /nfs/dbraw/zinc/46/03/07/1025460307.db2.gz HQRSXQKRRPEMEJ-HOCLYGCPSA-N 2 1 349.931 4.187 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)Cc1ccc(Br)cc1 ZINC001167826188 1025618534 /nfs/dbraw/zinc/61/85/34/1025618534.db2.gz OLHITYHCIJGRBZ-OAHLLOKOSA-N 2 1 341.337 4.391 20 0 EIADMP C[C@@H]([NH2+]C[C@H](C)[NH3+])c1ccc(-c2ccccc2Br)s1 ZINC000643527113 1025695062 /nfs/dbraw/zinc/69/50/62/1025695062.db2.gz DDOAXZNROGSVQG-WDEREUQCSA-N 2 1 339.302 4.175 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000657295916 1025740248 /nfs/dbraw/zinc/74/02/48/1025740248.db2.gz NVVNJHNWSBPOAF-UHFFFAOYSA-N 2 1 329.513 4.084 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)oc21 ZINC000643547884 1025750947 /nfs/dbraw/zinc/75/09/47/1025750947.db2.gz KGTZSWXJQMKMJK-GOEBONIOSA-N 2 1 328.456 4.157 20 0 EIADMP COc1cccc(C[C@H]([NH2+]CCCn2cc[nH+]c2C)c2ccccc2)c1 ZINC000511037571 1025787901 /nfs/dbraw/zinc/78/79/01/1025787901.db2.gz YZXBLAIOTWOWDG-QFIPXVFZSA-N 2 1 349.478 4.164 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)n1ccc([C@H](C)[NH2+]Cc2ccccc2)n1 ZINC001167833537 1025792246 /nfs/dbraw/zinc/79/22/46/1025792246.db2.gz CFBREMRMJUJQIE-OALUTQOASA-N 2 1 342.531 4.417 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1c1ccc(C(=O)OC)cc1 ZINC001167836395 1025846514 /nfs/dbraw/zinc/84/65/14/1025846514.db2.gz ZHBCKCYUTFODNU-FXAWDEMLSA-N 2 1 346.515 4.121 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCO[C@@](C)(c2ccc(C)cc2)C1 ZINC001167837436 1025848479 /nfs/dbraw/zinc/84/84/79/1025848479.db2.gz KBKWXNQPJWVJCD-TZIWHRDSSA-N 2 1 332.532 4.053 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(SC(F)F)cc1 ZINC000278943185 1025855457 /nfs/dbraw/zinc/85/54/57/1025855457.db2.gz KJZVIACXTKNKGS-QWHCGFSZSA-N 2 1 337.439 4.111 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCOC[C@H]1c1ccc(Cl)cc1 ZINC001167839891 1025856166 /nfs/dbraw/zinc/85/61/66/1025856166.db2.gz COSOXEBHSLPHAN-APWZRJJASA-N 2 1 338.923 4.224 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCOC[C@H]1c1ccc(Cl)cc1 ZINC001167839891 1025856172 /nfs/dbraw/zinc/85/61/72/1025856172.db2.gz COSOXEBHSLPHAN-APWZRJJASA-N 2 1 338.923 4.224 20 0 EIADMP C[C@H](c1cccc(F)c1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278952034 1025860372 /nfs/dbraw/zinc/86/03/72/1025860372.db2.gz VUNCGMSOUJWSPG-OAHLLOKOSA-N 2 1 327.447 4.299 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2c(F)cccc2Cl)CC1 ZINC000071954565 1025871053 /nfs/dbraw/zinc/87/10/53/1025871053.db2.gz WSVARVMJMZALRZ-UHFFFAOYSA-N 2 1 326.887 4.423 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c(F)cccc2Cl)CC1 ZINC000071954565 1025871059 /nfs/dbraw/zinc/87/10/59/1025871059.db2.gz WSVARVMJMZALRZ-UHFFFAOYSA-N 2 1 326.887 4.423 20 0 EIADMP CCC[C@H]([NH2+][C@H]1CC[N@@H+](CCCOCC)C[C@@H]1C)c1ccsc1 ZINC000187722541 1025887618 /nfs/dbraw/zinc/88/76/18/1025887618.db2.gz LOPPMPMVMMUCGZ-WDSOQIARSA-N 2 1 338.561 4.316 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](Cc1cc(C)no1)Cc1ccccc1 ZINC001167841999 1025892759 /nfs/dbraw/zinc/89/27/59/1025892759.db2.gz VNSWKQRDVBZVTP-LJQANCHMSA-N 2 1 343.515 4.496 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CCCO1 ZINC000432433114 1025968294 /nfs/dbraw/zinc/96/82/94/1025968294.db2.gz ZORANQBABCGQMQ-DYESRHJHSA-N 2 1 348.506 4.148 20 0 EIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@@H]2CCc3[nH+]ccn3C2)cc1 ZINC000279035238 1025994989 /nfs/dbraw/zinc/99/49/89/1025994989.db2.gz WRFGCTUBCYUBOV-CVEARBPZSA-N 2 1 329.513 4.297 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(Oc2cccnc2)cc1 ZINC000344090900 1025997368 /nfs/dbraw/zinc/99/73/68/1025997368.db2.gz JPIJOTDWBMGIDZ-SJLPKXTDSA-N 2 1 325.456 4.009 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CCCc4ccc(F)cc43)CC2)[nH+]1 ZINC000344156539 1026080880 /nfs/dbraw/zinc/08/08/80/1026080880.db2.gz AGIZJDVMQXBNEP-FQEVSTJZSA-N 2 1 339.458 4.165 20 0 EIADMP CCc1nocc1C[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000550111338 1026139838 /nfs/dbraw/zinc/13/98/38/1026139838.db2.gz KZSPZQZODKLDHF-UHFFFAOYSA-N 2 1 341.499 4.291 20 0 EIADMP CCc1nocc1C[NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000550111338 1026139847 /nfs/dbraw/zinc/13/98/47/1026139847.db2.gz KZSPZQZODKLDHF-UHFFFAOYSA-N 2 1 341.499 4.291 20 0 EIADMP CC(C)(C)Oc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167973137 1026152237 /nfs/dbraw/zinc/15/22/37/1026152237.db2.gz HNDLJNHEUVRFRL-IHWFROFDSA-N 2 1 342.527 4.359 20 0 EIADMP CCCC[NH+]1CCC([NH2+]Cc2ccc(-c3scnc3C)cc2)CC1 ZINC000657336895 1026160466 /nfs/dbraw/zinc/16/04/66/1026160466.db2.gz ZTPOZPXOAVHCDV-UHFFFAOYSA-N 2 1 343.540 4.473 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000344306301 1026237468 /nfs/dbraw/zinc/23/74/68/1026237468.db2.gz WHYZKULLOBYBJN-GFCCVEGCSA-N 2 1 331.312 4.284 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(F)c(F)c1 ZINC001167979151 1026344049 /nfs/dbraw/zinc/34/40/49/1026344049.db2.gz WZSVAZNJHJBWKV-KVMCETHSSA-N 2 1 334.454 4.411 20 0 EIADMP CC[C@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)CC1 ZINC000657371231 1026352251 /nfs/dbraw/zinc/35/22/51/1026352251.db2.gz ONRUTSITGSNGBA-ICSRJNTNSA-N 2 1 347.547 4.452 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCCc4sccc43)CC2)[nH+]c1 ZINC000163513052 1026379791 /nfs/dbraw/zinc/37/97/91/1026379791.db2.gz FNYIITVDZMVYIH-QGZVFWFLSA-N 2 1 327.497 4.088 20 0 EIADMP COCc1csc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000657389132 1026425681 /nfs/dbraw/zinc/42/56/81/1026425681.db2.gz SBEPBLFPONSVAN-QFBILLFUSA-N 2 1 344.524 4.037 20 0 EIADMP COCc1csc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000657389132 1026425692 /nfs/dbraw/zinc/42/56/92/1026425692.db2.gz SBEPBLFPONSVAN-QFBILLFUSA-N 2 1 344.524 4.037 20 0 EIADMP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000279499977 1026460862 /nfs/dbraw/zinc/46/08/62/1026460862.db2.gz MNBSVWZKAPDWHM-NEOGFGCTSA-N 2 1 330.516 4.005 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](C/C=C/c2ccccc2OC)CC1 ZINC000506867955 1026476611 /nfs/dbraw/zinc/47/66/11/1026476611.db2.gz PMOYYSUDJWOAFV-CSKARUKUSA-N 2 1 330.516 4.152 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccccn1 ZINC000158671281 1026621708 /nfs/dbraw/zinc/62/17/08/1026621708.db2.gz AQWCYSGSEPENMI-QRVBRYPASA-N 2 1 337.511 4.410 20 0 EIADMP CC[N@@H+](Cc1cc(Cl)ccc1C(F)(F)F)C1CCN(C)CC1 ZINC001140566493 1026668172 /nfs/dbraw/zinc/66/81/72/1026668172.db2.gz ITAPXSWYACKXJL-UHFFFAOYSA-N 2 1 334.813 4.275 20 0 EIADMP CCN(Cc1cc(Cl)ccc1C(F)(F)F)C1CC[NH+](C)CC1 ZINC001140566493 1026668175 /nfs/dbraw/zinc/66/81/75/1026668175.db2.gz ITAPXSWYACKXJL-UHFFFAOYSA-N 2 1 334.813 4.275 20 0 EIADMP CC(C)n1nccc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000279798837 1026699395 /nfs/dbraw/zinc/69/93/95/1026699395.db2.gz DMNZYIMEHSYESB-GOSISDBHSA-N 2 1 340.515 4.128 20 0 EIADMP CC(C)n1nccc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000279798837 1026699403 /nfs/dbraw/zinc/69/94/03/1026699403.db2.gz DMNZYIMEHSYESB-GOSISDBHSA-N 2 1 340.515 4.128 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512330905 1026709837 /nfs/dbraw/zinc/70/98/37/1026709837.db2.gz VVLQVQPPLDAPRY-FGTMMUONSA-N 2 1 330.516 4.389 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512330905 1026709847 /nfs/dbraw/zinc/70/98/47/1026709847.db2.gz VVLQVQPPLDAPRY-FGTMMUONSA-N 2 1 330.516 4.389 20 0 EIADMP Cc1ccccc1C[N@@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000432673079 1026709998 /nfs/dbraw/zinc/70/99/98/1026709998.db2.gz VRSVDMOTHNCYRX-IBGZPJMESA-N 2 1 326.509 4.201 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512330906 1026710289 /nfs/dbraw/zinc/71/02/89/1026710289.db2.gz VVLQVQPPLDAPRY-OKZBNKHCSA-N 2 1 330.516 4.389 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512330906 1026710298 /nfs/dbraw/zinc/71/02/98/1026710298.db2.gz VVLQVQPPLDAPRY-OKZBNKHCSA-N 2 1 330.516 4.389 20 0 EIADMP C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512333834 1026725239 /nfs/dbraw/zinc/72/52/39/1026725239.db2.gz XOSKDQZJOVRKRN-RTBURBONSA-N 2 1 347.591 4.026 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512333834 1026725251 /nfs/dbraw/zinc/72/52/51/1026725251.db2.gz XOSKDQZJOVRKRN-RTBURBONSA-N 3 1 347.591 4.026 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512333834 1026725267 /nfs/dbraw/zinc/72/52/67/1026725267.db2.gz XOSKDQZJOVRKRN-RTBURBONSA-N 3 1 347.591 4.026 20 0 EIADMP CC(C)Sc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000511151591 1026762777 /nfs/dbraw/zinc/76/27/77/1026762777.db2.gz VCGUVVMBLKZBJO-LJQANCHMSA-N 2 1 332.557 4.351 20 0 EIADMP CC(C)Sc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000511151591 1026762782 /nfs/dbraw/zinc/76/27/82/1026762782.db2.gz VCGUVVMBLKZBJO-LJQANCHMSA-N 2 1 332.557 4.351 20 0 EIADMP CC(C)Sc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1 ZINC000511151591 1026762793 /nfs/dbraw/zinc/76/27/93/1026762793.db2.gz VCGUVVMBLKZBJO-LJQANCHMSA-N 2 1 332.557 4.351 20 0 EIADMP CC(C)Sc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1 ZINC000511151591 1026762801 /nfs/dbraw/zinc/76/28/01/1026762801.db2.gz VCGUVVMBLKZBJO-LJQANCHMSA-N 2 1 332.557 4.351 20 0 EIADMP Cc1ccc2cc(C[NH2+]C[C@H]3CC[N@@H+](Cc4ccccc4)C3)[nH]c2c1 ZINC000657452859 1026770407 /nfs/dbraw/zinc/77/04/07/1026770407.db2.gz LPDQIEBPXQPAID-LJQANCHMSA-N 2 1 333.479 4.088 20 0 EIADMP CC[NH+]1CCN(c2ccccc2C[N@@H+](C)[C@@H](C)c2cccs2)CC1 ZINC000507440094 1026795754 /nfs/dbraw/zinc/79/57/54/1026795754.db2.gz HEBNQILQBPJIHC-KRWDZBQOSA-N 2 1 343.540 4.083 20 0 EIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)cn1 ZINC000512370166 1026812366 /nfs/dbraw/zinc/81/23/66/1026812366.db2.gz LZBANZGVJAYHDP-OAQYLSRUSA-N 2 1 337.511 4.034 20 0 EIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)cn1 ZINC000512370166 1026812367 /nfs/dbraw/zinc/81/23/67/1026812367.db2.gz LZBANZGVJAYHDP-OAQYLSRUSA-N 2 1 337.511 4.034 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@@H]1CCCOC1 ZINC000507491680 1026816200 /nfs/dbraw/zinc/81/62/00/1026816200.db2.gz CERWUDJOKKPDPX-LMVRJCEZSA-N 2 1 344.543 4.069 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@@H]1CCCOC1 ZINC000507491682 1026817184 /nfs/dbraw/zinc/81/71/84/1026817184.db2.gz CERWUDJOKKPDPX-VQQMMKBISA-N 2 1 344.543 4.069 20 0 EIADMP CCC(CC)(C[NH2+][C@H](C)[C@@H]1CCCOC1)[NH2+][C@H](C)c1ccccc1 ZINC000507523763 1026826386 /nfs/dbraw/zinc/82/63/86/1026826386.db2.gz DIHGUZFQXRVDBV-QWFCFKBJSA-N 2 1 332.532 4.301 20 0 EIADMP Cc1cccc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)c1C ZINC000152822067 1026853011 /nfs/dbraw/zinc/85/30/11/1026853011.db2.gz YLXATNQPWUJPFK-LJQANCHMSA-N 2 1 337.511 4.056 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](CCc2ccncc2)CC1)c1ccc(C)cc1 ZINC000152819752 1026853349 /nfs/dbraw/zinc/85/33/49/1026853349.db2.gz TZQXXMBZCZWGJC-QFIPXVFZSA-N 2 1 337.511 4.138 20 0 EIADMP CCC[C@H]([NH2+]C1CC[NH+](CCc2ccncc2)CC1)c1ccccc1 ZINC000152810402 1026854357 /nfs/dbraw/zinc/85/43/57/1026854357.db2.gz GMXSABOATRGCOO-QFIPXVFZSA-N 2 1 337.511 4.220 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCOc2cccc3ccccc32)C[C@@H]1C ZINC001167589377 1026860197 /nfs/dbraw/zinc/86/01/97/1026860197.db2.gz DKKYOBPXNIBJDQ-AZUAARDMSA-N 2 1 340.511 4.413 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCOc2cccc3ccccc32)C[C@@H]1C ZINC001167589377 1026860199 /nfs/dbraw/zinc/86/01/99/1026860199.db2.gz DKKYOBPXNIBJDQ-AZUAARDMSA-N 2 1 340.511 4.413 20 0 EIADMP FC(F)(F)c1cccc(CCCC[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000474469998 1027097474 /nfs/dbraw/zinc/09/74/74/1027097474.db2.gz CYJYJKDSTSAWOZ-MSOLQXFVSA-N 2 1 340.433 4.245 20 0 EIADMP C[C@@H]([NH2+]CC1([NH+](C)C)CCCC1)[C@H](C)c1nc2ccccc2s1 ZINC000474497966 1027147109 /nfs/dbraw/zinc/14/71/09/1027147109.db2.gz ZMTPONJSBJRXNJ-LSDHHAIUSA-N 2 1 331.529 4.252 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000342861014 1027334110 /nfs/dbraw/zinc/33/41/10/1027334110.db2.gz USFPZOPDEGNJMR-UHFFFAOYSA-N 2 1 349.478 4.293 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000342861014 1027334127 /nfs/dbraw/zinc/33/41/27/1027334127.db2.gz USFPZOPDEGNJMR-UHFFFAOYSA-N 2 1 349.478 4.293 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)C[C@@H]1c1ccccc1 ZINC000453353981 1027422349 /nfs/dbraw/zinc/42/23/49/1027422349.db2.gz OABKIFVURGNWTK-LEWJYISDSA-N 2 1 338.470 4.326 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)C[C@@H]1c1ccccc1 ZINC000453353981 1027422365 /nfs/dbraw/zinc/42/23/65/1027422365.db2.gz OABKIFVURGNWTK-LEWJYISDSA-N 2 1 338.470 4.326 20 0 EIADMP Cc1ccc(OCCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000441418643 1027534956 /nfs/dbraw/zinc/53/49/56/1027534956.db2.gz VJCLNCPTNWRQEA-KNQAVFIVSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000441418643 1027534962 /nfs/dbraw/zinc/53/49/62/1027534962.db2.gz VJCLNCPTNWRQEA-KNQAVFIVSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1C ZINC000441418643 1027534965 /nfs/dbraw/zinc/53/49/65/1027534965.db2.gz VJCLNCPTNWRQEA-KNQAVFIVSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1C ZINC000441418643 1027534974 /nfs/dbraw/zinc/53/49/74/1027534974.db2.gz VJCLNCPTNWRQEA-KNQAVFIVSA-N 2 1 342.527 4.021 20 0 EIADMP CC[NH+]1CCC([N@H+](C)C/C(C)=C/c2ccccc2OC(F)F)CC1 ZINC000582969623 1027783628 /nfs/dbraw/zinc/78/36/28/1027783628.db2.gz BSBRZXNTPUQDGP-FYWRMAATSA-N 2 1 338.442 4.107 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)C/C(C)=C/c2ccccc2OC(F)F)CC1 ZINC000582969623 1027783640 /nfs/dbraw/zinc/78/36/40/1027783640.db2.gz BSBRZXNTPUQDGP-FYWRMAATSA-N 2 1 338.442 4.107 20 0 EIADMP C[N@@H+](Cc1cccc2cccnc21)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995891 1027819772 /nfs/dbraw/zinc/81/97/72/1027819772.db2.gz UPOKYLBEPJNTIK-WCRBZPEASA-N 2 1 335.495 4.072 20 0 EIADMP C[NH+](Cc1cccc2cccnc21)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167995891 1027819776 /nfs/dbraw/zinc/81/97/76/1027819776.db2.gz UPOKYLBEPJNTIK-WCRBZPEASA-N 2 1 335.495 4.072 20 0 EIADMP C[NH+](Cc1cccc2cccnc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167995891 1027819787 /nfs/dbraw/zinc/81/97/87/1027819787.db2.gz UPOKYLBEPJNTIK-WCRBZPEASA-N 2 1 335.495 4.072 20 0 EIADMP FC1(F)CC12CCC([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000657716722 1027844708 /nfs/dbraw/zinc/84/47/08/1027844708.db2.gz SRMJYQUDJDMJKR-UHFFFAOYSA-N 2 1 334.454 4.209 20 0 EIADMP C[N@@H+](C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1)C12CC3CC(CC(C3)C1)C2 ZINC001167996090 1027845286 /nfs/dbraw/zinc/84/52/86/1027845286.db2.gz WQTXUWKNLDYTLH-OJGPNISVSA-N 2 1 328.544 4.292 20 0 EIADMP C[NH+](C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C12CC3CC(CC(C3)C1)C2 ZINC001167996090 1027845290 /nfs/dbraw/zinc/84/52/90/1027845290.db2.gz WQTXUWKNLDYTLH-OJGPNISVSA-N 2 1 328.544 4.292 20 0 EIADMP C[NH+](C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C12CC3CC(CC(C3)C1)C2 ZINC001167996090 1027845297 /nfs/dbraw/zinc/84/52/97/1027845297.db2.gz WQTXUWKNLDYTLH-OJGPNISVSA-N 2 1 328.544 4.292 20 0 EIADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(Br)c(Cl)c2)CC1 ZINC000192165388 1027904646 /nfs/dbraw/zinc/90/46/46/1027904646.db2.gz CUYQRJXZXFYINX-UHFFFAOYSA-N 2 1 345.712 4.065 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000384022471 1027983425 /nfs/dbraw/zinc/98/34/25/1027983425.db2.gz KFFYVQVPZPUDFJ-PKOBYXMFSA-N 2 1 326.459 4.389 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCOc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000583099513 1028001498 /nfs/dbraw/zinc/00/14/98/1028001498.db2.gz MMBSJDPBDQVICB-UYAOXDASSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCOc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000583099513 1028001518 /nfs/dbraw/zinc/00/15/18/1028001518.db2.gz MMBSJDPBDQVICB-UYAOXDASSA-N 2 1 344.886 4.144 20 0 EIADMP Cc1cc(C)cc(OCCC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000523439828 1028117376 /nfs/dbraw/zinc/11/73/76/1028117376.db2.gz OSRRWJWFMKQMDJ-HXUWFJFHSA-N 2 1 330.516 4.023 20 0 EIADMP Cc1cccc([C@H](O)C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1 ZINC001167660088 1028269196 /nfs/dbraw/zinc/26/91/96/1028269196.db2.gz ZFKIRFZPWGYURR-DENIHFKCSA-N 2 1 344.543 4.005 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](CCOC)CC1)c1ccc(Cl)c(Cl)c1 ZINC000154832989 1028306495 /nfs/dbraw/zinc/30/64/95/1028306495.db2.gz ACCXPEINIQJORA-KRWDZBQOSA-N 2 1 345.314 4.145 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H]1Cc1ccccc1C ZINC000346192038 1028319064 /nfs/dbraw/zinc/31/90/64/1028319064.db2.gz XLFZJBCVFPLEPX-JOCHJYFZSA-N 2 1 346.478 4.091 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000346207114 1028328866 /nfs/dbraw/zinc/32/88/66/1028328866.db2.gz MCOSMCTXVJPVJN-OAHLLOKOSA-N 2 1 340.858 4.422 20 0 EIADMP CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346222501 1028333494 /nfs/dbraw/zinc/33/34/94/1028333494.db2.gz OWHSWDPVWOOCEJ-HXUWFJFHSA-N 2 1 334.467 4.029 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(C(C)(C)C)cc2)[C@H](C)C1 ZINC000523733323 1028343131 /nfs/dbraw/zinc/34/31/31/1028343131.db2.gz VVRWNXYVOJKGRP-WIYYLYMNSA-N 2 1 346.559 4.211 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@H+](C)CCn1cc[nH+]c1C ZINC000346335109 1028391402 /nfs/dbraw/zinc/39/14/02/1028391402.db2.gz YHKJWKZFIBXDLE-OAHLLOKOSA-N 2 1 340.496 4.316 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)CCn1cc[nH+]c1C ZINC000346335109 1028391424 /nfs/dbraw/zinc/39/14/24/1028391424.db2.gz YHKJWKZFIBXDLE-OAHLLOKOSA-N 2 1 340.496 4.316 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+][C@@H](c2ccc(F)cc2)c2ccccn2)c1 ZINC000346488187 1028467057 /nfs/dbraw/zinc/46/70/57/1028467057.db2.gz PLPMSIUFSXKFQK-QFIPXVFZSA-N 2 1 349.453 4.162 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC[N@H+]1C ZINC000443983776 1028694035 /nfs/dbraw/zinc/69/40/35/1028694035.db2.gz FXZFFQDJODLJKW-MAUKXSAKSA-N 2 1 328.431 4.190 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CNc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000635021364 1028832303 /nfs/dbraw/zinc/83/23/03/1028832303.db2.gz OCIDUCPOGIHUGN-HLAWJBBLSA-N 2 1 349.522 4.229 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CNc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000635021364 1028832307 /nfs/dbraw/zinc/83/23/07/1028832307.db2.gz OCIDUCPOGIHUGN-HLAWJBBLSA-N 2 1 349.522 4.229 20 0 EIADMP Clc1ccc2cccnc2c1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000157106222 1028945196 /nfs/dbraw/zinc/94/51/96/1028945196.db2.gz CBFDJLHFXUMIPJ-QGZVFWFLSA-N 2 1 343.902 4.339 20 0 EIADMP Clc1ccc2cccnc2c1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000157106222 1028945220 /nfs/dbraw/zinc/94/52/20/1028945220.db2.gz CBFDJLHFXUMIPJ-QGZVFWFLSA-N 2 1 343.902 4.339 20 0 EIADMP CSc1ccc2c(c1)[C@H]([NH2+]C1CC([NH+]3CCCCC3)C1)CCC2 ZINC000583630737 1028974059 /nfs/dbraw/zinc/97/40/59/1028974059.db2.gz QRPJHXYFSUPBNA-LBXVMSDZSA-N 2 1 330.541 4.392 20 0 EIADMP Cc1ccsc1C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000583660788 1029005105 /nfs/dbraw/zinc/00/51/05/1029005105.db2.gz MFWBSJIYHNLTMC-HXUWFJFHSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1ccsc1C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000583660788 1029005120 /nfs/dbraw/zinc/00/51/20/1029005120.db2.gz MFWBSJIYHNLTMC-HXUWFJFHSA-N 2 1 326.509 4.155 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CNc3ccccc3C2)CC1 ZINC000650749563 1029112728 /nfs/dbraw/zinc/11/27/28/1029112728.db2.gz PXMVNOZYPUPPAG-ORFBVSJDSA-N 2 1 349.522 4.056 20 0 EIADMP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650752843 1029146040 /nfs/dbraw/zinc/14/60/40/1029146040.db2.gz BREHZZIZEUOENG-LBPRGKRZSA-N 2 1 336.838 4.187 20 0 EIADMP Cc1onc(-c2ccccc2)c1C[N@@H+]1CC[C@H](Oc2cc[nH+]cc2C)C1 ZINC001141992345 1029335597 /nfs/dbraw/zinc/33/55/97/1029335597.db2.gz LRKGSWCXMXZRPB-SFHVURJKSA-N 2 1 349.434 4.007 20 0 EIADMP Cc1onc(-c2ccccc2)c1C[N@H+]1CC[C@H](Oc2cc[nH+]cc2C)C1 ZINC001141992345 1029335617 /nfs/dbraw/zinc/33/56/17/1029335617.db2.gz LRKGSWCXMXZRPB-SFHVURJKSA-N 2 1 349.434 4.007 20 0 EIADMP COC(C)(C)[C@H]1CCC[N@@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168058672 1029371572 /nfs/dbraw/zinc/37/15/72/1029371572.db2.gz BQXZDKBPOOBKGM-KOUHRCEDSA-N 2 1 344.543 4.317 20 0 EIADMP COC(C)(C)[C@H]1CCC[N@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168058672 1029371591 /nfs/dbraw/zinc/37/15/91/1029371591.db2.gz BQXZDKBPOOBKGM-KOUHRCEDSA-N 2 1 344.543 4.317 20 0 EIADMP COC(C)(C)[C@H]1CCC[NH+]1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168058672 1029371608 /nfs/dbraw/zinc/37/16/08/1029371608.db2.gz BQXZDKBPOOBKGM-KOUHRCEDSA-N 2 1 344.543 4.317 20 0 EIADMP COC(C)(C)[C@H]1CCC[NH+]1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168058672 1029371627 /nfs/dbraw/zinc/37/16/27/1029371627.db2.gz BQXZDKBPOOBKGM-KOUHRCEDSA-N 2 1 344.543 4.317 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000475212272 1029443786 /nfs/dbraw/zinc/44/37/86/1029443786.db2.gz UQQQGHYKWUEKTB-GOSISDBHSA-N 2 1 342.449 4.444 20 0 EIADMP Cc1cc2[nH]c(C[NH2+]C[C@@H]3CC[N@@H+](Cc4ccccc4)C3)cc2c(C)c1 ZINC000475278362 1029485571 /nfs/dbraw/zinc/48/55/71/1029485571.db2.gz VNCOKMLBNHDFRW-FQEVSTJZSA-N 2 1 347.506 4.396 20 0 EIADMP C[C@H](CCc1ccccc1F)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475279234 1029486808 /nfs/dbraw/zinc/48/68/08/1029486808.db2.gz XQWNNSPMYHPYEI-QUCCMNQESA-N 2 1 340.486 4.259 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1OCCC ZINC000248026743 1029491548 /nfs/dbraw/zinc/49/15/48/1029491548.db2.gz PIDLMNWVBWRNJE-JENIJYKNSA-N 2 1 348.531 4.398 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OCCC ZINC000248026743 1029491552 /nfs/dbraw/zinc/49/15/52/1029491552.db2.gz PIDLMNWVBWRNJE-JENIJYKNSA-N 2 1 348.531 4.398 20 0 EIADMP C[C@H]1C[C@H](NCc2cc(Cl)ccc2OC2CCCC2)CC[N@H+]1C ZINC000525207852 1029514930 /nfs/dbraw/zinc/51/49/30/1029514930.db2.gz RFDBKVYVIQJXKK-WMLDXEAASA-N 2 1 336.907 4.234 20 0 EIADMP C[C@@H](CC[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000446758577 1029571328 /nfs/dbraw/zinc/57/13/28/1029571328.db2.gz JUGMXEJCQWCTGH-IBGZPJMESA-N 2 1 337.511 4.424 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Br)c(Cl)c2)CC1 ZINC000657826548 1029597952 /nfs/dbraw/zinc/59/79/52/1029597952.db2.gz VXLZXCFRWHPNLD-NSHDSACASA-N 2 1 345.712 4.237 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000657829511 1029627321 /nfs/dbraw/zinc/62/73/21/1029627321.db2.gz DMGYTQPDBKJGQL-MRXNPFEDSA-N 2 1 340.433 4.243 20 0 EIADMP COc1ccccc1[C@@H](CNc1cc[nH+]c2ccsc21)[NH+](C)C ZINC000301351192 1029714365 /nfs/dbraw/zinc/71/43/65/1029714365.db2.gz JZQMDFJGDSCHSO-MRXNPFEDSA-N 2 1 327.453 4.020 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838607 1029721456 /nfs/dbraw/zinc/72/14/56/1029721456.db2.gz DAGRBKJCXZRYSB-ZNMIVQPWSA-N 2 1 325.447 4.038 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838607 1029721465 /nfs/dbraw/zinc/72/14/65/1029721465.db2.gz DAGRBKJCXZRYSB-ZNMIVQPWSA-N 2 1 325.447 4.038 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000657841280 1029753770 /nfs/dbraw/zinc/75/37/70/1029753770.db2.gz OPFNPJMHCNKEAE-JSGCOSHPSA-N 2 1 348.840 4.221 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000657841275 1029754801 /nfs/dbraw/zinc/75/48/01/1029754801.db2.gz OPFNPJMHCNKEAE-GXTWGEPZSA-N 2 1 348.840 4.221 20 0 EIADMP COc1ccc(C[NH+]2CCC(CNc3cc[nH+]cc3Cl)CC2)cc1 ZINC000301554956 1029759385 /nfs/dbraw/zinc/75/93/85/1029759385.db2.gz ZOJTVIPCKATDPE-UHFFFAOYSA-N 2 1 345.874 4.068 20 0 EIADMP CC[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCn1cc[nH+]c1C ZINC000657847744 1029773602 /nfs/dbraw/zinc/77/36/02/1029773602.db2.gz ZFIRIAHBCLCESS-KRWDZBQOSA-N 2 1 339.405 4.211 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCn1cc[nH+]c1C ZINC000657847745 1029774198 /nfs/dbraw/zinc/77/41/98/1029774198.db2.gz ZFIRIAHBCLCESS-QGZVFWFLSA-N 2 1 339.405 4.211 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)s1 ZINC000708528741 1029813119 /nfs/dbraw/zinc/81/31/19/1029813119.db2.gz IGKGJNJDPDFCDV-GOEBONIOSA-N 2 1 334.916 4.259 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cnc(C2CCCCC2)s1 ZINC000084021668 1029822506 /nfs/dbraw/zinc/82/25/06/1029822506.db2.gz HYQSSKVSGIGTSK-CQSZACIVSA-N 2 1 332.517 4.122 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657859383 1029845745 /nfs/dbraw/zinc/84/57/45/1029845745.db2.gz TVMMZSVJNQWDIS-HKUYNNGSSA-N 2 1 349.478 4.391 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657859383 1029845746 /nfs/dbraw/zinc/84/57/46/1029845746.db2.gz TVMMZSVJNQWDIS-HKUYNNGSSA-N 2 1 349.478 4.391 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000091313923 1029883173 /nfs/dbraw/zinc/88/31/73/1029883173.db2.gz JGDVQSLYCGIDCH-INIZCTEOSA-N 2 1 325.378 4.197 20 0 EIADMP c1c[nH]c([C@@H]2CCC[N@H+](Cc3ccccc3OC3CCCC3)C2)n1 ZINC000092071552 1029899752 /nfs/dbraw/zinc/89/97/52/1029899752.db2.gz XQEBQJZKPZQFLU-QGZVFWFLSA-N 2 1 325.456 4.111 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@H+](C[C@@H]3CCCCC3(F)F)C1)CCCC2 ZINC000450788102 1029983050 /nfs/dbraw/zinc/98/30/50/1029983050.db2.gz TUOLCUOOIRFOKH-JKSUJKDBSA-N 2 1 337.458 4.143 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@@H+](C[C@@H]3CCCCC3(F)F)C1)CCCC2 ZINC000450788102 1029983068 /nfs/dbraw/zinc/98/30/68/1029983068.db2.gz TUOLCUOOIRFOKH-JKSUJKDBSA-N 2 1 337.458 4.143 20 0 EIADMP Cc1nc2c(s1)[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C3CCC3)C1)CCC2 ZINC000183187774 1029994615 /nfs/dbraw/zinc/99/46/15/1029994615.db2.gz DHDHOQQKKDMISZ-FRFSOERESA-N 2 1 333.545 4.072 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1nc2c(s1)CCCC2 ZINC000093398259 1030002108 /nfs/dbraw/zinc/00/21/08/1030002108.db2.gz KBAYEMORCRGJAB-HOTGVXAUSA-N 2 1 335.561 4.327 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(C(F)F)nc2)c1 ZINC000657872240 1030088387 /nfs/dbraw/zinc/08/83/87/1030088387.db2.gz PNQFDQSCILELDG-CQSZACIVSA-N 2 1 333.426 4.322 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccc(F)c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000526050078 1030231823 /nfs/dbraw/zinc/23/18/23/1030231823.db2.gz KGDHETITUATNCM-QFBILLFUSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccc(F)c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000526050078 1030231851 /nfs/dbraw/zinc/23/18/51/1030231851.db2.gz KGDHETITUATNCM-QFBILLFUSA-N 2 1 344.449 4.150 20 0 EIADMP COc1ccsc1[C@@H](C)[NH2+]Cc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000186125420 1030253380 /nfs/dbraw/zinc/25/33/80/1030253380.db2.gz RHSIXVASQLOVET-GFCCVEGCSA-N 2 1 345.443 4.241 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000685443117 1030319773 /nfs/dbraw/zinc/31/97/73/1030319773.db2.gz BXXSPNUWCSQTLW-SJPCQFCGSA-N 2 1 326.406 4.071 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000685443117 1030319798 /nfs/dbraw/zinc/31/97/98/1030319798.db2.gz BXXSPNUWCSQTLW-SJPCQFCGSA-N 2 1 326.406 4.071 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000685443117 1030319816 /nfs/dbraw/zinc/31/98/16/1030319816.db2.gz BXXSPNUWCSQTLW-SJPCQFCGSA-N 2 1 326.406 4.071 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1OCCC ZINC000392288464 1030330520 /nfs/dbraw/zinc/33/05/20/1030330520.db2.gz LVVVXZRTGJHRKV-QGZVFWFLSA-N 2 1 346.515 4.177 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470103 1030352884 /nfs/dbraw/zinc/35/28/84/1030352884.db2.gz WFKFTOJMZXJMBP-XMSQKQJNSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470103 1030352899 /nfs/dbraw/zinc/35/28/99/1030352899.db2.gz WFKFTOJMZXJMBP-XMSQKQJNSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470103 1030352915 /nfs/dbraw/zinc/35/29/15/1030352915.db2.gz WFKFTOJMZXJMBP-XMSQKQJNSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470103 1030352940 /nfs/dbraw/zinc/35/29/40/1030352940.db2.gz WFKFTOJMZXJMBP-XMSQKQJNSA-N 2 1 337.511 4.227 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH+](C)[C@@H]1CC[N@@H+](C)C[C@@H]1C ZINC000685470051 1030353964 /nfs/dbraw/zinc/35/39/64/1030353964.db2.gz LMSWROTUWHNWPP-ZLTRSOCKSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH+](C)[C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000685470051 1030353980 /nfs/dbraw/zinc/35/39/80/1030353980.db2.gz LMSWROTUWHNWPP-ZLTRSOCKSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[N@@H+](C)[C@@H]1CC[NH+](C)C[C@@H]1C ZINC000685470051 1030353998 /nfs/dbraw/zinc/35/39/98/1030353998.db2.gz LMSWROTUWHNWPP-ZLTRSOCKSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[N@H+](C)[C@@H]1CC[NH+](C)C[C@@H]1C ZINC000685470051 1030354005 /nfs/dbraw/zinc/35/40/05/1030354005.db2.gz LMSWROTUWHNWPP-ZLTRSOCKSA-N 2 1 340.433 4.381 20 0 EIADMP CCOC1CCC([NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)CC1 ZINC000657891336 1030363066 /nfs/dbraw/zinc/36/30/66/1030363066.db2.gz ZEYZALOINJXLKH-OCDPCBSRSA-N 2 1 330.516 4.149 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000657892741 1030375875 /nfs/dbraw/zinc/37/58/75/1030375875.db2.gz XSQDDSYCGVBMMO-XYPHTWIQSA-N 2 1 328.422 4.099 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000657892741 1030375894 /nfs/dbraw/zinc/37/58/94/1030375894.db2.gz XSQDDSYCGVBMMO-XYPHTWIQSA-N 2 1 328.422 4.099 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)C[C@@H]1C ZINC000530663224 1030620082 /nfs/dbraw/zinc/62/00/82/1030620082.db2.gz YNSHKOXVEPOUSC-HOCLYGCPSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Cl)c3cccnc23)C[C@@H]1C ZINC000530663224 1030620094 /nfs/dbraw/zinc/62/00/94/1030620094.db2.gz YNSHKOXVEPOUSC-HOCLYGCPSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c3cccnc23)C[C@@H]1C ZINC000530663224 1030620121 /nfs/dbraw/zinc/62/01/21/1030620121.db2.gz YNSHKOXVEPOUSC-HOCLYGCPSA-N 2 1 331.891 4.193 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000548851782 1030634281 /nfs/dbraw/zinc/63/42/81/1030634281.db2.gz FHCPGEDZZOCZAD-BAAYTWLHSA-N 2 1 326.406 4.040 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(C(F)F)nc2)C1 ZINC000657932241 1030637592 /nfs/dbraw/zinc/63/75/92/1030637592.db2.gz VAJNSEPGZLPTBD-HUUCEWRRSA-N 2 1 325.447 4.038 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(C(F)F)nc2)C1 ZINC000657932241 1030637599 /nfs/dbraw/zinc/63/75/99/1030637599.db2.gz VAJNSEPGZLPTBD-HUUCEWRRSA-N 2 1 325.447 4.038 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2ncc(C(C)(C)C)s2)CC1 ZINC000448223772 1030661643 /nfs/dbraw/zinc/66/16/43/1030661643.db2.gz PIJMODJHUOQXCJ-UHFFFAOYSA-N 2 1 337.577 4.385 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ncc(C(C)(C)C)s2)CC1 ZINC000448223772 1030661661 /nfs/dbraw/zinc/66/16/61/1030661661.db2.gz PIJMODJHUOQXCJ-UHFFFAOYSA-N 2 1 337.577 4.385 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2c(F)cccc2F)o1 ZINC000115616386 1030688540 /nfs/dbraw/zinc/68/85/40/1030688540.db2.gz RUOHPIDGLMHVTF-CYBMUJFWSA-N 2 1 345.393 4.156 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000398107406 1030697811 /nfs/dbraw/zinc/69/78/11/1030697811.db2.gz BYHHGMZJGWHUQN-NPFVIJTESA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000398107406 1030697831 /nfs/dbraw/zinc/69/78/31/1030697831.db2.gz BYHHGMZJGWHUQN-NPFVIJTESA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCc2c1cccc2F ZINC000398131415 1030712802 /nfs/dbraw/zinc/71/28/02/1030712802.db2.gz JQSJITNNAOJIFK-URZJWIJPSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCc2c1cccc2F ZINC000398131415 1030712818 /nfs/dbraw/zinc/71/28/18/1030712818.db2.gz JQSJITNNAOJIFK-URZJWIJPSA-N 2 1 338.470 4.313 20 0 EIADMP Cc1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc(C)c1O ZINC000398182632 1030732917 /nfs/dbraw/zinc/73/29/17/1030732917.db2.gz KKMMTTGOQHOVJI-GHTZIAJQSA-N 2 1 338.495 4.009 20 0 EIADMP Clc1ccc2oc(C3CC[NH+](CCC[NH+]4CCCC4)CC3)nc2c1 ZINC000193473068 1030797090 /nfs/dbraw/zinc/79/70/90/1030797090.db2.gz WLTGMMJJGHEJMQ-UHFFFAOYSA-N 2 1 347.890 4.147 20 0 EIADMP C1CCC(OC2CCC([NH2+][C@H]3CC[N@@H+](C4CCCCC4)C3)CC2)C1 ZINC000658229377 1030891601 /nfs/dbraw/zinc/89/16/01/1030891601.db2.gz CFTJNFQUHVYUHK-WBTXTPOCSA-N 2 1 334.548 4.253 20 0 EIADMP C1CCC(OC2CCC([NH2+][C@H]3CC[N@H+](C4CCCCC4)C3)CC2)C1 ZINC000658229377 1030891603 /nfs/dbraw/zinc/89/16/03/1030891603.db2.gz CFTJNFQUHVYUHK-WBTXTPOCSA-N 2 1 334.548 4.253 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)cc1 ZINC000658235995 1030894333 /nfs/dbraw/zinc/89/43/33/1030894333.db2.gz GYZFYURWVOIVQQ-SZNDQCEHSA-N 2 1 333.435 4.224 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCSc2ccccc2Cl)CC[N@@H+]1C ZINC000531143401 1030914824 /nfs/dbraw/zinc/91/48/24/1030914824.db2.gz IZOICXCKQWSUAQ-LSDHHAIUSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCSc2ccccc2Cl)CC[N@H+]1C ZINC000531143401 1030914853 /nfs/dbraw/zinc/91/48/53/1030914853.db2.gz IZOICXCKQWSUAQ-LSDHHAIUSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)CCCSc2ccccc2Cl)CC[NH+]1C ZINC000531143401 1030914873 /nfs/dbraw/zinc/91/48/73/1030914873.db2.gz IZOICXCKQWSUAQ-LSDHHAIUSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)CCCSc2ccccc2Cl)CC[NH+]1C ZINC000531143401 1030914895 /nfs/dbraw/zinc/91/48/95/1030914895.db2.gz IZOICXCKQWSUAQ-LSDHHAIUSA-N 2 1 326.937 4.237 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1OCCC ZINC000392722146 1030946758 /nfs/dbraw/zinc/94/67/58/1030946758.db2.gz PTWYZTCJCPXEGI-QZTJIDSGSA-N 2 1 348.531 4.257 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)C1CCOCC1 ZINC000532459775 1031107033 /nfs/dbraw/zinc/10/70/33/1031107033.db2.gz IVSHHGSSUUXKFV-GCJKJVERSA-N 2 1 344.543 4.213 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)CCOc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000531378174 1031138697 /nfs/dbraw/zinc/13/86/97/1031138697.db2.gz DGFJXBFNTLNZHK-UONOGXRCSA-N 2 1 345.314 4.177 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCOc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000531378174 1031138710 /nfs/dbraw/zinc/13/87/10/1031138710.db2.gz DGFJXBFNTLNZHK-UONOGXRCSA-N 2 1 345.314 4.177 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCOc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000531378174 1031138724 /nfs/dbraw/zinc/13/87/24/1031138724.db2.gz DGFJXBFNTLNZHK-UONOGXRCSA-N 2 1 345.314 4.177 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCOc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000531378174 1031138744 /nfs/dbraw/zinc/13/87/44/1031138744.db2.gz DGFJXBFNTLNZHK-UONOGXRCSA-N 2 1 345.314 4.177 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000532506783 1031228330 /nfs/dbraw/zinc/22/83/30/1031228330.db2.gz FXUMAODPFZMWOV-LMMKCTJWSA-N 2 1 332.557 4.410 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@H](C)[C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000532514295 1031244994 /nfs/dbraw/zinc/24/49/94/1031244994.db2.gz GIXISHXEKCNYDD-RTBURBONSA-N 2 1 344.543 4.192 20 0 EIADMP CCC(CC)(CN[C@@H]1C[C@H](C)[N@@H+](C)C[C@@H]1C)[NH2+][C@H](C)c1ccccc1 ZINC000532517022 1031248622 /nfs/dbraw/zinc/24/86/22/1031248622.db2.gz MAWIRKASXQLFEJ-CTAFRAEOSA-N 2 1 345.575 4.214 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCOC3(CCC3)C2)C1 ZINC000449082168 1031438436 /nfs/dbraw/zinc/43/84/36/1031438436.db2.gz LFFHJTMAZISQNL-NQIIRXRSSA-N 2 1 342.527 4.110 20 0 EIADMP Cc1ccc2sc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)nc2c1 ZINC000528370996 1031455855 /nfs/dbraw/zinc/45/58/55/1031455855.db2.gz GTUFKBMXVSUTMN-UHFFFAOYSA-N 2 1 331.529 4.157 20 0 EIADMP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)c2cccc(O)c2)CC1 ZINC000449129590 1031467602 /nfs/dbraw/zinc/46/76/02/1031467602.db2.gz CSAIJQUWEVHKKB-ROUUACIJSA-N 2 1 338.495 4.138 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)Cc3coc4ccccc34)CC2)[nH+]1 ZINC000449143923 1031478039 /nfs/dbraw/zinc/47/80/39/1031478039.db2.gz RJZLPEYVTZZZIT-QGZVFWFLSA-N 2 1 349.478 4.326 20 0 EIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000531715400 1031501927 /nfs/dbraw/zinc/50/19/27/1031501927.db2.gz ZOOLAGCFLCYWSC-ZBFHGGJFSA-N 2 1 326.937 4.142 20 0 EIADMP C[C@@H]([NH2+]C1CCC(OC2CCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000449231325 1031561552 /nfs/dbraw/zinc/56/15/52/1031561552.db2.gz DGUQYEXVNBSWJX-HQHQBECKSA-N 2 1 348.575 4.499 20 0 EIADMP C[C@H](NCCC[N@H+]1CCCC[C@H]1C)c1ncc(-c2ccccc2)n1C ZINC000453093397 1031585050 /nfs/dbraw/zinc/58/50/50/1031585050.db2.gz RCJUIOYTVFWRDU-MSOLQXFVSA-N 2 1 340.515 4.002 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H](C3CC3)C3CCCC3)CC2)oc1C ZINC000453118585 1031612306 /nfs/dbraw/zinc/61/23/06/1031612306.db2.gz KXHWJFQWGSCZSC-NRFANRHFSA-N 2 1 345.531 4.062 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453122747 1031615582 /nfs/dbraw/zinc/61/55/82/1031615582.db2.gz PKDYFHQYRJQBTC-KZNAEPCWSA-N 2 1 340.433 4.362 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000453122044 1031616104 /nfs/dbraw/zinc/61/61/04/1031616104.db2.gz DYKKGSXCDRARBX-RCCFBDPRSA-N 2 1 339.483 4.397 20 0 EIADMP CC[N@H+](Cc1ccnn1C1CCCC1)Cc1ccc(C[NH+](C)C)cc1 ZINC000449324697 1031623402 /nfs/dbraw/zinc/62/34/02/1031623402.db2.gz HCTXADLENPDYQY-UHFFFAOYSA-N 2 1 340.515 4.082 20 0 EIADMP CC[N@@H+](Cc1ccnn1C1CCCC1)Cc1ccc(C[NH+](C)C)cc1 ZINC000449324697 1031623429 /nfs/dbraw/zinc/62/34/29/1031623429.db2.gz HCTXADLENPDYQY-UHFFFAOYSA-N 2 1 340.515 4.082 20 0 EIADMP CC1(C)C[N@@H+](Cc2cccnc2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449413592 1031695761 /nfs/dbraw/zinc/69/57/61/1031695761.db2.gz JLEQUDOGHOUGMZ-QFIPXVFZSA-N 2 1 349.522 4.204 20 0 EIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCCO2 ZINC000453335189 1031860402 /nfs/dbraw/zinc/86/04/02/1031860402.db2.gz DCPGHNOQYOZINF-DLZDZTESSA-N 2 1 328.500 4.239 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C1CCOCC1 ZINC000531967643 1031888560 /nfs/dbraw/zinc/88/85/60/1031888560.db2.gz RCTVHNLTXPTACP-UTKZUKDTSA-N 2 1 330.516 4.007 20 0 EIADMP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000531970871 1031903582 /nfs/dbraw/zinc/90/35/82/1031903582.db2.gz ZDINZSKSVGJXEE-BFHYXJOUSA-N 2 1 345.314 4.081 20 0 EIADMP Cc1cccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cccc(F)c2)c1 ZINC000453376695 1031926460 /nfs/dbraw/zinc/92/64/60/1031926460.db2.gz YRFNHFSVELKRSZ-LQCXBHPOSA-N 2 1 338.470 4.438 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cccc(OC(F)(F)F)c1 ZINC000453399171 1031933179 /nfs/dbraw/zinc/93/31/79/1031933179.db2.gz KZQLVTCRNSHBBP-ZDUSSCGKSA-N 2 1 330.394 4.110 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(F)cc1Br ZINC000453399781 1031934182 /nfs/dbraw/zinc/93/41/82/1031934182.db2.gz LJTFZCLXEUWCLE-GFCCVEGCSA-N 2 1 343.284 4.113 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000453417581 1031952390 /nfs/dbraw/zinc/95/23/90/1031952390.db2.gz XVEGFGIYBKHQFZ-HUUCEWRRSA-N 2 1 331.529 4.252 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(OC(F)(F)F)cc1 ZINC000453420099 1031974835 /nfs/dbraw/zinc/97/48/35/1031974835.db2.gz ZCLSHIBLHNIXJP-CYBMUJFWSA-N 2 1 330.394 4.110 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]CCCC[N@@H+](C)C2CC2)cc1 ZINC000453592404 1032035362 /nfs/dbraw/zinc/03/53/62/1032035362.db2.gz DZBHWQNAEIUTJS-UHFFFAOYSA-N 2 1 338.495 4.326 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000512646591 1033613359 /nfs/dbraw/zinc/61/33/59/1033613359.db2.gz BMWAUGSCCQIEGO-VNTMZGSJSA-N 2 1 348.481 4.455 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCC2)c1)c1nccs1 ZINC000411518280 1033955690 /nfs/dbraw/zinc/95/56/90/1033955690.db2.gz OVGUYLQJWJAHOO-SFHVURJKSA-N 2 1 329.513 4.370 20 0 EIADMP C[C@H]1[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCC12CCOCC2 ZINC000411527755 1033964717 /nfs/dbraw/zinc/96/47/17/1033964717.db2.gz QXXRKLWYTSWXMK-LJQANCHMSA-N 2 1 342.527 4.064 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC1(C(F)(F)F)CC1 ZINC000512868449 1034102756 /nfs/dbraw/zinc/10/27/56/1034102756.db2.gz CYBWBYCDKVMAKY-UHFFFAOYSA-N 2 1 328.422 4.077 20 0 EIADMP C[N@@H+](Cc1ccc(-c2cccs2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513127017 1034604229 /nfs/dbraw/zinc/60/42/29/1034604229.db2.gz BHDNWNKRCWAIFK-DFNIBXOVSA-N 2 1 326.509 4.472 20 0 EIADMP C[NH+](Cc1ccc(-c2cccs2)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000513127017 1034604245 /nfs/dbraw/zinc/60/42/45/1034604245.db2.gz BHDNWNKRCWAIFK-DFNIBXOVSA-N 2 1 326.509 4.472 20 0 EIADMP C[NH+](Cc1ccc(-c2cccs2)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000513127017 1034604261 /nfs/dbraw/zinc/60/42/61/1034604261.db2.gz BHDNWNKRCWAIFK-DFNIBXOVSA-N 2 1 326.509 4.472 20 0 EIADMP 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 1034710673 /nfs/dbraw/zinc/71/06/73/1034710673.db2.gz GVMRSHOMCRAQES-YDMYOYKNSA-N 2 1 330.541 4.079 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+]([C@H]3C[C@H]4C[C@H]4C3)C[C@@H]21 ZINC001167934139 1034710688 /nfs/dbraw/zinc/71/06/88/1034710688.db2.gz GVMRSHOMCRAQES-YDMYOYKNSA-N 2 1 330.541 4.079 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+]([C@H]3C[C@H]4C[C@H]4C3)C[C@@H]21 ZINC001167934139 1034710702 /nfs/dbraw/zinc/71/07/02/1034710702.db2.gz GVMRSHOMCRAQES-YDMYOYKNSA-N 2 1 330.541 4.079 20 0 EIADMP COc1ccccc1C[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513500032 1034997730 /nfs/dbraw/zinc/99/77/30/1034997730.db2.gz KMYKOPSBVDGDAS-ICSRJNTNSA-N 2 1 338.495 4.086 20 0 EIADMP COc1ccccc1C[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513500031 1034998620 /nfs/dbraw/zinc/99/86/20/1034998620.db2.gz KMYKOPSBVDGDAS-AZUAARDMSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc(Cl)o2)C[N@H+]1Cc1ccccc1 ZINC000513501542 1034999468 /nfs/dbraw/zinc/99/94/68/1034999468.db2.gz TVTQRHXIURNJQL-NVXWUHKLSA-N 2 1 332.875 4.323 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501384129 1035436246 /nfs/dbraw/zinc/43/62/46/1035436246.db2.gz WRWVEMQVKNAFDD-HDAAZOAOSA-N 2 1 329.532 4.065 20 0 EIADMP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000420307251 1035505658 /nfs/dbraw/zinc/50/56/58/1035505658.db2.gz BILYTKVVPVAZCR-YLJYHZDGSA-N 2 1 340.515 4.144 20 0 EIADMP CCSC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000595100650 1035589853 /nfs/dbraw/zinc/58/98/53/1035589853.db2.gz TZVMMMIWIGCNDQ-REPLKXPHSA-N 2 1 330.541 4.057 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000485257797 1035801548 /nfs/dbraw/zinc/80/15/48/1035801548.db2.gz HADPKMFKABLZFO-NBCNXNJRSA-N 2 1 338.470 4.313 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCCC[C@@H]3CC)CC2)cs1 ZINC000502035236 1035813621 /nfs/dbraw/zinc/81/36/21/1035813621.db2.gz QZBHHYZFBKJSAX-HKUYNNGSSA-N 2 1 349.588 4.476 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CC23CCSCC3)cc1 ZINC000421374270 1036324835 /nfs/dbraw/zinc/32/48/35/1036324835.db2.gz HGLZTJSBLGMTCT-YJBOKZPZSA-N 2 1 341.524 4.365 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502729033 1036589255 /nfs/dbraw/zinc/58/92/55/1036589255.db2.gz VICITSWNRADEPX-QZTJIDSGSA-N 2 1 332.536 4.161 20 0 EIADMP Clc1ccc(O[C@@H]2CCC[N@@H+](C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC001168387287 1036677215 /nfs/dbraw/zinc/67/72/15/1036677215.db2.gz BUFDHBPKDKPAAK-HXUWFJFHSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(O[C@@H]2CCC[N@H+](C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC001168387287 1036677237 /nfs/dbraw/zinc/67/72/37/1036677237.db2.gz BUFDHBPKDKPAAK-HXUWFJFHSA-N 2 1 348.918 4.058 20 0 EIADMP C[C@H]([NH2+]C/C=C\c1ccc(F)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486472921 1036722029 /nfs/dbraw/zinc/72/20/29/1036722029.db2.gz DPKARZYRVMHYLF-BAZGULGGSA-N 2 1 338.470 4.339 20 0 EIADMP C[N@H+](Cc1ccccc1C(F)(F)F)C1CC[NH+](CC2CC2)CC1 ZINC001168390967 1036798757 /nfs/dbraw/zinc/79/87/57/1036798757.db2.gz JNYPCDBYBOMZHG-UHFFFAOYSA-N 2 1 326.406 4.012 20 0 EIADMP C[N@@H+](Cc1ccccc1C(F)(F)F)C1CC[NH+](CC2CC2)CC1 ZINC001168390967 1036798786 /nfs/dbraw/zinc/79/87/86/1036798786.db2.gz JNYPCDBYBOMZHG-UHFFFAOYSA-N 2 1 326.406 4.012 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3ccc(F)cc3[nH]2)c1 ZINC000486688126 1036817066 /nfs/dbraw/zinc/81/70/66/1036817066.db2.gz FRQZZPGSNQLYQH-UHFFFAOYSA-N 2 1 325.431 4.049 20 0 EIADMP Clc1cccc(OC2CC[NH+](C3CC[NH+](CC4CC4)CC3)CC2)c1 ZINC001168393172 1036863911 /nfs/dbraw/zinc/86/39/11/1036863911.db2.gz YCARNENRDOKQNZ-UHFFFAOYSA-N 2 1 348.918 4.058 20 0 EIADMP CN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000589837985 1036880280 /nfs/dbraw/zinc/88/02/80/1036880280.db2.gz OEAWLNDITAQATE-FGZHOGPDSA-N 2 1 335.495 4.171 20 0 EIADMP CN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000589837985 1036880281 /nfs/dbraw/zinc/88/02/81/1036880281.db2.gz OEAWLNDITAQATE-FGZHOGPDSA-N 2 1 335.495 4.171 20 0 EIADMP c1ccc(CC[C@@H]2CCC[N@H+](C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC001168395180 1036881350 /nfs/dbraw/zinc/88/13/50/1036881350.db2.gz PGHKRSPUAWGNJU-FQEVSTJZSA-N 2 1 326.528 4.206 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(C)ccc1OC ZINC000589999647 1036918190 /nfs/dbraw/zinc/91/81/90/1036918190.db2.gz QCCUKKFXZJKWBQ-UHFFFAOYSA-N 2 1 326.484 4.087 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1nccn1C ZINC000271742678 1037004242 /nfs/dbraw/zinc/00/42/42/1037004242.db2.gz VSIHOSLEWFWZNZ-FXAWDEMLSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1nccn1C ZINC000271742678 1037004263 /nfs/dbraw/zinc/00/42/63/1037004263.db2.gz VSIHOSLEWFWZNZ-FXAWDEMLSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@H]([NH2+]CCCc1c[nH+]cn1C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000569738793 1037022029 /nfs/dbraw/zinc/02/20/29/1037022029.db2.gz ZTOPYDQGYBTPBA-KGLIPLIRSA-N 2 1 339.405 4.153 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(Cl)c3cccnc23)CC1 ZINC000590786192 1037167665 /nfs/dbraw/zinc/16/76/65/1037167665.db2.gz GLIBYOGFLSKQEB-UHFFFAOYSA-N 2 1 345.918 4.440 20 0 EIADMP CC[C@@H]1C[C@H](C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000569860856 1037180925 /nfs/dbraw/zinc/18/09/25/1037180925.db2.gz MSSZQMDBIDHUDI-YPAWHYETSA-N 2 1 344.543 4.084 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000569860853 1037182476 /nfs/dbraw/zinc/18/24/76/1037182476.db2.gz MSSZQMDBIDHUDI-BHDDXSALSA-N 2 1 344.543 4.084 20 0 EIADMP CC(C)CCc1nc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cs1 ZINC000590819030 1037182788 /nfs/dbraw/zinc/18/27/88/1037182788.db2.gz UNBKVOGCZFLFMK-UHFFFAOYSA-N 2 1 337.577 4.284 20 0 EIADMP CC(C)CCc1nc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cs1 ZINC000590819030 1037182798 /nfs/dbraw/zinc/18/27/98/1037182798.db2.gz UNBKVOGCZFLFMK-UHFFFAOYSA-N 2 1 337.577 4.284 20 0 EIADMP CCc1ncc(C[NH+]2CCC(CC[N@H+](CC)CC(C)C)CC2)s1 ZINC000573167389 1037385373 /nfs/dbraw/zinc/38/53/73/1037385373.db2.gz FSLUDRAIVBVXNV-UHFFFAOYSA-N 2 1 337.577 4.286 20 0 EIADMP CC[NH+](CC)CC1CC[NH+](Cc2csc(C3CCCC3)n2)CC1 ZINC000488270433 1037468971 /nfs/dbraw/zinc/46/89/71/1037468971.db2.gz UKGWCFHNCUBRNI-UHFFFAOYSA-N 2 1 335.561 4.355 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(N(C)c2ccccc2)cc1 ZINC000591700474 1037551921 /nfs/dbraw/zinc/55/19/21/1037551921.db2.gz DANCKSPHXIFOMO-SFHVURJKSA-N 2 1 348.494 4.385 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CS[C@H](C(C)C)C2)cc1 ZINC000488427696 1037587030 /nfs/dbraw/zinc/58/70/30/1037587030.db2.gz XYGDJSFQFLTUCR-YJLNNSPDSA-N 2 1 329.513 4.361 20 0 EIADMP CC[C@@H]1C[C@H](C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000503572728 1037824116 /nfs/dbraw/zinc/82/41/16/1037824116.db2.gz HHKMJPMHYLVUCB-WSWWRLHASA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CN[C@@H]3C[C@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866966 1037849524 /nfs/dbraw/zinc/84/95/24/1037849524.db2.gz RGZOJHFOMMLFJE-MQNAVGNWSA-N 2 1 349.522 4.153 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3C[C@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866966 1037849530 /nfs/dbraw/zinc/84/95/30/1037849530.db2.gz RGZOJHFOMMLFJE-MQNAVGNWSA-N 3 1 349.522 4.153 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@@H]3C[C@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866966 1037849537 /nfs/dbraw/zinc/84/95/37/1037849537.db2.gz RGZOJHFOMMLFJE-MQNAVGNWSA-N 3 1 349.522 4.153 20 0 EIADMP Clc1ccc2sc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)nc2c1 ZINC000422899186 1037861891 /nfs/dbraw/zinc/86/18/91/1037861891.db2.gz GYDIHCLLWJCUBQ-QLFBSQMISA-N 2 1 349.931 4.350 20 0 EIADMP Clc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2cccs2)cc1 ZINC000422946099 1037882657 /nfs/dbraw/zinc/88/26/57/1037882657.db2.gz OLGMAQSKPOHJPA-ONYGOOLBSA-N 2 1 332.900 4.364 20 0 EIADMP c1ccc(-c2cccc3c2OCC[C@@H]3[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422957190 1037889300 /nfs/dbraw/zinc/88/93/00/1037889300.db2.gz SLCDOOVIPQBTTE-APZTZJSISA-N 2 1 334.463 4.050 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c2ccccc21 ZINC000423019750 1037905885 /nfs/dbraw/zinc/90/58/85/1037905885.db2.gz WZVNPLBIODRIHF-XWSJACJDSA-N 2 1 346.833 4.044 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CCC[N@@H+](C2CCCC2)CC1 ZINC000606156563 1037909087 /nfs/dbraw/zinc/90/90/87/1037909087.db2.gz BIRATQVSPDYRBP-UHFFFAOYSA-N 2 1 329.875 4.343 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CCC[N@H+](C2CCCC2)CC1 ZINC000606156563 1037909101 /nfs/dbraw/zinc/90/91/01/1037909101.db2.gz BIRATQVSPDYRBP-UHFFFAOYSA-N 2 1 329.875 4.343 20 0 EIADMP CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423035486 1037917966 /nfs/dbraw/zinc/91/79/66/1037917966.db2.gz JPKYSYYYCCIZJS-BTINSWFASA-N 2 1 330.859 4.150 20 0 EIADMP CCSc1ccc([C@@H](C)[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000423181473 1038035687 /nfs/dbraw/zinc/03/56/87/1038035687.db2.gz CXYPWNUSYKBOMJ-MRXNPFEDSA-N 2 1 329.513 4.024 20 0 EIADMP c1ccc2cc(OCC[N@@H+]3CCC[C@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000606447872 1038068624 /nfs/dbraw/zinc/06/86/24/1038068624.db2.gz KFHVMIOGGHWQRH-NRFANRHFSA-N 2 1 338.495 4.169 20 0 EIADMP c1ccc2cc(OCC[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000606447872 1038068648 /nfs/dbraw/zinc/06/86/48/1038068648.db2.gz KFHVMIOGGHWQRH-NRFANRHFSA-N 2 1 338.495 4.169 20 0 EIADMP C[N@H+](Cc1ccc(OCc2ccccc2)cc1)C[C@@H]1CCC[NH+](C)C1 ZINC000607358217 1038080270 /nfs/dbraw/zinc/08/02/70/1038080270.db2.gz RMRAEZMZAVFTPA-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP C[NH+](Cc1ccc(OCc2ccccc2)cc1)C[C@@H]1CCC[N@H+](C)C1 ZINC000607358217 1038080294 /nfs/dbraw/zinc/08/02/94/1038080294.db2.gz RMRAEZMZAVFTPA-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP C[NH+](Cc1ccc(OCc2ccccc2)cc1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000607358217 1038080317 /nfs/dbraw/zinc/08/03/17/1038080317.db2.gz RMRAEZMZAVFTPA-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cccc3c2OC(C)(C)C3)C1 ZINC000606469275 1038090914 /nfs/dbraw/zinc/09/09/14/1038090914.db2.gz FHBXMVFUNYHYOV-QGZVFWFLSA-N 2 1 330.516 4.002 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423290811 1038095164 /nfs/dbraw/zinc/09/51/64/1038095164.db2.gz FODDJEPMBCTEFR-HZPDHXFCSA-N 3 1 334.467 4.051 20 0 EIADMP CCCC[C@@H](C[NH3+])[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000423303547 1038127683 /nfs/dbraw/zinc/12/76/83/1038127683.db2.gz XFUABXYSXCBAMF-RBUKOAKNSA-N 2 1 331.891 4.126 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1 ZINC000423344726 1038138084 /nfs/dbraw/zinc/13/80/84/1038138084.db2.gz FMNZFCLQCZPLAZ-OYHNWAKOSA-N 2 1 346.478 4.491 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000423385009 1038195671 /nfs/dbraw/zinc/19/56/71/1038195671.db2.gz QTDRODSTLWSJGN-VNHYZAJKSA-N 2 1 334.410 4.232 20 0 EIADMP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000423391350 1038200046 /nfs/dbraw/zinc/20/00/46/1038200046.db2.gz KXJLPRFOIWLNEZ-VMDGZTHMSA-N 2 1 332.850 4.156 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccc(F)c1F ZINC000423476252 1038249897 /nfs/dbraw/zinc/24/98/97/1038249897.db2.gz RAFHFCIHNXWJNU-DHSIGJKJSA-N 2 1 348.412 4.148 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)CCOc2cc(Cl)cc(Cl)c2)CC1 ZINC000607728170 1038302652 /nfs/dbraw/zinc/30/26/52/1038302652.db2.gz MQGNSOWQYWLDLZ-UHFFFAOYSA-N 2 1 345.314 4.177 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCOc2cc(Cl)cc(Cl)c2)CC1 ZINC000607728170 1038302671 /nfs/dbraw/zinc/30/26/71/1038302671.db2.gz MQGNSOWQYWLDLZ-UHFFFAOYSA-N 2 1 345.314 4.177 20 0 EIADMP C[N@H+](CCCc1cccc(F)c1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000490010785 1038315511 /nfs/dbraw/zinc/31/55/11/1038315511.db2.gz BUGBXVLMBOPNKD-UHFFFAOYSA-N 2 1 340.486 4.355 20 0 EIADMP C[N@@H+](CCCc1cccc(F)c1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000490010785 1038315534 /nfs/dbraw/zinc/31/55/34/1038315534.db2.gz BUGBXVLMBOPNKD-UHFFFAOYSA-N 2 1 340.486 4.355 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000490070174 1038332003 /nfs/dbraw/zinc/33/20/03/1038332003.db2.gz WRCXGXISGHLADO-IRXDYDNUSA-N 2 1 347.572 4.076 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000490070174 1038332014 /nfs/dbraw/zinc/33/20/14/1038332014.db2.gz WRCXGXISGHLADO-IRXDYDNUSA-N 2 1 347.572 4.076 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000490070174 1038332023 /nfs/dbraw/zinc/33/20/23/1038332023.db2.gz WRCXGXISGHLADO-IRXDYDNUSA-N 2 1 347.572 4.076 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000490173614 1038368917 /nfs/dbraw/zinc/36/89/17/1038368917.db2.gz XATYQKXZGHAAPF-IBGZPJMESA-N 2 1 325.843 4.224 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000594786051 1038401812 /nfs/dbraw/zinc/40/18/12/1038401812.db2.gz ISDGXNRSXYNHSL-AWEZNQCLSA-N 2 1 334.916 4.500 20 0 EIADMP Cc1c(Cl)c(C[N@@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)nc2ccccc12 ZINC000424289143 1038768885 /nfs/dbraw/zinc/76/88/85/1038768885.db2.gz LTBVRURZFFSRAT-AWEZNQCLSA-N 2 1 343.902 4.161 20 0 EIADMP CO[C@H]1C[C@H]2C[C@H]([NH2+]C3CC[NH+]([C@@H](C)c4ccccc4)CC3)C[C@H]2C1 ZINC000424315669 1038800735 /nfs/dbraw/zinc/80/07/35/1038800735.db2.gz PQXWKFPSWODNRB-RNDWMSIDSA-N 2 1 342.527 4.005 20 0 EIADMP CO[C@H]1C[C@H]2C[C@H]([NH2+][C@H](C)c3ccc(-n4cc[nH+]c4C)cc3)C[C@H]2C1 ZINC000424307191 1038814577 /nfs/dbraw/zinc/81/45/77/1038814577.db2.gz XAMHQQCIEMMKDK-VDRYQNKJSA-N 2 1 339.483 4.035 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000539083148 1038814495 /nfs/dbraw/zinc/81/44/95/1038814495.db2.gz WVHSAIUKVCPXFN-KGLIPLIRSA-N 2 1 339.405 4.067 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000504927760 1038857066 /nfs/dbraw/zinc/85/70/66/1038857066.db2.gz UESBNPCWUKTUSI-ZIAGYGMSSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1c(F)cccc1F ZINC000480904325 1038859930 /nfs/dbraw/zinc/85/99/30/1038859930.db2.gz VZGGUVHZSRGCJQ-LSDHHAIUSA-N 2 1 348.437 4.317 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1 ZINC001168324859 1038873861 /nfs/dbraw/zinc/87/38/61/1038873861.db2.gz YQRAATMDXKTNIR-FAEJEUNOSA-N 2 1 340.433 4.368 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[N@@H+]1C ZINC000537615492 1038893596 /nfs/dbraw/zinc/89/35/96/1038893596.db2.gz WEEFGGHKBIBXNL-WMLDXEAASA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[N@H+]1C ZINC000537615492 1038893597 /nfs/dbraw/zinc/89/35/97/1038893597.db2.gz WEEFGGHKBIBXNL-WMLDXEAASA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[NH+]1C ZINC000537615492 1038893601 /nfs/dbraw/zinc/89/36/01/1038893601.db2.gz WEEFGGHKBIBXNL-WMLDXEAASA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[NH+]1C ZINC000537615492 1038893605 /nfs/dbraw/zinc/89/36/05/1038893605.db2.gz WEEFGGHKBIBXNL-WMLDXEAASA-N 2 1 332.488 4.469 20 0 EIADMP CC[N@H+](Cc1ccc(F)c(C)c1)CC1CCN(c2ccccn2)CC1 ZINC000537615689 1038899081 /nfs/dbraw/zinc/89/90/81/1038899081.db2.gz AKJCMGPCKYQIJE-UHFFFAOYSA-N 2 1 341.474 4.268 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCC[N@@H+]2C)cc1OCC ZINC000539269210 1038903701 /nfs/dbraw/zinc/90/37/01/1038903701.db2.gz CAWSSLQGGLLHGU-AEFFLSMTSA-N 2 1 334.504 4.009 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCC[N@H+]2C)cc1OCC ZINC000539269210 1038903717 /nfs/dbraw/zinc/90/37/17/1038903717.db2.gz CAWSSLQGGLLHGU-AEFFLSMTSA-N 2 1 334.504 4.009 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000481024740 1038963822 /nfs/dbraw/zinc/96/38/22/1038963822.db2.gz OQTDSOJOKCVWHG-HUUCEWRRSA-N 2 1 344.421 4.010 20 0 EIADMP C[C@H](C[NH+]1CCC[C@@H]([N@@H+](C)C[C@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333630 1039067753 /nfs/dbraw/zinc/06/77/53/1039067753.db2.gz TZEKGJJZFHRWMC-YNEHKIRRSA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[NH+]1CCC[C@@H]([N@H+](C)C[C@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333630 1039067771 /nfs/dbraw/zinc/06/77/71/1039067771.db2.gz TZEKGJJZFHRWMC-YNEHKIRRSA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[N@H+]1CCC[C@@H]([NH+](C)C[C@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333630 1039067789 /nfs/dbraw/zinc/06/77/89/1039067789.db2.gz TZEKGJJZFHRWMC-YNEHKIRRSA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[N@@H+]1CCC[C@@H]([NH+](C)C[C@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333630 1039067809 /nfs/dbraw/zinc/06/78/09/1039067809.db2.gz TZEKGJJZFHRWMC-YNEHKIRRSA-N 2 1 348.375 4.170 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)[C@H]2CCC[C@H]21 ZINC000552057359 1039075498 /nfs/dbraw/zinc/07/54/98/1039075498.db2.gz QDNPBNQPRRABEN-NZSAHSFTSA-N 2 1 328.431 4.048 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccsc1 ZINC000481185336 1039087324 /nfs/dbraw/zinc/08/73/24/1039087324.db2.gz GEJARYXQCORFNZ-FXAWDEMLSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccsc1 ZINC000481185336 1039087341 /nfs/dbraw/zinc/08/73/41/1039087341.db2.gz GEJARYXQCORFNZ-FXAWDEMLSA-N 2 1 328.525 4.181 20 0 EIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H](C)[C@H](C)c1nc2ccccc2s1 ZINC000552098928 1039152611 /nfs/dbraw/zinc/15/26/11/1039152611.db2.gz SSORXKIDCRARDS-XHSDSOJGSA-N 2 1 331.529 4.252 20 0 EIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H](C)[C@H](C)c1nc2ccccc2s1 ZINC000552098928 1039152616 /nfs/dbraw/zinc/15/26/16/1039152616.db2.gz SSORXKIDCRARDS-XHSDSOJGSA-N 2 1 331.529 4.252 20 0 EIADMP Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000555422767 1039178789 /nfs/dbraw/zinc/17/87/89/1039178789.db2.gz FOGQAIWSMYBRLQ-LPHOPBHVSA-N 2 1 329.532 4.256 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000693 1039296925 /nfs/dbraw/zinc/29/69/25/1039296925.db2.gz IQXGHXSNVQBBMJ-LSDHHAIUSA-N 2 1 328.422 4.430 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000693 1039296952 /nfs/dbraw/zinc/29/69/52/1039296952.db2.gz IQXGHXSNVQBBMJ-LSDHHAIUSA-N 2 1 328.422 4.430 20 0 EIADMP C[C@H]1C[C@H](N(C)Cc2ccc(Cl)o2)CC[N@H+]1Cc1ccccc1 ZINC000552256655 1039318806 /nfs/dbraw/zinc/31/88/06/1039318806.db2.gz WJTLDRFBMCGRFR-DOTOQJQBSA-N 2 1 332.875 4.418 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](C[C@@H]3CCCC(F)(F)C3)C2)CC1 ZINC000513882638 1039344870 /nfs/dbraw/zinc/34/48/70/1039344870.db2.gz MYLNQFIQCCADMP-QZTJIDSGSA-N 2 1 328.491 4.256 20 0 EIADMP C[N@H+]1CCC[C@@]2(CC[NH+](CCCSc3ccccc3Cl)C2)C1 ZINC000555598317 1039424990 /nfs/dbraw/zinc/42/49/90/1039424990.db2.gz XTCHPSXKTQDHJU-GOSISDBHSA-N 2 1 338.948 4.240 20 0 EIADMP C[NH+]1CCC[C@@]2(CC[N@H+](CCCSc3ccccc3Cl)C2)C1 ZINC000555598317 1039425008 /nfs/dbraw/zinc/42/50/08/1039425008.db2.gz XTCHPSXKTQDHJU-GOSISDBHSA-N 2 1 338.948 4.240 20 0 EIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](CCCSc3ccccc3Cl)C2)C1 ZINC000555598317 1039425050 /nfs/dbraw/zinc/42/50/50/1039425050.db2.gz XTCHPSXKTQDHJU-GOSISDBHSA-N 2 1 338.948 4.240 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000121892799 1039528681 /nfs/dbraw/zinc/52/86/81/1039528681.db2.gz MIZZYFSLPUJHNR-UZLBHIALSA-N 2 1 328.500 4.098 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000514097967 1039631169 /nfs/dbraw/zinc/63/11/69/1039631169.db2.gz CHLSOGABQDBQPF-YTFSRNRJSA-N 2 1 349.522 4.170 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000552562147 1039638887 /nfs/dbraw/zinc/63/88/87/1039638887.db2.gz RMORPFGLGKJBEM-AOIWGVFYSA-N 2 1 328.525 4.322 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000552562147 1039638911 /nfs/dbraw/zinc/63/89/11/1039638911.db2.gz RMORPFGLGKJBEM-AOIWGVFYSA-N 2 1 328.525 4.322 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCOc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000429781290 1039733988 /nfs/dbraw/zinc/73/39/88/1039733988.db2.gz SLHKRVDIHLAAPB-XJKSGUPXSA-N 2 1 345.314 4.034 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCOc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000429781290 1039734022 /nfs/dbraw/zinc/73/40/22/1039734022.db2.gz SLHKRVDIHLAAPB-XJKSGUPXSA-N 2 1 345.314 4.034 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCOc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000429781290 1039734046 /nfs/dbraw/zinc/73/40/46/1039734046.db2.gz SLHKRVDIHLAAPB-XJKSGUPXSA-N 2 1 345.314 4.034 20 0 EIADMP CCOCc1ccccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000122609499 1039766354 /nfs/dbraw/zinc/76/63/54/1039766354.db2.gz LHXWGEDOPAYHTM-UHFFFAOYSA-N 2 1 330.516 4.110 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000537647920 1039821545 /nfs/dbraw/zinc/82/15/45/1039821545.db2.gz VUKBKZZBKISPCR-INIZCTEOSA-N 2 1 330.447 4.168 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000537647920 1039821547 /nfs/dbraw/zinc/82/15/47/1039821547.db2.gz VUKBKZZBKISPCR-INIZCTEOSA-N 2 1 330.447 4.168 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000537647920 1039821551 /nfs/dbraw/zinc/82/15/51/1039821551.db2.gz VUKBKZZBKISPCR-INIZCTEOSA-N 2 1 330.447 4.168 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000537647920 1039821556 /nfs/dbraw/zinc/82/15/56/1039821556.db2.gz VUKBKZZBKISPCR-INIZCTEOSA-N 2 1 330.447 4.168 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+]C[C@@H]3CCC[C@@H](C)[C@H]3C)sc2C1 ZINC000481823502 1039850011 /nfs/dbraw/zinc/85/00/11/1039850011.db2.gz KJKHGCHOQCKQPY-OAGGEKHMSA-N 2 1 335.561 4.072 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+]C[C@@H]3CCC[C@@H](C)[C@H]3C)sc2C1 ZINC000481823502 1039850012 /nfs/dbraw/zinc/85/00/12/1039850012.db2.gz KJKHGCHOQCKQPY-OAGGEKHMSA-N 2 1 335.561 4.072 20 0 EIADMP Cc1ccccc1CCC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434746155 1039855752 /nfs/dbraw/zinc/85/57/52/1039855752.db2.gz IFWDREUMAPSISB-UHFFFAOYSA-N 2 1 337.511 4.340 20 0 EIADMP CSc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551007503 1039861671 /nfs/dbraw/zinc/86/16/71/1039861671.db2.gz PDDBFXQQLZHQQE-UYAOXDASSA-N 2 1 326.509 4.334 20 0 EIADMP CSc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551007503 1039861674 /nfs/dbraw/zinc/86/16/74/1039861674.db2.gz PDDBFXQQLZHQQE-UYAOXDASSA-N 2 1 326.509 4.334 20 0 EIADMP Cc1cccc(OC[C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551004981 1039866955 /nfs/dbraw/zinc/86/69/55/1039866955.db2.gz CEBLAGYSNCSKAI-RCZSKKKRSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1cccc(OC[C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551004981 1039866956 /nfs/dbraw/zinc/86/69/56/1039866956.db2.gz CEBLAGYSNCSKAI-RCZSKKKRSA-N 2 1 338.495 4.187 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc3ccccc3n2)C[C@H]1c1ccccc1 ZINC000551029283 1039886769 /nfs/dbraw/zinc/88/67/69/1039886769.db2.gz CBIANMYTINVFEZ-GGAORHGYSA-N 2 1 345.490 4.202 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc3ccccc3n2)C[C@H]1c1ccccc1 ZINC000551029283 1039886770 /nfs/dbraw/zinc/88/67/70/1039886770.db2.gz CBIANMYTINVFEZ-GGAORHGYSA-N 2 1 345.490 4.202 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCOc2ccccc2Cl)C[C@@H]1c1ccccc1 ZINC000551086043 1039968889 /nfs/dbraw/zinc/96/88/89/1039968889.db2.gz MCAMXBXRQNTZNA-IEBWSBKVSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCOc2ccccc2Cl)C[C@@H]1c1ccccc1 ZINC000551086043 1039968915 /nfs/dbraw/zinc/96/89/15/1039968915.db2.gz MCAMXBXRQNTZNA-IEBWSBKVSA-N 2 1 344.886 4.144 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000482137203 1040030939 /nfs/dbraw/zinc/03/09/39/1040030939.db2.gz ILYPSMHDXFWQAX-WBMJQRKESA-N 2 1 329.315 4.201 20 0 EIADMP CC1=CCC[C@@H](C)[C@@H]1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000435057821 1040037400 /nfs/dbraw/zinc/03/74/00/1040037400.db2.gz CPBSXWLIWJJWBT-YLJYHZDGSA-N 2 1 327.516 4.391 20 0 EIADMP CC(C)c1ncc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)s1 ZINC000435061384 1040038753 /nfs/dbraw/zinc/03/87/53/1040038753.db2.gz YNPQVLMKPZZNQX-UHFFFAOYSA-N 2 1 344.528 4.179 20 0 EIADMP C[C@@H]([NH2+]CCc1ccc2[nH]ccc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000514633510 1040068114 /nfs/dbraw/zinc/06/81/14/1040068114.db2.gz GARKPRQOZDCAPG-GCJKJVERSA-N 2 1 347.506 4.211 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccs1 ZINC000482443009 1040251443 /nfs/dbraw/zinc/25/14/43/1040251443.db2.gz FCYNTBQBECHXDS-OALUTQOASA-N 2 1 328.525 4.353 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)ccc1F ZINC000482455944 1040255429 /nfs/dbraw/zinc/25/54/29/1040255429.db2.gz YUWCFVCFFNYDJI-FUHWJXTLSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)ccc1F ZINC000482455944 1040255441 /nfs/dbraw/zinc/25/54/41/1040255441.db2.gz YUWCFVCFFNYDJI-FUHWJXTLSA-N 2 1 344.449 4.180 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)s1 ZINC000482462793 1040272853 /nfs/dbraw/zinc/27/28/53/1040272853.db2.gz XMIQLEIDEPGICQ-PKOBYXMFSA-N 2 1 328.525 4.272 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000479447866 1040376996 /nfs/dbraw/zinc/37/69/96/1040376996.db2.gz DRMJOMMKMZWRPQ-YOLZPYMBSA-N 2 1 344.543 4.082 20 0 EIADMP CC(C)Oc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1Cl ZINC000551541666 1040379794 /nfs/dbraw/zinc/37/97/94/1040379794.db2.gz UONPURGBOZSWTA-CQSZACIVSA-N 2 1 336.907 4.405 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cc(C)cc(C)c2)[C@H](C)C1 ZINC000482647707 1040408207 /nfs/dbraw/zinc/40/82/07/1040408207.db2.gz BMAQCEUHBIJGKV-SBHAEUEKSA-N 2 1 332.532 4.091 20 0 EIADMP CCC1(Cc2ccccc2)CC[NH+]([C@H]2CC[N@H+]3CCC[C@@H]3C2)CC1 ZINC000479540573 1040446231 /nfs/dbraw/zinc/44/62/31/1040446231.db2.gz GHACOGIEPKFVBY-RTWAWAEBSA-N 2 1 326.528 4.348 20 0 EIADMP CC[NH+](CC)CCC[NH2+][C@@H](C)c1sc(Cc2ccccc2)nc1C ZINC000479765935 1040638621 /nfs/dbraw/zinc/63/86/21/1040638621.db2.gz DNKBBGGCOXCVAE-INIZCTEOSA-N 2 1 345.556 4.425 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)cc1 ZINC000668194369 1040644790 /nfs/dbraw/zinc/64/47/90/1040644790.db2.gz GMMAYUGHHPIXDZ-HXUWFJFHSA-N 2 1 341.524 4.036 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1 ZINC000668194369 1040644797 /nfs/dbraw/zinc/64/47/97/1040644797.db2.gz GMMAYUGHHPIXDZ-HXUWFJFHSA-N 2 1 341.524 4.036 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1 ZINC000668194369 1040644809 /nfs/dbraw/zinc/64/48/09/1040644809.db2.gz GMMAYUGHHPIXDZ-HXUWFJFHSA-N 2 1 341.524 4.036 20 0 EIADMP CCCCOc1cc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)ccc1OC ZINC000539818057 1040812294 /nfs/dbraw/zinc/81/22/94/1040812294.db2.gz PJGDKLKPIIQSEK-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[N@@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)ccc1OC ZINC000539818057 1040812304 /nfs/dbraw/zinc/81/23/04/1040812304.db2.gz PJGDKLKPIIQSEK-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[NH+](C)[C@H]2CC[N@H+](CC)[C@H](C)C2)ccc1OC ZINC000539818057 1040812306 /nfs/dbraw/zinc/81/23/06/1040812306.db2.gz PJGDKLKPIIQSEK-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[NH+](C)[C@H]2CC[N@@H+](CC)[C@H](C)C2)ccc1OC ZINC000539818057 1040812308 /nfs/dbraw/zinc/81/23/08/1040812308.db2.gz PJGDKLKPIIQSEK-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cccc(OCc3ccccc3)c2)CC[N@@H+]1C ZINC000539838098 1040819929 /nfs/dbraw/zinc/81/99/29/1040819929.db2.gz IRKRVTFGHQCICV-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cccc(OCc3ccccc3)c2)CC[N@H+]1C ZINC000539838098 1040819935 /nfs/dbraw/zinc/81/99/35/1040819935.db2.gz IRKRVTFGHQCICV-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cccc(OCc3ccccc3)c2)CC[NH+]1C ZINC000539838098 1040819940 /nfs/dbraw/zinc/81/99/40/1040819940.db2.gz IRKRVTFGHQCICV-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc(OCc3ccccc3)c2)CC[NH+]1C ZINC000539838098 1040819951 /nfs/dbraw/zinc/81/99/51/1040819951.db2.gz IRKRVTFGHQCICV-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCCc4c(O)cccc43)CC2)C1 ZINC000483430727 1040851391 /nfs/dbraw/zinc/85/13/91/1040851391.db2.gz XGORLEZUZHZQCL-MMOPVJDHSA-N 2 1 342.527 4.402 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CCc1ccc(Oc2ccc(F)cc2)cc1 ZINC000537938879 1040900493 /nfs/dbraw/zinc/90/04/93/1040900493.db2.gz UUEVICWWFTXIIJ-KKSFZXQISA-N 2 1 342.458 4.090 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1cncs1 ZINC000537941598 1040906196 /nfs/dbraw/zinc/90/61/96/1040906196.db2.gz XLEMBIUWVDPEBJ-RYRKJORJSA-N 2 1 329.513 4.094 20 0 EIADMP COc1ccc(F)cc1C[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000462775297 1040912860 /nfs/dbraw/zinc/91/28/60/1040912860.db2.gz FWXMOULHPCDHBK-IFXJQAMLSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(F)cc1C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000462775297 1040912875 /nfs/dbraw/zinc/91/28/75/1040912875.db2.gz FWXMOULHPCDHBK-IFXJQAMLSA-N 2 1 348.487 4.069 20 0 EIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C(C)C)CC1)CCCO2 ZINC000537972324 1040977554 /nfs/dbraw/zinc/97/75/54/1040977554.db2.gz GAVAAWWLECZIJP-FQEVSTJZSA-N 2 1 330.516 4.486 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]CCC[NH+]2CCCCC2)cc1OCC ZINC000480134181 1040997577 /nfs/dbraw/zinc/99/75/77/1040997577.db2.gz GGIRSNLFLDHERS-QGZVFWFLSA-N 2 1 334.504 4.011 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000483729137 1040998131 /nfs/dbraw/zinc/99/81/31/1040998131.db2.gz OLWXYLCKDDCTBF-BBTUJRGHSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000483729137 1040998150 /nfs/dbraw/zinc/99/81/50/1040998150.db2.gz OLWXYLCKDDCTBF-BBTUJRGHSA-N 2 1 338.495 4.399 20 0 EIADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436282146 1041026760 /nfs/dbraw/zinc/02/67/60/1041026760.db2.gz QJNZACHVZSAAFW-GFCCVEGCSA-N 2 1 334.813 4.180 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436282146 1041026772 /nfs/dbraw/zinc/02/67/72/1041026772.db2.gz QJNZACHVZSAAFW-GFCCVEGCSA-N 2 1 334.813 4.180 20 0 EIADMP C[C@@H]([NH2+]CCCN(C)Cc1ccccc1)c1ccc2ccccc2n1 ZINC000480171296 1041030706 /nfs/dbraw/zinc/03/07/06/1041030706.db2.gz QIBFEPPDRODURB-GOSISDBHSA-N 2 1 333.479 4.408 20 0 EIADMP FC(F)(F)c1cc(Cl)cc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000436284960 1041032998 /nfs/dbraw/zinc/03/29/98/1041032998.db2.gz CGHBUHQHXCIOJS-HUUCEWRRSA-N 2 1 332.797 4.075 20 0 EIADMP FC(F)(F)c1cc(Cl)cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000436284960 1041033016 /nfs/dbraw/zinc/03/30/16/1041033016.db2.gz CGHBUHQHXCIOJS-HUUCEWRRSA-N 2 1 332.797 4.075 20 0 EIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1cccnc1 ZINC000538063620 1041034583 /nfs/dbraw/zinc/03/45/83/1041034583.db2.gz VQSHVYMDCSZDSV-JOCHJYFZSA-N 2 1 337.511 4.075 20 0 EIADMP Cc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)c1C ZINC000064616155 1041052097 /nfs/dbraw/zinc/05/20/97/1041052097.db2.gz WBRRYVDHSAVLMJ-SFHVURJKSA-N 2 1 328.525 4.367 20 0 EIADMP Cc1cccc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1C ZINC000064616155 1041052115 /nfs/dbraw/zinc/05/21/15/1041052115.db2.gz WBRRYVDHSAVLMJ-SFHVURJKSA-N 2 1 328.525 4.367 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000462889799 1041052624 /nfs/dbraw/zinc/05/26/24/1041052624.db2.gz UYJPOBYEMVZDAU-MRXNPFEDSA-N 2 1 339.527 4.441 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@@H](c3ccccc3)C3CC3)C2)cc1 ZINC000538103101 1041058027 /nfs/dbraw/zinc/05/80/27/1041058027.db2.gz UCVDGXKNAXNMFA-OFNKIYASSA-N 2 1 334.507 4.292 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000538114957 1041066880 /nfs/dbraw/zinc/06/68/80/1041066880.db2.gz IEJLDHQWVIKUKH-SFHVURJKSA-N 2 1 337.511 4.002 20 0 EIADMP Cc1ccc(SC2(C[NH2+][C@H]3CC[N@H+](C)C[C@H]3C)CCCC2)cc1 ZINC000484308114 1041204493 /nfs/dbraw/zinc/20/44/93/1041204493.db2.gz LYLMDENCGWLWEA-MJGOQNOKSA-N 2 1 332.557 4.330 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)cc1 ZINC000540164410 1041229265 /nfs/dbraw/zinc/22/92/65/1041229265.db2.gz SBIRQKVQMLQFIC-RFUDCGQUSA-N 2 1 343.474 4.417 20 0 EIADMP Clc1sccc1C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000480341785 1041230301 /nfs/dbraw/zinc/23/03/01/1041230301.db2.gz DEDFMPIVSGNYNA-ZDUSSCGKSA-N 2 1 340.945 4.465 20 0 EIADMP Clc1sccc1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000480341785 1041230315 /nfs/dbraw/zinc/23/03/15/1041230315.db2.gz DEDFMPIVSGNYNA-ZDUSSCGKSA-N 2 1 340.945 4.465 20 0 EIADMP CC[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000463070415 1041312722 /nfs/dbraw/zinc/31/27/22/1041312722.db2.gz OFLKTDJUWVDOFG-NRFANRHFSA-N 2 1 336.523 4.477 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]C[C@H](C)C[NH+]3CCCC3)oc21 ZINC000538397487 1041315323 /nfs/dbraw/zinc/31/53/23/1041315323.db2.gz IYMHEOIPXCZIRK-HOTGVXAUSA-N 2 1 330.472 4.214 20 0 EIADMP Cc1cc(N2CCC(C[N@H+](C)C(C)C)CC2)c2cc(F)ccc2[nH+]1 ZINC000540284639 1041341680 /nfs/dbraw/zinc/34/16/80/1041341680.db2.gz HACWWAYGKOYHOP-UHFFFAOYSA-N 2 1 329.463 4.239 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000540302936 1041354133 /nfs/dbraw/zinc/35/41/33/1041354133.db2.gz WMRLMJXLVNKPBE-WMLDXEAASA-N 2 1 328.422 4.334 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)Oc1ccccc1 ZINC000463117281 1041356792 /nfs/dbraw/zinc/35/67/92/1041356792.db2.gz GRKOXHYCYUAQKA-ZVDOUQERSA-N 2 1 338.495 4.097 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)Oc1ccccc1 ZINC000463117281 1041356812 /nfs/dbraw/zinc/35/68/12/1041356812.db2.gz GRKOXHYCYUAQKA-ZVDOUQERSA-N 2 1 338.495 4.097 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12)C(F)(F)F ZINC000554722030 1041363952 /nfs/dbraw/zinc/36/39/52/1041363952.db2.gz DJVVFMKVCLMZRO-BRWVUGGUSA-N 2 1 340.433 4.075 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccc(F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000463141437 1041374134 /nfs/dbraw/zinc/37/41/34/1041374134.db2.gz KCGUPNLZPBZXAY-LAUBAEHRSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccc(F)cc2)CC[N@H+]1Cc1ccccc1 ZINC000463141437 1041374142 /nfs/dbraw/zinc/37/41/42/1041374142.db2.gz KCGUPNLZPBZXAY-LAUBAEHRSA-N 2 1 326.459 4.011 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000463194976 1041410979 /nfs/dbraw/zinc/41/09/79/1041410979.db2.gz XRJIQWGTOXKTKO-CEWLAPEOSA-N 2 1 332.532 4.080 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000463194976 1041410990 /nfs/dbraw/zinc/41/09/90/1041410990.db2.gz XRJIQWGTOXKTKO-CEWLAPEOSA-N 2 1 332.532 4.080 20 0 EIADMP CCc1nc2c(s1)[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)CCC2 ZINC000480612192 1041423454 /nfs/dbraw/zinc/42/34/54/1041423454.db2.gz OCCNKNBYHXUHJF-HOTGVXAUSA-N 2 1 335.561 4.185 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@H]3C[C@H](c4ccccc4)C3)CC2)cc1 ZINC000463239562 1041447082 /nfs/dbraw/zinc/44/70/82/1041447082.db2.gz ZXZGBIBGQPCUNT-AFARHQOCSA-N 2 1 334.507 4.229 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1N(C)C ZINC000480638494 1041450337 /nfs/dbraw/zinc/45/03/37/1041450337.db2.gz IXZQRFUQUVQIIR-IRXDYDNUSA-N 2 1 335.511 4.197 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)C(F)(F)F ZINC000480668808 1041462178 /nfs/dbraw/zinc/46/21/78/1041462178.db2.gz WOZCBRVWDMKCSV-BZZMCLGOSA-N 2 1 340.433 4.075 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2c(F)cccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000401998633 1041474444 /nfs/dbraw/zinc/47/44/44/1041474444.db2.gz DGDVMFGZWCGHSV-AEFFLSMTSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2c(F)cccc2F)CC[N@H+]1Cc1ccccc1 ZINC000401998633 1041474448 /nfs/dbraw/zinc/47/44/48/1041474448.db2.gz DGDVMFGZWCGHSV-AEFFLSMTSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]([NH2+]C1(Cc2ccccc2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000480692503 1041476610 /nfs/dbraw/zinc/47/66/10/1041476610.db2.gz ASDBOOZMTQCQNQ-KNQAVFIVSA-N 2 1 334.507 4.262 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2c[nH]nc2C(C)(C)C)CC1 ZINC000538721710 1041493118 /nfs/dbraw/zinc/49/31/18/1041493118.db2.gz YWYFATFWPYQESG-QGZVFWFLSA-N 2 1 346.563 4.184 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@H]([C@H](C)[NH3+])C3)s2)cc1 ZINC000484903383 1041504605 /nfs/dbraw/zinc/50/46/05/1041504605.db2.gz FXFRZKDZJFSEKY-YOEHRIQHSA-N 2 1 329.513 4.103 20 0 EIADMP Cc1cccc(COc2ccc(C[NH2+][C@H]3CC[N@@H+](C)[C@H](C)C3)cc2)c1 ZINC000480753978 1041508574 /nfs/dbraw/zinc/50/85/74/1041508574.db2.gz CPLQXMMXWSEYHZ-NQIIRXRSSA-N 2 1 338.495 4.146 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c(OC)ccc3ccccc32)[C@@H](C)C1 ZINC000538738759 1041512973 /nfs/dbraw/zinc/51/29/73/1041512973.db2.gz XOMNFXNLWGXCPN-OXJNMPFZSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c(OC)ccc3ccccc32)[C@@H](C)C1 ZINC000538738759 1041512993 /nfs/dbraw/zinc/51/29/93/1041512993.db2.gz XOMNFXNLWGXCPN-OXJNMPFZSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c(OC)ccc3ccccc32)[C@@H](C)C1 ZINC000538738759 1041513012 /nfs/dbraw/zinc/51/30/12/1041513012.db2.gz XOMNFXNLWGXCPN-OXJNMPFZSA-N 2 1 326.484 4.011 20 0 EIADMP c1cc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc(-c2ccncc2)c1 ZINC000538799318 1041540082 /nfs/dbraw/zinc/54/00/82/1041540082.db2.gz YOXZFEVMKODDEY-JTHBVZDNSA-N 2 1 347.506 4.197 20 0 EIADMP c1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc(-c2ccncc2)c1 ZINC000538799318 1041540086 /nfs/dbraw/zinc/54/00/86/1041540086.db2.gz YOXZFEVMKODDEY-JTHBVZDNSA-N 2 1 347.506 4.197 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000540708625 1041606366 /nfs/dbraw/zinc/60/63/66/1041606366.db2.gz ZMGCHYBLRFFWJO-QZTJIDSGSA-N 2 1 338.417 4.193 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000539040588 1041616897 /nfs/dbraw/zinc/61/68/97/1041616897.db2.gz DNZHJXOMVWBMAS-AOIWGVFYSA-N 2 1 341.474 4.172 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]C[C@H]3CCCCS3)CC23CC3)cc1 ZINC000516768837 1041745853 /nfs/dbraw/zinc/74/58/53/1041745853.db2.gz ACYRYYNFDMBVDW-RTBURBONSA-N 2 1 330.541 4.059 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]C[C@H]3CCCCS3)CC23CC3)cc1 ZINC000516768837 1041745867 /nfs/dbraw/zinc/74/58/67/1041745867.db2.gz ACYRYYNFDMBVDW-RTBURBONSA-N 2 1 330.541 4.059 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2cnn(C)c2)C(C)(C)C)CC1 ZINC000540984050 1041766748 /nfs/dbraw/zinc/76/67/48/1041766748.db2.gz CMSPVPUVYRLHKF-LSTHTHJFSA-N 2 1 346.563 4.140 20 0 EIADMP CSC1(C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000516822418 1041774438 /nfs/dbraw/zinc/77/44/38/1041774438.db2.gz RHMOIXYPNLBTRD-PKOBYXMFSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCOCc2ccccc2)C1 ZINC000541579330 1042014272 /nfs/dbraw/zinc/01/42/72/1042014272.db2.gz WQKWBZKFLLMJIS-IFMALSPDSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCOCc2ccccc2)C1 ZINC000541579330 1042014278 /nfs/dbraw/zinc/01/42/78/1042014278.db2.gz WQKWBZKFLLMJIS-IFMALSPDSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCOCc2ccccc2)C1 ZINC000541579330 1042014286 /nfs/dbraw/zinc/01/42/86/1042014286.db2.gz WQKWBZKFLLMJIS-IFMALSPDSA-N 2 1 344.543 4.180 20 0 EIADMP Fc1ccc2c(c1)CC[C@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001168438782 1042061313 /nfs/dbraw/zinc/06/13/13/1042061313.db2.gz ODZJDEQHKCYARD-SFTDATJTSA-N 2 1 330.491 4.023 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464847134 1042194385 /nfs/dbraw/zinc/19/43/85/1042194385.db2.gz UTUIURPIHCXRCE-FCEUIQTBSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464847134 1042194392 /nfs/dbraw/zinc/19/43/92/1042194392.db2.gz UTUIURPIHCXRCE-FCEUIQTBSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464847134 1042194395 /nfs/dbraw/zinc/19/43/95/1042194395.db2.gz UTUIURPIHCXRCE-FCEUIQTBSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258745 1042436622 /nfs/dbraw/zinc/43/66/22/1042436622.db2.gz TYDROYGRANIVFW-AVRDEDQJSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258745 1042436626 /nfs/dbraw/zinc/43/66/26/1042436626.db2.gz TYDROYGRANIVFW-AVRDEDQJSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258745 1042436633 /nfs/dbraw/zinc/43/66/33/1042436633.db2.gz TYDROYGRANIVFW-AVRDEDQJSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258745 1042436640 /nfs/dbraw/zinc/43/66/40/1042436640.db2.gz TYDROYGRANIVFW-AVRDEDQJSA-N 2 1 338.495 4.038 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3scnc32)c1 ZINC000623877287 1042567251 /nfs/dbraw/zinc/56/72/51/1042567251.db2.gz XVTMKIPQHBEHFW-QGZVFWFLSA-N 2 1 329.513 4.151 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3scnc32)c1 ZINC000623877287 1042567258 /nfs/dbraw/zinc/56/72/58/1042567258.db2.gz XVTMKIPQHBEHFW-QGZVFWFLSA-N 2 1 329.513 4.151 20 0 EIADMP CSc1ccc([C@@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)cc1 ZINC000173440553 1042573975 /nfs/dbraw/zinc/57/39/75/1042573975.db2.gz LNBVRMMBCCRVFA-MRXNPFEDSA-N 2 1 341.524 4.432 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)[C@H](C)C1 ZINC000492335626 1042611483 /nfs/dbraw/zinc/61/14/83/1042611483.db2.gz SQMUEZOROOSWCW-CRAIPNDOSA-N 2 1 338.923 4.289 20 0 EIADMP C[N@@H+](Cc1ccc(SC(F)(F)F)cc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000261992007 1042621962 /nfs/dbraw/zinc/62/19/62/1042621962.db2.gz TYEYXCVCHOYYFZ-PBWFPOADSA-N 2 1 330.419 4.013 20 0 EIADMP Fc1ccc(CSCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167964574 1042639417 /nfs/dbraw/zinc/63/94/17/1042639417.db2.gz SVQZWUFVVGPDHI-IHWFROFDSA-N 2 1 348.531 4.054 20 0 EIADMP Cc1nc2ccc(C[N@@H+]3CCC[C@H]([NH+]4CCCC4)CC3)cc2s1 ZINC000426410931 1042677934 /nfs/dbraw/zinc/67/79/34/1042677934.db2.gz NXPGVFVRSHYGOT-KRWDZBQOSA-N 2 1 329.513 4.055 20 0 EIADMP Cc1nc2ccc(C[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)cc2s1 ZINC000426410931 1042677939 /nfs/dbraw/zinc/67/79/39/1042677939.db2.gz NXPGVFVRSHYGOT-KRWDZBQOSA-N 2 1 329.513 4.055 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1nccs1 ZINC000639046977 1042819231 /nfs/dbraw/zinc/81/92/31/1042819231.db2.gz YNXSJFAYBXCQKZ-SZVBFZGTSA-N 2 1 341.524 4.204 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1nccs1 ZINC000639046977 1042819233 /nfs/dbraw/zinc/81/92/33/1042819233.db2.gz YNXSJFAYBXCQKZ-SZVBFZGTSA-N 2 1 341.524 4.204 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310236026 1042832094 /nfs/dbraw/zinc/83/20/94/1042832094.db2.gz KSFFZNFLYDVSOF-UHOSZYNNSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000310473097 1042838138 /nfs/dbraw/zinc/83/81/38/1042838138.db2.gz BXUBODHVCUMBPF-ZWOKBUDYSA-N 2 1 326.459 4.387 20 0 EIADMP FC1(F)CCC[C@H](C[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000311007386 1042849935 /nfs/dbraw/zinc/84/99/35/1042849935.db2.gz WOYAWOMPCPZDHJ-VNTMZGSJSA-N 2 1 348.481 4.312 20 0 EIADMP CC(C)(C)OCc1cccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1 ZINC000178444376 1042866465 /nfs/dbraw/zinc/86/64/65/1042866465.db2.gz MEUUMGBPPDKRJV-UHFFFAOYSA-N 2 1 332.532 4.354 20 0 EIADMP COCCC[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000178439914 1042866488 /nfs/dbraw/zinc/86/64/88/1042866488.db2.gz WIOTYGOJIQUFAB-GOSISDBHSA-N 2 1 332.532 4.356 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)CC1 ZINC000493257388 1042887035 /nfs/dbraw/zinc/88/70/35/1042887035.db2.gz ONIRVRKDWGZYDT-UHFFFAOYSA-N 2 1 338.923 4.433 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)CC1 ZINC000493257388 1042887037 /nfs/dbraw/zinc/88/70/37/1042887037.db2.gz ONIRVRKDWGZYDT-UHFFFAOYSA-N 2 1 338.923 4.433 20 0 EIADMP COc1ccc(C2CCC([NH2+]C[C@H](C)Cn3cc[nH+]c3C)CC2)cc1 ZINC000542469286 1042925891 /nfs/dbraw/zinc/92/58/91/1042925891.db2.gz WSYNKNPZZIJKLJ-VQSBYGRUSA-N 2 1 341.499 4.152 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@@H+](C)CC1CC[NH2+]CC1 ZINC000262124523 1042991503 /nfs/dbraw/zinc/99/15/03/1042991503.db2.gz CHTOFHGJSWFVIZ-MRXNPFEDSA-N 2 1 343.540 4.419 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1N(C)C ZINC000183195394 1043039674 /nfs/dbraw/zinc/03/96/74/1043039674.db2.gz VVPWURMSYYSBGE-OKZBNKHCSA-N 2 1 329.532 4.056 20 0 EIADMP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2cc(O)cc(F)c2)C1 ZINC000185468142 1043187758 /nfs/dbraw/zinc/18/77/58/1043187758.db2.gz OMALAQMEAXLDBB-INIZCTEOSA-N 2 1 342.458 4.053 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2cc(O)cc(F)c2)C1 ZINC000185468142 1043187764 /nfs/dbraw/zinc/18/77/64/1043187764.db2.gz OMALAQMEAXLDBB-INIZCTEOSA-N 2 1 342.458 4.053 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cn1cc(-c2ccccc2)cn1 ZINC000727427280 1043219427 /nfs/dbraw/zinc/21/94/27/1043219427.db2.gz GESZHUQKMSCTKC-UHFFFAOYSA-N 2 1 348.494 4.091 20 0 EIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cn1cc(-c2ccccc2)cn1 ZINC000727427280 1043219436 /nfs/dbraw/zinc/21/94/36/1043219436.db2.gz GESZHUQKMSCTKC-UHFFFAOYSA-N 2 1 348.494 4.091 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2(c3ccc(F)cc3Cl)CCCC2)CC[N@H+]1C ZINC000427882717 1043246835 /nfs/dbraw/zinc/24/68/35/1043246835.db2.gz ANQQNIRAJHNZNV-GOEBONIOSA-N 2 1 338.898 4.363 20 0 EIADMP COc1cccc2cc(C[NH2+]CCCC[N@H+]3CCC[C@H](C)C3)oc21 ZINC000727644194 1043255891 /nfs/dbraw/zinc/25/58/91/1043255891.db2.gz RTIPUKLCAKBDPG-INIZCTEOSA-N 2 1 330.472 4.043 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(C(F)F)nc1 ZINC000631084662 1043282918 /nfs/dbraw/zinc/28/29/18/1043282918.db2.gz WRTGDHWRAZVEMM-CRAIPNDOSA-N 2 1 345.437 4.019 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(C(F)F)nc1 ZINC000631084662 1043282924 /nfs/dbraw/zinc/28/29/24/1043282924.db2.gz WRTGDHWRAZVEMM-CRAIPNDOSA-N 2 1 345.437 4.019 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674008001 1043285292 /nfs/dbraw/zinc/28/52/92/1043285292.db2.gz VODYWMWFEQKFOG-QGZVFWFLSA-N 2 1 342.449 4.302 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674008001 1043285302 /nfs/dbraw/zinc/28/53/02/1043285302.db2.gz VODYWMWFEQKFOG-QGZVFWFLSA-N 2 1 342.449 4.302 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674008001 1043285308 /nfs/dbraw/zinc/28/53/08/1043285308.db2.gz VODYWMWFEQKFOG-QGZVFWFLSA-N 2 1 342.449 4.302 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)C1CCSCC1 ZINC000187246704 1043336123 /nfs/dbraw/zinc/33/61/23/1043336123.db2.gz JLHCBNXBLPTMCE-ZVZYQTTQSA-N 2 1 338.586 4.252 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)C1CCSCC1 ZINC000187246704 1043336130 /nfs/dbraw/zinc/33/61/30/1043336130.db2.gz JLHCBNXBLPTMCE-ZVZYQTTQSA-N 2 1 338.586 4.252 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CCSCC1 ZINC000187215503 1043336518 /nfs/dbraw/zinc/33/65/18/1043336518.db2.gz FYRRGBXZXGBERM-IRXDYDNUSA-N 2 1 332.557 4.333 20 0 EIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccccc1 ZINC000674049647 1043350635 /nfs/dbraw/zinc/35/06/35/1043350635.db2.gz VROMDBPTQAQOFU-LEWJYISDSA-N 2 1 330.516 4.007 20 0 EIADMP c1cc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cs1 ZINC000520811511 1043390683 /nfs/dbraw/zinc/39/06/83/1043390683.db2.gz KOWGQOJNNFNKAT-IBGZPJMESA-N 2 1 326.509 4.077 20 0 EIADMP c1cc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cs1 ZINC000520811511 1043390689 /nfs/dbraw/zinc/39/06/89/1043390689.db2.gz KOWGQOJNNFNKAT-IBGZPJMESA-N 2 1 326.509 4.077 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)cc1 ZINC000665269583 1043451008 /nfs/dbraw/zinc/45/10/08/1043451008.db2.gz IZPQQJKBKBMCLQ-LHSJRXKWSA-N 2 1 332.451 4.101 20 0 EIADMP Cc1nc2ccc(C[NH2+]CCCC[N@@H+]3CCC[C@H](C)C3)cc2s1 ZINC000494385260 1043459063 /nfs/dbraw/zinc/45/90/63/1043459063.db2.gz LYCJIMWAPQCUQV-HNNXBMFYSA-N 2 1 331.529 4.206 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000520974167 1043459510 /nfs/dbraw/zinc/45/95/10/1043459510.db2.gz RSXKKVMIKSUDEI-AWEZNQCLSA-N 2 1 334.916 4.500 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccnn1-c1ccccc1 ZINC000467364157 1043581459 /nfs/dbraw/zinc/58/14/59/1043581459.db2.gz JIHAYROLHMUBSG-MOPGFXCFSA-N 2 1 340.515 4.178 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]CC[C@@H](C)[NH+]3CCCCC3)oc21 ZINC000542486727 1043723562 /nfs/dbraw/zinc/72/35/62/1043723562.db2.gz LIVBICOCDLPYNU-HZPDHXFCSA-N 2 1 330.472 4.357 20 0 EIADMP CCCCCC[N@@H+](C)CC(=O)Nc1cccc(C[NH+]2CCCCC2)c1 ZINC000731868950 1043841633 /nfs/dbraw/zinc/84/16/33/1043841633.db2.gz GCXGGVCMWOJSGC-UHFFFAOYSA-N 2 1 345.531 4.123 20 0 EIADMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000442918221 1043889662 /nfs/dbraw/zinc/88/96/62/1043889662.db2.gz CEHOTZQZWDEMIZ-AWEZNQCLSA-N 2 1 341.480 4.117 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000674878092 1043905103 /nfs/dbraw/zinc/90/51/03/1043905103.db2.gz BIQAGPVUEGQPLJ-WOJBJXKFSA-N 2 1 347.522 4.169 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000674878092 1043905116 /nfs/dbraw/zinc/90/51/16/1043905116.db2.gz BIQAGPVUEGQPLJ-WOJBJXKFSA-N 2 1 347.522 4.169 20 0 EIADMP CCCC[NH+]1CCC([NH2+]Cc2cccc(OC3CCCC3)c2)CC1 ZINC000521831460 1044000632 /nfs/dbraw/zinc/00/06/32/1044000632.db2.gz UXEIXIIKORLSLW-UHFFFAOYSA-N 2 1 330.516 4.362 20 0 EIADMP c1ccc2sc(C3CC[NH+](CCC[NH+]4CCCCC4)CC3)nc2c1 ZINC000193458028 1044059429 /nfs/dbraw/zinc/05/94/29/1044059429.db2.gz JHMKBLNUIOYJNW-UHFFFAOYSA-N 2 1 343.540 4.352 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035647 1044175552 /nfs/dbraw/zinc/17/55/52/1044175552.db2.gz CMUWDRBBSFHYDV-RDTXWAMCSA-N 2 1 332.875 4.372 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035647 1044175567 /nfs/dbraw/zinc/17/55/67/1044175567.db2.gz CMUWDRBBSFHYDV-RDTXWAMCSA-N 2 1 332.875 4.372 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035647 1044175600 /nfs/dbraw/zinc/17/56/00/1044175600.db2.gz CMUWDRBBSFHYDV-RDTXWAMCSA-N 2 1 332.875 4.372 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035647 1044175622 /nfs/dbraw/zinc/17/56/22/1044175622.db2.gz CMUWDRBBSFHYDV-RDTXWAMCSA-N 2 1 332.875 4.372 20 0 EIADMP C[NH+]1CCC([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC1 ZINC000466362968 1044324860 /nfs/dbraw/zinc/32/48/60/1044324860.db2.gz SWRKVJYGTFNIJB-UHFFFAOYSA-N 2 1 327.299 4.099 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(Cc2ccc(F)cc2)CC1 ZINC000348068010 1044375466 /nfs/dbraw/zinc/37/54/66/1044375466.db2.gz FPEBFIKMWXYZDU-UHFFFAOYSA-N 2 1 329.463 4.066 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)cc1 ZINC000348066893 1044386580 /nfs/dbraw/zinc/38/65/80/1044386580.db2.gz BTGUEEUVWHFNKK-NDSDBLNTSA-N 2 1 339.483 4.035 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH2+][C@H]3CC[N@@H+](C)[C@@H](C)C3)ccc21 ZINC000327016915 1044402939 /nfs/dbraw/zinc/40/29/39/1044402939.db2.gz HMJOJOWVVUOPHZ-WMZOPIPTSA-N 2 1 335.495 4.387 20 0 EIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)Cc1ccccc1 ZINC000542518733 1044436282 /nfs/dbraw/zinc/43/62/82/1044436282.db2.gz VCUREJMJBCGNKE-AZUAARDMSA-N 2 1 342.552 4.429 20 0 EIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)Cc1ccccc1 ZINC000542518733 1044436293 /nfs/dbraw/zinc/43/62/93/1044436293.db2.gz VCUREJMJBCGNKE-AZUAARDMSA-N 2 1 342.552 4.429 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2ccc(OC)c3F)c1 ZINC000675728664 1044460126 /nfs/dbraw/zinc/46/01/26/1044460126.db2.gz SRVJWOIRWZOWOG-IBGZPJMESA-N 2 1 342.458 4.063 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3c4ccccc4[nH]c32)C1 ZINC000675728290 1044461291 /nfs/dbraw/zinc/46/12/91/1044461291.db2.gz FVLGTTIIQYEYGU-JXFKEZNVSA-N 2 1 325.500 4.255 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001168473091 1044474928 /nfs/dbraw/zinc/47/49/28/1044474928.db2.gz JAICDESYSHZOHQ-GOSISDBHSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000177813950 1044511183 /nfs/dbraw/zinc/51/11/83/1044511183.db2.gz AUJBTEVOZPLMSN-YOEHRIQHSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000177813950 1044511201 /nfs/dbraw/zinc/51/12/01/1044511201.db2.gz AUJBTEVOZPLMSN-YOEHRIQHSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC[NH+]1C ZINC000177813950 1044511220 /nfs/dbraw/zinc/51/12/20/1044511220.db2.gz AUJBTEVOZPLMSN-YOEHRIQHSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC[NH+]1C ZINC000177813950 1044511233 /nfs/dbraw/zinc/51/12/33/1044511233.db2.gz AUJBTEVOZPLMSN-YOEHRIQHSA-N 2 1 328.422 4.053 20 0 EIADMP CCOc1ccc([C@@H](CC)N[C@H]2CC[N@H+](CC3CC3)C2)cc1OCC ZINC000675833491 1044520189 /nfs/dbraw/zinc/52/01/89/1044520189.db2.gz KRUMSXBYLNEQSN-RBUKOAKNSA-N 2 1 346.515 4.009 20 0 EIADMP CCOc1ccc([C@@H](CC)N[C@H]2CC[N@@H+](CC3CC3)C2)cc1OCC ZINC000675833491 1044520207 /nfs/dbraw/zinc/52/02/07/1044520207.db2.gz KRUMSXBYLNEQSN-RBUKOAKNSA-N 2 1 346.515 4.009 20 0 EIADMP C[N@H+]1CC=C(C[NH2+][C@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000494973135 1044554169 /nfs/dbraw/zinc/55/41/69/1044554169.db2.gz SNFJKSYFQCGPTQ-HXUWFJFHSA-N 2 1 344.861 4.420 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000494973135 1044554180 /nfs/dbraw/zinc/55/41/80/1044554180.db2.gz SNFJKSYFQCGPTQ-HXUWFJFHSA-N 2 1 344.861 4.420 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](Cc1ccccc1Cl)c1cccs1 ZINC000495066177 1044631714 /nfs/dbraw/zinc/63/17/14/1044631714.db2.gz GPZXWRZSTBDBJD-QGZVFWFLSA-N 2 1 345.899 4.480 20 0 EIADMP Clc1cccc2c1SCC[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000360434019 1044713358 /nfs/dbraw/zinc/71/33/58/1044713358.db2.gz REBJESFCTWZBRT-QGZVFWFLSA-N 2 1 336.932 4.341 20 0 EIADMP CC1(C[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532366 1044800881 /nfs/dbraw/zinc/80/08/81/1044800881.db2.gz OAUAXHSXRHJXKP-AEFFLSMTSA-N 2 1 334.454 4.380 20 0 EIADMP CC1(C[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532366 1044800887 /nfs/dbraw/zinc/80/08/87/1044800887.db2.gz OAUAXHSXRHJXKP-AEFFLSMTSA-N 2 1 334.454 4.380 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1CCC2(CCCCC2)O1 ZINC000429260344 1044857270 /nfs/dbraw/zinc/85/72/70/1044857270.db2.gz MCJZSKXTFPTTRJ-GOSISDBHSA-N 2 1 333.520 4.039 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1CCC2(CCCCC2)O1 ZINC000429260344 1044857273 /nfs/dbraw/zinc/85/72/73/1044857273.db2.gz MCJZSKXTFPTTRJ-GOSISDBHSA-N 2 1 333.520 4.039 20 0 EIADMP CCC(C)(C)c1ccc(C[N@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)cc1 ZINC000509022464 1044945154 /nfs/dbraw/zinc/94/51/54/1044945154.db2.gz PUPVVBJVJQUNND-QHAWAJNXSA-N 2 1 344.543 4.058 20 0 EIADMP CC[C@H](C[NH2+][C@H](C)[C@H](C)c1nc2ccccc2s1)[NH+]1CCCC1 ZINC000474478246 1045020488 /nfs/dbraw/zinc/02/04/88/1045020488.db2.gz OQMBEHLGYNNQKJ-ARFHVFGLSA-N 2 1 331.529 4.252 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cn2c3ccccc3oc2=S)CC1 ZINC000738066791 1045033163 /nfs/dbraw/zinc/03/31/63/1045033163.db2.gz DXAOWHIUTUAJIL-UHFFFAOYSA-N 2 1 347.528 4.365 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCc2cccs2)CC[N@@H+]1Cc1ccccc1 ZINC000738330846 1045050774 /nfs/dbraw/zinc/05/07/74/1045050774.db2.gz JISLDNSHLCWVMT-HKUYNNGSSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCc2cccs2)CC[N@H+]1Cc1ccccc1 ZINC000738330846 1045050794 /nfs/dbraw/zinc/05/07/94/1045050794.db2.gz JISLDNSHLCWVMT-HKUYNNGSSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)CCc2cccs2)CC[NH+]1Cc1ccccc1 ZINC000738330846 1045050811 /nfs/dbraw/zinc/05/08/11/1045050811.db2.gz JISLDNSHLCWVMT-HKUYNNGSSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)CCc2cccs2)CC[NH+]1Cc1ccccc1 ZINC000738330846 1045050828 /nfs/dbraw/zinc/05/08/28/1045050828.db2.gz JISLDNSHLCWVMT-HKUYNNGSSA-N 2 1 328.525 4.276 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CC(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000509069619 1045055916 /nfs/dbraw/zinc/05/59/16/1045055916.db2.gz LDCIJLFNCAIJGV-FYYLOGMGSA-N 2 1 334.507 4.235 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CC(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000509069619 1045055930 /nfs/dbraw/zinc/05/59/30/1045055930.db2.gz LDCIJLFNCAIJGV-FYYLOGMGSA-N 2 1 334.507 4.235 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CC(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000509069619 1045055942 /nfs/dbraw/zinc/05/59/42/1045055942.db2.gz LDCIJLFNCAIJGV-FYYLOGMGSA-N 2 1 334.507 4.235 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)oc1-c1ccc(Cl)cc1 ZINC000923494881 1045135837 /nfs/dbraw/zinc/13/58/37/1045135837.db2.gz PYRMSXMOXSPFOQ-DUVNUKRYSA-N 2 1 347.890 4.281 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]Cc3scnc3C3CC3)C2)c1 ZINC000486926076 1045218905 /nfs/dbraw/zinc/21/89/05/1045218905.db2.gz NFNYQZQZLXHCNQ-CQSZACIVSA-N 2 1 347.553 4.084 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]Cc3scnc3C3CC3)C2)c1 ZINC000486926076 1045218918 /nfs/dbraw/zinc/21/89/18/1045218918.db2.gz NFNYQZQZLXHCNQ-CQSZACIVSA-N 2 1 347.553 4.084 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]Cc3scnc3C3CC3)C2)c1 ZINC000486926075 1045219375 /nfs/dbraw/zinc/21/93/75/1045219375.db2.gz NFNYQZQZLXHCNQ-AWEZNQCLSA-N 2 1 347.553 4.084 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]Cc3scnc3C3CC3)C2)c1 ZINC000486926075 1045219382 /nfs/dbraw/zinc/21/93/82/1045219382.db2.gz NFNYQZQZLXHCNQ-AWEZNQCLSA-N 2 1 347.553 4.084 20 0 EIADMP Cc1nccn1CCCC[N@H+]1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000429124231 1045257011 /nfs/dbraw/zinc/25/70/11/1045257011.db2.gz ZFVOIVFRMWIZOG-SFHVURJKSA-N 2 1 349.931 4.492 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000429124231 1045257019 /nfs/dbraw/zinc/25/70/19/1045257019.db2.gz ZFVOIVFRMWIZOG-SFHVURJKSA-N 2 1 349.931 4.492 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000429124231 1045257027 /nfs/dbraw/zinc/25/70/27/1045257027.db2.gz ZFVOIVFRMWIZOG-SFHVURJKSA-N 2 1 349.931 4.492 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000495728075 1045316888 /nfs/dbraw/zinc/31/68/88/1045316888.db2.gz WCUDFFWKQFZUEQ-HZPDHXFCSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000495728075 1045316895 /nfs/dbraw/zinc/31/68/95/1045316895.db2.gz WCUDFFWKQFZUEQ-HZPDHXFCSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]CC[C@H]1CCC[N@H+]1C ZINC000542567526 1045334210 /nfs/dbraw/zinc/33/42/10/1045334210.db2.gz ZTSCPPKJVFINIK-SOUVJXGZSA-N 2 1 328.422 4.271 20 0 EIADMP CCCCCOc1cc(C[NH2+]C2CC[NH+](C(C)C)CC2)ccc1OC ZINC000236766921 1045366275 /nfs/dbraw/zinc/36/62/75/1045366275.db2.gz QIFZIAWJJVBLHW-UHFFFAOYSA-N 2 1 348.531 4.227 20 0 EIADMP C[C@H](CCc1ccccc1)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000237508624 1045387289 /nfs/dbraw/zinc/38/72/89/1045387289.db2.gz RAPJSSCWXSOMTP-HXUWFJFHSA-N 2 1 336.523 4.304 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2cccc(F)c2C)o1 ZINC000237580288 1045389965 /nfs/dbraw/zinc/38/99/65/1045389965.db2.gz LLSYQKAWFNQAMJ-CQSZACIVSA-N 2 1 341.430 4.325 20 0 EIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000237626371 1045390729 /nfs/dbraw/zinc/39/07/29/1045390729.db2.gz LGVMMCLYPWNYCV-ZDUSSCGKSA-N 2 1 326.406 4.230 20 0 EIADMP C[NH+](C)CC[C@H]([NH2+]Cc1cnc(-c2ccsc2)s1)C(C)(C)C ZINC000084663124 1045413717 /nfs/dbraw/zinc/41/37/17/1045413717.db2.gz QSDVLRNNNYQCCJ-HNNXBMFYSA-N 2 1 337.558 4.328 20 0 EIADMP C[NH+](C)CC[C@@H]([NH2+]Cc1cnc(-c2ccsc2)s1)C(C)(C)C ZINC000084663123 1045413824 /nfs/dbraw/zinc/41/38/24/1045413824.db2.gz QSDVLRNNNYQCCJ-OAHLLOKOSA-N 2 1 337.558 4.328 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000429531727 1045677491 /nfs/dbraw/zinc/67/74/91/1045677491.db2.gz SFKZTMZPRWGJSX-UKRRQHHQSA-N 2 1 330.394 4.062 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc2c(c1)COC(C)(C)O2 ZINC000768677085 1045826630 /nfs/dbraw/zinc/82/66/30/1045826630.db2.gz IGFVFQDAJRASOZ-KRWDZBQOSA-N 2 1 346.515 4.076 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000246881473 1045832948 /nfs/dbraw/zinc/83/29/48/1045832948.db2.gz DAWSDYWFVDZYSA-MJGOQNOKSA-N 2 1 328.500 4.143 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000246881473 1045832959 /nfs/dbraw/zinc/83/29/59/1045832959.db2.gz DAWSDYWFVDZYSA-MJGOQNOKSA-N 2 1 328.500 4.143 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000247123235 1045841373 /nfs/dbraw/zinc/84/13/73/1045841373.db2.gz RFTIWVPMOVTUCU-RBUKOAKNSA-N 2 1 340.515 4.178 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1cnn(C)c1 ZINC000247210535 1045843327 /nfs/dbraw/zinc/84/33/27/1045843327.db2.gz WXIFTLYPYRJPKO-UTKZUKDTSA-N 2 1 340.515 4.035 20 0 EIADMP CSC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000248649016 1045879794 /nfs/dbraw/zinc/87/97/94/1045879794.db2.gz KGPNXZIBTZZEPT-LDLYASANSA-N 2 1 330.541 4.057 20 0 EIADMP Cc1cc2cc[nH]c2c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[nH+]1 ZINC001170330221 1046001322 /nfs/dbraw/zinc/00/13/22/1046001322.db2.gz JDADZWPSESKCGM-OWZKRDHZSA-N 2 1 346.478 4.479 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000261896123 1046163006 /nfs/dbraw/zinc/16/30/06/1046163006.db2.gz VAUQAPFXRCAALB-OXJNMPFZSA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000261896123 1046163011 /nfs/dbraw/zinc/16/30/11/1046163011.db2.gz VAUQAPFXRCAALB-OXJNMPFZSA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000261932077 1046165987 /nfs/dbraw/zinc/16/59/87/1046165987.db2.gz LROFGFGVTRBGQM-DLBZAZTESA-N 2 1 343.540 4.419 20 0 EIADMP Cc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3C[C@H](C)C[C@H](C)C3)cc2)o1 ZINC000237687798 1046304107 /nfs/dbraw/zinc/30/41/07/1046304107.db2.gz YCDGVIDCRLGVED-CALCHBBNSA-N 2 1 326.484 4.356 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000125520932 1046314484 /nfs/dbraw/zinc/31/44/84/1046314484.db2.gz KHBSFDVAOVQCHZ-VQIMIIECSA-N 2 1 329.513 4.150 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000125520932 1046314504 /nfs/dbraw/zinc/31/45/04/1046314504.db2.gz KHBSFDVAOVQCHZ-VQIMIIECSA-N 2 1 329.513 4.150 20 0 EIADMP C[C@H](Nc1cccc(C[NH+](C)C)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508688656 1046321442 /nfs/dbraw/zinc/32/14/42/1046321442.db2.gz DLAGTOFQMIXOFR-GHTZIAJQSA-N 2 1 337.511 4.071 20 0 EIADMP C[C@@H]([NH2+]CCc1cc(F)cc(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508712196 1046370440 /nfs/dbraw/zinc/37/04/40/1046370440.db2.gz CHGFJHWTZUOCLR-APWZRJJASA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508715807 1046381373 /nfs/dbraw/zinc/38/13/73/1046381373.db2.gz XZKKVGXJZCHKKW-DWLNXYMOSA-N 2 1 346.518 4.073 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)C1 ZINC000125974479 1046398461 /nfs/dbraw/zinc/39/84/61/1046398461.db2.gz LUAGKWYTEXZGFO-KBPBESRZSA-N 2 1 344.421 4.198 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)C1 ZINC000125974479 1046398472 /nfs/dbraw/zinc/39/84/72/1046398472.db2.gz LUAGKWYTEXZGFO-KBPBESRZSA-N 2 1 344.421 4.198 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000126815271 1046563754 /nfs/dbraw/zinc/56/37/54/1046563754.db2.gz HBSGMMGTHLUOLE-IRXDYDNUSA-N 2 1 344.524 4.320 20 0 EIADMP c1cn(C2CCN(Cc3cnc(C4CCCCC4)s3)CC2)cn1 ZINC000536654037 1046597712 /nfs/dbraw/zinc/59/77/12/1046597712.db2.gz GJAURLIQQVDUIW-UHFFFAOYSA-N 2 1 330.501 4.224 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)[C@@H](C)C1 ZINC000536659055 1046607216 /nfs/dbraw/zinc/60/72/16/1046607216.db2.gz AQNSURGEIHJDTB-KXBFYZLASA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)[C@@H](C)C1 ZINC000536659055 1046607227 /nfs/dbraw/zinc/60/72/27/1046607227.db2.gz AQNSURGEIHJDTB-KXBFYZLASA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3ccccc3F)o2)[C@@H](C)C1 ZINC000536659055 1046607255 /nfs/dbraw/zinc/60/72/55/1046607255.db2.gz AQNSURGEIHJDTB-KXBFYZLASA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)[C@@H](C)C1 ZINC000536659055 1046607271 /nfs/dbraw/zinc/60/72/71/1046607271.db2.gz AQNSURGEIHJDTB-KXBFYZLASA-N 2 1 330.447 4.248 20 0 EIADMP Cc1cc(F)c(CNCc2ccc(F)c(CN(C)C)c2)c(Cl)c1 ZINC000459416946 1046641821 /nfs/dbraw/zinc/64/18/21/1046641821.db2.gz UEBAPWQUYUOZRX-UHFFFAOYSA-N 2 1 338.829 4.278 20 0 EIADMP C[C@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)[C@@H]1CC1(C)C ZINC000785497555 1046700105 /nfs/dbraw/zinc/70/01/05/1046700105.db2.gz SHSFEMITMMVZQS-JXFKEZNVSA-N 2 1 329.532 4.311 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCC1 ZINC000459464652 1046701771 /nfs/dbraw/zinc/70/17/71/1046701771.db2.gz WUJWXZUZZMTPBL-KRWDZBQOSA-N 2 1 337.389 4.112 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(F)cc2cccnc21 ZINC000191474191 1046730247 /nfs/dbraw/zinc/73/02/47/1046730247.db2.gz GVAIBUNQRVNORH-UHFFFAOYSA-N 2 1 340.446 4.045 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(F)cc2cccnc21 ZINC000191474191 1046730262 /nfs/dbraw/zinc/73/02/62/1046730262.db2.gz GVAIBUNQRVNORH-UHFFFAOYSA-N 2 1 340.446 4.045 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379630272 1046731199 /nfs/dbraw/zinc/73/11/99/1046731199.db2.gz PKRPOZRVBJGGCM-GGPKGHCWSA-N 2 1 326.484 4.243 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379630272 1046731212 /nfs/dbraw/zinc/73/12/12/1046731212.db2.gz PKRPOZRVBJGGCM-GGPKGHCWSA-N 2 1 326.484 4.243 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1CN(C)C[C@@H]1CC[N@@H+](C)C1 ZINC000459528485 1046756134 /nfs/dbraw/zinc/75/61/34/1046756134.db2.gz ZIOVDGXHTRBBSW-GOSISDBHSA-N 2 1 338.495 4.054 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[N@H+](C)C[C@@H]1CC[NH+](C)C1 ZINC000459528485 1046756147 /nfs/dbraw/zinc/75/61/47/1046756147.db2.gz ZIOVDGXHTRBBSW-GOSISDBHSA-N 2 1 338.495 4.054 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[N@@H+](C)C[C@@H]1CC[NH+](C)C1 ZINC000459528485 1046756159 /nfs/dbraw/zinc/75/61/59/1046756159.db2.gz ZIOVDGXHTRBBSW-GOSISDBHSA-N 2 1 338.495 4.054 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[NH+](C)C[C@@H]1CC[N@H+](C)C1 ZINC000459528485 1046756174 /nfs/dbraw/zinc/75/61/74/1046756174.db2.gz ZIOVDGXHTRBBSW-GOSISDBHSA-N 2 1 338.495 4.054 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[NH+](C)C[C@@H]1CC[N@@H+](C)C1 ZINC000459528485 1046756190 /nfs/dbraw/zinc/75/61/90/1046756190.db2.gz ZIOVDGXHTRBBSW-GOSISDBHSA-N 2 1 338.495 4.054 20 0 EIADMP CCOc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379656071 1046759925 /nfs/dbraw/zinc/75/99/25/1046759925.db2.gz NXSNMKJTWLSNSY-GHTZIAJQSA-N 2 1 338.495 4.228 20 0 EIADMP CCOc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379656071 1046759938 /nfs/dbraw/zinc/75/99/38/1046759938.db2.gz NXSNMKJTWLSNSY-GHTZIAJQSA-N 2 1 338.495 4.228 20 0 EIADMP CCOc1ccccc1[C@@H](C)[NH2+]C1CCN(c2cccc(C)[nH+]2)CC1 ZINC000128217979 1046782461 /nfs/dbraw/zinc/78/24/61/1046782461.db2.gz OYTLTJUCTLRXLP-QGZVFWFLSA-N 2 1 339.483 4.108 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000536833477 1046809475 /nfs/dbraw/zinc/80/94/75/1046809475.db2.gz PTOCXSMJNMKQNP-CEXWTWQISA-N 2 1 332.532 4.145 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000536832777 1046809634 /nfs/dbraw/zinc/80/96/34/1046809634.db2.gz NDZRRNFYLCXKLR-ICSRJNTNSA-N 2 1 342.527 4.391 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000536832777 1046809636 /nfs/dbraw/zinc/80/96/36/1046809636.db2.gz NDZRRNFYLCXKLR-ICSRJNTNSA-N 2 1 342.527 4.391 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CCC1 ZINC000536845214 1046817680 /nfs/dbraw/zinc/81/76/80/1046817680.db2.gz KRPJOJPOCREQLT-TZIWHRDSSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)c(Cl)c1 ZINC000536860580 1046828305 /nfs/dbraw/zinc/82/83/05/1046828305.db2.gz YXDMWRCWYDDBLW-ZNMIVQPWSA-N 2 1 342.886 4.019 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000536859833 1046828443 /nfs/dbraw/zinc/82/84/43/1046828443.db2.gz WTZMNZPRZCTSPG-MDASCCDHSA-N 2 1 331.891 4.407 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cccc(F)c1F ZINC000536863771 1046829872 /nfs/dbraw/zinc/82/98/72/1046829872.db2.gz MSKUJLBHWZNHIN-OXQOHEQNSA-N 2 1 344.449 4.008 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cccc(Cl)c1Cl ZINC000536866229 1046830693 /nfs/dbraw/zinc/83/06/93/1046830693.db2.gz ZOOVLWCKDDHJDQ-VXGBXAGGSA-N 2 1 326.271 4.485 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000459723560 1046863885 /nfs/dbraw/zinc/86/38/85/1046863885.db2.gz ADDZODQHPOSTON-CBBWQLFWSA-N 2 1 326.937 4.215 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)[C@H](C)c1nc2ccccc2s1 ZINC000459728907 1046865547 /nfs/dbraw/zinc/86/55/47/1046865547.db2.gz CWEUNKCBHXIVIJ-HRCADAONSA-N 2 1 331.529 4.110 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459728939 1046866056 /nfs/dbraw/zinc/86/60/56/1046866056.db2.gz CWEUNKCBHXIVIJ-PMPSAXMXSA-N 2 1 331.529 4.110 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000459737547 1046875888 /nfs/dbraw/zinc/87/58/88/1046875888.db2.gz RLPZZZNVIMRBKH-LJQANCHMSA-N 2 1 338.495 4.184 20 0 EIADMP Cc1c([C@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cnn1C(C)C ZINC000786906463 1046880307 /nfs/dbraw/zinc/88/03/07/1046880307.db2.gz ZXURTFUEBHVDQC-KRWDZBQOSA-N 2 1 346.563 4.468 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000459790964 1046891522 /nfs/dbraw/zinc/89/15/22/1046891522.db2.gz RECVULUJFYGGDU-CQSZACIVSA-N 2 1 349.931 4.285 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000537012674 1046892619 /nfs/dbraw/zinc/89/26/19/1046892619.db2.gz BSTPTBCIEOCUPF-LVCYWYKZSA-N 2 1 337.511 4.348 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000537012674 1046892635 /nfs/dbraw/zinc/89/26/35/1046892635.db2.gz BSTPTBCIEOCUPF-LVCYWYKZSA-N 2 1 337.511 4.348 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1 ZINC000537012369 1046894341 /nfs/dbraw/zinc/89/43/41/1046894341.db2.gz NLUPBYLGVCGYIS-ZWOKBUDYSA-N 2 1 329.532 4.338 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C(C)(C)c1ccc(OCC(C)C)cc1 ZINC000537116467 1046969233 /nfs/dbraw/zinc/96/92/33/1046969233.db2.gz DZVHSEWCIPTMST-UHFFFAOYSA-N 2 1 329.488 4.141 20 0 EIADMP CC(C)CCC[C@@H](C)[NH+]1CCC2(CCC[N@H+]2Cc2cnn(C)c2)CC1 ZINC001170079618 1047064937 /nfs/dbraw/zinc/06/49/37/1047064937.db2.gz DYXMDFFDFCIEHM-LJQANCHMSA-N 2 1 346.563 4.065 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@@H]3CCC[C@@H]([NH+](C)C)C3)oc21 ZINC000537293518 1047076733 /nfs/dbraw/zinc/07/67/33/1047076733.db2.gz VQTBQIKVVMLHRM-USXIJHARSA-N 2 1 330.472 4.355 20 0 EIADMP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000537303718 1047084441 /nfs/dbraw/zinc/08/44/41/1047084441.db2.gz IVOYGQAYMOPURI-QWHCGFSZSA-N 2 1 343.298 4.001 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1cc[nH]c(=O)c1 ZINC000788525004 1047200810 /nfs/dbraw/zinc/20/08/10/1047200810.db2.gz AEIGLMZUEHZTQM-IRXDYDNUSA-N 2 1 339.483 4.012 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCCn2ccc3ccccc32)C[C@H]1c1ccccc1 ZINC000556052952 1047418497 /nfs/dbraw/zinc/41/84/97/1047418497.db2.gz LDMKZOXMQAOAJW-GMAHTHKFSA-N 2 1 347.506 4.457 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCn2ccc3ccccc32)C[C@H]1c1ccccc1 ZINC000556052952 1047418501 /nfs/dbraw/zinc/41/85/01/1047418501.db2.gz LDMKZOXMQAOAJW-GMAHTHKFSA-N 2 1 347.506 4.457 20 0 EIADMP CCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1F ZINC000556077760 1047433959 /nfs/dbraw/zinc/43/39/59/1047433959.db2.gz ZXROQWKXCYGVHG-UYAOXDASSA-N 2 1 342.458 4.150 20 0 EIADMP CCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1F ZINC000556077760 1047433969 /nfs/dbraw/zinc/43/39/69/1047433969.db2.gz ZXROQWKXCYGVHG-UYAOXDASSA-N 2 1 342.458 4.150 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)Oc1cccc(F)c1 ZINC000556093678 1047444266 /nfs/dbraw/zinc/44/42/66/1047444266.db2.gz KEXDFFUYKWEUIC-LKUPVBHCSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)Oc1cccc(F)c1 ZINC000556093678 1047444272 /nfs/dbraw/zinc/44/42/72/1047444272.db2.gz KEXDFFUYKWEUIC-LKUPVBHCSA-N 2 1 342.458 4.018 20 0 EIADMP Cc1ccccc1O[C@H](C)C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556094112 1047446312 /nfs/dbraw/zinc/44/63/12/1047446312.db2.gz QPZWVOVOCSSWIQ-GIVPXCGWSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1ccccc1O[C@H](C)C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556094112 1047446316 /nfs/dbraw/zinc/44/63/16/1047446316.db2.gz QPZWVOVOCSSWIQ-GIVPXCGWSA-N 2 1 338.495 4.187 20 0 EIADMP c1ccc([C@H]2C[C@@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC[N@H+]2C2CC2)cc1 ZINC000897746550 1047481678 /nfs/dbraw/zinc/48/16/78/1047481678.db2.gz NLWSJCUAKIKCQL-WOJQTJRTSA-N 2 1 342.552 4.371 20 0 EIADMP c1ccc([C@H]2C[C@@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC[N@@H+]2C2CC2)cc1 ZINC000897746550 1047481683 /nfs/dbraw/zinc/48/16/83/1047481683.db2.gz NLWSJCUAKIKCQL-WOJQTJRTSA-N 2 1 342.552 4.371 20 0 EIADMP C[C@H](N[C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1cncs1 ZINC000897931036 1047500881 /nfs/dbraw/zinc/50/08/81/1047500881.db2.gz VABOCWNQNJKYNJ-LESCRADOSA-N 2 1 327.497 4.162 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCNc2ccccc2F)C[C@@H]1c1ccccc1 ZINC000556172916 1047537138 /nfs/dbraw/zinc/53/71/38/1047537138.db2.gz CQLNYDPZCBFJIV-WIYYLYMNSA-N 2 1 341.474 4.053 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCNc2ccccc2F)C[C@@H]1c1ccccc1 ZINC000556172916 1047537147 /nfs/dbraw/zinc/53/71/47/1047537147.db2.gz CQLNYDPZCBFJIV-WIYYLYMNSA-N 2 1 341.474 4.053 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2cccc3[nH]ccc32)C[C@H]1c1ccccc1 ZINC000556179699 1047539940 /nfs/dbraw/zinc/53/99/40/1047539940.db2.gz WELFNQHLHCGYMI-KNQAVFIVSA-N 2 1 333.479 4.136 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2cccc3[nH]ccc32)C[C@H]1c1ccccc1 ZINC000556179699 1047539954 /nfs/dbraw/zinc/53/99/54/1047539954.db2.gz WELFNQHLHCGYMI-KNQAVFIVSA-N 2 1 333.479 4.136 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cnn(CC2CCC2)c1 ZINC000898178575 1047576878 /nfs/dbraw/zinc/57/68/78/1047576878.db2.gz CQCSQMQKYSHNOS-KRWDZBQOSA-N 2 1 344.547 4.131 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCCc3c(O)cccc32)C1 ZINC000556236330 1047602511 /nfs/dbraw/zinc/60/25/11/1047602511.db2.gz QNECRCSOTKRISO-FUHIMQAGSA-N 2 1 330.516 4.117 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242192 1047622726 /nfs/dbraw/zinc/62/27/26/1047622726.db2.gz RJIGLFQNEXNFOK-PVSGBFIBSA-N 2 1 334.507 4.290 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242192 1047622735 /nfs/dbraw/zinc/62/27/35/1047622735.db2.gz RJIGLFQNEXNFOK-PVSGBFIBSA-N 2 1 334.507 4.290 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC000556260182 1047631747 /nfs/dbraw/zinc/63/17/47/1047631747.db2.gz KORQZFRFUVFYEZ-LMDPOFIKSA-N 2 1 336.470 4.455 20 0 EIADMP Oc1cccc2c1CCC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000191639573 1047715191 /nfs/dbraw/zinc/71/51/91/1047715191.db2.gz JQHUCIJFTWXORW-HXUWFJFHSA-N 2 1 328.500 4.156 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000556406672 1047737738 /nfs/dbraw/zinc/73/77/38/1047737738.db2.gz ARFGFIVIOCYXKK-UHFFFAOYSA-N 2 1 349.931 4.428 20 0 EIADMP Cc1ccccc1[C@@H](O)C[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000763435121 1047791603 /nfs/dbraw/zinc/79/16/03/1047791603.db2.gz ZJBLMAGGRXMRJD-KNQAVFIVSA-N 2 1 344.543 4.005 20 0 EIADMP Cc1ccccc1[C@H](O)C[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000763435120 1047792417 /nfs/dbraw/zinc/79/24/17/1047792417.db2.gz ZJBLMAGGRXMRJD-DENIHFKCSA-N 2 1 344.543 4.005 20 0 EIADMP C[C@H](CCc1ccc(O)cc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550643956 1047801763 /nfs/dbraw/zinc/80/17/63/1047801763.db2.gz HYXWBVCNOOBVMN-PIPMEXSNSA-N 2 1 338.495 4.138 20 0 EIADMP C[C@H](CCc1ccc(O)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550643956 1047801764 /nfs/dbraw/zinc/80/17/64/1047801764.db2.gz HYXWBVCNOOBVMN-PIPMEXSNSA-N 2 1 338.495 4.138 20 0 EIADMP c1cc(C2CCCCC2)ccc1C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000655770403 1047805296 /nfs/dbraw/zinc/80/52/96/1047805296.db2.gz JPQYOCMUXUUHSS-QFIPXVFZSA-N 2 1 342.527 4.077 20 0 EIADMP COCCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000550678095 1047813770 /nfs/dbraw/zinc/81/37/70/1047813770.db2.gz AOWJHMLBTHXDJP-WOJBJXKFSA-N 2 1 330.516 4.008 20 0 EIADMP COCCC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000550678095 1047813773 /nfs/dbraw/zinc/81/37/73/1047813773.db2.gz AOWJHMLBTHXDJP-WOJBJXKFSA-N 2 1 330.516 4.008 20 0 EIADMP C[C@H](Nc1ccc2c(c1)[nH+]cn2[C@@H]1CCC[NH2+]CC1)c1cccc(N)c1 ZINC001170733629 1047890036 /nfs/dbraw/zinc/89/00/36/1047890036.db2.gz JRIMJDRFOOCKSB-HNAYVOBHSA-N 2 1 349.482 4.106 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001171064634 1047923509 /nfs/dbraw/zinc/92/35/09/1047923509.db2.gz SFSZBVLJPHMJNX-CZUORRHYSA-N 2 1 341.326 4.172 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@]2(C)CC2(Cl)Cl)CC[N@H+]1Cc1ccccc1 ZINC000824775050 1047931408 /nfs/dbraw/zinc/93/14/08/1047931408.db2.gz XRDHYLLTENEGDE-DJIMGWMZSA-N 2 1 341.326 4.213 20 0 EIADMP C[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000824775079 1047935340 /nfs/dbraw/zinc/93/53/40/1047935340.db2.gz YFVHBNRDGSHPJV-XIRDDKMYSA-N 2 1 341.326 4.071 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(OCC(F)F)cc2)CC1 ZINC001136942202 1047966419 /nfs/dbraw/zinc/96/64/19/1047966419.db2.gz ZHFGWUJUOAJULM-UHFFFAOYSA-N 2 1 340.458 4.027 20 0 EIADMP CC(C)[C@@H](NCC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939039 1047994228 /nfs/dbraw/zinc/99/42/28/1047994228.db2.gz FDXHNMPIJDWPHW-LAUBAEHRSA-N 2 1 343.490 4.418 20 0 EIADMP CC(C)[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939039 1047994246 /nfs/dbraw/zinc/99/42/46/1047994246.db2.gz FDXHNMPIJDWPHW-LAUBAEHRSA-N 2 1 343.490 4.418 20 0 EIADMP CC(C)[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939039 1047994264 /nfs/dbraw/zinc/99/42/64/1047994264.db2.gz FDXHNMPIJDWPHW-LAUBAEHRSA-N 2 1 343.490 4.418 20 0 EIADMP C[N@@H+](CC1CC[NH+](C)CC1)[C@@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171082942 1048069514 /nfs/dbraw/zinc/06/95/14/1048069514.db2.gz PJFYHSZBFQHLOH-MRXNPFEDSA-N 2 1 341.326 4.124 20 0 EIADMP FC1(F)CC([NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000556887850 1048099681 /nfs/dbraw/zinc/09/96/81/1048099681.db2.gz MGQXTUWWPAZQGA-QXAKKESOSA-N 2 1 334.454 4.065 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@H+](CCc2ccccc2)C2CCCC2)s1 ZINC000809548943 1048411415 /nfs/dbraw/zinc/41/14/15/1048411415.db2.gz QLIYSLOHLKECGL-UHFFFAOYSA-N 2 1 343.540 4.192 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@@H+](CCc2ccccc2)C2CCCC2)s1 ZINC000809548943 1048411452 /nfs/dbraw/zinc/41/14/52/1048411452.db2.gz QLIYSLOHLKECGL-UHFFFAOYSA-N 2 1 343.540 4.192 20 0 EIADMP CC[C@@H](Cc1ccc(C)cc1)[N@H+](CC)Cc1ncc(C[NH+](C)C)s1 ZINC000809582727 1048425312 /nfs/dbraw/zinc/42/53/12/1048425312.db2.gz BPSOGLUZCWKXBO-SFHVURJKSA-N 2 1 345.556 4.356 20 0 EIADMP CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)Cc1ncc(C[NH+](C)C)s1 ZINC000809582727 1048425318 /nfs/dbraw/zinc/42/53/18/1048425318.db2.gz BPSOGLUZCWKXBO-SFHVURJKSA-N 2 1 345.556 4.356 20 0 EIADMP Cc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000499219592 1048429627 /nfs/dbraw/zinc/42/96/27/1048429627.db2.gz QTHXSNCNKODMHD-NUNAXRQHSA-N 2 1 334.507 4.323 20 0 EIADMP C[NH+]1CCC(C2CC[NH+](Cc3cc(Cl)c(F)cc3F)CC2)CC1 ZINC001144131143 1048454115 /nfs/dbraw/zinc/45/41/15/1048454115.db2.gz VXLKBVMXGALZQF-UHFFFAOYSA-N 2 1 342.861 4.172 20 0 EIADMP Cc1ccc2cc(C[N@H+](C)Cc3ccc(C[NH+](C)C)cc3)ccc2n1 ZINC000809738933 1048509967 /nfs/dbraw/zinc/50/99/67/1048509967.db2.gz PTHLTDVPWYUZHN-UHFFFAOYSA-N 2 1 333.479 4.237 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCCCOc2ccccc2)cc1 ZINC000809738177 1048510577 /nfs/dbraw/zinc/51/05/77/1048510577.db2.gz SLSBFEYPGOOLHI-UHFFFAOYSA-N 2 1 326.484 4.039 20 0 EIADMP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc([C@H]4CC[N@@H+](C)C4)cc3)c2c1 ZINC001171167786 1048614057 /nfs/dbraw/zinc/61/40/57/1048614057.db2.gz MQQKKLQDVXNWPC-MJGOQNOKSA-N 2 1 347.506 4.248 20 0 EIADMP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc2scnc2c1 ZINC001144743262 1048848395 /nfs/dbraw/zinc/84/83/95/1048848395.db2.gz HIVHAURPADHAJR-DLBZAZTESA-N 2 1 329.513 4.135 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc2scnc2c1 ZINC001144743262 1048848397 /nfs/dbraw/zinc/84/83/97/1048848397.db2.gz HIVHAURPADHAJR-DLBZAZTESA-N 2 1 329.513 4.135 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccc2scnc2c1 ZINC001144743262 1048848402 /nfs/dbraw/zinc/84/84/02/1048848402.db2.gz HIVHAURPADHAJR-DLBZAZTESA-N 2 1 329.513 4.135 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccc2scnc2c1 ZINC001144743262 1048848405 /nfs/dbraw/zinc/84/84/05/1048848405.db2.gz HIVHAURPADHAJR-DLBZAZTESA-N 2 1 329.513 4.135 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc3cc[nH]c32)CC[N@@H+]1Cc1ccccc1 ZINC000237492675 1048952811 /nfs/dbraw/zinc/95/28/11/1048952811.db2.gz JOSAJMPZFNWJTB-DYESRHJHSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc3cc[nH]c32)CC[N@H+]1Cc1ccccc1 ZINC000237492675 1048952823 /nfs/dbraw/zinc/95/28/23/1048952823.db2.gz JOSAJMPZFNWJTB-DYESRHJHSA-N 2 1 333.479 4.311 20 0 EIADMP CCC[N@@H+](Cc1cccc(Br)c1)[C@@H]1CC[NH2+]C(C)(C)C1 ZINC001246846794 1049022389 /nfs/dbraw/zinc/02/23/89/1049022389.db2.gz QBOGFYHJWBYZPK-MRXNPFEDSA-N 2 1 339.321 4.192 20 0 EIADMP CC(C)Cc1ccc([C@H]([NH2+][C@H](C)C2C[NH2+]C2)c2cccs2)cc1 ZINC000817897343 1049054758 /nfs/dbraw/zinc/05/47/58/1049054758.db2.gz LFQGHAAVVMAQJQ-QRWLVFNGSA-N 2 1 328.525 4.234 20 0 EIADMP CCC([NH3+])(CC)C[NH2+][C@H](C)c1ccc(SC(F)F)c(OC)c1 ZINC000817960933 1049070429 /nfs/dbraw/zinc/07/04/29/1049070429.db2.gz UPYPZEGEDAKLDL-LLVKDONJSA-N 2 1 332.460 4.178 20 0 EIADMP CC(C)c1ccc(C2(O)CCC([NH2+][C@H](C[NH3+])C3CCCC3)CC2)cc1 ZINC000817982421 1049077567 /nfs/dbraw/zinc/07/75/67/1049077567.db2.gz RZNNRNQRKMTDQT-ATKRNPRHSA-N 2 1 344.543 4.047 20 0 EIADMP CC[C@H]([NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C1CCOCC1 ZINC000348095365 1049415644 /nfs/dbraw/zinc/41/56/44/1049415644.db2.gz KZGFXGBEFLANCZ-QRWLVFNGSA-N 2 1 327.472 4.037 20 0 EIADMP C[C@@H](CC[NH2+][C@@H]1CCCNc2ccccc21)[N@@H+](C)Cc1ccccc1 ZINC000348097586 1049416960 /nfs/dbraw/zinc/41/69/60/1049416960.db2.gz WQQBUJDVEKAHFB-PGRDOPGGSA-N 2 1 337.511 4.434 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H](c2ccccc2)N(C)C)cc1 ZINC000348130216 1049437700 /nfs/dbraw/zinc/43/77/00/1049437700.db2.gz KFVCIDKKHZTKJJ-VGOFRKELSA-N 2 1 348.494 4.134 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCO[C@H]2CC(C)C)cc1 ZINC000348195759 1049466127 /nfs/dbraw/zinc/46/61/27/1049466127.db2.gz YHEDXTFPPFFMPP-NDXORKPFSA-N 2 1 341.499 4.425 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCC2CC(OC(C)(C)C)C2)C[C@@H]1c1ccccc1 ZINC000517226226 1049504662 /nfs/dbraw/zinc/50/46/62/1049504662.db2.gz GPEUNCDPDPLNDY-OPWVIFHQSA-N 2 1 344.543 4.395 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCC2CC(OC(C)(C)C)C2)C[C@@H]1c1ccccc1 ZINC000517226226 1049504679 /nfs/dbraw/zinc/50/46/79/1049504679.db2.gz GPEUNCDPDPLNDY-OPWVIFHQSA-N 2 1 344.543 4.395 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1CCCO1 ZINC000820829453 1049562670 /nfs/dbraw/zinc/56/26/70/1049562670.db2.gz JLOLZGTZHBMGKF-RFQIGKHKSA-N 2 1 342.527 4.119 20 0 EIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CCCO1 ZINC000820829452 1049563924 /nfs/dbraw/zinc/56/39/24/1049563924.db2.gz JLOLZGTZHBMGKF-NAQMCUANSA-N 2 1 342.527 4.119 20 0 EIADMP Fc1cccc2c1CC[C@@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001171434021 1049674299 /nfs/dbraw/zinc/67/42/99/1049674299.db2.gz PMPLLEMGYBUIAV-RTBURBONSA-N 2 1 330.491 4.023 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)c1cccc(O)c1 ZINC000716693170 1049700792 /nfs/dbraw/zinc/70/07/92/1049700792.db2.gz OGBURNTVXIMOMX-GIUOSPMZSA-N 2 1 336.479 4.096 20 0 EIADMP CC(C)(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cccc(F)c2C1 ZINC001170972572 1049703444 /nfs/dbraw/zinc/70/34/44/1049703444.db2.gz QSABAKZILKQCBP-BZSNNMDCSA-N 2 1 332.507 4.301 20 0 EIADMP FC1(F)CCC[C@@H]1C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716704540 1049703593 /nfs/dbraw/zinc/70/35/93/1049703593.db2.gz GIHUGJXMZINIDQ-RDGPPVDQSA-N 2 1 334.454 4.065 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccccc2Oc2cccnc2)[C@@H](C)C1 ZINC000245412717 1049710733 /nfs/dbraw/zinc/71/07/33/1049710733.db2.gz AWSHODHLRMKYBK-FXAWDEMLSA-N 2 1 339.483 4.036 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccccc2Oc2cccnc2)[C@@H](C)C1 ZINC000245412717 1049710739 /nfs/dbraw/zinc/71/07/39/1049710739.db2.gz AWSHODHLRMKYBK-FXAWDEMLSA-N 2 1 339.483 4.036 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2Oc2cccnc2)[C@@H](C)C1 ZINC000245412717 1049710746 /nfs/dbraw/zinc/71/07/46/1049710746.db2.gz AWSHODHLRMKYBK-FXAWDEMLSA-N 2 1 339.483 4.036 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc3ccccc3)C1)C2 ZINC001171551555 1049753713 /nfs/dbraw/zinc/75/37/13/1049753713.db2.gz QEMPQVNZFGECDU-GMAHTHKFSA-N 2 1 348.534 4.354 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@@H+](C)C[C@@H]1CC[NH+](Cc3ccccc3)C1)C2 ZINC001171573528 1049759495 /nfs/dbraw/zinc/75/94/95/1049759495.db2.gz IYVKHQYLIGSPFI-JTHBVZDNSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH+](C)C[C@@H]1CC[N@H+](Cc3ccccc3)C1)C2 ZINC001171573528 1049759503 /nfs/dbraw/zinc/75/95/03/1049759503.db2.gz IYVKHQYLIGSPFI-JTHBVZDNSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH+](C)C[C@@H]1CC[N@@H+](Cc3ccccc3)C1)C2 ZINC001171573528 1049759510 /nfs/dbraw/zinc/75/95/10/1049759510.db2.gz IYVKHQYLIGSPFI-JTHBVZDNSA-N 2 1 348.534 4.306 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1nccs1 ZINC000245535882 1049769223 /nfs/dbraw/zinc/76/92/23/1049769223.db2.gz KWYADWNEKOKMNQ-BRWVUGGUSA-N 2 1 343.540 4.472 20 0 EIADMP C[NH+]1C(C)(C)CC([N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171626889 1049769276 /nfs/dbraw/zinc/76/92/76/1049769276.db2.gz GCRLYJWGKYQRRU-QAQDUYKDSA-N 3 1 337.596 4.256 20 0 EIADMP CN1C(C)(C)CC([N@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171626889 1049769283 /nfs/dbraw/zinc/76/92/83/1049769283.db2.gz GCRLYJWGKYQRRU-QAQDUYKDSA-N 2 1 337.596 4.256 20 0 EIADMP CN1C(C)(C)CC([N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171626889 1049769292 /nfs/dbraw/zinc/76/92/92/1049769292.db2.gz GCRLYJWGKYQRRU-QAQDUYKDSA-N 2 1 337.596 4.256 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@H](c2cncc(Cl)c2)C2CC2)CC1(C)C ZINC001171627532 1049769760 /nfs/dbraw/zinc/76/97/60/1049769760.db2.gz VDMYMVAEHPGURI-KRWDZBQOSA-N 2 1 335.923 4.427 20 0 EIADMP C[NH+]1C(C)(C)CC([N@H+]2CCSC[C@@H]2c2ccccc2)CC1(C)C ZINC001171640035 1049779952 /nfs/dbraw/zinc/77/99/52/1049779952.db2.gz ZXYCUUNCSIXLQH-GOSISDBHSA-N 2 1 332.557 4.428 20 0 EIADMP C[C@H]([NH3+])c1ccc2c(ccn2[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC001171726747 1049785277 /nfs/dbraw/zinc/78/52/77/1049785277.db2.gz HYUKEBSYGJXHJT-XGHQBKJUSA-N 2 1 333.479 4.497 20 0 EIADMP Cc1ccc2c(c1)c(CC[NH3+])cn2[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727764 1049785395 /nfs/dbraw/zinc/78/53/95/1049785395.db2.gz XPSVBZMJBISYAB-GHTZIAJQSA-N 2 1 347.506 4.286 20 0 EIADMP C[N@H+](CC[C@@H]1CC1(Cl)Cl)C1CC[NH+](Cc2ccccc2)CC1 ZINC000822746687 1049791904 /nfs/dbraw/zinc/79/19/04/1049791904.db2.gz MPNKHHBQTJYBOO-MRXNPFEDSA-N 2 1 341.326 4.167 20 0 EIADMP C[N@@H+](CC[C@@H]1CC1(Cl)Cl)C1CC[NH+](Cc2ccccc2)CC1 ZINC000822746687 1049791916 /nfs/dbraw/zinc/79/19/16/1049791916.db2.gz MPNKHHBQTJYBOO-MRXNPFEDSA-N 2 1 341.326 4.167 20 0 EIADMP C[C@H]([NH3+])c1cn([C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171740729 1049802144 /nfs/dbraw/zinc/80/21/44/1049802144.db2.gz LEFBZQQWOYYPFO-LNLFQRSKSA-N 2 1 333.479 4.497 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001171961666 1049824611 /nfs/dbraw/zinc/82/46/11/1049824611.db2.gz ABLVLXFERXUTSO-CYBMUJFWSA-N 2 1 337.389 4.173 20 0 EIADMP CC[N@H+](C)C1CC[NH+]([C@@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171966038 1049826219 /nfs/dbraw/zinc/82/62/19/1049826219.db2.gz NPGGXGNQFMHRPY-AWEZNQCLSA-N 2 1 328.422 4.053 20 0 EIADMP CC[N@@H+](C)C1CC[NH+]([C@@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171966038 1049826221 /nfs/dbraw/zinc/82/62/21/1049826221.db2.gz NPGGXGNQFMHRPY-AWEZNQCLSA-N 2 1 328.422 4.053 20 0 EIADMP CC1(C)C[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171967083 1049827483 /nfs/dbraw/zinc/82/74/83/1049827483.db2.gz XFXZRKVNDUCNNF-ROUUACIJSA-N 2 1 336.470 4.455 20 0 EIADMP CC[NH+](CC)CCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171967451 1049828077 /nfs/dbraw/zinc/82/80/77/1049828077.db2.gz MCUFNQAKVLLGFX-OAQYLSRUSA-N 3 1 345.575 4.141 20 0 EIADMP CC[NH+](CC)CCCC[NH2+][C@@H]1CCN(Cc2ccccc2)C(C)(C)C1 ZINC001171967451 1049828081 /nfs/dbraw/zinc/82/80/81/1049828081.db2.gz MCUFNQAKVLLGFX-OAQYLSRUSA-N 2 1 345.575 4.141 20 0 EIADMP CC1(C)C[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171967086 1049828259 /nfs/dbraw/zinc/82/82/59/1049828259.db2.gz XFXZRKVNDUCNNF-ZWKOTPCHSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccn1 ZINC000813881283 1049830431 /nfs/dbraw/zinc/83/04/31/1049830431.db2.gz NELUWNOIFSTXJW-XSLAUPDRSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC000813881283 1049830432 /nfs/dbraw/zinc/83/04/32/1049830432.db2.gz NELUWNOIFSTXJW-XSLAUPDRSA-N 2 1 335.495 4.318 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]Cc2occc2C)cc1C[NH+]1CCCCC1 ZINC000813882815 1049830630 /nfs/dbraw/zinc/83/06/30/1049830630.db2.gz LPCZAABIWXELEW-QGZVFWFLSA-N 2 1 342.483 4.433 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CCCc3cccnc32)CC[N@@H+]1Cc1ccccc1 ZINC001171973094 1049836364 /nfs/dbraw/zinc/83/63/64/1049836364.db2.gz VTUCVXONHGCQMR-LEWJYISDSA-N 2 1 349.522 4.492 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CCCc3cccnc32)CC[N@H+]1Cc1ccccc1 ZINC001171973094 1049836366 /nfs/dbraw/zinc/83/63/66/1049836366.db2.gz VTUCVXONHGCQMR-LEWJYISDSA-N 2 1 349.522 4.492 20 0 EIADMP CCOC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980627 1049838818 /nfs/dbraw/zinc/83/88/18/1049838818.db2.gz SHXZTRVAZQKWKU-KBWCOIMZSA-N 2 1 344.543 4.367 20 0 EIADMP C[NH2+]Cc1ccc(N[C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)cc1 ZINC001171985743 1049840319 /nfs/dbraw/zinc/84/03/19/1049840319.db2.gz ZJJNVBQHDVHAAW-NRFANRHFSA-N 2 1 337.511 4.261 20 0 EIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCc2cccc(F)c2C1 ZINC001171014369 1049841320 /nfs/dbraw/zinc/84/13/20/1049841320.db2.gz YYMBIIVXFTWQNB-HXUWFJFHSA-N 2 1 344.518 4.412 20 0 EIADMP Cc1ccncc1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172061098 1049841848 /nfs/dbraw/zinc/84/18/48/1049841848.db2.gz FNIOUNMDWPGFEB-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccncc1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172061098 1049841850 /nfs/dbraw/zinc/84/18/50/1049841850.db2.gz FNIOUNMDWPGFEB-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000245738948 1049844495 /nfs/dbraw/zinc/84/44/95/1049844495.db2.gz RFUHKMZCLCDMOQ-JRSUCEMESA-N 2 1 344.568 4.446 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@H]2CCc4ncccc42)C3)cc1 ZINC001172077020 1049844420 /nfs/dbraw/zinc/84/44/20/1049844420.db2.gz OGECTQHXZGKJCB-GJPOJAMWSA-N 2 1 347.506 4.244 20 0 EIADMP FC1(F)C[C@]12CC[N@H+]([C@@H]1C[C@H]3CCC[C@@H](C1)[NH+]3Cc1ccccc1)C2 ZINC001172074410 1049844668 /nfs/dbraw/zinc/84/46/68/1049844668.db2.gz IRDZIINYEOOPCE-YRPNKDGESA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)C[C@]12CC[NH+]([C@@H]1C[C@H]3CCC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001172074410 1049844669 /nfs/dbraw/zinc/84/46/69/1049844669.db2.gz IRDZIINYEOOPCE-YRPNKDGESA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)C[C@]12CC[NH+]([C@@H]1C[C@H]3CCC[C@@H](C1)[N@@H+]3Cc1ccccc1)C2 ZINC001172074410 1049844672 /nfs/dbraw/zinc/84/46/72/1049844672.db2.gz IRDZIINYEOOPCE-YRPNKDGESA-N 2 1 346.465 4.303 20 0 EIADMP C[N@@H+](C[C@@H]1CCCCO1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076441 1049844713 /nfs/dbraw/zinc/84/47/13/1049844713.db2.gz YOKNTWVFPLFCQJ-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP C[NH+](C[C@@H]1CCCCO1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076441 1049844718 /nfs/dbraw/zinc/84/47/18/1049844718.db2.gz YOKNTWVFPLFCQJ-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP C[NH+](C[C@@H]1CCCCO1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076441 1049844719 /nfs/dbraw/zinc/84/47/19/1049844719.db2.gz YOKNTWVFPLFCQJ-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP Fc1ccccc1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245746919 1049845584 /nfs/dbraw/zinc/84/55/84/1049845584.db2.gz SSFBICODDTUSFK-WKCHPHFGSA-N 2 1 338.470 4.153 20 0 EIADMP CC(C)N([C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C[NH3+] ZINC001172079168 1049846714 /nfs/dbraw/zinc/84/67/14/1049846714.db2.gz MPWZEBRRXDPQCZ-AERCQKQUSA-N 2 1 343.559 4.020 20 0 EIADMP Cc1cc2c(cn1)CN([C@@H]1C[C@H]3CCC[C@@H](C1)[N@@H+]3Cc1ccccc1)C2 ZINC001172082888 1049847842 /nfs/dbraw/zinc/84/78/42/1049847842.db2.gz NAZSVDZTYCPTFQ-NUNAXRQHSA-N 2 1 347.506 4.291 20 0 EIADMP [NH3+]CCc1ccc(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001172062283 1049849394 /nfs/dbraw/zinc/84/93/94/1049849394.db2.gz LUCAPIZOWFWNDK-NUNAXRQHSA-N 2 1 349.522 4.185 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]CCCc2cccnc2)C3)cc1 ZINC001172063740 1049849715 /nfs/dbraw/zinc/84/97/15/1049849715.db2.gz CWSBTIQIPJKTLN-NUNAXRQHSA-N 2 1 349.522 4.190 20 0 EIADMP F[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067367 1049851743 /nfs/dbraw/zinc/85/17/43/1049851743.db2.gz MZOOMGKLVHYUFU-YMQHIKHWSA-N 2 1 330.491 4.442 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccncc1 ZINC001172064788 1049851917 /nfs/dbraw/zinc/85/19/17/1049851917.db2.gz JPPHKUJKYSZQNR-MVWVFHAYSA-N 2 1 335.495 4.318 20 0 EIADMP COC1CCC([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172070027 1049852334 /nfs/dbraw/zinc/85/23/34/1049852334.db2.gz IXJKXAMNDOMHJC-PLZZICSBSA-N 2 1 342.527 4.119 20 0 EIADMP Cc1ccnc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172070003 1049853682 /nfs/dbraw/zinc/85/36/82/1049853682.db2.gz ZOGCIJOAMZSMRR-QQFNCUIESA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccnc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172070003 1049853685 /nfs/dbraw/zinc/85/36/85/1049853685.db2.gz ZOGCIJOAMZSMRR-QQFNCUIESA-N 2 1 335.495 4.065 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H](CCc3ccccc3)C1)C2 ZINC001172134694 1049854152 /nfs/dbraw/zinc/85/41/52/1049854152.db2.gz YPGCDIDIDBVSNK-CZYKHXBRSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H](CCc3ccccc3)C1)C2 ZINC001172134694 1049854153 /nfs/dbraw/zinc/85/41/53/1049854153.db2.gz YPGCDIDIDBVSNK-CZYKHXBRSA-N 2 1 326.528 4.347 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H](CCc3ccccc3)C1)C2 ZINC001172134694 1049854155 /nfs/dbraw/zinc/85/41/55/1049854155.db2.gz YPGCDIDIDBVSNK-CZYKHXBRSA-N 2 1 326.528 4.347 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@H](CCc3ccccc3)C1)C2 ZINC001172134694 1049854158 /nfs/dbraw/zinc/85/41/58/1049854158.db2.gz YPGCDIDIDBVSNK-CZYKHXBRSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@]3(CCc4c3cccc4F)C1)C2 ZINC001172133612 1049854982 /nfs/dbraw/zinc/85/49/82/1049854982.db2.gz UACFFLSCCOQYKS-SUWCGCSTSA-N 2 1 342.502 4.121 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@]3(CCc4c3cccc4F)C1)C2 ZINC001172133612 1049854983 /nfs/dbraw/zinc/85/49/83/1049854983.db2.gz UACFFLSCCOQYKS-SUWCGCSTSA-N 2 1 342.502 4.121 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@]3(CCc4c3cccc4F)C1)C2 ZINC001172133612 1049854986 /nfs/dbraw/zinc/85/49/86/1049854986.db2.gz UACFFLSCCOQYKS-SUWCGCSTSA-N 2 1 342.502 4.121 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cccc(C(F)(F)F)c1Cl)C2 ZINC001172104673 1049856471 /nfs/dbraw/zinc/85/64/71/1049856471.db2.gz FAZZGKADOYZSTR-BTTYYORXSA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cccc(C(F)(F)F)c1Cl)C2 ZINC001172104673 1049856472 /nfs/dbraw/zinc/85/64/72/1049856472.db2.gz FAZZGKADOYZSTR-BTTYYORXSA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccccc1N1CCCCCC1)C2 ZINC001172103758 1049856776 /nfs/dbraw/zinc/85/67/76/1049856776.db2.gz XLTCMMHIEIBZKG-MZADTFQBSA-N 2 1 341.543 4.172 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)C2 ZINC001172105745 1049856935 /nfs/dbraw/zinc/85/69/35/1049856935.db2.gz KARUCVQYMGEBFW-MUJYYYPQSA-N 2 1 346.824 4.464 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Br)cc1 ZINC001172104766 1049857002 /nfs/dbraw/zinc/85/70/02/1049857002.db2.gz FZVDUDLMWFEPMS-VDNDLQMASA-N 2 1 337.305 4.115 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Br)cc1 ZINC001172104766 1049857004 /nfs/dbraw/zinc/85/70/04/1049857004.db2.gz FZVDUDLMWFEPMS-VDNDLQMASA-N 2 1 337.305 4.115 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCCc1cccc(C(F)(F)F)c1)C2 ZINC001172104248 1049857074 /nfs/dbraw/zinc/85/70/74/1049857074.db2.gz BHIRKRBYNMGKED-NNZMDNLPSA-N 2 1 340.433 4.243 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108403 1049857688 /nfs/dbraw/zinc/85/76/88/1049857688.db2.gz AAORPMLCJSBXIZ-LRSLUSHPSA-N 2 1 342.527 4.149 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108403 1049857690 /nfs/dbraw/zinc/85/76/90/1049857690.db2.gz AAORPMLCJSBXIZ-LRSLUSHPSA-N 2 1 342.527 4.149 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(Cc3cccc(Cl)c3)CC1)C2 ZINC001172112632 1049858129 /nfs/dbraw/zinc/85/81/29/1049858129.db2.gz YBXIYMCRKMEVIQ-LDLYASANSA-N 2 1 332.919 4.268 20 0 EIADMP C[N@H+](Cc1cccc(Cl)c1Cl)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172120957 1049858688 /nfs/dbraw/zinc/85/86/88/1049858688.db2.gz AKRGHTMYBPZFPY-FICVDOATSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@@H+](Cc1cccc(Cl)c1Cl)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172120957 1049858690 /nfs/dbraw/zinc/85/86/90/1049858690.db2.gz AKRGHTMYBPZFPY-FICVDOATSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1cccc(Cl)c1Cl)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172120957 1049858691 /nfs/dbraw/zinc/85/86/91/1049858691.db2.gz AKRGHTMYBPZFPY-FICVDOATSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1cccc(Cl)c1Cl)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172120957 1049858692 /nfs/dbraw/zinc/85/86/92/1049858692.db2.gz AKRGHTMYBPZFPY-FICVDOATSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CSc2ccccc2C1 ZINC001172208079 1049864988 /nfs/dbraw/zinc/86/49/88/1049864988.db2.gz NBHDFDYZGBVUKH-FQEVSTJZSA-N 2 1 344.568 4.432 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cc(C3CC3)no2)CC1)CC(C)C ZINC000660170531 1049868380 /nfs/dbraw/zinc/86/83/80/1049868380.db2.gz HCSKELIWADTBBH-UHFFFAOYSA-N 2 1 333.520 4.132 20 0 EIADMP COCCC[NH+]1CCC([NH2+][C@@H](CC(C)C)c2ccccc2F)CC1 ZINC001172246911 1049872145 /nfs/dbraw/zinc/87/21/45/1049872145.db2.gz ZSYFCZHZOXKHPQ-FQEVSTJZSA-N 2 1 336.495 4.003 20 0 EIADMP COCCC[NH+]1CCC([N@H+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001172252734 1049872567 /nfs/dbraw/zinc/87/25/67/1049872567.db2.gz STWHGUIDQRKPTM-UHFFFAOYSA-N 2 1 344.543 4.322 20 0 EIADMP COCCC[NH+]1CCC([N@@H+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001172252734 1049872572 /nfs/dbraw/zinc/87/25/72/1049872572.db2.gz STWHGUIDQRKPTM-UHFFFAOYSA-N 2 1 344.543 4.322 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172315278 1049875696 /nfs/dbraw/zinc/87/56/96/1049875696.db2.gz BLJRQWGABSLJAU-FTSHXLFYSA-N 2 1 344.543 4.365 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[N@@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC001172327954 1049885648 /nfs/dbraw/zinc/88/56/48/1049885648.db2.gz AENGEPFONOVMPI-MOPGFXCFSA-N 2 1 332.532 4.177 20 0 EIADMP Cc1ccccc1C[N@H+]([C@H](C)CCOC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172445804 1049914853 /nfs/dbraw/zinc/91/48/53/1049914853.db2.gz UDMHMQMOYQQXPX-HMXCVIKNSA-N 2 1 332.532 4.271 20 0 EIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172554393 1049930935 /nfs/dbraw/zinc/93/09/35/1049930935.db2.gz UYXOIMXOFYZDMU-CTNGQTDRSA-N 2 1 335.495 4.285 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cnc3ccsc3c2)C1 ZINC000246356487 1049959236 /nfs/dbraw/zinc/95/92/36/1049959236.db2.gz ICLXUSJAOKYSIV-CVEARBPZSA-N 2 1 331.529 4.315 20 0 EIADMP c1cc(C[NH+]2CCOCC2)ccc1C[NH2+]C1CCC2(CCCC2)CC1 ZINC001172725570 1049967049 /nfs/dbraw/zinc/96/70/49/1049967049.db2.gz YFWWXJGTYFPUIU-UHFFFAOYSA-N 2 1 342.527 4.111 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(Br)s2)C1 ZINC000246902203 1050005269 /nfs/dbraw/zinc/00/52/69/1050005269.db2.gz FLKUXUWKOIVNGJ-CHWSQXEVSA-N 2 1 345.350 4.282 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248410270 1050055841 /nfs/dbraw/zinc/05/58/41/1050055841.db2.gz XWFVSDGZTDXWMT-LXZJYRNTSA-N 2 1 344.543 4.430 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248410269 1050055905 /nfs/dbraw/zinc/05/59/05/1050055905.db2.gz XWFVSDGZTDXWMT-AJYBTWMASA-N 2 1 344.543 4.430 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cnn1C(C)(C)C ZINC000248707743 1050073414 /nfs/dbraw/zinc/07/34/14/1050073414.db2.gz PFQAEXCXOFXGEE-RYRKJORJSA-N 2 1 346.563 4.250 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cnn1C(C)(C)C ZINC000248707743 1050073425 /nfs/dbraw/zinc/07/34/25/1050073425.db2.gz PFQAEXCXOFXGEE-RYRKJORJSA-N 2 1 346.563 4.250 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2csc(Cl)c2)[C@@H](C)C1 ZINC000248732219 1050075655 /nfs/dbraw/zinc/07/56/55/1050075655.db2.gz WEHKHECIYLKJHY-DZKIICNBSA-N 2 1 344.952 4.189 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2csc(Cl)c2)[C@@H](C)C1 ZINC000248732219 1050075657 /nfs/dbraw/zinc/07/56/57/1050075657.db2.gz WEHKHECIYLKJHY-DZKIICNBSA-N 2 1 344.952 4.189 20 0 EIADMP 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 1050092297 /nfs/dbraw/zinc/09/22/97/1050092297.db2.gz SEHWPXBTUMHCPE-UMPJEAMMSA-N 2 1 328.422 4.127 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc3ccccc3)C1)CC2 ZINC001172825423 1050167051 /nfs/dbraw/zinc/16/70/51/1050167051.db2.gz GXKYYGRURNLFIJ-XUZZJYLKSA-N 2 1 348.534 4.354 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)C[C@@H]1C)CC2 ZINC001172837773 1050174025 /nfs/dbraw/zinc/17/40/25/1050174025.db2.gz MWUAHBKSJWLZRK-WUMKDDEVSA-N 2 1 348.534 4.353 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)C[C@@H]1C)CC2 ZINC001172837773 1050174027 /nfs/dbraw/zinc/17/40/27/1050174027.db2.gz MWUAHBKSJWLZRK-WUMKDDEVSA-N 2 1 348.534 4.353 20 0 EIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH+]1CCC([NH3+])(c2ccccc2)CC1 ZINC001172866585 1050175207 /nfs/dbraw/zinc/17/52/07/1050175207.db2.gz VDNLPBDRPMGCLU-OAHLLOKOSA-N 2 1 346.877 4.360 20 0 EIADMP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC001177256388 1050175638 /nfs/dbraw/zinc/17/56/38/1050175638.db2.gz DYPAKMVNKXKTPW-BVYCBKJFSA-N 2 1 344.543 4.356 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cc(F)cc(Cl)c2)C1 ZINC001177289360 1050176929 /nfs/dbraw/zinc/17/69/29/1050176929.db2.gz FEIPOJLDYPWTBL-GASCZTMLSA-N 2 1 326.887 4.327 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)CCC2 ZINC000090586922 1050188132 /nfs/dbraw/zinc/18/81/32/1050188132.db2.gz RQXDKKINSMBAAX-JKSUJKDBSA-N 2 1 335.561 4.041 20 0 EIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H](C)Cc2c(F)cccc2Cl)[C@H](C)C1 ZINC001172849531 1050188928 /nfs/dbraw/zinc/18/89/28/1050188928.db2.gz NPSIXVIBKSUVMT-LBTNJELSSA-N 2 1 326.887 4.119 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C/C=C\c2c(C)cc(C)cc2C)cn1 ZINC001177362735 1050203191 /nfs/dbraw/zinc/20/31/91/1050203191.db2.gz DWKBZIFWGZVLBL-WAYWQWQTSA-N 2 1 346.478 4.304 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@H]2C(C)=CCC[C@H]2C)cc1F ZINC001177454609 1050211920 /nfs/dbraw/zinc/21/19/20/1050211920.db2.gz SXMBSFBPBNISKT-QAPCUYQASA-N 2 1 327.447 4.402 20 0 EIADMP C[C@@H](CSc1ccc(Cl)cc1)[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001172881686 1050222054 /nfs/dbraw/zinc/22/20/54/1050222054.db2.gz KQYIXKUKCVQNQP-HNNXBMFYSA-N 2 1 338.948 4.238 20 0 EIADMP CO[C@H]1CCC[C@H]([N@@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928120 1050238807 /nfs/dbraw/zinc/23/88/07/1050238807.db2.gz IXZRQQUZHITUAG-TUFLPTIASA-N 2 1 330.516 4.025 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)C2CCC3(CCOCC3)CC2)CC1 ZINC001173043737 1050270614 /nfs/dbraw/zinc/27/06/14/1050270614.db2.gz IAHLUUSCUWMMGV-UAPYVXQJSA-N 2 1 334.548 4.240 20 0 EIADMP CCCOC1CCC([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173094396 1050284661 /nfs/dbraw/zinc/28/46/61/1050284661.db2.gz XIGMSVTWGGQXJA-IJDVVPKISA-N 2 1 344.543 4.496 20 0 EIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC001177741689 1050290738 /nfs/dbraw/zinc/29/07/38/1050290738.db2.gz BUGDTWNNTRZNJW-CEWLAPEOSA-N 2 1 329.532 4.352 20 0 EIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC001177741689 1050290750 /nfs/dbraw/zinc/29/07/50/1050290750.db2.gz BUGDTWNNTRZNJW-CEWLAPEOSA-N 2 1 329.532 4.352 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173106777 1050307851 /nfs/dbraw/zinc/30/78/51/1050307851.db2.gz SBIGRQTVXULNAF-OFVLBHHSSA-N 3 1 337.596 4.257 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001173113487 1050309598 /nfs/dbraw/zinc/30/95/98/1050309598.db2.gz QNIPKBWUMCEKAE-XEVCZEQESA-N 2 1 330.516 4.138 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 ZINC001177855571 1050317450 /nfs/dbraw/zinc/31/74/50/1050317450.db2.gz ZDJAZJKCIAAODB-XQBPLPMBSA-N 2 1 344.518 4.391 20 0 EIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001173208755 1050367606 /nfs/dbraw/zinc/36/76/06/1050367606.db2.gz BPZSPRLQBZQCBE-ZFJSRUIDSA-N 2 1 348.534 4.481 20 0 EIADMP CC[N@@H+]1C[C@@H]2C[NH+]([C@H](C)CC(c3ccccc3)c3ccccc3)C[C@@H]2C1 ZINC001173213749 1050372182 /nfs/dbraw/zinc/37/21/82/1050372182.db2.gz HONRGJXYNZYDOQ-PTUXOGIPSA-N 2 1 348.534 4.481 20 0 EIADMP CC[NH+]1C[C@@H]2C[N@H+]([C@H](C)CC(c3ccccc3)c3ccccc3)C[C@@H]2C1 ZINC001173213749 1050372191 /nfs/dbraw/zinc/37/21/91/1050372191.db2.gz HONRGJXYNZYDOQ-PTUXOGIPSA-N 2 1 348.534 4.481 20 0 EIADMP CC[NH+]1C[C@@H]2C[N@@H+]([C@H](C)CC(c3ccccc3)c3ccccc3)C[C@@H]2C1 ZINC001173213749 1050372209 /nfs/dbraw/zinc/37/22/09/1050372209.db2.gz HONRGJXYNZYDOQ-PTUXOGIPSA-N 2 1 348.534 4.481 20 0 EIADMP COCc1c(C)cc(C)c(C[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c1C ZINC001178250006 1050409561 /nfs/dbraw/zinc/40/95/61/1050409561.db2.gz ZLHBRIWGYIOOQS-FQEVSTJZSA-N 2 1 346.559 4.216 20 0 EIADMP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173343035 1050432471 /nfs/dbraw/zinc/43/24/71/1050432471.db2.gz GKYKFAJMGBBABW-RTWAWAEBSA-N 2 1 348.575 4.455 20 0 EIADMP CC[N@H+]1CC[C@H](n2cc(C[NH2+]Cc3ccccc3)c3ccccc32)C1 ZINC001173367369 1050442910 /nfs/dbraw/zinc/44/29/10/1050442910.db2.gz GXBCXPQXBXQQMQ-FQEVSTJZSA-N 2 1 333.479 4.198 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(Br)cs2)C1 ZINC000253355222 1050454643 /nfs/dbraw/zinc/45/46/43/1050454643.db2.gz FBVDPBPAPAFXNI-CHWSQXEVSA-N 2 1 345.350 4.282 20 0 EIADMP Cc1c[nH+]c(CC[NH3+])n1[C@@H](C)CCc1ccc(Cl)c(Cl)c1 ZINC001173543280 1050477751 /nfs/dbraw/zinc/47/77/51/1050477751.db2.gz LAECLWVIUVVLLR-NSHDSACASA-N 2 1 326.271 4.193 20 0 EIADMP Cc1cc(C[N@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)ccc1Oc1ccccc1 ZINC001206209689 1050536335 /nfs/dbraw/zinc/53/63/35/1050536335.db2.gz IBHJEAWSWLQLRE-OALUTQOASA-N 2 1 328.431 4.049 20 0 EIADMP COCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCCCC1 ZINC001178868244 1050573492 /nfs/dbraw/zinc/57/34/92/1050573492.db2.gz QBSWRXNTCXRYEI-CTNGQTDRSA-N 2 1 344.543 4.226 20 0 EIADMP COCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCCCC1 ZINC001178868244 1050573508 /nfs/dbraw/zinc/57/35/08/1050573508.db2.gz QBSWRXNTCXRYEI-CTNGQTDRSA-N 2 1 344.543 4.226 20 0 EIADMP CC[C@@H]1C[C@@H](C)CC[C@@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000093945085 1050726970 /nfs/dbraw/zinc/72/69/70/1050726970.db2.gz WPOSIRPPBIMXRY-BEVDRBHNSA-N 2 1 347.547 4.308 20 0 EIADMP CC[NH+]1CCC(C[N@@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001180103231 1050888352 /nfs/dbraw/zinc/88/83/52/1050888352.db2.gz HMGXNLGLAIDEHT-UHFFFAOYSA-N 2 1 336.523 4.463 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccccc2NC)CC1)CC1CC1 ZINC001180323286 1050968291 /nfs/dbraw/zinc/96/82/91/1050968291.db2.gz YFBONVAOYPPSTO-UHFFFAOYSA-N 2 1 329.532 4.062 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000414155138 1051143145 /nfs/dbraw/zinc/14/31/45/1051143145.db2.gz MNQPZASKSYZUIG-STZQEDGTSA-N 2 1 337.511 4.218 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000414155138 1051143156 /nfs/dbraw/zinc/14/31/56/1051143156.db2.gz MNQPZASKSYZUIG-STZQEDGTSA-N 2 1 337.511 4.218 20 0 EIADMP Cc1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)nc1Cl ZINC001190318223 1051148573 /nfs/dbraw/zinc/14/85/73/1051148573.db2.gz LOWYSHWJQQJNGB-UHFFFAOYSA-N 2 1 335.923 4.131 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775378985 1051170298 /nfs/dbraw/zinc/17/02/98/1051170298.db2.gz OTMRNVPXJFQJPN-CXAGYDPISA-N 2 1 340.483 4.310 20 0 EIADMP c1cc2cc(C[NH2+]C[C@@H]3CCC[N@@H+](Cc4ccccc4)C3)ccc2[nH]1 ZINC000385729274 1051174258 /nfs/dbraw/zinc/17/42/58/1051174258.db2.gz KHFVLPPQPCPLAU-FQEVSTJZSA-N 2 1 333.479 4.170 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775388772 1051187029 /nfs/dbraw/zinc/18/70/29/1051187029.db2.gz TVIZAXSSTPSNNB-CXAGYDPISA-N 2 1 340.483 4.310 20 0 EIADMP CC(C)(C)CC[C@H](CO)[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001181222402 1051189211 /nfs/dbraw/zinc/18/92/11/1051189211.db2.gz GZUYDSHNDGPZKT-ZVDOUQERSA-N 2 1 344.543 4.131 20 0 EIADMP CC(C)(C)CC[C@H](CO)[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001181222402 1051189224 /nfs/dbraw/zinc/18/92/24/1051189224.db2.gz GZUYDSHNDGPZKT-ZVDOUQERSA-N 2 1 344.543 4.131 20 0 EIADMP CCC(CC)(C[NH2+][C@@H](C)C1CCOCC1)[NH2+][C@@H](C)c1ccccc1 ZINC000153896043 1051242849 /nfs/dbraw/zinc/24/28/49/1051242849.db2.gz XXUHAYGVUQGQQE-ROUUACIJSA-N 2 1 332.532 4.301 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccnc(Cl)c2)cc1 ZINC000183672774 1051245168 /nfs/dbraw/zinc/24/51/68/1051245168.db2.gz XVADMMZSPLWFCD-ZDUSSCGKSA-N 2 1 326.831 4.080 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC001181514338 1051245767 /nfs/dbraw/zinc/24/57/67/1051245767.db2.gz GCADNEFXOKPYPC-KRWDZBQOSA-N 2 1 340.433 4.178 20 0 EIADMP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533887 1051247213 /nfs/dbraw/zinc/24/72/13/1051247213.db2.gz COTKAVGURZDTKZ-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533887 1051247225 /nfs/dbraw/zinc/24/72/25/1051247225.db2.gz COTKAVGURZDTKZ-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533887 1051247238 /nfs/dbraw/zinc/24/72/38/1051247238.db2.gz COTKAVGURZDTKZ-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533887 1051247251 /nfs/dbraw/zinc/24/72/51/1051247251.db2.gz COTKAVGURZDTKZ-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H]2CCCC(C)(C)O2)CC1 ZINC001190790909 1051280178 /nfs/dbraw/zinc/28/01/78/1051280178.db2.gz GASYBQCUTZOJIJ-NRFANRHFSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)C1 ZINC000620762236 1051285814 /nfs/dbraw/zinc/28/58/14/1051285814.db2.gz WAZYHKJJEHUQPP-FQEVSTJZSA-N 2 1 337.511 4.274 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cccc3ncccc23)C1 ZINC001191048958 1051349758 /nfs/dbraw/zinc/34/97/58/1051349758.db2.gz VLVCRMHDWSLVHU-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cccc3ncccc23)C1 ZINC001191048958 1051349772 /nfs/dbraw/zinc/34/97/72/1051349772.db2.gz VLVCRMHDWSLVHU-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cccc3ncccc23)C1 ZINC001191048958 1051349782 /nfs/dbraw/zinc/34/97/82/1051349782.db2.gz VLVCRMHDWSLVHU-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000268792349 1051391820 /nfs/dbraw/zinc/39/18/20/1051391820.db2.gz MOOZIEJJXIBASU-URLQWDBASA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000268792349 1051391840 /nfs/dbraw/zinc/39/18/40/1051391840.db2.gz MOOZIEJJXIBASU-URLQWDBASA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000268792349 1051391854 /nfs/dbraw/zinc/39/18/54/1051391854.db2.gz MOOZIEJJXIBASU-URLQWDBASA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000268792349 1051391867 /nfs/dbraw/zinc/39/18/67/1051391867.db2.gz MOOZIEJJXIBASU-URLQWDBASA-N 2 1 343.540 4.321 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2n2cccn2)cc1 ZINC000155980580 1051483081 /nfs/dbraw/zinc/48/30/81/1051483081.db2.gz LYAZAMZVNCQRTN-DQLDELGASA-N 2 1 349.482 4.212 20 0 EIADMP c1nc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)sc1-c1ccccc1 ZINC000156155374 1051503987 /nfs/dbraw/zinc/50/39/87/1051503987.db2.gz WCQYLWMKZMRSSU-UHFFFAOYSA-N 2 1 341.524 4.118 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(NC2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000774272124 1051541251 /nfs/dbraw/zinc/54/12/51/1051541251.db2.gz NJPRFZIJDVZKJF-BRIRTLKKSA-N 2 1 327.516 4.098 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000774272124 1051541259 /nfs/dbraw/zinc/54/12/59/1051541259.db2.gz NJPRFZIJDVZKJF-BRIRTLKKSA-N 2 1 327.516 4.098 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000774272124 1051541262 /nfs/dbraw/zinc/54/12/62/1051541262.db2.gz NJPRFZIJDVZKJF-BRIRTLKKSA-N 2 1 327.516 4.098 20 0 EIADMP Cc1csc2sc(C[N@H+]3CCC[C@](F)(C[NH3+])CC3)c(C)c12 ZINC001205571609 1051555409 /nfs/dbraw/zinc/55/54/09/1051555409.db2.gz VYEMVODJFJPIQO-MRXNPFEDSA-N 2 1 326.506 4.233 20 0 EIADMP C[C@@]1(Cc2ccc(F)c(F)c2)CCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001175492710 1051617954 /nfs/dbraw/zinc/61/79/54/1051617954.db2.gz QOPDDQYDEPIVLX-FQEVSTJZSA-N 2 1 336.470 4.238 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)c(C(F)(F)F)c1 ZINC000157679215 1051664288 /nfs/dbraw/zinc/66/42/88/1051664288.db2.gz DXFIXBGARPDTJK-UKRRQHHQSA-N 2 1 344.421 4.065 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)c(C(F)(F)F)c1 ZINC000157679215 1051664293 /nfs/dbraw/zinc/66/42/93/1051664293.db2.gz DXFIXBGARPDTJK-UKRRQHHQSA-N 2 1 344.421 4.065 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000158102938 1051709689 /nfs/dbraw/zinc/70/96/89/1051709689.db2.gz BFFSAQLGOJJYKT-KBPBESRZSA-N 2 1 328.472 4.036 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000158162195 1051721618 /nfs/dbraw/zinc/72/16/18/1051721618.db2.gz HJHWZLDLJJYTKR-IERDGZPVSA-N 2 1 326.484 4.231 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@@H]([NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC001182959835 1051750446 /nfs/dbraw/zinc/75/04/46/1051750446.db2.gz MPYVZNGBQLKLHG-URVUXULASA-N 2 1 326.528 4.493 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@@H]([NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC001182959835 1051750458 /nfs/dbraw/zinc/75/04/58/1051750458.db2.gz MPYVZNGBQLKLHG-URVUXULASA-N 2 1 326.528 4.493 20 0 EIADMP CCC1([NH+]2CCCCC2)CC[NH+](Cc2ccc3cc[nH]c3c2)CC1 ZINC001175758009 1051769645 /nfs/dbraw/zinc/76/96/45/1051769645.db2.gz JGMBIGUJEYGJRH-UHFFFAOYSA-N 2 1 325.500 4.398 20 0 EIADMP C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001183094091 1051785529 /nfs/dbraw/zinc/78/55/29/1051785529.db2.gz HAORXWSGVHPCMQ-UYAOXDASSA-N 2 1 328.544 4.454 20 0 EIADMP C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001183094090 1051786786 /nfs/dbraw/zinc/78/67/86/1051786786.db2.gz HAORXWSGVHPCMQ-QUCCMNQESA-N 2 1 328.544 4.454 20 0 EIADMP CCc1noc(C)c1C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000158979129 1051803829 /nfs/dbraw/zinc/80/38/29/1051803829.db2.gz JONILGCIXCHSLZ-MRXNPFEDSA-N 2 1 333.520 4.022 20 0 EIADMP Cc1ccc(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@]3(C)C2)cc1C ZINC001175973579 1051856409 /nfs/dbraw/zinc/85/64/09/1051856409.db2.gz ODFPASIWGDUIEQ-PKTZIBPZSA-N 2 1 334.507 4.257 20 0 EIADMP Cc1ccc(C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@@]3(C)C2)cc1C ZINC001175973579 1051856413 /nfs/dbraw/zinc/85/64/13/1051856413.db2.gz ODFPASIWGDUIEQ-PKTZIBPZSA-N 2 1 334.507 4.257 20 0 EIADMP Cc1ccc(C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@@]3(C)C2)cc1C ZINC001175973579 1051856415 /nfs/dbraw/zinc/85/64/15/1051856415.db2.gz ODFPASIWGDUIEQ-PKTZIBPZSA-N 2 1 334.507 4.257 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC(C)(C)CO1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001184045762 1051944619 /nfs/dbraw/zinc/94/46/19/1051944619.db2.gz QCTHVMYNINRUCM-TYPHKJRUSA-N 2 1 344.543 4.082 20 0 EIADMP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000621768926 1051944901 /nfs/dbraw/zinc/94/49/01/1051944901.db2.gz WRLQDDHEMYHMCH-MANSERQUSA-N 2 1 334.454 4.065 20 0 EIADMP COCCC[NH+]1CCC([NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)CC1 ZINC000159212045 1051946014 /nfs/dbraw/zinc/94/60/14/1051946014.db2.gz IRHVESAHSRYOEL-ZDUSSCGKSA-N 2 1 345.314 4.145 20 0 EIADMP CCC(CC)[C@H](c1ccc(Cl)cc1)[N@H+](C)C[C@H](O)C[NH+](C)CC ZINC001193974318 1052035436 /nfs/dbraw/zinc/03/54/36/1052035436.db2.gz BOIUGEMZNICWEB-RTBURBONSA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@H](c1ccc(Cl)cc1)[N@@H+](C)C[C@H](O)C[NH+](C)CC ZINC001193974318 1052035439 /nfs/dbraw/zinc/03/54/39/1052035439.db2.gz BOIUGEMZNICWEB-RTBURBONSA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@H](c1ccc(Cl)cc1)[NH+](C)C[C@H](O)C[N@H+](C)CC ZINC001193974318 1052035442 /nfs/dbraw/zinc/03/54/42/1052035442.db2.gz BOIUGEMZNICWEB-RTBURBONSA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@H](c1ccc(Cl)cc1)[NH+](C)C[C@H](O)C[N@@H+](C)CC ZINC001193974318 1052035450 /nfs/dbraw/zinc/03/54/50/1052035450.db2.gz BOIUGEMZNICWEB-RTBURBONSA-N 2 1 340.939 4.062 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000165634706 1052071951 /nfs/dbraw/zinc/07/19/51/1052071951.db2.gz FOYMCYOKJRWRAZ-SFHVURJKSA-N 2 1 333.479 4.392 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000336788964 1052519579 /nfs/dbraw/zinc/51/95/79/1052519579.db2.gz HZZBKVVKAGJIES-KRWDZBQOSA-N 2 1 335.451 4.121 20 0 EIADMP C[C@H]1C[C@H](NCC2=Cc3ccccc3OC2)CC[N@H+]1Cc1ccccc1 ZINC000175978024 1052601520 /nfs/dbraw/zinc/60/15/20/1052601520.db2.gz IYXJESHBXMTHCL-PGRDOPGGSA-N 2 1 348.490 4.105 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2=Cc3ccccc3OC2)CC[N@@H+]1Cc1ccccc1 ZINC000175978024 1052601527 /nfs/dbraw/zinc/60/15/27/1052601527.db2.gz IYXJESHBXMTHCL-PGRDOPGGSA-N 2 1 348.490 4.105 20 0 EIADMP CCCCOc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1OC ZINC000623362429 1052633456 /nfs/dbraw/zinc/63/34/56/1052633456.db2.gz STJQQECZJOAAQS-WMZOPIPTSA-N 2 1 348.531 4.398 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1OC ZINC000623362429 1052633457 /nfs/dbraw/zinc/63/34/57/1052633457.db2.gz STJQQECZJOAAQS-WMZOPIPTSA-N 2 1 348.531 4.398 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)c(C)c2c1 ZINC000623408061 1052648309 /nfs/dbraw/zinc/64/83/09/1052648309.db2.gz GPCNHOPDADLOEI-GJZGRUSLSA-N 2 1 330.472 4.273 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@H]3CC[N@@H+](C)C(C)(C)C3)c(C)c2c1 ZINC000623408061 1052648312 /nfs/dbraw/zinc/64/83/12/1052648312.db2.gz GPCNHOPDADLOEI-GJZGRUSLSA-N 2 1 330.472 4.273 20 0 EIADMP C[C@@H]([NH2+]C1(CN[C@@H]2CC[N@@H+](C)C(C)(C)C2)CCCC1)c1ccccc1 ZINC000623427616 1052654326 /nfs/dbraw/zinc/65/43/26/1052654326.db2.gz FTQLKYLPBODQAX-UYAOXDASSA-N 2 1 343.559 4.112 20 0 EIADMP C[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000623447497 1052658161 /nfs/dbraw/zinc/65/81/61/1052658161.db2.gz TUJCJWJLQWLRQQ-YOEHRIQHSA-N 2 1 334.479 4.138 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000623447497 1052658162 /nfs/dbraw/zinc/65/81/62/1052658162.db2.gz TUJCJWJLQWLRQQ-YOEHRIQHSA-N 2 1 334.479 4.138 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000177933374 1052694917 /nfs/dbraw/zinc/69/49/17/1052694917.db2.gz RGILGGXUTLPYBU-LVCYWYKZSA-N 2 1 338.495 4.051 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000623656913 1052697994 /nfs/dbraw/zinc/69/79/94/1052697994.db2.gz FMWKFQBMRXWOLV-QZFKAFNDSA-N 2 1 338.442 4.013 20 0 EIADMP Clc1cccc2c1OCCC[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000178254337 1052703238 /nfs/dbraw/zinc/70/32/38/1052703238.db2.gz KDAYTCXPFVDXTJ-SFHVURJKSA-N 2 1 334.891 4.018 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cc(C)ccc1OC(F)F ZINC000178698324 1052711002 /nfs/dbraw/zinc/71/10/02/1052711002.db2.gz RTFNLQJAQWAKPP-ZIAGYGMSSA-N 2 1 337.414 4.088 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000180403069 1052798280 /nfs/dbraw/zinc/79/82/80/1052798280.db2.gz FJTODTVMVUQMEA-KRWDZBQOSA-N 2 1 342.405 4.035 20 0 EIADMP Fc1ccc(S[C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000623866515 1052825000 /nfs/dbraw/zinc/82/50/00/1052825000.db2.gz YQOTVWTZTDGIBY-LCLWPZTBSA-N 2 1 348.531 4.445 20 0 EIADMP CC[C@@H](C)Oc1cc(C[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)ccc1OC ZINC000624019696 1052853762 /nfs/dbraw/zinc/85/37/62/1052853762.db2.gz YIUNLZNOUJRHFS-ZWKOTPCHSA-N 2 1 348.531 4.227 20 0 EIADMP CC[C@@H](C)Oc1cc(C[NH2+]CCC[N@H+]2CCCC[C@@H]2C)ccc1OC ZINC000624019696 1052853767 /nfs/dbraw/zinc/85/37/67/1052853767.db2.gz YIUNLZNOUJRHFS-ZWKOTPCHSA-N 2 1 348.531 4.227 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccccc1OC(F)F ZINC000624121093 1052867224 /nfs/dbraw/zinc/86/72/24/1052867224.db2.gz NXLSPJMKPQFZCR-GOEBONIOSA-N 2 1 326.431 4.061 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccccc1OC(F)F ZINC000624121093 1052867225 /nfs/dbraw/zinc/86/72/25/1052867225.db2.gz NXLSPJMKPQFZCR-GOEBONIOSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000624120498 1052867470 /nfs/dbraw/zinc/86/74/70/1052867470.db2.gz ALQHHGVSMURXMY-CABCVRRESA-N 2 1 344.421 4.010 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccccc1OC(F)F ZINC000624121095 1052867563 /nfs/dbraw/zinc/86/75/63/1052867563.db2.gz NXLSPJMKPQFZCR-ZBFHGGJFSA-N 2 1 326.431 4.061 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccccc1OC(F)F ZINC000624121095 1052867567 /nfs/dbraw/zinc/86/75/67/1052867567.db2.gz NXLSPJMKPQFZCR-ZBFHGGJFSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)CC[N@H+]1C ZINC000181798911 1052898349 /nfs/dbraw/zinc/89/83/49/1052898349.db2.gz KQODMOVTXGVFBR-BBRMVZONSA-N 2 1 349.931 4.078 20 0 EIADMP CC[NH+](CC)CCCC1CC[NH+]([C@@H](C)c2nc(C(C)C)no2)CC1 ZINC000182762283 1052948777 /nfs/dbraw/zinc/94/87/77/1052948777.db2.gz MBMCJKMOLCHOCU-INIZCTEOSA-N 2 1 336.524 4.088 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+][C@H](c2ccccc2)c2ccc(F)cn2)c1 ZINC000183326735 1052970062 /nfs/dbraw/zinc/97/00/62/1052970062.db2.gz CSDARGJWRGZEEO-JOCHJYFZSA-N 2 1 349.453 4.162 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cn2)cc1 ZINC000183308548 1052970174 /nfs/dbraw/zinc/97/01/74/1052970174.db2.gz SWTALRDNENCZJO-QFIPXVFZSA-N 2 1 349.453 4.162 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@@H]3CCCNc4ccccc43)C2)cc1 ZINC000195138984 1053052521 /nfs/dbraw/zinc/05/25/21/1053052521.db2.gz HNOFEUCVUDALQA-SIKLNZKXSA-N 2 1 335.495 4.045 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000381195274 1053057549 /nfs/dbraw/zinc/05/75/49/1053057549.db2.gz ZVBSNEPYWJPDKP-FKBYEOEOSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1c([C@H](C)NCCC[N@H+]2CCCC[C@@H]2C)cnn1-c1ccccc1 ZINC000764627581 1053236711 /nfs/dbraw/zinc/23/67/11/1053236711.db2.gz JKQFUUUMTAZEOM-ROUUACIJSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cnn1-c1ccccc1 ZINC000764627581 1053236733 /nfs/dbraw/zinc/23/67/33/1053236733.db2.gz JKQFUUUMTAZEOM-ROUUACIJSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cnn1-c1ccccc1 ZINC000764627581 1053236751 /nfs/dbraw/zinc/23/67/51/1053236751.db2.gz JKQFUUUMTAZEOM-ROUUACIJSA-N 2 1 340.515 4.096 20 0 EIADMP CC(C)c1cccc2c1OCC[C@@H]2[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000339068366 1053259463 /nfs/dbraw/zinc/25/94/63/1053259463.db2.gz GCIBLGXUAGRSOU-KRXYWNSISA-N 2 1 328.500 4.239 20 0 EIADMP CC(C)c1cccc2c1OCC[C@@H]2[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000339068366 1053259480 /nfs/dbraw/zinc/25/94/80/1053259480.db2.gz GCIBLGXUAGRSOU-KRXYWNSISA-N 2 1 328.500 4.239 20 0 EIADMP COc1ccc(CC[C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC000764961017 1053397686 /nfs/dbraw/zinc/39/76/86/1053397686.db2.gz GJEVUWXMXUFTJL-RBUKOAKNSA-N 2 1 332.532 4.118 20 0 EIADMP CCOc1cccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000794829648 1053441456 /nfs/dbraw/zinc/44/14/56/1053441456.db2.gz VOZNHRGEJZUUDX-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP CC[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc2c(c1)CCCO2 ZINC000794834328 1053453225 /nfs/dbraw/zinc/45/32/25/1053453225.db2.gz HALFKTAXJXSMAU-SOAGJPPSSA-N 2 1 328.500 4.069 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000765506207 1053588039 /nfs/dbraw/zinc/58/80/39/1053588039.db2.gz CYVYVDLNTWIZPU-HZPDHXFCSA-N 2 1 340.602 4.470 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000765506207 1053588050 /nfs/dbraw/zinc/58/80/50/1053588050.db2.gz CYVYVDLNTWIZPU-HZPDHXFCSA-N 2 1 340.602 4.470 20 0 EIADMP Fc1ccccc1C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000429509932 1053617399 /nfs/dbraw/zinc/61/73/99/1053617399.db2.gz GSPVDARRPKWYRD-VWPQPMDRSA-N 2 1 338.470 4.326 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](CCc1ccccc1)c1ccccn1 ZINC000866258946 1053667489 /nfs/dbraw/zinc/66/74/89/1053667489.db2.gz DQHDGMBGKDRLAH-AVRDEDQJSA-N 2 1 348.494 4.186 20 0 EIADMP CSc1ccccc1[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccccc1 ZINC000866341229 1053695942 /nfs/dbraw/zinc/69/59/42/1053695942.db2.gz KUFFVCWRZONYLU-HXUWFJFHSA-N 2 1 337.492 4.064 20 0 EIADMP CCOc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000386416531 1053713702 /nfs/dbraw/zinc/71/37/02/1053713702.db2.gz YTOLFOWGZUAATJ-WIYYLYMNSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc2c(ccnc2Cl)o1 ZINC000866392352 1053713801 /nfs/dbraw/zinc/71/38/01/1053713801.db2.gz AQFMHBJZWQCBQR-DZGCQCFKSA-N 2 1 347.890 4.254 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc2c(ccnc2Cl)o1 ZINC000866392352 1053713813 /nfs/dbraw/zinc/71/38/13/1053713813.db2.gz AQFMHBJZWQCBQR-DZGCQCFKSA-N 2 1 347.890 4.254 20 0 EIADMP CCC1([NH+](C)C)CC[NH+]([C@@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC001196684877 1053737102 /nfs/dbraw/zinc/73/71/02/1053737102.db2.gz ORFMEOQWLOQOLD-AWEZNQCLSA-N 2 1 344.421 4.452 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2ccccc2C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386546131 1053771160 /nfs/dbraw/zinc/77/11/60/1053771160.db2.gz SFZXELNJKSBGRT-CDNPAEQRSA-N 2 1 334.507 4.044 20 0 EIADMP CCCCCCc1ccc(C[N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)s1 ZINC001205796590 1053824883 /nfs/dbraw/zinc/82/48/83/1053824883.db2.gz SGUOBTJAXWTBTL-CQSZACIVSA-N 2 1 330.488 4.287 20 0 EIADMP CCCCCCc1ccc(C[N@H+]2CCC(F)(F)[C@H](C[NH3+])C2)s1 ZINC001205796590 1053824886 /nfs/dbraw/zinc/82/48/86/1053824886.db2.gz SGUOBTJAXWTBTL-CQSZACIVSA-N 2 1 330.488 4.287 20 0 EIADMP CC(C)C[N@@H+](CCSC1CCCCC1)CC1CC[NH+](C)CC1 ZINC001197194709 1053850913 /nfs/dbraw/zinc/85/09/13/1053850913.db2.gz SUSAQDPOSFCHBE-UHFFFAOYSA-N 2 1 326.594 4.352 20 0 EIADMP CC(C)C[C@@H](C)C[N@H+]1CC[C@@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856559698 1054084273 /nfs/dbraw/zinc/08/42/73/1054084273.db2.gz SMUOPAJPWAIMNW-WIYYLYMNSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)C[C@@H](C)C[NH+]1CC[C@@H](Oc2ccnc(C[N@H+](C)C(C)C)c2)C1 ZINC000856559698 1054084276 /nfs/dbraw/zinc/08/42/76/1054084276.db2.gz SMUOPAJPWAIMNW-WIYYLYMNSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)C[C@@H](C)C[NH+]1CC[C@@H](Oc2ccnc(C[N@@H+](C)C(C)C)c2)C1 ZINC000856559698 1054084287 /nfs/dbraw/zinc/08/42/87/1054084287.db2.gz SMUOPAJPWAIMNW-WIYYLYMNSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCO1 ZINC001198799942 1054272199 /nfs/dbraw/zinc/27/21/99/1054272199.db2.gz GFCOXHSTTMXWMR-OAQYLSRUSA-N 2 1 344.543 4.310 20 0 EIADMP CC(C)[C@@H](C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1)[NH+]1CCC(C)CC1 ZINC001199258530 1054374881 /nfs/dbraw/zinc/37/48/81/1054374881.db2.gz KQJBEPYYQMWXRJ-KSEOMHKRSA-N 2 1 343.559 4.454 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(F)ccc1OC(F)F ZINC001199336845 1054388745 /nfs/dbraw/zinc/38/87/45/1054388745.db2.gz YJBHKSNGDUFIBC-CQSZACIVSA-N 2 1 344.421 4.171 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCO1 ZINC001199629671 1054435328 /nfs/dbraw/zinc/43/53/28/1054435328.db2.gz LRCRXIZUNPPZKK-XLIONFOSSA-N 2 1 330.516 4.108 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(SC(F)F)cc1 ZINC000858490897 1054499470 /nfs/dbraw/zinc/49/94/70/1054499470.db2.gz RUNKDZPYWUVZSI-UONOGXRCSA-N 2 1 328.472 4.384 20 0 EIADMP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H](C)c1ccc(C(F)(F)F)nc1 ZINC000873297498 1054525881 /nfs/dbraw/zinc/52/58/81/1054525881.db2.gz XSGMZSVDXOPNFI-IPYPFGDCSA-N 2 1 329.410 4.062 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(OC(F)F)cc2)CC1 ZINC000057754826 1054540419 /nfs/dbraw/zinc/54/04/19/1054540419.db2.gz AYWISPRWTJUHNT-UHFFFAOYSA-N 2 1 340.458 4.232 20 0 EIADMP CC(C)[NH+](CCC[NH2+]Cc1ccc(Cl)c2cccnc12)C(C)C ZINC001200922087 1054577357 /nfs/dbraw/zinc/57/73/57/1054577357.db2.gz LHUOYHYTYPDUNS-UHFFFAOYSA-N 2 1 333.907 4.487 20 0 EIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1nc(C)c2ccccc2n1 ZINC000859995324 1054756744 /nfs/dbraw/zinc/75/67/44/1054756744.db2.gz PDHXPGHZTKXHFG-UHFFFAOYSA-N 2 1 348.494 4.022 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1nc(C)c2ccccc2n1 ZINC000859995324 1054756753 /nfs/dbraw/zinc/75/67/53/1054756753.db2.gz PDHXPGHZTKXHFG-UHFFFAOYSA-N 2 1 348.494 4.022 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2ccc(C)cc2)s1 ZINC000063522174 1054815391 /nfs/dbraw/zinc/81/53/91/1054815391.db2.gz CYJXRGBWBYUPSR-UHFFFAOYSA-N 2 1 325.481 4.408 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(NC[C@@H]3CC=CCC3)cc2)CC1 ZINC000125585359 1054820294 /nfs/dbraw/zinc/82/02/94/1054820294.db2.gz YLXNDDLBIBWZRB-GOSISDBHSA-N 2 1 327.516 4.233 20 0 EIADMP CCC[C@@H](C)C[NH+]1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201544392 1054837545 /nfs/dbraw/zinc/83/75/45/1054837545.db2.gz PNPPYTVQIIHOSQ-CTNGQTDRSA-N 2 1 344.543 4.178 20 0 EIADMP CCC[C@H](C)C[NH+]1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001201544137 1054837588 /nfs/dbraw/zinc/83/75/88/1054837588.db2.gz NJJNBRABSAJMRM-FQEVSTJZSA-N 2 1 344.543 4.098 20 0 EIADMP CCCCCC[NH+]1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201750112 1054894456 /nfs/dbraw/zinc/89/44/56/1054894456.db2.gz HMHZMZAGCHOEKC-OAQYLSRUSA-N 2 1 344.543 4.322 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3nc(Cl)cs3)cc2)C1 ZINC000876931345 1054986435 /nfs/dbraw/zinc/98/64/35/1054986435.db2.gz LVWDAGGKKHBPPI-CQSZACIVSA-N 2 1 349.931 4.318 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3nc(Cl)cs3)cc2)C1 ZINC000876931345 1054986445 /nfs/dbraw/zinc/98/64/45/1054986445.db2.gz LVWDAGGKKHBPPI-CQSZACIVSA-N 2 1 349.931 4.318 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc(Cl)c2N)[C@@H]1c1cccs1 ZINC000877055174 1055007453 /nfs/dbraw/zinc/00/74/53/1055007453.db2.gz QEWFPIMDIQQQGI-KBXCAEBGSA-N 2 1 349.931 4.156 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc(Cl)c2N)[C@@H]1c1cccs1 ZINC000877055174 1055007469 /nfs/dbraw/zinc/00/74/69/1055007469.db2.gz QEWFPIMDIQQQGI-KBXCAEBGSA-N 2 1 349.931 4.156 20 0 EIADMP COc1cccc(C[N@H+]2CCC3(C2)CC[NH+](CC2CCCC2)CC3)c1 ZINC001202161526 1055063781 /nfs/dbraw/zinc/06/37/81/1055063781.db2.gz URFSUXSPJNEEFM-UHFFFAOYSA-N 2 1 342.527 4.173 20 0 EIADMP COc1cc([C@H](C)[NH2+]CC[C@H]2CCC[N@H+]2C)ccc1OCCC(C)C ZINC001168604131 1055152515 /nfs/dbraw/zinc/15/25/15/1055152515.db2.gz KYBQANZSVTWHHW-PKOBYXMFSA-N 2 1 348.531 4.255 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)sc1Br ZINC000623657313 1055533916 /nfs/dbraw/zinc/53/39/16/1055533916.db2.gz NKFOECRTFJJQEL-OLZOCXBDSA-N 2 1 345.350 4.202 20 0 EIADMP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000282300150 1055790773 /nfs/dbraw/zinc/79/07/73/1055790773.db2.gz MGAHYHHSXLHRKX-ZTRSQXPZSA-N 2 1 336.470 4.311 20 0 EIADMP COC1CCC(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000542693389 1055834793 /nfs/dbraw/zinc/83/47/93/1055834793.db2.gz WSSPDYOANWSNKT-FFKUYJCKSA-N 2 1 344.543 4.224 20 0 EIADMP COC1CCC(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000542693389 1055834797 /nfs/dbraw/zinc/83/47/97/1055834797.db2.gz WSSPDYOANWSNKT-FFKUYJCKSA-N 2 1 344.543 4.224 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cnn(CC3CCC3)c2)cc1 ZINC000921823849 1056654669 /nfs/dbraw/zinc/65/46/69/1056654669.db2.gz APILRTKNQIFSFA-MRXNPFEDSA-N 2 1 349.482 4.028 20 0 EIADMP C[NH+](C)CC[C@@H]([NH2+][C@@H]1Cc2cccc(Cl)c2C1)c1ccccc1 ZINC001168684236 1056721050 /nfs/dbraw/zinc/72/10/50/1056721050.db2.gz HPCXNSUFWIYTPN-YLJYHZDGSA-N 2 1 328.887 4.090 20 0 EIADMP CC[N@H+](C[C@H]1CC1(Cl)Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000743873774 1059191812 /nfs/dbraw/zinc/19/18/12/1059191812.db2.gz VCRGOBKRBQMJMO-IAGOWNOFSA-N 2 1 341.326 4.024 20 0 EIADMP CC[N@@H+](C[C@H]1CC1(Cl)Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000743873774 1059191840 /nfs/dbraw/zinc/19/18/40/1059191840.db2.gz VCRGOBKRBQMJMO-IAGOWNOFSA-N 2 1 341.326 4.024 20 0 EIADMP CC[NH+](C[C@H]1CC1(Cl)Cl)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000743873774 1059191849 /nfs/dbraw/zinc/19/18/49/1059191849.db2.gz VCRGOBKRBQMJMO-IAGOWNOFSA-N 2 1 341.326 4.024 20 0 EIADMP CC[NH+](C[C@H]1CC1(Cl)Cl)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000743873774 1059191858 /nfs/dbraw/zinc/19/18/58/1059191858.db2.gz VCRGOBKRBQMJMO-IAGOWNOFSA-N 2 1 341.326 4.024 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc3cnccc32)c1 ZINC000181505680 1059473418 /nfs/dbraw/zinc/47/34/18/1059473418.db2.gz FSBKCYSHFYPLTL-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CCC[C@@H]1C[NH3+] ZINC001205996031 1060564326 /nfs/dbraw/zinc/56/43/26/1060564326.db2.gz UBOWPPKEPATJCA-GXTWGEPZSA-N 2 1 332.435 4.105 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCc1cccc(Oc3ccccc3)c1)C2 ZINC001169095666 1060632395 /nfs/dbraw/zinc/63/23/95/1060632395.db2.gz QRTOBSZNGOHMRE-OWZKRDHZSA-N 2 1 336.479 4.236 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C2 ZINC001169092641 1060633119 /nfs/dbraw/zinc/63/31/19/1060633119.db2.gz BYPCNYVCMSFGNR-XYYAHUGASA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C2 ZINC001169092641 1060633132 /nfs/dbraw/zinc/63/31/32/1060633132.db2.gz BYPCNYVCMSFGNR-XYYAHUGASA-N 2 1 332.797 4.074 20 0 EIADMP CCCC[C@H]([NH3+])Cc1cn([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc12 ZINC001169109482 1060657412 /nfs/dbraw/zinc/65/74/12/1060657412.db2.gz JDNYHUBZMNHQQG-VNTMZGSJSA-N 2 1 339.527 4.499 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1OC ZINC000310781985 1032241681 /nfs/dbraw/zinc/24/16/81/1032241681.db2.gz PBFKQCDJZCZOOK-OAQYLSRUSA-N 2 1 338.495 4.401 20 0 EIADMP Cc1[nH]c2ccccc2c1C1=CCN(CC[C@H]2CCCC[N@@H+]2C)CC1 ZINC000532726849 1032278027 /nfs/dbraw/zinc/27/80/27/1032278027.db2.gz GPYQFUPCQCROKB-LJQANCHMSA-N 2 1 337.511 4.440 20 0 EIADMP Cc1[nH]c2ccccc2c1C1=CC[NH+](CC[C@H]2CCCC[N@H+]2C)CC1 ZINC000532726849 1032278038 /nfs/dbraw/zinc/27/80/38/1032278038.db2.gz GPYQFUPCQCROKB-LJQANCHMSA-N 2 1 337.511 4.440 20 0 EIADMP Cc1[nH]c2ccccc2c1C1=CC[NH+](CC[C@H]2CCCC[N@@H+]2C)CC1 ZINC000532726849 1032278050 /nfs/dbraw/zinc/27/80/50/1032278050.db2.gz GPYQFUPCQCROKB-LJQANCHMSA-N 2 1 337.511 4.440 20 0 EIADMP Cc1[nH]c2ccccc2c1C1=CC[N@H+](CC[C@H]2CCCC[NH+]2C)CC1 ZINC000532726849 1032278060 /nfs/dbraw/zinc/27/80/60/1032278060.db2.gz GPYQFUPCQCROKB-LJQANCHMSA-N 2 1 337.511 4.440 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(Sc3ccccc3)cc2)CC[N@H+]1C ZINC000532804322 1032322829 /nfs/dbraw/zinc/32/28/29/1032322829.db2.gz BEVNNXQPISFUKI-FUHWJXTLSA-N 2 1 326.509 4.410 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc3[nH]ccc32)[C@@H]1c1cccs1 ZINC000174459990 1032400683 /nfs/dbraw/zinc/40/06/83/1032400683.db2.gz MOKWSDFGHORVAP-OXJNMPFZSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc3[nH]ccc32)[C@@H]1c1cccs1 ZINC000174459990 1032400688 /nfs/dbraw/zinc/40/06/88/1032400688.db2.gz MOKWSDFGHORVAP-OXJNMPFZSA-N 2 1 339.508 4.402 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)C1 ZINC000760161691 1032484670 /nfs/dbraw/zinc/48/46/70/1032484670.db2.gz ZDVFOMBJNWWUQH-OLZOCXBDSA-N 2 1 344.330 4.347 20 0 EIADMP CC(C)Oc1ccc2[nH+]ccc(N3CCC4(CCC[N@H+]4C)CC3)c2c1 ZINC000450422179 1032492679 /nfs/dbraw/zinc/49/26/79/1032492679.db2.gz UPGACUYKNWQYTH-UHFFFAOYSA-N 2 1 339.483 4.087 20 0 EIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C[C@@H]1CCCCC1(F)F ZINC000450455629 1032511409 /nfs/dbraw/zinc/51/14/09/1032511409.db2.gz OFYUOHGZROAWRC-MOPGFXCFSA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)C[C@@H]1CCCCC1(F)F ZINC000450455629 1032511413 /nfs/dbraw/zinc/51/14/13/1032511413.db2.gz OFYUOHGZROAWRC-MOPGFXCFSA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C[C@@H]1CCCCC1(F)F ZINC000450455629 1032511423 /nfs/dbraw/zinc/51/14/23/1032511423.db2.gz OFYUOHGZROAWRC-MOPGFXCFSA-N 2 1 336.470 4.266 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475825 1032521471 /nfs/dbraw/zinc/52/14/71/1032521471.db2.gz ZYOYMCQNFCPKTR-ZBFHGGJFSA-N 2 1 328.422 4.126 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475825 1032521480 /nfs/dbraw/zinc/52/14/80/1032521480.db2.gz ZYOYMCQNFCPKTR-ZBFHGGJFSA-N 2 1 328.422 4.126 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475825 1032521487 /nfs/dbraw/zinc/52/14/87/1032521487.db2.gz ZYOYMCQNFCPKTR-ZBFHGGJFSA-N 2 1 328.422 4.126 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475825 1032521495 /nfs/dbraw/zinc/52/14/95/1032521495.db2.gz ZYOYMCQNFCPKTR-ZBFHGGJFSA-N 2 1 328.422 4.126 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475825 1032521503 /nfs/dbraw/zinc/52/15/03/1032521503.db2.gz ZYOYMCQNFCPKTR-ZBFHGGJFSA-N 2 1 328.422 4.126 20 0 EIADMP FC1(F)CC(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000450499640 1032540409 /nfs/dbraw/zinc/54/04/09/1032540409.db2.gz JJFKJTIQZGGCHZ-MOPGFXCFSA-N 2 1 334.454 4.018 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000760169508 1032541989 /nfs/dbraw/zinc/54/19/89/1032541989.db2.gz FTABMJUJTZZBEF-GFCCVEGCSA-N 2 1 344.330 4.491 20 0 EIADMP CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccccc1OC(F)F ZINC000178704012 1032544429 /nfs/dbraw/zinc/54/44/29/1032544429.db2.gz MMFIPKGASXCVPN-BBRMVZONSA-N 2 1 337.414 4.170 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000178700632 1032544701 /nfs/dbraw/zinc/54/47/01/1032544701.db2.gz FLUZIUKNKLJEHS-BLLLJJGKSA-N 2 1 335.904 4.308 20 0 EIADMP C[N@@H+](CC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1CCCCC1(F)F ZINC000450638615 1032609949 /nfs/dbraw/zinc/60/99/49/1032609949.db2.gz JDSGJXDHLPXBLI-KRWDZBQOSA-N 2 1 337.458 4.055 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(C(C)=O)cc2)CC1)CC1CC1 ZINC000450654973 1032624073 /nfs/dbraw/zinc/62/40/73/1032624073.db2.gz SLSXARYVDGNLSW-UHFFFAOYSA-N 2 1 342.527 4.223 20 0 EIADMP C[NH+](C)CCC1CC[NH+](Cc2ccc(F)c(Cl)c2Cl)CC1 ZINC000432743843 1032668718 /nfs/dbraw/zinc/66/87/18/1032668718.db2.gz AJAHMNVIXABVCE-UHFFFAOYSA-N 2 1 333.278 4.296 20 0 EIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCCO2 ZINC000643545832 1018893162 /nfs/dbraw/zinc/89/31/62/1018893162.db2.gz CWRVWNJJMULTJC-HKUYNNGSSA-N 2 1 328.500 4.288 20 0 EIADMP COc1ccc([C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643548109 1018924047 /nfs/dbraw/zinc/92/40/47/1018924047.db2.gz MPEGLKFNDCZNAJ-PZJWPPBQSA-N 2 1 336.479 4.049 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000432796643 1032818706 /nfs/dbraw/zinc/81/87/06/1032818706.db2.gz BCWQPGKTSHRLIP-INIZCTEOSA-N 2 1 332.488 4.470 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000432796643 1032818712 /nfs/dbraw/zinc/81/87/12/1032818712.db2.gz BCWQPGKTSHRLIP-INIZCTEOSA-N 2 1 332.488 4.470 20 0 EIADMP CCc1nc([C@H](C)N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000274892556 1019839317 /nfs/dbraw/zinc/83/93/17/1019839317.db2.gz JSALVMWAGPBBNE-RYRKJORJSA-N 2 1 343.540 4.267 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cn2)c1 ZINC000274945398 1019875306 /nfs/dbraw/zinc/87/53/06/1019875306.db2.gz UJNUDPJXELPALK-OAHLLOKOSA-N 2 1 331.891 4.426 20 0 EIADMP c1ccc(CSCCC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000535627063 1020013619 /nfs/dbraw/zinc/01/36/19/1020013619.db2.gz RPBWSOVUWQQMQL-FPOVZHCZSA-N 2 1 344.568 4.259 20 0 EIADMP c1ccc(CSCCC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000535627063 1020013634 /nfs/dbraw/zinc/01/36/34/1020013634.db2.gz RPBWSOVUWQQMQL-FPOVZHCZSA-N 2 1 344.568 4.259 20 0 EIADMP c1ccc(CSCCC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000535627063 1020013649 /nfs/dbraw/zinc/01/36/49/1020013649.db2.gz RPBWSOVUWQQMQL-FPOVZHCZSA-N 2 1 344.568 4.259 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cnc(-c3ccccc3)[nH]2)CC1 ZINC000180122735 1020063138 /nfs/dbraw/zinc/06/31/38/1020063138.db2.gz HBULNHDZYBLIAO-UHFFFAOYSA-N 2 1 340.515 4.021 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2c[nH]c(-c3ccccc3)n2)CC1 ZINC000180122735 1020063140 /nfs/dbraw/zinc/06/31/40/1020063140.db2.gz HBULNHDZYBLIAO-UHFFFAOYSA-N 2 1 340.515 4.021 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c[nH]c(-c3ccccc3)n2)CC1 ZINC000180122735 1020063144 /nfs/dbraw/zinc/06/31/44/1020063144.db2.gz HBULNHDZYBLIAO-UHFFFAOYSA-N 2 1 340.515 4.021 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](CSc1ccccc1)C(C)C ZINC000180626933 1020157468 /nfs/dbraw/zinc/15/74/68/1020157468.db2.gz RVTJMSBHSHNRAY-IBGZPJMESA-N 2 1 331.529 4.378 20 0 EIADMP Cc1ccc2cc[nH+]c(N3Cc4ccccc4C4(CC[NH2+]CC4)C3)c2c1 ZINC001167160711 1020437502 /nfs/dbraw/zinc/43/75/02/1020437502.db2.gz ZDWIKKOGTRSMLH-UHFFFAOYSA-N 2 1 343.474 4.185 20 0 EIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)CC1=Cc2ccccc2OC1 ZINC000579892900 1020507846 /nfs/dbraw/zinc/50/78/46/1020507846.db2.gz JGYRPIYZDNERMQ-UHFFFAOYSA-N 2 1 336.479 4.046 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccncc1F ZINC000340185073 1020588922 /nfs/dbraw/zinc/58/89/22/1020588922.db2.gz PBOOEJZDMOVUKB-QGZVFWFLSA-N 2 1 341.474 4.303 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000236669180 1020627385 /nfs/dbraw/zinc/62/73/85/1020627385.db2.gz XYJOAQNNBLMDGM-UHFFFAOYSA-N 2 1 330.516 4.361 20 0 EIADMP C[C@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000655710804 1020908684 /nfs/dbraw/zinc/90/86/84/1020908684.db2.gz FSTUBCMALRSBBL-VJAOCGABSA-N 2 1 330.541 4.056 20 0 EIADMP c1cc(C2CCCCC2)ccc1C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000655770402 1020944765 /nfs/dbraw/zinc/94/47/65/1020944765.db2.gz JPQYOCMUXUUHSS-JOCHJYFZSA-N 2 1 342.527 4.077 20 0 EIADMP CC(C)n1ccc(C[C@@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)n1 ZINC000543993052 1020944782 /nfs/dbraw/zinc/94/47/82/1020944782.db2.gz SRGFQMDQNGKURV-GOSISDBHSA-N 2 1 342.531 4.025 20 0 EIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+]CCCc1c[nH+]cn1C ZINC000579974385 1021063604 /nfs/dbraw/zinc/06/36/04/1021063604.db2.gz DHLYXSLFIATJSB-IBGZPJMESA-N 2 1 329.488 4.128 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccncc1F ZINC000340473421 1021083572 /nfs/dbraw/zinc/08/35/72/1021083572.db2.gz CGINCOILXCFMIC-QGZVFWFLSA-N 2 1 341.474 4.303 20 0 EIADMP CCc1cnc(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)s1 ZINC000340492278 1021137451 /nfs/dbraw/zinc/13/74/51/1021137451.db2.gz YMOHLYXJBKKDMV-UHFFFAOYSA-N 2 1 343.540 4.238 20 0 EIADMP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@H+]2Cc1ccc(C2CCCC2)cc1 ZINC000570197195 1021227936 /nfs/dbraw/zinc/22/79/36/1021227936.db2.gz VTZAKIKXBVUOMT-FSSWDIPSSA-N 2 1 342.527 4.028 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000125826724 1021310829 /nfs/dbraw/zinc/31/08/29/1021310829.db2.gz UOBHUIYPOZZHSX-LSDHHAIUSA-N 2 1 326.431 4.059 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000683929141 1021995494 /nfs/dbraw/zinc/99/54/94/1021995494.db2.gz OVRPRCKFIYRXOS-CYGODWOOSA-N 2 1 347.506 4.414 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1nc(-c2ccccc2)cs1 ZINC000414184742 1022060885 /nfs/dbraw/zinc/06/08/85/1022060885.db2.gz OGHHKRXIAGNJHC-HOTGVXAUSA-N 2 1 329.513 4.193 20 0 EIADMP Cc1sccc1C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC001204543043 1022189947 /nfs/dbraw/zinc/18/99/47/1022189947.db2.gz LFDPRQYGRKAMQQ-UHFFFAOYSA-N 2 1 328.525 4.401 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)ccc1Cl ZINC000549041205 1022249306 /nfs/dbraw/zinc/24/93/06/1022249306.db2.gz FVLSDSUTFTYVOX-IRXDYDNUSA-N 2 1 338.923 4.127 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000892575070 1022266908 /nfs/dbraw/zinc/26/69/08/1022266908.db2.gz RHEOKXRNUOHWQV-MRXNPFEDSA-N 2 1 341.499 4.067 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1 ZINC001167424315 1022317550 /nfs/dbraw/zinc/31/75/50/1022317550.db2.gz HDRVFCXYGZVGRE-HKUYNNGSSA-N 2 1 334.935 4.469 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H](C)CC(F)(F)F)cc1 ZINC000414256343 1022324838 /nfs/dbraw/zinc/32/48/38/1022324838.db2.gz COEIHSVXDMFOIP-CHWSQXEVSA-N 2 1 325.378 4.420 20 0 EIADMP CCCCCCOc1cccc(C[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC000236672653 1022550280 /nfs/dbraw/zinc/55/02/80/1022550280.db2.gz CEHQMAWDTHRCAQ-UHFFFAOYSA-N 2 1 330.516 4.362 20 0 EIADMP CCC[NH+]1CCC(Nc2cccc(Cn3cc[nH+]c3C(C)C)c2)CC1 ZINC000130021624 1022570592 /nfs/dbraw/zinc/57/05/92/1022570592.db2.gz JTRRPZVEKUWWMV-UHFFFAOYSA-N 2 1 340.515 4.341 20 0 EIADMP CCOc1ccccc1C1=CCN(CC[C@H]2CCCC[N@H+]2C)CC1 ZINC000472591799 1022631854 /nfs/dbraw/zinc/63/18/54/1022631854.db2.gz YQLXOWQJPCZVPG-LJQANCHMSA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccccc1C1=CC[N@H+](CC[C@H]2CCCC[NH+]2C)CC1 ZINC000472591799 1022631883 /nfs/dbraw/zinc/63/18/83/1022631883.db2.gz YQLXOWQJPCZVPG-LJQANCHMSA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccccc1C1=CC[N@@H+](CC[C@H]2CCCC[NH+]2C)CC1 ZINC000472591799 1022631904 /nfs/dbraw/zinc/63/19/04/1022631904.db2.gz YQLXOWQJPCZVPG-LJQANCHMSA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccccc1C1=CC[NH+](CC[C@H]2CCCC[N@@H+]2C)CC1 ZINC000472591799 1022631924 /nfs/dbraw/zinc/63/19/24/1022631924.db2.gz YQLXOWQJPCZVPG-LJQANCHMSA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccccc1C1=CC[NH+](CC[C@H]2CCCC[N@H+]2C)CC1 ZINC000472591799 1022631940 /nfs/dbraw/zinc/63/19/40/1022631940.db2.gz YQLXOWQJPCZVPG-LJQANCHMSA-N 2 1 328.500 4.049 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CC2 ZINC000134313615 1022650615 /nfs/dbraw/zinc/65/06/15/1022650615.db2.gz YWBCFUISXMKDCD-MEDUHNTESA-N 2 1 325.283 4.055 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CC2 ZINC000134313615 1022650618 /nfs/dbraw/zinc/65/06/18/1022650618.db2.gz YWBCFUISXMKDCD-MEDUHNTESA-N 2 1 325.283 4.055 20 0 EIADMP Cc1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)ccc1C(F)(F)F ZINC000414359613 1022731274 /nfs/dbraw/zinc/73/12/74/1022731274.db2.gz OWJVVWVKFNZWBT-MQVJKMGUSA-N 2 1 326.406 4.119 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H](Cc2ccccc2)C2CC2)C[C@@H]1c1ccccc1 ZINC000580955653 1022748170 /nfs/dbraw/zinc/74/81/70/1022748170.db2.gz KVEMPZPDJUATCX-YTFSRNRJSA-N 2 1 334.507 4.433 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H](Cc2ccccc2)C2CC2)C[C@@H]1c1ccccc1 ZINC000580955653 1022748189 /nfs/dbraw/zinc/74/81/89/1022748189.db2.gz KVEMPZPDJUATCX-YTFSRNRJSA-N 2 1 334.507 4.433 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000236821804 1022775099 /nfs/dbraw/zinc/77/50/99/1022775099.db2.gz YDGWLUAAGIXWFR-CYBMUJFWSA-N 2 1 330.394 4.109 20 0 EIADMP c1sc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)nc1-c1ccccc1 ZINC000647542954 1022779223 /nfs/dbraw/zinc/77/92/23/1022779223.db2.gz FGGLESDVRQDVKT-QZTJIDSGSA-N 2 1 341.524 4.022 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000374542764 1022787801 /nfs/dbraw/zinc/78/78/01/1022787801.db2.gz HSYDIUXRGOTNOZ-QHAWAJNXSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000374542764 1022787822 /nfs/dbraw/zinc/78/78/22/1022787822.db2.gz HSYDIUXRGOTNOZ-QHAWAJNXSA-N 2 1 344.543 4.080 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccnc(Cl)c1 ZINC000160759527 1022823081 /nfs/dbraw/zinc/82/30/81/1022823081.db2.gz ZNPOAJVJVYBDSK-GJYPPUQNSA-N 2 1 343.902 4.296 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1Br ZINC000378489591 1022843225 /nfs/dbraw/zinc/84/32/25/1022843225.db2.gz CTXBTYNBLSYSPU-CWRNSKLLSA-N 2 1 337.305 4.035 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1)c1ccc(Cl)nc1 ZINC000378513145 1022852713 /nfs/dbraw/zinc/85/27/13/1022852713.db2.gz AGOMEDHCRQTWOU-YJLNNSPDSA-N 2 1 329.875 4.079 20 0 EIADMP C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548154388 1022873968 /nfs/dbraw/zinc/87/39/68/1022873968.db2.gz NZNDNIVPHMBIEU-WTOYTKOKSA-N 2 1 335.495 4.033 20 0 EIADMP CSc1ccc2c(c1)[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)CCC2 ZINC000581251195 1022915584 /nfs/dbraw/zinc/91/55/84/1022915584.db2.gz HHKCZWIUHFFVPU-IFXJQAMLSA-N 2 1 329.513 4.217 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC2(OC)CCC(c3ccccc3)CC2)[C@H](C)C1 ZINC000581292417 1022970416 /nfs/dbraw/zinc/97/04/16/1022970416.db2.gz HVJXTFYSGNRFTE-DWOCFRCJSA-N 2 1 344.543 4.049 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000584581443 1023036440 /nfs/dbraw/zinc/03/64/40/1023036440.db2.gz VNRAMWUDGAKDEF-FUDKSRODSA-N 2 1 349.522 4.081 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000584581443 1023036456 /nfs/dbraw/zinc/03/64/56/1023036456.db2.gz VNRAMWUDGAKDEF-FUDKSRODSA-N 2 1 349.522 4.081 20 0 EIADMP C[C@H]([NH2+]CCCOC1CCCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548162960 1023097803 /nfs/dbraw/zinc/09/78/03/1023097803.db2.gz GGJHBQXIDWBDBC-PZJWPPBQSA-N 2 1 344.543 4.226 20 0 EIADMP CCC[C@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)[C@@H]1CC1(C)C ZINC000417300618 1023249211 /nfs/dbraw/zinc/24/92/11/1023249211.db2.gz APGZBZMGTMJZCR-OALUTQOASA-N 2 1 347.547 4.308 20 0 EIADMP C[C@H]([NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310067397 1023346397 /nfs/dbraw/zinc/34/63/97/1023346397.db2.gz BYZLFJGPBUEYET-UWJYYQICSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310067397 1023346405 /nfs/dbraw/zinc/34/64/05/1023346405.db2.gz BYZLFJGPBUEYET-UWJYYQICSA-N 2 1 326.459 4.389 20 0 EIADMP Brc1cccc2c1CCC[C@@H]2[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000341197496 1023359183 /nfs/dbraw/zinc/35/91/83/1023359183.db2.gz WLDPSVQQSFCLGY-SFHVURJKSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H]2CC2(Cl)Cl)CC1 ZINC000728688750 1023394364 /nfs/dbraw/zinc/39/43/64/1023394364.db2.gz TZHBVXBJPKFBRT-KRWDZBQOSA-N 2 1 341.326 4.024 20 0 EIADMP COc1cccc(SCC[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000660257465 1023396084 /nfs/dbraw/zinc/39/60/84/1023396084.db2.gz TZZSCRKNKKBFNG-SJORKVTESA-N 2 1 348.556 4.030 20 0 EIADMP c1ccc([C@H]2C[C@@H]([NH2+]Cc3ccccc3OC3CCC3)CC[NH2+]2)cc1 ZINC000415090444 1023431837 /nfs/dbraw/zinc/43/18/37/1023431837.db2.gz OUKHZILLHDSRJB-PZJWPPBQSA-N 2 1 336.479 4.201 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+]Cc3ccccc3OC3CCC3)CC[NH2+]2)cc1 ZINC000415090445 1023433496 /nfs/dbraw/zinc/43/34/96/1023433496.db2.gz OUKHZILLHDSRJB-TZIWHRDSSA-N 2 1 336.479 4.201 20 0 EIADMP FC(F)(F)c1ccccc1CC[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415087150 1023436504 /nfs/dbraw/zinc/43/65/04/1023436504.db2.gz VMJLSIWNOHDVOU-HKUYNNGSSA-N 2 1 348.412 4.331 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccncc2Cl)CC1 ZINC000473038016 1023443468 /nfs/dbraw/zinc/44/34/68/1023443468.db2.gz XCTQOAPJHKDIRS-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccncc2Cl)CC1 ZINC000473038016 1023443472 /nfs/dbraw/zinc/44/34/72/1023443472.db2.gz XCTQOAPJHKDIRS-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@H](C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118178 1023517018 /nfs/dbraw/zinc/51/70/18/1023517018.db2.gz SNSVTIFQPIFYKD-KYJSFNMBSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118178 1023517033 /nfs/dbraw/zinc/51/70/33/1023517033.db2.gz SNSVTIFQPIFYKD-KYJSFNMBSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118178 1023517045 /nfs/dbraw/zinc/51/70/45/1023517045.db2.gz SNSVTIFQPIFYKD-KYJSFNMBSA-N 2 1 340.433 4.225 20 0 EIADMP c1nc(C2CCCC2)sc1C[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656782691 1023518099 /nfs/dbraw/zinc/51/80/99/1023518099.db2.gz ILSXHWJFFWQFLA-QGZVFWFLSA-N 2 1 333.545 4.012 20 0 EIADMP CC[NH+]1CCC([N@H+](C)C[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000500139460 1023537913 /nfs/dbraw/zinc/53/79/13/1023537913.db2.gz OFPVNUWYFMAFJM-CQSZACIVSA-N 2 1 328.422 4.225 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)C[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000500139460 1023537915 /nfs/dbraw/zinc/53/79/15/1023537915.db2.gz OFPVNUWYFMAFJM-CQSZACIVSA-N 2 1 328.422 4.225 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(NCCC[N@@H+]2CCCC[C@@H]2C)nc1 ZINC001167750758 1023617557 /nfs/dbraw/zinc/61/75/57/1023617557.db2.gz BHEUNUPTUGBTLM-OALUTQOASA-N 2 1 344.547 4.132 20 0 EIADMP C[C@H]1CCCC[NH+]1CCCNc1ccc(C[N@@H+]2CCCC[C@@H]2C)cn1 ZINC001167750758 1023617560 /nfs/dbraw/zinc/61/75/60/1023617560.db2.gz BHEUNUPTUGBTLM-OALUTQOASA-N 2 1 344.547 4.132 20 0 EIADMP C[C@H]1CCCC[NH+]1CCCNc1ccc(C[N@H+]2CCCC[C@@H]2C)cn1 ZINC001167750758 1023617563 /nfs/dbraw/zinc/61/75/63/1023617563.db2.gz BHEUNUPTUGBTLM-OALUTQOASA-N 2 1 344.547 4.132 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCNc1cccc2c1C1(C=C2)CC[NH2+]CC1 ZINC001167751962 1023623381 /nfs/dbraw/zinc/62/33/81/1023623381.db2.gz QCYHWIXMLNZNMU-SFHVURJKSA-N 2 1 339.527 4.011 20 0 EIADMP Cc1cccc(CCC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)n1 ZINC000582122044 1023686958 /nfs/dbraw/zinc/68/69/58/1023686958.db2.gz XEINLRPSJYHVSO-JOCHJYFZSA-N 2 1 349.522 4.109 20 0 EIADMP Cc1cccc(CCC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)n1 ZINC000582122044 1023686970 /nfs/dbraw/zinc/68/69/70/1023686970.db2.gz XEINLRPSJYHVSO-JOCHJYFZSA-N 2 1 349.522 4.109 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[N@@H+]2CCC3(CCOCC3)[C@H]2C)cc1 ZINC000377710939 1023705044 /nfs/dbraw/zinc/70/50/44/1023705044.db2.gz YKLQOAWRXMNGSP-DLBZAZTESA-N 2 1 339.483 4.133 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[N@H+]2CCC3(CCOCC3)[C@H]2C)cc1 ZINC000377710939 1023705059 /nfs/dbraw/zinc/70/50/59/1023705059.db2.gz YKLQOAWRXMNGSP-DLBZAZTESA-N 2 1 339.483 4.133 20 0 EIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccccc1Br ZINC000020143290 1023738922 /nfs/dbraw/zinc/73/89/22/1023738922.db2.gz RVMMZEATBJMKDG-LBPRGKRZSA-N 2 1 339.321 4.409 20 0 EIADMP CCCn1ccnc1CCC[N@@H+](C)CCc1nsc2ccccc21 ZINC000660416498 1023742520 /nfs/dbraw/zinc/74/25/20/1023742520.db2.gz JNYSICVNDWFCEJ-UHFFFAOYSA-N 2 1 342.512 4.010 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCc1nsc2ccccc12 ZINC000660416498 1023742529 /nfs/dbraw/zinc/74/25/29/1023742529.db2.gz JNYSICVNDWFCEJ-UHFFFAOYSA-N 2 1 342.512 4.010 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCc1nsc2ccccc12 ZINC000660416498 1023742534 /nfs/dbraw/zinc/74/25/34/1023742534.db2.gz JNYSICVNDWFCEJ-UHFFFAOYSA-N 2 1 342.512 4.010 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000510469317 1023767283 /nfs/dbraw/zinc/76/72/83/1023767283.db2.gz MJWBLLWXGVWOES-UHFFFAOYSA-N 2 1 346.849 4.248 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000510469317 1023767288 /nfs/dbraw/zinc/76/72/88/1023767288.db2.gz MJWBLLWXGVWOES-UHFFFAOYSA-N 2 1 346.849 4.248 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+]CC[C@H]3CCC[N@H+]3C)cc2)cs1 ZINC000341588621 1023895655 /nfs/dbraw/zinc/89/56/55/1023895655.db2.gz BXJBIMBPUBSSLY-KBXCAEBGSA-N 2 1 329.513 4.253 20 0 EIADMP Cc1nc(-c2ccc([C@@H](C)[NH2+]CC[C@@H]3CCC[N@H+]3C)cc2)cs1 ZINC000341588622 1023895798 /nfs/dbraw/zinc/89/57/98/1023895798.db2.gz BXJBIMBPUBSSLY-KDOFPFPSSA-N 2 1 329.513 4.253 20 0 EIADMP CCC[C@@H]([NH2+]CCc1c[nH+]cn1C)c1cccc(C(F)(F)F)c1 ZINC000276727900 1023904384 /nfs/dbraw/zinc/90/43/84/1023904384.db2.gz XMXIRBPFLGCYJH-MRXNPFEDSA-N 2 1 325.378 4.112 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1 ZINC000130245360 1023931988 /nfs/dbraw/zinc/93/19/88/1023931988.db2.gz TXOITUSPGAUTNC-BBWFWOEESA-N 2 1 337.305 4.117 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660710095 1024024473 /nfs/dbraw/zinc/02/44/73/1024024473.db2.gz JUNXZQWMCCRIRD-ZDUSSCGKSA-N 2 1 345.878 4.194 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660710095 1024024490 /nfs/dbraw/zinc/02/44/90/1024024490.db2.gz JUNXZQWMCCRIRD-ZDUSSCGKSA-N 2 1 345.878 4.194 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)ccc1OC(C)C ZINC000341638188 1024078159 /nfs/dbraw/zinc/07/81/59/1024078159.db2.gz LBMVDAAZTDHTNM-INIZCTEOSA-N 2 1 345.487 4.118 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@@H]3C3CCC3)CC2)cs1 ZINC000510716718 1024302406 /nfs/dbraw/zinc/30/24/06/1024302406.db2.gz FPMVBCLEEMOXKI-RTBURBONSA-N 2 1 347.572 4.086 20 0 EIADMP FCCC[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000510723889 1024318669 /nfs/dbraw/zinc/31/86/69/1024318669.db2.gz UQRFZZRGLWNUCT-PZJWPPBQSA-N 2 1 332.507 4.202 20 0 EIADMP CC[NH+](CC)CC1CC[NH+](Cc2csc(-c3cccs3)n2)CC1 ZINC000047978334 1024379506 /nfs/dbraw/zinc/37/95/06/1024379506.db2.gz BGCYGNNZKOCFRY-UHFFFAOYSA-N 2 1 349.569 4.425 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)c1cncs1 ZINC000164500763 1024466213 /nfs/dbraw/zinc/46/62/13/1024466213.db2.gz CPDDZYTXPJIGSV-HNNXBMFYSA-N 2 1 341.480 4.219 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)[C@@H](C)c1nc2ccccc2s1 ZINC000164647050 1024756372 /nfs/dbraw/zinc/75/63/72/1024756372.db2.gz SWNPEPBWACMYPL-CABCVRRESA-N 2 1 342.512 4.363 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)C[C@@H]2CCC[NH+](C)C2)cc1 ZINC000092253699 1024760222 /nfs/dbraw/zinc/76/02/22/1024760222.db2.gz MUHOICKYTPWBRQ-LJQANCHMSA-N 2 1 338.495 4.136 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000092253699 1024760239 /nfs/dbraw/zinc/76/02/39/1024760239.db2.gz MUHOICKYTPWBRQ-LJQANCHMSA-N 2 1 338.495 4.136 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000092253699 1024760266 /nfs/dbraw/zinc/76/02/66/1024760266.db2.gz MUHOICKYTPWBRQ-LJQANCHMSA-N 2 1 338.495 4.136 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)[C@@H](C)c1nc2ccccc2s1 ZINC000164647176 1024761922 /nfs/dbraw/zinc/76/19/22/1024761922.db2.gz SWNPEPBWACMYPL-HUUCEWRRSA-N 2 1 342.512 4.363 20 0 EIADMP CCc1nc(C(C)C)ccc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000549806856 1033237724 /nfs/dbraw/zinc/23/77/24/1033237724.db2.gz WKZZVYHZWWCGCF-UHFFFAOYSA-N 2 1 331.548 4.320 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481308 1024825222 /nfs/dbraw/zinc/82/52/22/1024825222.db2.gz MWFKQSDJOWAXQU-LQWHRVPQSA-N 2 1 337.511 4.205 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582002539 1024835633 /nfs/dbraw/zinc/83/56/33/1024835633.db2.gz QSPRFYPJLPMWFP-QUCCMNQESA-N 2 1 338.495 4.388 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582002539 1024835635 /nfs/dbraw/zinc/83/56/35/1024835635.db2.gz QSPRFYPJLPMWFP-QUCCMNQESA-N 2 1 338.495 4.388 20 0 EIADMP c1sc(C2CCCC2)nc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662292602 1025044324 /nfs/dbraw/zinc/04/43/24/1025044324.db2.gz OROSIGJOKVIGJD-KRWDZBQOSA-N 2 1 333.545 4.012 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2csc(-c3cccs3)n2)[C@@H]1CCC[NH3+] ZINC000662312390 1025067397 /nfs/dbraw/zinc/06/73/97/1025067397.db2.gz FTCQKGBBHYNHCV-UKRRQHHQSA-N 2 1 335.542 4.211 20 0 EIADMP Cc1cc2c(cc1C)[C@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CCS2 ZINC000187029178 1025169170 /nfs/dbraw/zinc/16/91/70/1025169170.db2.gz XRWNHAUAWVVWOU-LJQANCHMSA-N 2 1 330.541 4.304 20 0 EIADMP C[C@@H](Cc1coc2ccccc12)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663466259 1025390959 /nfs/dbraw/zinc/39/09/59/1025390959.db2.gz QDVIOSJHQTXFLR-FUHWJXTLSA-N 2 1 326.484 4.075 20 0 EIADMP C[C@H](Cc1coc2ccccc12)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663466260 1025392587 /nfs/dbraw/zinc/39/25/87/1025392587.db2.gz QDVIOSJHQTXFLR-SJLPKXTDSA-N 2 1 326.484 4.075 20 0 EIADMP c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467857 1025399103 /nfs/dbraw/zinc/39/91/03/1025399103.db2.gz IHXZCJNXTRBZSS-UYAOXDASSA-N 2 1 340.511 4.145 20 0 EIADMP c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467857 1025399120 /nfs/dbraw/zinc/39/91/20/1025399120.db2.gz IHXZCJNXTRBZSS-UYAOXDASSA-N 2 1 340.511 4.145 20 0 EIADMP c1cncc([C@H]([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)C2CCCCC2)c1 ZINC000663467019 1025401251 /nfs/dbraw/zinc/40/12/51/1025401251.db2.gz YZWZURYEBFPYEW-SIKLNZKXSA-N 2 1 341.543 4.415 20 0 EIADMP COc1cccc2cc([C@H](C)NC[C@H]3CCC[N@@H+](CC4CC4)C3)oc21 ZINC000663467540 1025408885 /nfs/dbraw/zinc/40/88/85/1025408885.db2.gz GOGKQEJZHYMFEI-DOTOQJQBSA-N 2 1 342.483 4.214 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)oc21 ZINC000663467540 1025408898 /nfs/dbraw/zinc/40/88/98/1025408898.db2.gz GOGKQEJZHYMFEI-DOTOQJQBSA-N 2 1 342.483 4.214 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)oc21 ZINC000663467540 1025408912 /nfs/dbraw/zinc/40/89/12/1025408912.db2.gz GOGKQEJZHYMFEI-DOTOQJQBSA-N 2 1 342.483 4.214 20 0 EIADMP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@H+]1CC1CC[NH+](C)CC1 ZINC000892034302 1025454806 /nfs/dbraw/zinc/45/48/06/1025454806.db2.gz LUSDRTKUXYCPCT-FQEVSTJZSA-N 2 1 340.515 4.096 20 0 EIADMP C[C@@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000663478482 1025468600 /nfs/dbraw/zinc/46/86/00/1025468600.db2.gz RENAFAOTWRLTKD-WBVHZDCISA-N 2 1 342.449 4.465 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@H](c2ccc(C)cc2)C[C@@H]1C ZINC000426539582 1025492337 /nfs/dbraw/zinc/49/23/37/1025492337.db2.gz NEHVQJLHHAYKKK-FXAWDEMLSA-N 2 1 346.478 4.262 20 0 EIADMP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000563135559 1025516957 /nfs/dbraw/zinc/51/69/57/1025516957.db2.gz QKRSOJGTBDAWRS-VHSXEESVSA-N 2 1 344.311 4.332 20 0 EIADMP C[C@@H]1C[N@H+](CCC[NH2+]Cc2cc(-c3ccccc3)cs2)CCCO1 ZINC000432352163 1025729836 /nfs/dbraw/zinc/72/98/36/1025729836.db2.gz WCXDNBAKLIFWEO-QGZVFWFLSA-N 2 1 344.524 4.006 20 0 EIADMP Clc1ccc2c(c1)CC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167966701 1025839920 /nfs/dbraw/zinc/83/99/20/1025839920.db2.gz ZYOPGBDRJNYJLV-DLZDZTESSA-N 2 1 330.903 4.322 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCO[C@](C)(c2ccc(C)cc2)C1 ZINC001167837434 1025848706 /nfs/dbraw/zinc/84/87/06/1025848706.db2.gz KBKWXNQPJWVJCD-FPOVZHCZSA-N 2 1 332.532 4.053 20 0 EIADMP CC[C@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)c1cccc(Cl)c1 ZINC000344020111 1025880169 /nfs/dbraw/zinc/88/01/69/1025880169.db2.gz MWMXEDUVQMUYPL-SFHVURJKSA-N 2 1 336.907 4.026 20 0 EIADMP c1cc2cc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)ccc2s1 ZINC001167967907 1025889590 /nfs/dbraw/zinc/88/95/90/1025889590.db2.gz KXAHHWHOILVYPW-YQQQUEKLSA-N 2 1 326.509 4.396 20 0 EIADMP Clc1cccc([C@@H]2C[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167968567 1025904420 /nfs/dbraw/zinc/90/44/20/1025904420.db2.gz RNEQODQCZMQXSI-OLPBJYBYSA-N 2 1 330.903 4.191 20 0 EIADMP Clc1cccc([C@H]2C[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167968564 1025905576 /nfs/dbraw/zinc/90/55/76/1025905576.db2.gz RNEQODQCZMQXSI-DGDSNLKDSA-N 2 1 330.903 4.191 20 0 EIADMP Cc1cccc(C2(C[NH2+]Cc3ncc(C[NH+](C)C)s3)CCCC2)c1 ZINC000512086089 1025908409 /nfs/dbraw/zinc/90/84/09/1025908409.db2.gz AWDAWQWKFJOHNC-UHFFFAOYSA-N 2 1 343.540 4.115 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C)sc1Br ZINC000512088707 1025927768 /nfs/dbraw/zinc/92/77/68/1025927768.db2.gz PTVHPGAXCHCTRT-GFCCVEGCSA-N 2 1 333.339 4.200 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]CCC[N@H+](C)C(C)C)sc1Br ZINC000512088707 1025927795 /nfs/dbraw/zinc/92/77/95/1025927795.db2.gz PTVHPGAXCHCTRT-GFCCVEGCSA-N 2 1 333.339 4.200 20 0 EIADMP CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C1(C)C ZINC000344066008 1025953194 /nfs/dbraw/zinc/95/31/94/1025953194.db2.gz DPOAMVDZCSKLEK-GDIGMMSISA-N 2 1 327.472 4.035 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000432447187 1026025822 /nfs/dbraw/zinc/02/58/22/1026025822.db2.gz OKURUDITGZEMKQ-UONOGXRCSA-N 2 1 345.314 4.145 20 0 EIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccccc1OC ZINC001167970917 1026048309 /nfs/dbraw/zinc/04/83/09/1026048309.db2.gz PZOPIOUCSRDWLU-DLZDZTESSA-N 2 1 328.500 4.141 20 0 EIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccccc1OC ZINC001167970917 1026048331 /nfs/dbraw/zinc/04/83/31/1026048331.db2.gz PZOPIOUCSRDWLU-DLZDZTESSA-N 2 1 328.500 4.141 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Oc2cccnc2)cc1 ZINC000894521699 1026124599 /nfs/dbraw/zinc/12/45/99/1026124599.db2.gz ZYQGRPBNQJSYJC-UXDRXVOSSA-N 2 1 337.467 4.150 20 0 EIADMP COc1ccc(CC(C)(C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167975122 1026222407 /nfs/dbraw/zinc/22/24/07/1026222407.db2.gz HWNNVURRPKKIAU-IHWFROFDSA-N 2 1 342.527 4.011 20 0 EIADMP Cc1ccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)cc1 ZINC001167975414 1026255846 /nfs/dbraw/zinc/25/58/46/1026255846.db2.gz OTGMNEYOTQPEPW-FRIKZZABSA-N 2 1 338.539 4.313 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCSc2cc(C)c(C)cc21 ZINC000187246250 1026359007 /nfs/dbraw/zinc/35/90/07/1026359007.db2.gz GDBRWQJQYFSGLV-GOSISDBHSA-N 2 1 329.513 4.415 20 0 EIADMP Cc1ccc2cccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)c2n1 ZINC001167981920 1026367399 /nfs/dbraw/zinc/36/73/99/1026367399.db2.gz PHVIEDVDVOQYFR-SEJPIABJSA-N 2 1 335.495 4.038 20 0 EIADMP CC1(C)CC([NH2+]Cc2ccc(CSC(F)F)o2)CC(C)(C)[NH2+]1 ZINC000061554955 1026368205 /nfs/dbraw/zinc/36/82/05/1026368205.db2.gz HMPUHKGGSNBGJM-UHFFFAOYSA-N 2 1 332.460 4.134 20 0 EIADMP FC(F)(F)[C@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001167982120 1026385242 /nfs/dbraw/zinc/38/52/42/1026385242.db2.gz XNDFWDURSKPDRT-ZZCJBCQWSA-N 2 1 330.438 4.103 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(O)cc2)CC1 ZINC000511095822 1026389441 /nfs/dbraw/zinc/38/94/41/1026389441.db2.gz XHRJHKSRFHVXPO-ZWKOTPCHSA-N 2 1 338.495 4.138 20 0 EIADMP Clc1ccc([C@@H]2C[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167982177 1026389662 /nfs/dbraw/zinc/38/96/62/1026389662.db2.gz ZLDWSDAWESBIHG-OLPBJYBYSA-N 2 1 330.903 4.191 20 0 EIADMP C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CS1 ZINC000709726466 1026426253 /nfs/dbraw/zinc/42/62/53/1026426253.db2.gz MGPVRDJLBULYDN-QRQLOZEOSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CS1 ZINC000709726466 1026426258 /nfs/dbraw/zinc/42/62/58/1026426258.db2.gz MGPVRDJLBULYDN-QRQLOZEOSA-N 2 1 332.557 4.161 20 0 EIADMP CCC(CC)[N@@H+](CC(C)C)C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC001167562661 1026435821 /nfs/dbraw/zinc/43/58/21/1026435821.db2.gz OJUXEPQJLHZRJY-JOCHJYFZSA-N 2 1 346.559 4.424 20 0 EIADMP C[NH+]1CCC([NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000432535038 1026436637 /nfs/dbraw/zinc/43/66/37/1026436637.db2.gz IUFXSAZCMMGXII-UHFFFAOYSA-N 2 1 340.433 4.415 20 0 EIADMP C[NH+](C)CC1CC[NH+](Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000506881204 1026484993 /nfs/dbraw/zinc/48/49/93/1026484993.db2.gz MWGSUPDCIRYXHP-UHFFFAOYSA-N 2 1 334.813 4.132 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CCC[C@@H]([NH+](C)C)CC3)s2)cc1 ZINC000277561211 1026505472 /nfs/dbraw/zinc/50/54/72/1026505472.db2.gz RUECZOWWTFDNEY-QGZVFWFLSA-N 2 1 329.513 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CCC[C@@H]([NH+](C)C)CC3)s2)cc1 ZINC000277561211 1026505475 /nfs/dbraw/zinc/50/54/75/1026505475.db2.gz RUECZOWWTFDNEY-QGZVFWFLSA-N 2 1 329.513 4.035 20 0 EIADMP CN1CCC([N@@H+](C)CC(C)(C)Sc2ccc(Cl)cc2)CC1 ZINC001207293544 1026590557 /nfs/dbraw/zinc/59/05/57/1026590557.db2.gz BBNIUIXKAUQQBL-UHFFFAOYSA-N 2 1 326.937 4.237 20 0 EIADMP C[N@H+](CC(C)(C)Sc1ccc(Cl)cc1)C1CC[NH+](C)CC1 ZINC001207293544 1026590566 /nfs/dbraw/zinc/59/05/66/1026590566.db2.gz BBNIUIXKAUQQBL-UHFFFAOYSA-N 2 1 326.937 4.237 20 0 EIADMP C[N@@H+](CC(C)(C)Sc1ccc(Cl)cc1)C1CC[NH+](C)CC1 ZINC001207293544 1026590573 /nfs/dbraw/zinc/59/05/73/1026590573.db2.gz BBNIUIXKAUQQBL-UHFFFAOYSA-N 2 1 326.937 4.237 20 0 EIADMP Cc1ccc2cc(C[NH2+][C@@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)[nH]c2c1 ZINC000657429841 1026640711 /nfs/dbraw/zinc/64/07/11/1026640711.db2.gz LMEDEXIBHHNPJC-FUHWJXTLSA-N 2 1 325.500 4.219 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCCOC1 ZINC000507513044 1026822332 /nfs/dbraw/zinc/82/23/32/1026822332.db2.gz QNKHQFOOXBDKMS-MOXWOTFGSA-N 2 1 344.543 4.069 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](CCc2ccncc2)CC1)C1CCCCC1 ZINC000152900212 1026875475 /nfs/dbraw/zinc/87/54/75/1026875475.db2.gz FACBPPCAMKYOOD-NRFANRHFSA-N 2 1 329.532 4.037 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCc3cccnc32)cc1 ZINC000684957151 1026892091 /nfs/dbraw/zinc/89/20/91/1026892091.db2.gz GMXLGSURGLUMEO-YWZLYKJASA-N 2 1 332.451 4.304 20 0 EIADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+]([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC001167603780 1026993585 /nfs/dbraw/zinc/99/35/85/1026993585.db2.gz ZQDGHSMBHIROQW-VQTJNVASSA-N 2 1 332.532 4.106 20 0 EIADMP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000164624772 1027068177 /nfs/dbraw/zinc/06/81/77/1027068177.db2.gz DBOVEOCUWGQUSC-CQSZACIVSA-N 2 1 335.879 4.375 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000474477198 1027110353 /nfs/dbraw/zinc/11/03/53/1027110353.db2.gz RCBBSSSKCCLRQH-IPMKNSEASA-N 2 1 332.532 4.431 20 0 EIADMP C[C@@H]([NH2+]CC1([NH+](C)C)CCCC1)[C@@H](C)c1nc2ccccc2s1 ZINC000474497964 1027149708 /nfs/dbraw/zinc/14/97/08/1027149708.db2.gz ZMTPONJSBJRXNJ-HUUCEWRRSA-N 2 1 331.529 4.252 20 0 EIADMP Cc1ccc(CNc2cc(C)[nH+]c3ccccc23)c(N2CCCC2)[nH+]1 ZINC000302049753 1027199067 /nfs/dbraw/zinc/19/90/67/1027199067.db2.gz NCVJZPRAWLSUHN-UHFFFAOYSA-N 2 1 332.451 4.459 20 0 EIADMP CC(C)c1ccccc1NC(=O)[C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000116396416 1027349068 /nfs/dbraw/zinc/34/90/68/1027349068.db2.gz HNFXJUTZHDBPAI-QFBILLFUSA-N 2 1 347.547 4.093 20 0 EIADMP C[N@H+]1CC[C@H]2[C@H](CCCN2c2ccnc3cc(C(F)(F)F)ccc32)C1 ZINC000302709302 1027365415 /nfs/dbraw/zinc/36/54/15/1027365415.db2.gz DEQSBXCXEQAZNW-DYVFJYSZSA-N 2 1 349.400 4.174 20 0 EIADMP C[N@@H+]1CC[C@H]2[C@H](CCCN2c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000302709302 1027365433 /nfs/dbraw/zinc/36/54/33/1027365433.db2.gz DEQSBXCXEQAZNW-DYVFJYSZSA-N 2 1 349.400 4.174 20 0 EIADMP C[N@H+]1CC[C@H]2[C@H](CCCN2c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000302709302 1027365455 /nfs/dbraw/zinc/36/54/55/1027365455.db2.gz DEQSBXCXEQAZNW-DYVFJYSZSA-N 2 1 349.400 4.174 20 0 EIADMP COC1CC[NH+](C2(C[NH2+]CC[C@H](C)c3ccccc3)CCCC2)CC1 ZINC000582825342 1027425459 /nfs/dbraw/zinc/42/54/59/1027425459.db2.gz UUKNYWWWDGENQR-IBGZPJMESA-N 2 1 344.543 4.193 20 0 EIADMP Cc1ccc(F)c(CC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000453362287 1027425992 /nfs/dbraw/zinc/42/59/92/1027425992.db2.gz QZEFTFTURINELT-FPOVZHCZSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1ccc(F)c(CC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000453362287 1027426001 /nfs/dbraw/zinc/42/60/01/1027426001.db2.gz QZEFTFTURINELT-FPOVZHCZSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@H](C(C)C)C3)CC2)oc1C ZINC000474717138 1027435417 /nfs/dbraw/zinc/43/54/17/1027435417.db2.gz AZYVLLBXUWWEFR-VQTJNVASSA-N 2 1 347.547 4.308 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCC[C@@H](C(C)C)C3)CC2)oc1C ZINC000474717137 1027437038 /nfs/dbraw/zinc/43/70/38/1027437038.db2.gz AZYVLLBXUWWEFR-UXHICEINSA-N 2 1 347.547 4.308 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000441331237 1027467938 /nfs/dbraw/zinc/46/79/38/1027467938.db2.gz NMXPITKARPHRJM-GOEBONIOSA-N 2 1 326.431 4.155 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC000441331237 1027467950 /nfs/dbraw/zinc/46/79/50/1027467950.db2.gz NMXPITKARPHRJM-GOEBONIOSA-N 2 1 326.431 4.155 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC000441331237 1027467961 /nfs/dbraw/zinc/46/79/61/1027467961.db2.gz NMXPITKARPHRJM-GOEBONIOSA-N 2 1 326.431 4.155 20 0 EIADMP CC(=O)c1c(C)cc(C)c(CN(C)CC[C@H]2CCCC[N@H+]2C)c1C ZINC000441367423 1027490535 /nfs/dbraw/zinc/49/05/35/1027490535.db2.gz IBXZXZAUCUGHQG-LJQANCHMSA-N 2 1 330.516 4.121 20 0 EIADMP Cc1ccc(C)c(OCCC[N@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)c1 ZINC000441399029 1027519380 /nfs/dbraw/zinc/51/93/80/1027519380.db2.gz UEJKRHDGQKEZTK-TZIWHRDSSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441399029 1027519398 /nfs/dbraw/zinc/51/93/98/1027519398.db2.gz UEJKRHDGQKEZTK-TZIWHRDSSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441399029 1027519414 /nfs/dbraw/zinc/51/94/14/1027519414.db2.gz UEJKRHDGQKEZTK-TZIWHRDSSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441399029 1027519432 /nfs/dbraw/zinc/51/94/32/1027519432.db2.gz UEJKRHDGQKEZTK-TZIWHRDSSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000441418646 1027537229 /nfs/dbraw/zinc/53/72/29/1027537229.db2.gz VJCLNCPTNWRQEA-UGKGYDQZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1C ZINC000441418646 1027537246 /nfs/dbraw/zinc/53/72/46/1027537246.db2.gz VJCLNCPTNWRQEA-UGKGYDQZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1C ZINC000441418646 1027537257 /nfs/dbraw/zinc/53/72/57/1027537257.db2.gz VJCLNCPTNWRQEA-UGKGYDQZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(OCCC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1C ZINC000441418646 1027537272 /nfs/dbraw/zinc/53/72/72/1027537272.db2.gz VJCLNCPTNWRQEA-UGKGYDQZSA-N 2 1 342.527 4.021 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cc(F)ccc1F ZINC000112524280 1027580888 /nfs/dbraw/zinc/58/08/88/1027580888.db2.gz NOYMOOGEJVEIPH-OAHLLOKOSA-N 2 1 330.422 4.411 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1OC ZINC000152466046 1027661425 /nfs/dbraw/zinc/66/14/25/1027661425.db2.gz LGEWIZXJLJYNJQ-DLBZAZTESA-N 2 1 346.515 4.009 20 0 EIADMP CCOC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000474874642 1027717358 /nfs/dbraw/zinc/71/73/58/1027717358.db2.gz BVESUQMUTGBEAR-QESAQDPVSA-N 2 1 344.543 4.082 20 0 EIADMP c1ccc(C[C@@H]2CCC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)C2)cc1 ZINC001167995500 1027775212 /nfs/dbraw/zinc/77/52/12/1027775212.db2.gz HTIJQYCABLVOIZ-JYEDNEFCSA-N 2 1 338.539 4.347 20 0 EIADMP c1ccc(C[C@@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167995500 1027775232 /nfs/dbraw/zinc/77/52/32/1027775232.db2.gz HTIJQYCABLVOIZ-JYEDNEFCSA-N 2 1 338.539 4.347 20 0 EIADMP c1ccc(C[C@@H]2CCC[N@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167995500 1027775244 /nfs/dbraw/zinc/77/52/44/1027775244.db2.gz HTIJQYCABLVOIZ-JYEDNEFCSA-N 2 1 338.539 4.347 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)s1 ZINC000162317076 1027861913 /nfs/dbraw/zinc/86/19/13/1027861913.db2.gz AHNVGYXFWBYVJF-AWEZNQCLSA-N 2 1 344.528 4.037 20 0 EIADMP Cc1[nH]c2ccccc2c1C1=CC[N@H+](CCC[NH+]2CCCCC2)CC1 ZINC000444567870 1027871033 /nfs/dbraw/zinc/87/10/33/1027871033.db2.gz HYRJYCXRKXBNPX-UHFFFAOYSA-N 2 1 337.511 4.441 20 0 EIADMP Cc1[nH]c2ccccc2c1C1=CC[N@@H+](CCC[NH+]2CCCCC2)CC1 ZINC000444567870 1027871039 /nfs/dbraw/zinc/87/10/39/1027871039.db2.gz HYRJYCXRKXBNPX-UHFFFAOYSA-N 2 1 337.511 4.441 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000384022467 1027982300 /nfs/dbraw/zinc/98/23/00/1027982300.db2.gz KFFYVQVPZPUDFJ-MJGOQNOKSA-N 2 1 326.459 4.389 20 0 EIADMP FC(F)(F)c1cc(Cl)cc(C[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000189053709 1028061478 /nfs/dbraw/zinc/06/14/78/1028061478.db2.gz IMXIIJQMCBVGEC-UHFFFAOYSA-N 2 1 346.824 4.323 20 0 EIADMP Cc1ccc([C@@H]2CCC[N@H+]2Cc2cn(-c3cc[nH+]cc3)nc2C)s1 ZINC000346205299 1028330153 /nfs/dbraw/zinc/33/01/53/1028330153.db2.gz LYPRIIGMRSXBAQ-SFHVURJKSA-N 2 1 338.480 4.283 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+](Cc1ccc(Cl)c(Cl)c1)C(C)C ZINC000346370911 1028406673 /nfs/dbraw/zinc/40/66/73/1028406673.db2.gz QFAAJYXYQCKIGK-UHFFFAOYSA-N 2 1 326.271 4.409 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)C(C)C ZINC000346370911 1028406686 /nfs/dbraw/zinc/40/66/86/1028406686.db2.gz QFAAJYXYQCKIGK-UHFFFAOYSA-N 2 1 326.271 4.409 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)Cc1ccccc1C(F)(F)F ZINC000347280310 1029022257 /nfs/dbraw/zinc/02/22/57/1029022257.db2.gz SMPZUQDOJIAUIG-AWEZNQCLSA-N 2 1 339.405 4.163 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)Cc1ccccc1C(F)(F)F ZINC000347280310 1029022274 /nfs/dbraw/zinc/02/22/74/1029022274.db2.gz SMPZUQDOJIAUIG-AWEZNQCLSA-N 2 1 339.405 4.163 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444200768 1029071688 /nfs/dbraw/zinc/07/16/88/1029071688.db2.gz UESXPABGYIFMDL-HOTGVXAUSA-N 2 1 338.442 4.157 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444200768 1029071706 /nfs/dbraw/zinc/07/17/06/1029071706.db2.gz UESXPABGYIFMDL-HOTGVXAUSA-N 2 1 338.442 4.157 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cccc(Oc2ccccc2)c1 ZINC000524619257 1029120804 /nfs/dbraw/zinc/12/08/04/1029120804.db2.gz PYBAOJWWBPWZCH-KRWDZBQOSA-N 2 1 335.451 4.410 20 0 EIADMP Cc1nc(C(C)C)oc1CN[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000428430026 1029125551 /nfs/dbraw/zinc/12/55/51/1029125551.db2.gz GUEYEGXSAWATCT-APWZRJJASA-N 2 1 341.499 4.107 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@H](c3cccnc3)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168053368 1029160539 /nfs/dbraw/zinc/16/05/39/1029160539.db2.gz OEOPTENAXNXTEN-YDLSIGKMSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@H](c3cccnc3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053368 1029160545 /nfs/dbraw/zinc/16/05/45/1029160545.db2.gz OEOPTENAXNXTEN-YDLSIGKMSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3cccnc3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053368 1029160560 /nfs/dbraw/zinc/16/05/60/1029160560.db2.gz OEOPTENAXNXTEN-YDLSIGKMSA-N 2 1 349.522 4.313 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]Cc3ccc(C[NH3+])cc3F)oc21 ZINC000650754874 1029180751 /nfs/dbraw/zinc/18/07/51/1029180751.db2.gz UGLQYUXBRCGNBW-ZDUSSCGKSA-N 2 1 342.414 4.280 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCc3c2cccc3O)cc1 ZINC000130454749 1029184247 /nfs/dbraw/zinc/18/42/47/1029184247.db2.gz SFYZFYVIWWTWEY-VBKZILBWSA-N 2 1 333.435 4.224 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000157935968 1029287865 /nfs/dbraw/zinc/28/78/65/1029287865.db2.gz WIKYXDQVCGRQDY-MOPGFXCFSA-N 3 1 340.515 4.035 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCOC2CCCCCC2)C1 ZINC000524892636 1029298246 /nfs/dbraw/zinc/29/82/46/1029298246.db2.gz XXUALWYLMPJARX-VQTJNVASSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCOC2CCCCCC2)C1 ZINC000524892636 1029298262 /nfs/dbraw/zinc/29/82/62/1029298262.db2.gz XXUALWYLMPJARX-VQTJNVASSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCOC2CCCCCC2)C1 ZINC000524892636 1029298278 /nfs/dbraw/zinc/29/82/78/1029298278.db2.gz XXUALWYLMPJARX-VQTJNVASSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCOC2CCCCCC2)C1 ZINC000524892636 1029298296 /nfs/dbraw/zinc/29/82/96/1029298296.db2.gz XXUALWYLMPJARX-VQTJNVASSA-N 2 1 336.564 4.312 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCC[NH+](C(C)C)C(C)C)CCS2 ZINC000343467338 1029306770 /nfs/dbraw/zinc/30/67/70/1029306770.db2.gz LZANOGCDXILVFY-SFHVURJKSA-N 2 1 336.545 4.331 20 0 EIADMP CCC[N@@H+](C1CCOCC1)C1C[C@@H](C)N(Cc2ccccc2)[C@H](C)C1 ZINC001168059634 1029437721 /nfs/dbraw/zinc/43/77/21/1029437721.db2.gz USQPLUTXAFCUSS-RTBURBONSA-N 2 1 344.543 4.319 20 0 EIADMP CCC[N@H+](C1CCOCC1)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168059634 1029437727 /nfs/dbraw/zinc/43/77/27/1029437727.db2.gz USQPLUTXAFCUSS-RTBURBONSA-N 2 1 344.543 4.319 20 0 EIADMP CCC[N@@H+](C1CCOCC1)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168059634 1029437739 /nfs/dbraw/zinc/43/77/39/1029437739.db2.gz USQPLUTXAFCUSS-RTBURBONSA-N 2 1 344.543 4.319 20 0 EIADMP CC(C)CCn1cccc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475218836 1029451502 /nfs/dbraw/zinc/45/15/02/1029451502.db2.gz HDWPIZNTEYGBSX-OAQYLSRUSA-N 2 1 339.527 4.146 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000132512320 1029475341 /nfs/dbraw/zinc/47/53/41/1029475341.db2.gz OIONFXABPGHRHZ-PBFPGSCMSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000132512320 1029475347 /nfs/dbraw/zinc/47/53/47/1029475347.db2.gz OIONFXABPGHRHZ-PBFPGSCMSA-N 2 1 347.503 4.391 20 0 EIADMP COCCC1(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCCCC1 ZINC000475269210 1029477882 /nfs/dbraw/zinc/47/78/82/1029477882.db2.gz MSANAWAJAARJPF-OAQYLSRUSA-N 2 1 344.543 4.085 20 0 EIADMP Cc1cc2[nH]c(C[NH2+]C[C@H]3CC[N@@H+](Cc4ccccc4)C3)cc2c(C)c1 ZINC000475278363 1029484362 /nfs/dbraw/zinc/48/43/62/1029484362.db2.gz VNCOKMLBNHDFRW-HXUWFJFHSA-N 2 1 347.506 4.396 20 0 EIADMP CC(C)[N@H+](CCCCCO)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168060700 1029494535 /nfs/dbraw/zinc/49/45/35/1029494535.db2.gz XSYIYRAVDYZUOI-WOJBJXKFSA-N 2 1 346.559 4.301 20 0 EIADMP CC(C)[N@@H+](CCCCCO)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168060700 1029494543 /nfs/dbraw/zinc/49/45/43/1029494543.db2.gz XSYIYRAVDYZUOI-WOJBJXKFSA-N 2 1 346.559 4.301 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCOC(C)(C)C ZINC000475335710 1029549461 /nfs/dbraw/zinc/54/94/61/1029549461.db2.gz SEHXHDOTZXENLO-AZUAARDMSA-N 2 1 332.532 4.082 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCOC(C)(C)C ZINC000475335710 1029549467 /nfs/dbraw/zinc/54/94/67/1029549467.db2.gz SEHXHDOTZXENLO-AZUAARDMSA-N 2 1 332.532 4.082 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCCOC(C)(C)C ZINC000475335712 1029549933 /nfs/dbraw/zinc/54/99/33/1029549933.db2.gz SEHXHDOTZXENLO-ICSRJNTNSA-N 2 1 332.532 4.082 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCCOC(C)(C)C ZINC000475335712 1029549941 /nfs/dbraw/zinc/54/99/41/1029549941.db2.gz SEHXHDOTZXENLO-ICSRJNTNSA-N 2 1 332.532 4.082 20 0 EIADMP C[C@@H]([NH2+]CCCN(C)Cc1ccccc1)c1ccc(C(F)F)nc1 ZINC000657823251 1029577029 /nfs/dbraw/zinc/57/70/29/1029577029.db2.gz COFPYGBUVYHAFN-OAHLLOKOSA-N 2 1 333.426 4.192 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1ccc(C(F)F)nc1 ZINC000657823251 1029577042 /nfs/dbraw/zinc/57/70/42/1029577042.db2.gz COFPYGBUVYHAFN-OAHLLOKOSA-N 2 1 333.426 4.192 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccc(C(F)F)nc1 ZINC000657823251 1029577049 /nfs/dbraw/zinc/57/70/49/1029577049.db2.gz COFPYGBUVYHAFN-OAHLLOKOSA-N 2 1 333.426 4.192 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cc2ccccc2s1 ZINC000446817221 1029580443 /nfs/dbraw/zinc/58/04/43/1029580443.db2.gz GYDWWPGMKKJUJB-IXDOHACOSA-N 2 1 346.540 4.441 20 0 EIADMP C[C@@H]([N@@H+](C)Cc1cncc(C[NH+](C)[C@@H](C)C2(C)CC2)c1)C1(C)CC1 ZINC000584094448 1029613266 /nfs/dbraw/zinc/61/32/66/1029613266.db2.gz PTPUIXZKJKSSLE-CALCHBBNSA-N 2 1 329.532 4.322 20 0 EIADMP C[C@@H]([NH+](C)Cc1cncc(C[N@H+](C)[C@@H](C)C2(C)CC2)c1)C1(C)CC1 ZINC000584094448 1029613270 /nfs/dbraw/zinc/61/32/70/1029613270.db2.gz PTPUIXZKJKSSLE-CALCHBBNSA-N 2 1 329.532 4.322 20 0 EIADMP C[C@@H]([NH+](C)Cc1cncc(C[N@@H+](C)[C@@H](C)C2(C)CC2)c1)C1(C)CC1 ZINC000584094448 1029613276 /nfs/dbraw/zinc/61/32/76/1029613276.db2.gz PTPUIXZKJKSSLE-CALCHBBNSA-N 2 1 329.532 4.322 20 0 EIADMP COC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000347319982 1029619176 /nfs/dbraw/zinc/61/91/76/1029619176.db2.gz JGINQJRPRMRSIJ-UTKZUKDTSA-N 2 1 349.478 4.089 20 0 EIADMP Cc1cccc(C[NH+]2CCC(N[C@H](C)c3cnn(C(C)C)c3)CC2)c1 ZINC000159355883 1029700991 /nfs/dbraw/zinc/70/09/91/1029700991.db2.gz HRQWCPURFIUKJN-GOSISDBHSA-N 2 1 340.515 4.088 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNCc1ccc(Cl)cc1F ZINC000708519309 1029743102 /nfs/dbraw/zinc/74/31/02/1029743102.db2.gz HNRPWTURFWUPRO-YJBOKZPZSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)cc1F ZINC000708519309 1029743109 /nfs/dbraw/zinc/74/31/09/1029743109.db2.gz HNRPWTURFWUPRO-YJBOKZPZSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)cc1F ZINC000708519309 1029743113 /nfs/dbraw/zinc/74/31/13/1029743113.db2.gz HNRPWTURFWUPRO-YJBOKZPZSA-N 2 1 346.877 4.337 20 0 EIADMP Cc1cc(N2CCC(Nc3cc(C)[nH+]c4ccccc34)CC2)nc(C)[nH+]1 ZINC000301508714 1029746918 /nfs/dbraw/zinc/74/69/18/1029746918.db2.gz ABCCSYOKYRFULQ-UHFFFAOYSA-N 2 1 347.466 4.031 20 0 EIADMP C[N@H+]1CC[C@@H](C[NH2+]C/C=C/c2ccc(F)c(F)c2)[C@H]1c1cccs1 ZINC000375751957 1029859894 /nfs/dbraw/zinc/85/98/94/1029859894.db2.gz YWUBBPJFJMGRDR-WKSODWKVSA-N 2 1 348.462 4.322 20 0 EIADMP C[C@@H](C[N@H+]1CCC[C@H](c2ncc[nH]2)C1)c1cccc(Br)c1 ZINC000092073653 1029899093 /nfs/dbraw/zinc/89/90/93/1029899093.db2.gz HSOJHHPLCPHDLW-ZFWWWQNUSA-N 2 1 348.288 4.155 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)o1 ZINC000092071840 1029899578 /nfs/dbraw/zinc/89/95/78/1029899578.db2.gz WRPQTTZCAISSLK-OAHLLOKOSA-N 2 1 339.414 4.497 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000525786792 1030004086 /nfs/dbraw/zinc/00/40/86/1030004086.db2.gz OGDVIPIGJGNITI-HUUCEWRRSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000525786792 1030004115 /nfs/dbraw/zinc/00/41/15/1030004115.db2.gz OGDVIPIGJGNITI-HUUCEWRRSA-N 2 1 342.405 4.064 20 0 EIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccc(Cl)c2cccnc12 ZINC000525783783 1030016669 /nfs/dbraw/zinc/01/66/69/1030016669.db2.gz OSPBEGWBHKDXRO-MRXNPFEDSA-N 2 1 331.891 4.194 20 0 EIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccc(Cl)c2cccnc12 ZINC000525783783 1030016693 /nfs/dbraw/zinc/01/66/93/1030016693.db2.gz OSPBEGWBHKDXRO-MRXNPFEDSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1ccc(Cl)c2cccnc12 ZINC000525783783 1030016714 /nfs/dbraw/zinc/01/67/14/1030016714.db2.gz OSPBEGWBHKDXRO-MRXNPFEDSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1ccc(Cl)c2cccnc12 ZINC000525783783 1030016740 /nfs/dbraw/zinc/01/67/40/1030016740.db2.gz OSPBEGWBHKDXRO-MRXNPFEDSA-N 2 1 331.891 4.194 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390682496 1030035707 /nfs/dbraw/zinc/03/57/07/1030035707.db2.gz WINOUGHSAKZNHW-RXVVDRJESA-N 2 1 340.511 4.491 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390682496 1030035724 /nfs/dbraw/zinc/03/57/24/1030035724.db2.gz WINOUGHSAKZNHW-RXVVDRJESA-N 2 1 340.511 4.491 20 0 EIADMP Fc1ccc(C[C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000447536257 1030142363 /nfs/dbraw/zinc/14/23/63/1030142363.db2.gz LZPUEEIWBHOTNO-GCJKJVERSA-N 2 1 338.470 4.183 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2c(Cl)cccc2Cl)CCC1 ZINC000447571372 1030156770 /nfs/dbraw/zinc/15/67/70/1030156770.db2.gz XXIAANBZCJNINZ-BBRMVZONSA-N 2 1 341.326 4.345 20 0 EIADMP Fc1ccc(C[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000447560908 1030167034 /nfs/dbraw/zinc/16/70/34/1030167034.db2.gz GDIRCYTUHRQVBV-QFIPXVFZSA-N 2 1 338.470 4.326 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@H]2C)o1 ZINC000685470258 1030350856 /nfs/dbraw/zinc/35/08/56/1030350856.db2.gz BYSVLDNMPCHONK-BEFAXECRSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@H]2C)o1 ZINC000685470258 1030350871 /nfs/dbraw/zinc/35/08/71/1030350871.db2.gz BYSVLDNMPCHONK-BEFAXECRSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)o1 ZINC000685470258 1030350888 /nfs/dbraw/zinc/35/08/88/1030350888.db2.gz BYSVLDNMPCHONK-BEFAXECRSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)o1 ZINC000685470258 1030350907 /nfs/dbraw/zinc/35/09/07/1030350907.db2.gz BYSVLDNMPCHONK-BEFAXECRSA-N 2 1 330.447 4.166 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1 ZINC000447812582 1030354124 /nfs/dbraw/zinc/35/41/24/1030354124.db2.gz MPZJJEGKZASVRN-ROUUACIJSA-N 2 1 328.525 4.353 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1 ZINC000447812582 1030354151 /nfs/dbraw/zinc/35/41/51/1030354151.db2.gz MPZJJEGKZASVRN-ROUUACIJSA-N 2 1 328.525 4.353 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]CC2(F)CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000526989031 1030385210 /nfs/dbraw/zinc/38/52/10/1030385210.db2.gz PLZBWFSPKBIQFY-HOCLYGCPSA-N 2 1 344.396 4.180 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]CC2(F)CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000526989031 1030385224 /nfs/dbraw/zinc/38/52/24/1030385224.db2.gz PLZBWFSPKBIQFY-HOCLYGCPSA-N 2 1 344.396 4.180 20 0 EIADMP CCOC1CCC([NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000657904429 1030437199 /nfs/dbraw/zinc/43/71/99/1030437199.db2.gz SAFGSMCRPDUAEE-IJNIYJAUSA-N 2 1 327.472 4.179 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)c1cccc(CO)c1 ZINC000121857226 1030462854 /nfs/dbraw/zinc/46/28/54/1030462854.db2.gz GHVJHCXJVAJRRL-MSOLQXFVSA-N 2 1 338.495 4.055 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cscc2C(F)(F)F)C1 ZINC000685612953 1030574596 /nfs/dbraw/zinc/57/45/96/1030574596.db2.gz KPKXMVMKUWTVPN-ZDUSSCGKSA-N 2 1 334.451 4.369 20 0 EIADMP COc1ccc([C@@H]([NH2+]C[C@H](C)C[NH+]2CCCC2)c2ccccc2)cc1 ZINC000392937736 1030584679 /nfs/dbraw/zinc/58/46/79/1030584679.db2.gz JGRDGRRDEPJOMU-AVRDEDQJSA-N 2 1 338.495 4.106 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3ccncc3s2)C1 ZINC000657932151 1030637461 /nfs/dbraw/zinc/63/74/61/1030637461.db2.gz UQPQMHBWDDNADY-HOTGVXAUSA-N 2 1 331.529 4.315 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000685665177 1030664948 /nfs/dbraw/zinc/66/49/48/1030664948.db2.gz HDQIYFLOXYCNAU-VQIMIIECSA-N 2 1 343.540 4.404 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000685665177 1030664963 /nfs/dbraw/zinc/66/49/63/1030664963.db2.gz HDQIYFLOXYCNAU-VQIMIIECSA-N 2 1 343.540 4.404 20 0 EIADMP Cc1nccn1CCCC[N@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000451878311 1030757502 /nfs/dbraw/zinc/75/75/02/1030757502.db2.gz MJVXPJVWZFUZCY-IBGZPJMESA-N 2 1 337.471 4.075 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000451878311 1030757548 /nfs/dbraw/zinc/75/75/48/1030757548.db2.gz MJVXPJVWZFUZCY-IBGZPJMESA-N 2 1 337.471 4.075 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657998975 1030770192 /nfs/dbraw/zinc/77/01/92/1030770192.db2.gz QHTMWQXWFPMAPL-SJLPKXTDSA-N 2 1 335.451 4.001 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657998975 1030770218 /nfs/dbraw/zinc/77/02/18/1030770218.db2.gz QHTMWQXWFPMAPL-SJLPKXTDSA-N 2 1 335.451 4.001 20 0 EIADMP CC[C@@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000658090005 1030818996 /nfs/dbraw/zinc/81/89/96/1030818996.db2.gz DKRBQKAOCCYZII-KXBFYZLASA-N 2 1 327.472 4.037 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2cccc3cc[nH]c32)CC1 ZINC000237732946 1030861940 /nfs/dbraw/zinc/86/19/40/1030861940.db2.gz GKLHQJSNOKJNGH-UHFFFAOYSA-N 2 1 333.479 4.231 20 0 EIADMP Oc1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CC2 ZINC000658240088 1030898764 /nfs/dbraw/zinc/89/87/64/1030898764.db2.gz XSYQYZFFSBKZDS-GJPOJAMWSA-N 2 1 348.490 4.165 20 0 EIADMP Oc1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3Cc1ccccc1)CC2 ZINC000658240088 1030898765 /nfs/dbraw/zinc/89/87/65/1030898765.db2.gz XSYQYZFFSBKZDS-GJPOJAMWSA-N 2 1 348.490 4.165 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCOc2cccc3ccccc32)C[C@H]1C ZINC000531140874 1030912513 /nfs/dbraw/zinc/91/25/13/1030912513.db2.gz MCHAGDIHZULHQR-IEBWSBKVSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCOc2cccc3ccccc32)C[C@H]1C ZINC000531140874 1030912532 /nfs/dbraw/zinc/91/25/32/1030912532.db2.gz MCHAGDIHZULHQR-IEBWSBKVSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCOc2cccc3ccccc32)C[C@H]1C ZINC000531140874 1030912552 /nfs/dbraw/zinc/91/25/52/1030912552.db2.gz MCHAGDIHZULHQR-IEBWSBKVSA-N 2 1 326.484 4.023 20 0 EIADMP COc1cccc(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000531188849 1030954610 /nfs/dbraw/zinc/95/46/10/1030954610.db2.gz NHTAQWYUPAQRTH-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000531188849 1030954615 /nfs/dbraw/zinc/95/46/15/1030954615.db2.gz NHTAQWYUPAQRTH-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000531188849 1030954625 /nfs/dbraw/zinc/95/46/25/1030954625.db2.gz NHTAQWYUPAQRTH-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000531188849 1030954630 /nfs/dbraw/zinc/95/46/30/1030954630.db2.gz NHTAQWYUPAQRTH-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP Brc1ccc(/C=C\CC[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000527930537 1030971551 /nfs/dbraw/zinc/97/15/51/1030971551.db2.gz KBCNAWBBQCFFSA-IWQZZHSRSA-N 2 1 349.316 4.069 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658320001 1030978244 /nfs/dbraw/zinc/97/82/44/1030978244.db2.gz LPPXBLLDTCDEFJ-FPOVZHCZSA-N 2 1 349.522 4.343 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cncs1 ZINC000658319530 1030980844 /nfs/dbraw/zinc/98/08/44/1030980844.db2.gz FYEQZJAXPOQXRL-AEFFLSMTSA-N 2 1 341.524 4.096 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCC1 ZINC000340306993 1031205640 /nfs/dbraw/zinc/20/56/40/1031205640.db2.gz WDZYUMRCPRISIP-WOJBJXKFSA-N 2 1 330.516 4.008 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCC1 ZINC000340306993 1031205660 /nfs/dbraw/zinc/20/56/60/1031205660.db2.gz WDZYUMRCPRISIP-WOJBJXKFSA-N 2 1 330.516 4.008 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000532506785 1031230167 /nfs/dbraw/zinc/23/01/67/1031230167.db2.gz FXUMAODPFZMWOV-ZIFCJYIRSA-N 2 1 332.557 4.410 20 0 EIADMP CN(C)[C@@H](C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1ccco1 ZINC000449059449 1031388857 /nfs/dbraw/zinc/38/88/57/1031388857.db2.gz ATGVVBXCBUHTHZ-SFHVURJKSA-N 2 1 349.563 4.151 20 0 EIADMP C[NH+](C)[C@@H](CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1ccco1 ZINC000449059449 1031388880 /nfs/dbraw/zinc/38/88/80/1031388880.db2.gz ATGVVBXCBUHTHZ-SFHVURJKSA-N 2 1 349.563 4.151 20 0 EIADMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cnn1C ZINC000449071907 1031427082 /nfs/dbraw/zinc/42/70/82/1031427082.db2.gz CKEJWCUKNCKYQJ-OAHLLOKOSA-N 2 1 334.552 4.058 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCOC3(CCC3)C2)C1 ZINC000449082169 1031436676 /nfs/dbraw/zinc/43/66/76/1031436676.db2.gz LFFHJTMAZISQNL-RXVVDRJESA-N 2 1 342.527 4.110 20 0 EIADMP Cc1cnc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)s1 ZINC000449083502 1031437228 /nfs/dbraw/zinc/43/72/28/1031437228.db2.gz UJUHEIBBUFJMHN-HOTGVXAUSA-N 2 1 343.540 4.219 20 0 EIADMP c1csc([C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C2CC2)c1 ZINC000531689536 1031459653 /nfs/dbraw/zinc/45/96/53/1031459653.db2.gz DPYMXCUODKPSNT-OAQYLSRUSA-N 2 1 340.536 4.496 20 0 EIADMP COc1cc2ccccc2cc1C[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000449133525 1031466229 /nfs/dbraw/zinc/46/62/29/1031466229.db2.gz YTCHCNCTALUZTC-KRWDZBQOSA-N 2 1 326.484 4.058 20 0 EIADMP COc1cc2ccccc2cc1C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000449133525 1031466246 /nfs/dbraw/zinc/46/62/46/1031466246.db2.gz YTCHCNCTALUZTC-KRWDZBQOSA-N 2 1 326.484 4.058 20 0 EIADMP COc1cccc2c(C[NH2+]C[C@H]3CCC[N@H+](C(C)C)C3)cccc12 ZINC000449133311 1031469878 /nfs/dbraw/zinc/46/98/78/1031469878.db2.gz XXYBMWXJHQAYMA-QGZVFWFLSA-N 2 1 326.484 4.058 20 0 EIADMP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000531678113 1031471263 /nfs/dbraw/zinc/47/12/63/1031471263.db2.gz VRROQNAPIHJLCV-AOMKIAJQSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@H](Cc1ccoc1)[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000449157071 1031488420 /nfs/dbraw/zinc/48/84/20/1031488420.db2.gz FTWIANXPTUIMGD-QGZVFWFLSA-N 2 1 338.451 4.225 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(C)cc1)c1ccccn1 ZINC000375917467 1031507316 /nfs/dbraw/zinc/50/73/16/1031507316.db2.gz BJEKOFWKDKZISS-OAQYLSRUSA-N 2 1 334.467 4.054 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000531738281 1031515928 /nfs/dbraw/zinc/51/59/28/1031515928.db2.gz FUHJTXZAAOBUOM-IIYDPXPESA-N 2 1 329.315 4.244 20 0 EIADMP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H](c2cccnc2)C2CC2)CC1 ZINC000449202809 1031545740 /nfs/dbraw/zinc/54/57/40/1031545740.db2.gz GRKCEVGKIMDXDF-JPYJTQIMSA-N 2 1 349.522 4.218 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccsc1 ZINC000453085615 1031575942 /nfs/dbraw/zinc/57/59/42/1031575942.db2.gz OVVZZNACMJUBBA-FQEVSTJZSA-N 2 1 328.525 4.496 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccncc1 ZINC000453116541 1031606936 /nfs/dbraw/zinc/60/69/36/1031606936.db2.gz HRQXXIQHTXNLLN-ZIFCJYIRSA-N 2 1 329.513 4.267 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)c1ccncc1 ZINC000453116541 1031606942 /nfs/dbraw/zinc/60/69/42/1031606942.db2.gz HRQXXIQHTXNLLN-ZIFCJYIRSA-N 2 1 329.513 4.267 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453122745 1031616061 /nfs/dbraw/zinc/61/60/61/1031616061.db2.gz PKDYFHQYRJQBTC-KURKYZTESA-N 2 1 340.433 4.362 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)cc1 ZINC000449481588 1031777901 /nfs/dbraw/zinc/77/79/01/1031777901.db2.gz ULGWEGZTEHLURS-WMZOPIPTSA-N 2 1 339.483 4.181 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCCC2(F)F)CC1 ZINC000453317176 1031844239 /nfs/dbraw/zinc/84/42/39/1031844239.db2.gz JNDUPHDVMAWPPT-VIQWUECVSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cccc(COc2ccccc2)c1 ZINC000531939385 1031850934 /nfs/dbraw/zinc/85/09/34/1031850934.db2.gz DMTRBAVYMWBLFY-FGSXEWAUSA-N 2 1 338.495 4.084 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)C1CCOCC1 ZINC000531947151 1031859126 /nfs/dbraw/zinc/85/91/26/1031859126.db2.gz HNGSHGJGTZTUDG-GCJKJVERSA-N 2 1 344.543 4.213 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000459345054 1031869732 /nfs/dbraw/zinc/86/97/32/1031869732.db2.gz JAPPZKJNUQIVPG-SFHVURJKSA-N 2 1 338.495 4.054 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[N@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000459345054 1031869738 /nfs/dbraw/zinc/86/97/38/1031869738.db2.gz JAPPZKJNUQIVPG-SFHVURJKSA-N 2 1 338.495 4.054 20 0 EIADMP CC(C)CCOc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000453349731 1031876556 /nfs/dbraw/zinc/87/65/56/1031876556.db2.gz LWPZXBKNKPUGJH-VOBGVNJCSA-N 2 1 330.516 4.387 20 0 EIADMP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1F ZINC000453359690 1031888831 /nfs/dbraw/zinc/88/88/31/1031888831.db2.gz QFNHWAAPNACHMS-OQVRHKMJSA-N 2 1 346.490 4.075 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cccc(Br)c21 ZINC000453366824 1031908257 /nfs/dbraw/zinc/90/82/57/1031908257.db2.gz SWLNWJYQITZZPD-XRBJRZNLSA-N 2 1 349.316 4.212 20 0 EIADMP C[C@H]1C[C@H](NCc2ccc(Oc3ccccc3F)c(F)c2)CC[N@H+]1C ZINC000531980816 1031926495 /nfs/dbraw/zinc/92/64/95/1031926495.db2.gz SJRBQFYSZUUVNW-GOEBONIOSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CCN1C ZINC000531980816 1031926499 /nfs/dbraw/zinc/92/64/99/1031926499.db2.gz SJRBQFYSZUUVNW-GOEBONIOSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CC[N@@H+]1C ZINC000531980816 1031926510 /nfs/dbraw/zinc/92/65/10/1031926510.db2.gz SJRBQFYSZUUVNW-GOEBONIOSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CC[N@H+]1C ZINC000531980816 1031926519 /nfs/dbraw/zinc/92/65/19/1031926519.db2.gz SJRBQFYSZUUVNW-GOEBONIOSA-N 2 1 346.421 4.329 20 0 EIADMP COc1ccc(C2CCC([NH2+]CCCC[N@@H+](C)C3CC3)CC2)cc1 ZINC000453403752 1031938321 /nfs/dbraw/zinc/93/83/21/1031938321.db2.gz OSIHSDDDYUNJFU-UHFFFAOYSA-N 2 1 330.516 4.185 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1 ZINC000237339123 1032020060 /nfs/dbraw/zinc/02/00/60/1032020060.db2.gz HCAYUFYNUGFFAB-KRWDZBQOSA-N 2 1 349.478 4.293 20 0 EIADMP CCc1ccc(C[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)nc1 ZINC000549866456 1033488520 /nfs/dbraw/zinc/48/85/20/1033488520.db2.gz XNIPHBHOTAENEA-XMSQKQJNSA-N 2 1 337.511 4.129 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000512772674 1033904004 /nfs/dbraw/zinc/90/40/04/1033904004.db2.gz CWTVGMGTGQYLTH-HXUWFJFHSA-N 2 1 347.462 4.465 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2csc(-c3ccco3)n2)CC1 ZINC000052209830 1034478779 /nfs/dbraw/zinc/47/87/79/1034478779.db2.gz XRQAFBNECMWTGU-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2csc(-c3ccco3)n2)CC1 ZINC000052209830 1034478783 /nfs/dbraw/zinc/47/87/83/1034478783.db2.gz XRQAFBNECMWTGU-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP COc1ccccc1C[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513500092 1034995442 /nfs/dbraw/zinc/99/54/42/1034995442.db2.gz KMYKOPSBVDGDAS-UYAOXDASSA-N 2 1 338.495 4.086 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cc(C(F)(F)F)ccc1Cl ZINC000513500734 1034997610 /nfs/dbraw/zinc/99/76/10/1034997610.db2.gz OBYQTYHKPAOLMH-LLVKDONJSA-N 2 1 345.796 4.290 20 0 EIADMP CCc1ncc(C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)s1 ZINC000513500611 1034998178 /nfs/dbraw/zinc/99/81/78/1034998178.db2.gz NMKKXRFBVBDCFV-AEFFLSMTSA-N 2 1 343.540 4.096 20 0 EIADMP COc1ccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000513513009 1035008190 /nfs/dbraw/zinc/00/81/90/1035008190.db2.gz QZNFYGCYPMSIMR-NQIIRXRSSA-N 2 1 338.495 4.086 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]C4CCSCC4)[C@@H]3C2)cc1 ZINC000513683639 1035100837 /nfs/dbraw/zinc/10/08/37/1035100837.db2.gz LUBPYKMVIWMFOB-TYPHKJRUSA-N 2 1 344.568 4.162 20 0 EIADMP C[C@H](c1nc2ccccc2n1C(F)F)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000345694438 1035281968 /nfs/dbraw/zinc/28/19/68/1035281968.db2.gz KLEWDFIPKYKBBT-GFCCVEGCSA-N 2 1 345.397 4.095 20 0 EIADMP Cc1cccc(CCC[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000501019802 1035350737 /nfs/dbraw/zinc/35/07/37/1035350737.db2.gz ABKYCKKMZUKQKI-UHFFFAOYSA-N 2 1 337.511 4.171 20 0 EIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501417428 1035437516 /nfs/dbraw/zinc/43/75/16/1035437516.db2.gz AYCWEIYDUWCEIA-QWFCFKBJSA-N 2 1 329.532 4.208 20 0 EIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501417428 1035437518 /nfs/dbraw/zinc/43/75/18/1035437518.db2.gz AYCWEIYDUWCEIA-QWFCFKBJSA-N 2 1 329.532 4.208 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000501419090 1035440189 /nfs/dbraw/zinc/44/01/89/1035440189.db2.gz FQNARMIUJUEDCK-WYMLVPIESA-N 2 1 338.417 4.325 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420326869 1035530219 /nfs/dbraw/zinc/53/02/19/1035530219.db2.gz XSWMONHUSDQKKZ-SJORKVTESA-N 2 1 343.540 4.419 20 0 EIADMP Cc1c(Cl)c(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)nc2ccccc12 ZINC000420413041 1035572911 /nfs/dbraw/zinc/57/29/11/1035572911.db2.gz ZKTGYKCENZBJNV-KXBFYZLASA-N 2 1 343.902 4.161 20 0 EIADMP Cc1c(Cl)c(C[N@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)nc2ccccc12 ZINC000420413041 1035572937 /nfs/dbraw/zinc/57/29/37/1035572937.db2.gz ZKTGYKCENZBJNV-KXBFYZLASA-N 2 1 343.902 4.161 20 0 EIADMP C[NH+](C)CCCC1CC[NH+](Cc2csc(Br)c2)CC1 ZINC000501774935 1035583125 /nfs/dbraw/zinc/58/31/25/1035583125.db2.gz LQQBTUWHMSDIJQ-UHFFFAOYSA-N 2 1 345.350 4.064 20 0 EIADMP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)CC3 ZINC000491043100 1035794349 /nfs/dbraw/zinc/79/43/49/1035794349.db2.gz YZIYFYSDOWEDAL-ZWKOTPCHSA-N 2 1 339.527 4.044 20 0 EIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C2)c(C)c1 ZINC000629561697 1035826613 /nfs/dbraw/zinc/82/66/13/1035826613.db2.gz KKJWUZKTAKQDHN-HRCADAONSA-N 2 1 328.422 4.132 20 0 EIADMP Cc1ccc(N2CCC([NH2+]Cc3ccc(C)c(Cl)c3)CC2)[nH+]c1 ZINC000195444441 1035853567 /nfs/dbraw/zinc/85/35/67/1035853567.db2.gz NPUSORDVQKRNGE-UHFFFAOYSA-N 2 1 329.875 4.110 20 0 EIADMP Fc1ccccc1C[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000485480909 1035944891 /nfs/dbraw/zinc/94/48/91/1035944891.db2.gz ZLVRHAPOSSBUAV-UHFFFAOYSA-N 2 1 338.470 4.314 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000502285033 1036040862 /nfs/dbraw/zinc/04/08/62/1036040862.db2.gz SWPJOXCVANDCNI-QZFKAFNDSA-N 2 1 340.433 4.382 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000502285033 1036040884 /nfs/dbraw/zinc/04/08/84/1036040884.db2.gz SWPJOXCVANDCNI-QZFKAFNDSA-N 2 1 340.433 4.382 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000502285033 1036040906 /nfs/dbraw/zinc/04/09/06/1036040906.db2.gz SWPJOXCVANDCNI-QZFKAFNDSA-N 2 1 340.433 4.382 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000502285033 1036040931 /nfs/dbraw/zinc/04/09/31/1036040931.db2.gz SWPJOXCVANDCNI-QZFKAFNDSA-N 2 1 340.433 4.382 20 0 EIADMP CC[C@H](NCc1nc2c(s1)C[N@H+](C(C)C)CC2)c1ccccc1 ZINC000414497288 1036044023 /nfs/dbraw/zinc/04/40/23/1036044023.db2.gz SJZNJGNPWQTXMA-INIZCTEOSA-N 2 1 329.513 4.151 20 0 EIADMP CC[N@H+]1CCC[C@@H]1CN[C@@H](C)c1ccc(SC(F)F)c(OC)c1 ZINC000156592832 1036051106 /nfs/dbraw/zinc/05/11/06/1036051106.db2.gz QJSDZLJIIJPCDX-GXTWGEPZSA-N 2 1 344.471 4.145 20 0 EIADMP C[C@H]([NH2+]C1(C[NH2+][C@H]2C[C@@H](C)O[C@@H](C)C2)CCCC1)c1ccccc1 ZINC000571492437 1036056869 /nfs/dbraw/zinc/05/68/69/1036056869.db2.gz XOSHOUYOPBKZCY-HLNWXESRSA-N 2 1 330.516 4.196 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@@H+](C)CC2CC[NH+](C)CC2)o1 ZINC000513741038 1036057719 /nfs/dbraw/zinc/05/77/19/1036057719.db2.gz DGWJDPIBTSRAKY-UHFFFAOYSA-N 2 1 330.447 4.168 20 0 EIADMP FC(F)C1CCC([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000669614285 1036243831 /nfs/dbraw/zinc/24/38/31/1036243831.db2.gz ZGNMGWXMSNSPFP-VIQWUECVSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cnn(C2CCCC2)c1 ZINC000502475092 1036252963 /nfs/dbraw/zinc/25/29/63/1036252963.db2.gz VDSRDTXLLKEMEM-KRWDZBQOSA-N 2 1 344.547 4.446 20 0 EIADMP Cc1cc(N(C)C[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)c2ccccc2[nH+]1 ZINC000486002176 1036416862 /nfs/dbraw/zinc/41/68/62/1036416862.db2.gz JDSIUOKJWWLKQU-AVRDEDQJSA-N 2 1 346.478 4.067 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2ccc(F)cc2F)CCCC1 ZINC000486079830 1036465586 /nfs/dbraw/zinc/46/55/86/1036465586.db2.gz QGLMYQLUFRVJFR-ZRGWGRIASA-N 2 1 336.470 4.095 20 0 EIADMP CCc1cccc2c(C3CC[NH+](CC[C@H]4CCC[N@H+]4C)CC3)c[nH]c21 ZINC000502690548 1036486009 /nfs/dbraw/zinc/48/60/09/1036486009.db2.gz VCMZQHYAALZGDH-LJQANCHMSA-N 2 1 339.527 4.394 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000502696049 1036513649 /nfs/dbraw/zinc/51/36/49/1036513649.db2.gz BMJSLHZGLUHBPA-YUXAGFNASA-N 2 1 344.543 4.213 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000502725581 1036582453 /nfs/dbraw/zinc/58/24/53/1036582453.db2.gz XUVKLZSTDGHCGE-CNNODRBYSA-N 2 1 344.543 4.213 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000502723871 1036587666 /nfs/dbraw/zinc/58/76/66/1036587666.db2.gz RZINJQFLCBFOSQ-XQBPLPMBSA-N 2 1 344.543 4.356 20 0 EIADMP CC(C)c1ncc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000486565878 1036770388 /nfs/dbraw/zinc/77/03/88/1036770388.db2.gz NIVSOSPRXLQRMF-AEFFLSMTSA-N 2 1 343.540 4.267 20 0 EIADMP CC(C)c1ncc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000486565878 1036770408 /nfs/dbraw/zinc/77/04/08/1036770408.db2.gz NIVSOSPRXLQRMF-AEFFLSMTSA-N 2 1 343.540 4.267 20 0 EIADMP c1ccc(CC[C@H]2CCC[N@H+](C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC001168395181 1036881723 /nfs/dbraw/zinc/88/17/23/1036881723.db2.gz PGHKRSPUAWGNJU-HXUWFJFHSA-N 2 1 326.528 4.206 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]C[C@H]3C[C@H]3c3ccccc3)C2)c1 ZINC000503046894 1036884848 /nfs/dbraw/zinc/88/48/48/1036884848.db2.gz SMMJDHSDZHQSOO-DSKINZAPSA-N 2 1 340.536 4.353 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]C[C@H]3C[C@H]3c3ccccc3)C2)c1 ZINC000503046894 1036884849 /nfs/dbraw/zinc/88/48/49/1036884849.db2.gz SMMJDHSDZHQSOO-DSKINZAPSA-N 2 1 340.536 4.353 20 0 EIADMP CCOc1ccc(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)cc1F ZINC000486962090 1036921463 /nfs/dbraw/zinc/92/14/63/1036921463.db2.gz CMUMPEBXECDNMS-UHFFFAOYSA-N 2 1 344.474 4.354 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000272298752 1037152899 /nfs/dbraw/zinc/15/28/99/1037152899.db2.gz GNLATBODLQRPQL-CMKODMSKSA-N 2 1 340.515 4.025 20 0 EIADMP Cc1ccc(-c2nc(C[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)cs2)o1 ZINC000590786375 1037168060 /nfs/dbraw/zinc/16/80/60/1037168060.db2.gz UOAMLGJEUJFTKX-UHFFFAOYSA-N 2 1 347.528 4.264 20 0 EIADMP Cc1ccc(-c2nc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)cs2)o1 ZINC000590786375 1037168071 /nfs/dbraw/zinc/16/80/71/1037168071.db2.gz UOAMLGJEUJFTKX-UHFFFAOYSA-N 2 1 347.528 4.264 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=[NH2+])Nc2ccccc2)C1 ZINC000057887186 1037288318 /nfs/dbraw/zinc/28/83/18/1037288318.db2.gz UJXKHDAUKSJDSQ-QGZVFWFLSA-N 2 1 336.483 4.055 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccnc(Cl)c2)CC1 ZINC000171384277 1037365750 /nfs/dbraw/zinc/36/57/50/1037365750.db2.gz JINLNWGAZOTIIC-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CS[C@H](C(C)(C)C)C1 ZINC000488423513 1037574637 /nfs/dbraw/zinc/57/46/37/1037574637.db2.gz AZEDIPMECBQYMP-LMCOJAPRSA-N 2 1 346.584 4.407 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CS[C@H](C(C)(C)C)C1 ZINC000488423513 1037574639 /nfs/dbraw/zinc/57/46/39/1037574639.db2.gz AZEDIPMECBQYMP-LMCOJAPRSA-N 2 1 346.584 4.407 20 0 EIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC000488423315 1037578758 /nfs/dbraw/zinc/57/87/58/1037578758.db2.gz WMNRYTSGQLCEHA-MOPGFXCFSA-N 2 1 332.557 4.161 20 0 EIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CS1 ZINC000488434579 1037591817 /nfs/dbraw/zinc/59/18/17/1037591817.db2.gz JEAZSXIEQXQFOE-UFYCRDLUSA-N 2 1 346.584 4.061 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CS[C@@H](C(C)(C)C)C2)CC1 ZINC000488454057 1037598398 /nfs/dbraw/zinc/59/83/98/1037598398.db2.gz XZZICNOQJLPSPN-WOJBJXKFSA-N 2 1 346.584 4.469 20 0 EIADMP COCCSc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422709441 1037804564 /nfs/dbraw/zinc/80/45/64/1037804564.db2.gz DISJIJVJKZJDCL-VHKYSDTDSA-N 2 1 342.508 4.221 20 0 EIADMP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C1CCN([C@@H](C)c2ccccc2)CC1 ZINC000422740254 1037821626 /nfs/dbraw/zinc/82/16/26/1037821626.db2.gz BJZHZMNFODVQQN-XQBPLPMBSA-N 2 1 343.559 4.112 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414690884 1037832130 /nfs/dbraw/zinc/83/21/30/1037832130.db2.gz AXIFKXRPEDTUOG-PVAVHDDUSA-N 2 1 343.540 4.499 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)ccc1OC(C)C ZINC000422814207 1037839445 /nfs/dbraw/zinc/83/94/45/1037839445.db2.gz UAWJSBIDCOMBTA-GDIGMMSISA-N 2 1 340.467 4.278 20 0 EIADMP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000422818964 1037845656 /nfs/dbraw/zinc/84/56/56/1037845656.db2.gz LULDDIQZPKLGMM-XDNAFOTISA-N 2 1 340.433 4.438 20 0 EIADMP Fc1cccc([C@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2cccc(Cl)c2)c1 ZINC000422873149 1037858750 /nfs/dbraw/zinc/85/87/50/1037858750.db2.gz KFUPLPUIQLXYQS-RTBURBONSA-N 2 1 332.850 4.300 20 0 EIADMP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c(OC(C)C)c1 ZINC000422872172 1037859283 /nfs/dbraw/zinc/85/92/83/1037859283.db2.gz GACHLMVMPALSKH-SFTDATJTSA-N 2 1 338.495 4.365 20 0 EIADMP Cc1sc(C[NH2+][C@@H]2CC[NH2+]CC[C@H]2C)nc1-c1ccc(Cl)cc1 ZINC000422936814 1037875000 /nfs/dbraw/zinc/87/50/00/1037875000.db2.gz BYWIITNKEJFSLI-MLGOLLRUSA-N 2 1 349.931 4.250 20 0 EIADMP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000423000440 1037898076 /nfs/dbraw/zinc/89/80/76/1037898076.db2.gz ZDUTZOCMFAUMBZ-MRVPVSSYSA-N 2 1 330.284 4.068 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC000423007046 1037899339 /nfs/dbraw/zinc/89/93/39/1037899339.db2.gz XCIZUZMXZAGSDI-ANEJOOLBSA-N 3 1 349.522 4.022 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2C[C@@H](N)c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC000423007046 1037899340 /nfs/dbraw/zinc/89/93/40/1037899340.db2.gz XCIZUZMXZAGSDI-ANEJOOLBSA-N 2 1 349.522 4.022 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2C[C@@H](N)c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC000423007046 1037899344 /nfs/dbraw/zinc/89/93/44/1037899344.db2.gz XCIZUZMXZAGSDI-ANEJOOLBSA-N 2 1 349.522 4.022 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CCC[N@@H+](C4CCCC4)CC3)c2c1 ZINC000606156729 1037907951 /nfs/dbraw/zinc/90/79/51/1037907951.db2.gz QTCFPLLUCRVYFX-UHFFFAOYSA-N 2 1 329.875 4.343 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CCC[N@H+](C4CCCC4)CC3)c2c1 ZINC000606156729 1037907965 /nfs/dbraw/zinc/90/79/65/1037907965.db2.gz QTCFPLLUCRVYFX-UHFFFAOYSA-N 2 1 329.875 4.343 20 0 EIADMP C[C@H](CC(F)(F)F)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574039360 1037924841 /nfs/dbraw/zinc/92/48/41/1037924841.db2.gz MTSHWUNKXFECLR-ZBFHGGJFSA-N 2 1 326.406 4.114 20 0 EIADMP C[C@H](CC(F)(F)F)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574039360 1037924856 /nfs/dbraw/zinc/92/48/56/1037924856.db2.gz MTSHWUNKXFECLR-ZBFHGGJFSA-N 2 1 326.406 4.114 20 0 EIADMP CC(C)N(C)c1ccccc1C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000423056735 1037925195 /nfs/dbraw/zinc/92/51/95/1037925195.db2.gz GDKCNPSHJOLKFX-LEWJYISDSA-N 2 1 337.511 4.114 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C1CC(c2cc(F)cc(F)c2)C1 ZINC000574199214 1037947646 /nfs/dbraw/zinc/94/76/46/1037947646.db2.gz ROVNTTFYHIBVOQ-FVWXCPNNSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)c1ccc(C(F)(F)F)cc1)c1c[nH+]ccc1N ZINC000423075931 1037961621 /nfs/dbraw/zinc/96/16/21/1037961621.db2.gz XYCJRLNUNKJBCL-LBPRGKRZSA-N 2 1 337.389 4.141 20 0 EIADMP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H](Cc2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423127489 1037972432 /nfs/dbraw/zinc/97/24/32/1037972432.db2.gz UBKOBEJXPQQDNE-ZTFGCOKTSA-N 2 1 334.385 4.142 20 0 EIADMP COCCC[C@@H](C[NH2+][C@H](C)c1c[nH+]ccc1N)c1ccc(Cl)cc1 ZINC000423108463 1037985438 /nfs/dbraw/zinc/98/54/38/1037985438.db2.gz RDOQSNXLDIRKOU-ZBFHGGJFSA-N 2 1 347.890 4.009 20 0 EIADMP C[C@H]([NH2+]CC1CCC(F)(F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000503906431 1038005703 /nfs/dbraw/zinc/00/57/03/1038005703.db2.gz ZKOOACSSMHPGAJ-QFBILLFUSA-N 2 1 336.470 4.312 20 0 EIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000423192244 1038044430 /nfs/dbraw/zinc/04/44/30/1038044430.db2.gz UYPLJPUBVKGOHG-NRFANRHFSA-N 2 1 348.494 4.018 20 0 EIADMP c1ccc(C[C@@H]([NH2+]CCC[NH2+]Cc2cccnc2)c2ccccc2)cc1 ZINC000423192418 1038046474 /nfs/dbraw/zinc/04/64/74/1038046474.db2.gz VFNINDANNAZHIY-HSZRJFAPSA-N 2 1 345.490 4.135 20 0 EIADMP Cc1cc2c(cc1C)[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)CCS2 ZINC000423193304 1038049981 /nfs/dbraw/zinc/04/99/81/1038049981.db2.gz WZKADPVJTHXAGU-IBGZPJMESA-N 2 1 341.524 4.005 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423193275 1038051535 /nfs/dbraw/zinc/05/15/35/1038051535.db2.gz WVIROEBVLKWGRJ-IBGZPJMESA-N 2 1 331.891 4.202 20 0 EIADMP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H](C[NH3+])CC(C)C)s2)cc1 ZINC000423258120 1038089626 /nfs/dbraw/zinc/08/96/26/1038089626.db2.gz BAWHBSIDHDSCKL-XJKSGUPXSA-N 2 1 347.528 4.151 20 0 EIADMP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1sc(Cc2ccccc2)nc1C ZINC000423287466 1038093070 /nfs/dbraw/zinc/09/30/70/1038093070.db2.gz MLXUJWOHFWPFQC-AWEZNQCLSA-N 2 1 331.529 4.210 20 0 EIADMP [NH3+]C[C@H]([NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1)C1CC1 ZINC000423276218 1038099065 /nfs/dbraw/zinc/09/90/65/1038099065.db2.gz MTEBAUYJQCVNCC-SEFLRBGSSA-N 2 1 326.406 4.059 20 0 EIADMP CS[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000593717199 1038136532 /nfs/dbraw/zinc/13/65/32/1038136532.db2.gz ZEHWZGGUOMCWNJ-FDKIHUSFSA-N 2 1 344.568 4.446 20 0 EIADMP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000423391349 1038199876 /nfs/dbraw/zinc/19/98/76/1038199876.db2.gz KXJLPRFOIWLNEZ-UPRAQXHNSA-N 2 1 332.850 4.156 20 0 EIADMP c1coc([C@H]2CC[NH+](CCCCC[N@H+]3CC[C@H](c4ccco4)C3)C2)c1 ZINC000607152483 1038395407 /nfs/dbraw/zinc/39/54/07/1038395407.db2.gz YNOXRAYMXQLHBM-OALUTQOASA-N 2 1 342.483 4.322 20 0 EIADMP Cc1ccc(COc2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H](C)C3)cc2)cc1 ZINC000608061371 1038444664 /nfs/dbraw/zinc/44/46/64/1038444664.db2.gz RGXOILJNFWAARJ-WIYYLYMNSA-N 2 1 338.495 4.146 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H](Cc1ccncc1)c1cccs1 ZINC000424266220 1038764756 /nfs/dbraw/zinc/76/47/56/1038764756.db2.gz WPYQMWFMOSTQSA-MJGOQNOKSA-N 2 1 343.540 4.281 20 0 EIADMP C[C@@H]1CC2(C[N@H+]1Cc1csc(C3CCCCC3)n1)CC[NH2+]CC2 ZINC000424290589 1038769808 /nfs/dbraw/zinc/76/98/08/1038769808.db2.gz MXFDIYBCDUUIPA-OAHLLOKOSA-N 2 1 333.545 4.155 20 0 EIADMP CC[N@@H+](CCC1CCN(Cc2ccn(C(C)C)n2)CC1)CC(C)C ZINC000539100130 1038838888 /nfs/dbraw/zinc/83/88/88/1038838888.db2.gz QSPKRLOKQQJERY-UHFFFAOYSA-N 2 1 334.552 4.044 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2ccn(C(C)C)n2)CC1)CC(C)C ZINC000539100130 1038838895 /nfs/dbraw/zinc/83/88/95/1038838895.db2.gz QSPKRLOKQQJERY-UHFFFAOYSA-N 2 1 334.552 4.044 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccn(C(C)C)n2)CC1)CC(C)C ZINC000539100130 1038838900 /nfs/dbraw/zinc/83/89/00/1038838900.db2.gz QSPKRLOKQQJERY-UHFFFAOYSA-N 2 1 334.552 4.044 20 0 EIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)CCN(C)C1CC[NH+](C)CC1 ZINC000539219803 1038889456 /nfs/dbraw/zinc/88/94/56/1038889456.db2.gz RPLQFWCNJZHTPT-GOSISDBHSA-N 2 1 345.575 4.003 20 0 EIADMP COc1cccc(C2(N[C@H]3CC[N@H+](C)[C@H](c4ccccc4)C3)CC2)c1 ZINC000550754224 1038899202 /nfs/dbraw/zinc/89/92/02/1038899202.db2.gz RISJLTJIYDIYOO-FPOVZHCZSA-N 2 1 336.479 4.109 20 0 EIADMP COc1cccc(C2(N[C@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)CC2)c1 ZINC000550754224 1038899203 /nfs/dbraw/zinc/89/92/03/1038899203.db2.gz RISJLTJIYDIYOO-FPOVZHCZSA-N 2 1 336.479 4.109 20 0 EIADMP CC[C@H](C)[C@H]([NH2+]C1CC[NH+](CCOC)CC1)c1ccc(Cl)cc1 ZINC000462117782 1038935072 /nfs/dbraw/zinc/93/50/72/1038935072.db2.gz CKBSXWKDUHALHY-KXBFYZLASA-N 2 1 338.923 4.128 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cccc(Br)c2)C1 ZINC000481024774 1038965728 /nfs/dbraw/zinc/96/57/28/1038965728.db2.gz NJPQJONRZQKKHC-PBHICJAKSA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccccc2Br)C1 ZINC000481042588 1038972717 /nfs/dbraw/zinc/97/27/17/1038972717.db2.gz TUIWILSVCXFCBL-YOEHRIQHSA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccccc2Br)C1 ZINC000481042588 1038972748 /nfs/dbraw/zinc/97/27/48/1038972748.db2.gz TUIWILSVCXFCBL-YOEHRIQHSA-N 2 1 339.321 4.222 20 0 EIADMP C/C=C/COc1ccc(CC[C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000119678891 1038985480 /nfs/dbraw/zinc/98/54/80/1038985480.db2.gz NBYNAJRFZCUCNX-OAJJDEHYSA-N 2 1 342.527 4.179 20 0 EIADMP Cc1ccc(-c2nc(C[NH2+]Cc3ccc([C@@H](C)[NH3+])cc3)cs2)cc1 ZINC000414814691 1039087294 /nfs/dbraw/zinc/08/72/94/1039087294.db2.gz VYNVAYJGUQKWHA-OAHLLOKOSA-N 2 1 337.492 4.428 20 0 EIADMP Cc1cc2cc(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)ccc2[nH]1 ZINC000552091247 1039115900 /nfs/dbraw/zinc/11/59/00/1039115900.db2.gz GQGNMWWZRNWRSJ-UHFFFAOYSA-N 2 1 347.506 4.273 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc(F)c(F)c2F)C[C@@H]1c1ccccc1 ZINC000550780551 1039128733 /nfs/dbraw/zinc/12/87/33/1039128733.db2.gz HSAPQDJNKZKVKB-FUHWJXTLSA-N 2 1 348.412 4.072 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc(F)c(F)c2F)C[C@@H]1c1ccccc1 ZINC000550780551 1039128757 /nfs/dbraw/zinc/12/87/57/1039128757.db2.gz HSAPQDJNKZKVKB-FUHWJXTLSA-N 2 1 348.412 4.072 20 0 EIADMP Cc1ncc([C@H](C)[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)s1 ZINC000090419088 1039227620 /nfs/dbraw/zinc/22/76/20/1039227620.db2.gz FXRVOJNZYUJRES-STQMWFEESA-N 2 1 326.469 4.357 20 0 EIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccccc2OCc2ccccc2)C1 ZINC000481309907 1039262408 /nfs/dbraw/zinc/26/24/08/1039262408.db2.gz NBTWJEGDINKQBU-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccccc2OCc2ccccc2)C1 ZINC000481309907 1039262446 /nfs/dbraw/zinc/26/24/46/1039262446.db2.gz NBTWJEGDINKQBU-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)cc1 ZINC000481318209 1039270572 /nfs/dbraw/zinc/27/05/72/1039270572.db2.gz ZYXGZTQYHKSHQM-SFHVURJKSA-N 2 1 338.495 4.319 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000552277142 1039350392 /nfs/dbraw/zinc/35/03/92/1039350392.db2.gz PJUCXQMDZIZKDG-ZJOUEHCJSA-N 2 1 337.511 4.341 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000555598407 1039422833 /nfs/dbraw/zinc/42/28/33/1039422833.db2.gz ZACGXEKXCIHKNQ-PBHICJAKSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000555598407 1039422859 /nfs/dbraw/zinc/42/28/59/1039422859.db2.gz ZACGXEKXCIHKNQ-PBHICJAKSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000555598407 1039422881 /nfs/dbraw/zinc/42/28/81/1039422881.db2.gz ZACGXEKXCIHKNQ-PBHICJAKSA-N 2 1 342.405 4.064 20 0 EIADMP CCOCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000514103471 1039611467 /nfs/dbraw/zinc/61/14/67/1039611467.db2.gz CIONWXYZOWWFHF-BHIFYINESA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000552562149 1039640082 /nfs/dbraw/zinc/64/00/82/1039640082.db2.gz RMORPFGLGKJBEM-ZHALLVOQSA-N 2 1 328.525 4.322 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000552562149 1039640131 /nfs/dbraw/zinc/64/01/31/1039640131.db2.gz RMORPFGLGKJBEM-ZHALLVOQSA-N 2 1 328.525 4.322 20 0 EIADMP CCC[N@@H+](Cc1ccsc1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000093417599 1039685154 /nfs/dbraw/zinc/68/51/54/1039685154.db2.gz BZQKEQJLASTSJY-UHFFFAOYSA-N 2 1 344.528 4.036 20 0 EIADMP CCC[N@H+](Cc1ccsc1)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000093417599 1039685158 /nfs/dbraw/zinc/68/51/58/1039685158.db2.gz BZQKEQJLASTSJY-UHFFFAOYSA-N 2 1 344.528 4.036 20 0 EIADMP CCC[N@@H+](Cc1ccsc1)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000093417599 1039685198 /nfs/dbraw/zinc/68/51/98/1039685198.db2.gz BZQKEQJLASTSJY-UHFFFAOYSA-N 2 1 344.528 4.036 20 0 EIADMP c1cc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc(-c2ccncc2)c1 ZINC000093563941 1039715124 /nfs/dbraw/zinc/71/51/24/1039715124.db2.gz ALWGTUVAHBOEPX-QFIPXVFZSA-N 2 1 335.495 4.199 20 0 EIADMP C[C@@H]1C[C@H](Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC[N@H+]1C ZINC000899874949 1039754693 /nfs/dbraw/zinc/75/46/93/1039754693.db2.gz QKHDSSPNTCLBMC-VXGBXAGGSA-N 2 1 339.361 4.028 20 0 EIADMP COc1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c2ccccc12 ZINC000537646995 1039802153 /nfs/dbraw/zinc/80/21/53/1039802153.db2.gz GJHORJCAEXESPP-SFHVURJKSA-N 2 1 338.495 4.156 20 0 EIADMP COc1cccc([C@H](C)[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000434684155 1039816450 /nfs/dbraw/zinc/81/64/50/1039816450.db2.gz JVLBNAQZKFVNBQ-INIZCTEOSA-N 2 1 339.483 4.169 20 0 EIADMP C[C@H](COc1cccc(F)c1)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000551008625 1039860512 /nfs/dbraw/zinc/86/05/12/1039860512.db2.gz YLIHBXHXVGQXAU-LKUPVBHCSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](COc1cccc(F)c1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000551008625 1039860514 /nfs/dbraw/zinc/86/05/14/1039860514.db2.gz YLIHBXHXVGQXAU-LKUPVBHCSA-N 2 1 342.458 4.018 20 0 EIADMP CCOCc1ccccc1C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550999063 1039863019 /nfs/dbraw/zinc/86/30/19/1039863019.db2.gz HZLMNVCMSLYODK-FCHUYYIVSA-N 2 1 338.495 4.148 20 0 EIADMP CCOCc1ccccc1C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550999063 1039863021 /nfs/dbraw/zinc/86/30/21/1039863021.db2.gz HZLMNVCMSLYODK-FCHUYYIVSA-N 2 1 338.495 4.148 20 0 EIADMP Cc1cc(C)cc(OCC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551014356 1039876135 /nfs/dbraw/zinc/87/61/35/1039876135.db2.gz SIQYIRQHVBCDSP-IFMALSPDSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1cc(C)cc(OCC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551014356 1039876136 /nfs/dbraw/zinc/87/61/36/1039876136.db2.gz SIQYIRQHVBCDSP-IFMALSPDSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1cccc(C)c1OCC[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000551013211 1039876847 /nfs/dbraw/zinc/87/68/47/1039876847.db2.gz GVXIAUWJKFJCRC-LEWJYISDSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1cccc(C)c1OCC[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000551013211 1039876848 /nfs/dbraw/zinc/87/68/48/1039876848.db2.gz GVXIAUWJKFJCRC-LEWJYISDSA-N 2 1 338.495 4.107 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCO[C@H]2C(C)(C)C)C[C@H]1c1ccccc1 ZINC000551051607 1039925073 /nfs/dbraw/zinc/92/50/73/1039925073.db2.gz SLWLKRAOPIFNML-XSDIEEQYSA-N 2 1 344.543 4.253 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCCO[C@H]2C(C)(C)C)C[C@H]1c1ccccc1 ZINC000551051607 1039925094 /nfs/dbraw/zinc/92/50/94/1039925094.db2.gz SLWLKRAOPIFNML-XSDIEEQYSA-N 2 1 344.543 4.253 20 0 EIADMP Cc1cc2[nH]c(C[N@@H+]3CCC[C@H]([NH+]4CCCC4)CC3)cc2c(C)c1 ZINC000481989921 1039930994 /nfs/dbraw/zinc/93/09/94/1039930994.db2.gz CVYZECWUNQZZOX-IBGZPJMESA-N 2 1 325.500 4.235 20 0 EIADMP Cc1cc2[nH]c(C[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)cc2c(C)c1 ZINC000481989921 1039931014 /nfs/dbraw/zinc/93/10/14/1039931014.db2.gz CVYZECWUNQZZOX-IBGZPJMESA-N 2 1 325.500 4.235 20 0 EIADMP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cnc(C4CCCCC4)s3)CC[C@H]21 ZINC000537695389 1039972420 /nfs/dbraw/zinc/97/24/20/1039972420.db2.gz NUABRROLCQVIGW-SJLPKXTDSA-N 2 1 333.545 4.107 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3cnc(C4CCCCC4)s3)CC[C@H]21 ZINC000537695389 1039972427 /nfs/dbraw/zinc/97/24/27/1039972427.db2.gz NUABRROLCQVIGW-SJLPKXTDSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3cnc(C4CCCCC4)s3)CC[C@H]21 ZINC000537695389 1039972433 /nfs/dbraw/zinc/97/24/33/1039972433.db2.gz NUABRROLCQVIGW-SJLPKXTDSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3cnc(C4CCCCC4)s3)CC[C@H]21 ZINC000537695389 1039972438 /nfs/dbraw/zinc/97/24/38/1039972438.db2.gz NUABRROLCQVIGW-SJLPKXTDSA-N 2 1 333.545 4.107 20 0 EIADMP CSc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551174773 1040018353 /nfs/dbraw/zinc/01/83/53/1040018353.db2.gz DAIKOORIQDXPQY-CTNGQTDRSA-N 2 1 340.536 4.376 20 0 EIADMP CSc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551174773 1040018371 /nfs/dbraw/zinc/01/83/71/1040018371.db2.gz DAIKOORIQDXPQY-CTNGQTDRSA-N 2 1 340.536 4.376 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000551175565 1040019664 /nfs/dbraw/zinc/01/96/64/1040019664.db2.gz MTYKFPLPLPEVBW-OSIBBQKWSA-N 2 1 330.516 4.007 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000551175565 1040019687 /nfs/dbraw/zinc/01/96/87/1040019687.db2.gz MTYKFPLPLPEVBW-OSIBBQKWSA-N 2 1 330.516 4.007 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc2ccccc2c1OC(F)F ZINC000482109389 1040022567 /nfs/dbraw/zinc/02/25/67/1040022567.db2.gz KHXPPKMSKZDRCA-ZDUSSCGKSA-N 2 1 345.393 4.297 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cccc(F)c1 ZINC000482133277 1040028216 /nfs/dbraw/zinc/02/82/16/1040028216.db2.gz IXPFWZXKRSIRKW-HZPDHXFCSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(F)c1 ZINC000482133277 1040028233 /nfs/dbraw/zinc/02/82/33/1040028233.db2.gz IXPFWZXKRSIRKW-HZPDHXFCSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@H](C[N@H+]1CCC[C@H]2C[NH+](C)CC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890640 1040327355 /nfs/dbraw/zinc/32/73/55/1040327355.db2.gz KVYNOJCNKJXPKN-HFTRVMKXSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CCC[C@H]2C[N@H+](C)CC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890640 1040327367 /nfs/dbraw/zinc/32/73/67/1040327367.db2.gz KVYNOJCNKJXPKN-HFTRVMKXSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CCC[C@H]2C[N@@H+](C)CC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890640 1040327383 /nfs/dbraw/zinc/32/73/83/1040327383.db2.gz KVYNOJCNKJXPKN-HFTRVMKXSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1 ZINC000479468652 1040394114 /nfs/dbraw/zinc/39/41/14/1040394114.db2.gz ZFMWULRPQZTNRE-GOEBONIOSA-N 2 1 348.412 4.277 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1 ZINC000479468652 1040394130 /nfs/dbraw/zinc/39/41/30/1040394130.db2.gz ZFMWULRPQZTNRE-GOEBONIOSA-N 2 1 348.412 4.277 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000551533797 1040394327 /nfs/dbraw/zinc/39/43/27/1040394327.db2.gz QOCIATXHKCPLEQ-ZSGPHXLJSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000551533797 1040394345 /nfs/dbraw/zinc/39/43/45/1040394345.db2.gz QOCIATXHKCPLEQ-ZSGPHXLJSA-N 2 1 340.433 4.414 20 0 EIADMP Cc1ccc(N2CCC([NH2+]Cc3cc4c(cc(C)cc4C)[nH]3)CC2)[nH+]c1 ZINC000479472616 1040395609 /nfs/dbraw/zinc/39/56/09/1040395609.db2.gz SYDMDVORYGSMHL-UHFFFAOYSA-N 2 1 348.494 4.247 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1nccc2ccccc21 ZINC000515019143 1040434904 /nfs/dbraw/zinc/43/49/04/1040434904.db2.gz HZSYULOATZWXPC-KZNAEPCWSA-N 2 1 325.500 4.253 20 0 EIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000539508893 1040503281 /nfs/dbraw/zinc/50/32/81/1040503281.db2.gz BVDBEZRBYBVVLN-GJZGRUSLSA-N 2 1 325.456 4.487 20 0 EIADMP c1sc(C[NH2+]CCC[NH2+]Cc2cccnc2)cc1-c1ccccc1 ZINC000414871925 1040521187 /nfs/dbraw/zinc/52/11/87/1040521187.db2.gz FGJASTGASDZIQF-UHFFFAOYSA-N 2 1 337.492 4.080 20 0 EIADMP COc1ncc([C@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)cc1Cl ZINC000551794099 1040606990 /nfs/dbraw/zinc/60/69/90/1040606990.db2.gz MBUOEVZFTRIWJK-AWEZNQCLSA-N 2 1 339.911 4.049 20 0 EIADMP COc1ncc([C@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1Cl ZINC000551794099 1040606996 /nfs/dbraw/zinc/60/69/96/1040606996.db2.gz MBUOEVZFTRIWJK-AWEZNQCLSA-N 2 1 339.911 4.049 20 0 EIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](CC(c2ccccc2)c2ccccc2)C1 ZINC000508857201 1040652994 /nfs/dbraw/zinc/65/29/94/1040652994.db2.gz CSQKTYYSKXYIST-OAQYLSRUSA-N 2 1 348.534 4.482 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC000508857201 1040653022 /nfs/dbraw/zinc/65/30/22/1040653022.db2.gz CSQKTYYSKXYIST-OAQYLSRUSA-N 2 1 348.534 4.482 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC000508857201 1040653034 /nfs/dbraw/zinc/65/30/34/1040653034.db2.gz CSQKTYYSKXYIST-OAQYLSRUSA-N 2 1 348.534 4.482 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cc3ccncc3s2)C1 ZINC000667560869 1040681562 /nfs/dbraw/zinc/68/15/62/1040681562.db2.gz DTBMXQMJEWIRCQ-SJORKVTESA-N 2 1 343.540 4.383 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cc3ccncc3s2)C1 ZINC000667560869 1040681588 /nfs/dbraw/zinc/68/15/88/1040681588.db2.gz DTBMXQMJEWIRCQ-SJORKVTESA-N 2 1 343.540 4.383 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cc3ccncc3s2)C1 ZINC000667560869 1040681608 /nfs/dbraw/zinc/68/16/08/1040681608.db2.gz DTBMXQMJEWIRCQ-SJORKVTESA-N 2 1 343.540 4.383 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cc3ccncc3s2)C1 ZINC000667560869 1040681620 /nfs/dbraw/zinc/68/16/20/1040681620.db2.gz DTBMXQMJEWIRCQ-SJORKVTESA-N 2 1 343.540 4.383 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3cc4ccncc4s3)C2)CC1 ZINC000667561326 1040703389 /nfs/dbraw/zinc/70/33/89/1040703389.db2.gz SLSZTDWNHLZAEE-KRWDZBQOSA-N 2 1 343.540 4.240 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3cc4ccncc4s3)C2)CC1 ZINC000667561326 1040703410 /nfs/dbraw/zinc/70/34/10/1040703410.db2.gz SLSZTDWNHLZAEE-KRWDZBQOSA-N 2 1 343.540 4.240 20 0 EIADMP CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000483258620 1040795869 /nfs/dbraw/zinc/79/58/69/1040795869.db2.gz NJGSIKZABLLINO-YLJYHZDGSA-N 2 1 345.531 4.166 20 0 EIADMP CCCCOc1cc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)ccc1OC ZINC000539818058 1040811621 /nfs/dbraw/zinc/81/16/21/1040811621.db2.gz PJGDKLKPIIQSEK-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[N@@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)ccc1OC ZINC000539818058 1040811629 /nfs/dbraw/zinc/81/16/29/1040811629.db2.gz PJGDKLKPIIQSEK-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[NH+](C)[C@@H]2CC[N@H+](CC)[C@@H](C)C2)ccc1OC ZINC000539818058 1040811631 /nfs/dbraw/zinc/81/16/31/1040811631.db2.gz PJGDKLKPIIQSEK-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[NH+](C)[C@@H]2CC[N@@H+](CC)[C@@H](C)C2)ccc1OC ZINC000539818058 1040811639 /nfs/dbraw/zinc/81/16/39/1040811639.db2.gz PJGDKLKPIIQSEK-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000537881517 1040869771 /nfs/dbraw/zinc/86/97/71/1040869771.db2.gz NZHAJUAUGYBCJP-LMVRJCEZSA-N 2 1 337.511 4.197 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483472226 1040870776 /nfs/dbraw/zinc/87/07/76/1040870776.db2.gz JXRLRQRQQOEODL-KMFMINBZSA-N 2 1 342.405 4.062 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000483472226 1040870780 /nfs/dbraw/zinc/87/07/80/1040870780.db2.gz JXRLRQRQQOEODL-KMFMINBZSA-N 2 1 342.405 4.062 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H](c3cccnc3)C3CC3)CC2)C1 ZINC000537947835 1040940272 /nfs/dbraw/zinc/94/02/72/1040940272.db2.gz LSGJGKZZOPDRDP-HBGVWJBISA-N 2 1 327.516 4.165 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)C1CC(F)(F)C1 ZINC000898519771 1040975382 /nfs/dbraw/zinc/97/53/82/1040975382.db2.gz RBKNZMMVEHXVCZ-LBKNJMOBSA-N 2 1 348.481 4.311 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000483743787 1040993276 /nfs/dbraw/zinc/99/32/76/1040993276.db2.gz IGWXXKDABRIHOF-PWNZVWSESA-N 2 1 345.314 4.222 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000483743787 1040993306 /nfs/dbraw/zinc/99/33/06/1040993306.db2.gz IGWXXKDABRIHOF-PWNZVWSESA-N 2 1 345.314 4.222 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000480173857 1041037063 /nfs/dbraw/zinc/03/70/63/1041037063.db2.gz ZUWIBXUXWPKBEV-KRWDZBQOSA-N 2 1 342.405 4.037 20 0 EIADMP 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 1041077415 /nfs/dbraw/zinc/07/74/15/1041077415.db2.gz NTILICQRBKONJP-RUEOWNRQSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1nc2c(s1)CCCC2 ZINC000540083803 1041101195 /nfs/dbraw/zinc/10/11/95/1041101195.db2.gz KBAYEMORCRGJAB-JKSUJKDBSA-N 2 1 335.561 4.327 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000540141005 1041159198 /nfs/dbraw/zinc/15/91/98/1041159198.db2.gz VIKRDUYHGRUDGB-SFHLNBCPSA-N 2 1 340.511 4.491 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000540170095 1041211742 /nfs/dbraw/zinc/21/17/42/1041211742.db2.gz YSABVYQJEXRRNP-NEPJUHHUSA-N 2 1 326.271 4.485 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000540170102 1041212444 /nfs/dbraw/zinc/21/24/44/1041212444.db2.gz YSABVYQJEXRRNP-NWDGAFQWSA-N 2 1 326.271 4.485 20 0 EIADMP CCc1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000515924605 1041255563 /nfs/dbraw/zinc/25/55/63/1041255563.db2.gz KEDUTUQMPJJCFJ-NRFANRHFSA-N 2 1 337.511 4.036 20 0 EIADMP CCc1ccc(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000515924605 1041255579 /nfs/dbraw/zinc/25/55/79/1041255579.db2.gz KEDUTUQMPJJCFJ-NRFANRHFSA-N 2 1 337.511 4.036 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000540199437 1041257046 /nfs/dbraw/zinc/25/70/46/1041257046.db2.gz VIFGBWPMPRMFLN-SFHVURJKSA-N 2 1 340.433 4.369 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c1 ZINC000484485146 1041257278 /nfs/dbraw/zinc/25/72/78/1041257278.db2.gz JBPWCEQQCPPJEN-ZNMIVQPWSA-N 2 1 326.431 4.120 20 0 EIADMP CSc1ccccc1[C@@H](C)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000194899988 1041293307 /nfs/dbraw/zinc/29/33/07/1041293307.db2.gz DYXRDAULOAWOPY-MRXNPFEDSA-N 2 1 341.524 4.432 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc2ccccc2c1OC(F)F ZINC000538406081 1041303114 /nfs/dbraw/zinc/30/31/14/1041303114.db2.gz ORJNPBHTLSXSSE-CQSZACIVSA-N 2 1 346.421 4.354 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]CC2CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000538419231 1041320284 /nfs/dbraw/zinc/32/02/84/1041320284.db2.gz GSAPYNXEZCALMP-DOTOQJQBSA-N 2 1 326.406 4.088 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]CC2CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000538419231 1041320322 /nfs/dbraw/zinc/32/03/22/1041320322.db2.gz GSAPYNXEZCALMP-DOTOQJQBSA-N 2 1 326.406 4.088 20 0 EIADMP Cc1ccc2c(c1)CC[C@H]2[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463117245 1041355052 /nfs/dbraw/zinc/35/50/52/1041355052.db2.gz SIBXFFBLAWUNSU-HSZRJFAPSA-N 2 1 334.507 4.279 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCOC2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000463140786 1041360615 /nfs/dbraw/zinc/36/06/15/1041360615.db2.gz IILQDPBXVWTRJA-FPOVZHCZSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCOC2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000463140786 1041360624 /nfs/dbraw/zinc/36/06/24/1041360624.db2.gz IILQDPBXVWTRJA-FPOVZHCZSA-N 2 1 344.543 4.369 20 0 EIADMP Cc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463137420 1041371000 /nfs/dbraw/zinc/37/10/00/1041371000.db2.gz KOIBNJFBRCJDBJ-GOSISDBHSA-N 2 1 340.486 4.492 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCC[C@H]1Oc1cccc(C)c1 ZINC000484659669 1041380140 /nfs/dbraw/zinc/38/01/40/1041380140.db2.gz YSIORNHYRKEWQG-NHCUHLMSSA-N 2 1 341.499 4.260 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+]2C)ccc1OC1CCCC1 ZINC000540352020 1041391538 /nfs/dbraw/zinc/39/15/38/1041391538.db2.gz KZDFSQHVDZVDHQ-SJLPKXTDSA-N 2 1 346.515 4.152 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+]2C)ccc1OC1CCCC1 ZINC000540352012 1041391664 /nfs/dbraw/zinc/39/16/64/1041391664.db2.gz KZDFSQHVDZVDHQ-AEFFLSMTSA-N 2 1 346.515 4.152 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cnc2ccsc2c1 ZINC000480601052 1041412023 /nfs/dbraw/zinc/41/20/23/1041412023.db2.gz NJGQNWWIWBYHFB-XHSDSOJGSA-N 2 1 331.529 4.315 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cnc2ccsc2c1 ZINC000480601052 1041412027 /nfs/dbraw/zinc/41/20/27/1041412027.db2.gz NJGQNWWIWBYHFB-XHSDSOJGSA-N 2 1 331.529 4.315 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463207404 1041420314 /nfs/dbraw/zinc/42/03/14/1041420314.db2.gz SQVYGBXETXBYRB-RXVVDRJESA-N 2 1 338.495 4.146 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc(F)c(F)c(F)c1 ZINC000480606332 1041430400 /nfs/dbraw/zinc/43/04/00/1041430400.db2.gz DDHUWCMPJAZXFO-ZIAGYGMSSA-N 2 1 328.422 4.267 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccccc1OC(F)F ZINC000480618623 1041436426 /nfs/dbraw/zinc/43/64/26/1041436426.db2.gz TZBGZKUIYRRMAZ-HZPDHXFCSA-N 2 1 340.458 4.451 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccc(OC(F)F)c1 ZINC000480622503 1041437580 /nfs/dbraw/zinc/43/75/80/1041437580.db2.gz YNWFIJDBFSTDKB-HZPDHXFCSA-N 2 1 340.458 4.451 20 0 EIADMP C[N@@H+]1CC[C@H]2CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC000516221092 1041458138 /nfs/dbraw/zinc/45/81/38/1041458138.db2.gz OGIBKTARSPUBIY-BJKOFHAPSA-N 2 1 348.534 4.114 20 0 EIADMP C[N@H+]1CC[C@H]2CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC000516221092 1041458140 /nfs/dbraw/zinc/45/81/40/1041458140.db2.gz OGIBKTARSPUBIY-BJKOFHAPSA-N 2 1 348.534 4.114 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@H+](CC(Cc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC000516221092 1041458142 /nfs/dbraw/zinc/45/81/42/1041458142.db2.gz OGIBKTARSPUBIY-BJKOFHAPSA-N 2 1 348.534 4.114 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@@H+](CC(Cc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC000516221092 1041458143 /nfs/dbraw/zinc/45/81/43/1041458143.db2.gz OGIBKTARSPUBIY-BJKOFHAPSA-N 2 1 348.534 4.114 20 0 EIADMP C[C@H](Nc1cccc2cc[nH+]cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000538627993 1041459294 /nfs/dbraw/zinc/45/92/94/1041459294.db2.gz MMOMNZSYJIDZJF-INIZCTEOSA-N 2 1 335.451 4.348 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000463262583 1041459531 /nfs/dbraw/zinc/45/95/31/1041459531.db2.gz ZKCOIRDQSKPOTC-AVRDEDQJSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000463262583 1041459537 /nfs/dbraw/zinc/45/95/37/1041459537.db2.gz ZKCOIRDQSKPOTC-AVRDEDQJSA-N 2 1 347.506 4.353 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463251313 1041463429 /nfs/dbraw/zinc/46/34/29/1041463429.db2.gz DKBMSXZHQLWYFJ-GRTSPXDGSA-N 2 1 344.543 4.224 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463251313 1041463432 /nfs/dbraw/zinc/46/34/32/1041463432.db2.gz DKBMSXZHQLWYFJ-GRTSPXDGSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1F ZINC000195133277 1041485090 /nfs/dbraw/zinc/48/50/90/1041485090.db2.gz YIIMKTDJUNETCW-DOTOQJQBSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1F ZINC000195133277 1041485095 /nfs/dbraw/zinc/48/50/95/1041485095.db2.gz YIIMKTDJUNETCW-DOTOQJQBSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[N@@H+]1C ZINC000538717700 1041487286 /nfs/dbraw/zinc/48/72/86/1041487286.db2.gz SDEGMBKCMYNOGV-GOEBONIOSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[N@H+]1C ZINC000538717700 1041487290 /nfs/dbraw/zinc/48/72/90/1041487290.db2.gz SDEGMBKCMYNOGV-GOEBONIOSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[NH+]1C ZINC000538717700 1041487293 /nfs/dbraw/zinc/48/72/93/1041487293.db2.gz SDEGMBKCMYNOGV-GOEBONIOSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[NH+]1C ZINC000538717700 1041487303 /nfs/dbraw/zinc/48/73/03/1041487303.db2.gz SDEGMBKCMYNOGV-GOEBONIOSA-N 2 1 332.488 4.469 20 0 EIADMP CCC[N@H+]1CC[C@H](CN[C@@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722228 1041488794 /nfs/dbraw/zinc/48/87/94/1041488794.db2.gz KALWYMVIIQRVPI-UTKZUKDTSA-N 2 1 326.459 4.237 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722228 1041488798 /nfs/dbraw/zinc/48/87/98/1041488798.db2.gz KALWYMVIIQRVPI-UTKZUKDTSA-N 2 1 326.459 4.237 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722228 1041488801 /nfs/dbraw/zinc/48/88/01/1041488801.db2.gz KALWYMVIIQRVPI-UTKZUKDTSA-N 2 1 326.459 4.237 20 0 EIADMP COCCC[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000480723740 1041490327 /nfs/dbraw/zinc/49/03/27/1041490327.db2.gz FCPDDIBIHIVNBU-CEXWTWQISA-N 2 1 332.532 4.069 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C)c(Br)c2)C[C@H]1C ZINC000538718944 1041490508 /nfs/dbraw/zinc/49/05/08/1041490508.db2.gz YBRDCWWMOVARIR-ZBFHGGJFSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C)c(Br)c2)C[C@H]1C ZINC000538718944 1041490516 /nfs/dbraw/zinc/49/05/16/1041490516.db2.gz YBRDCWWMOVARIR-ZBFHGGJFSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(C)c(Br)c2)C[C@H]1C ZINC000538718944 1041490523 /nfs/dbraw/zinc/49/05/23/1041490523.db2.gz YBRDCWWMOVARIR-ZBFHGGJFSA-N 2 1 339.321 4.062 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc3[nH]cnc3c2)CC1 ZINC000538724661 1041494904 /nfs/dbraw/zinc/49/49/04/1041494904.db2.gz VKFIGKQBSGZAAY-QGZVFWFLSA-N 2 1 340.515 4.039 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3nc[nH]c3c2)CC1 ZINC000538724661 1041494915 /nfs/dbraw/zinc/49/49/15/1041494915.db2.gz VKFIGKQBSGZAAY-QGZVFWFLSA-N 2 1 340.515 4.039 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc3nc[nH]c3c2)CC1 ZINC000538724661 1041494927 /nfs/dbraw/zinc/49/49/27/1041494927.db2.gz VKFIGKQBSGZAAY-QGZVFWFLSA-N 2 1 340.515 4.039 20 0 EIADMP Cc1cccc(COc2ccc(C[NH2+][C@H]3CC[N@@H+](C)[C@@H](C)C3)cc2)c1 ZINC000480753979 1041509860 /nfs/dbraw/zinc/50/98/60/1041509860.db2.gz CPLQXMMXWSEYHZ-RXVVDRJESA-N 2 1 338.495 4.146 20 0 EIADMP c1sc2ccccc2c1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000538799446 1041539852 /nfs/dbraw/zinc/53/98/52/1041539852.db2.gz GDYBWSBGAIJXDZ-HNAYVOBHSA-N 2 1 326.509 4.350 20 0 EIADMP c1sc2ccccc2c1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000538799446 1041539858 /nfs/dbraw/zinc/53/98/58/1041539858.db2.gz GDYBWSBGAIJXDZ-HNAYVOBHSA-N 2 1 326.509 4.350 20 0 EIADMP CCC[C@@H](C[NH2+]CC1([NH+]2CCCCC2)CCOCC1)c1ccccc1 ZINC000540630158 1041571739 /nfs/dbraw/zinc/57/17/39/1041571739.db2.gz VNKXRCXOASKTDX-NRFANRHFSA-N 2 1 344.543 4.195 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C3(c4ccccc4)CCC3)CC2)cc1 ZINC000540764297 1041668769 /nfs/dbraw/zinc/66/87/69/1041668769.db2.gz BDKOWYXZKVRMJV-UHFFFAOYSA-N 2 1 334.507 4.363 20 0 EIADMP C[C@@H]([NH2+]CCCCCOc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000437784866 1041908898 /nfs/dbraw/zinc/90/88/98/1041908898.db2.gz KZZOXKLAYQHDDO-WOJBJXKFSA-N 2 1 344.543 4.478 20 0 EIADMP CC[C@H]1CCC[C@H](C[N@@H+](C)C2CCN(CCc3ccccn3)CC2)C1 ZINC000541536592 1041999333 /nfs/dbraw/zinc/99/93/33/1041999333.db2.gz CWDFCQMVGIDHCD-PMACEKPBSA-N 2 1 343.559 4.237 20 0 EIADMP C[C@H](CCC(F)(F)F)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000541555755 1042011395 /nfs/dbraw/zinc/01/13/95/1042011395.db2.gz IRZJHNOWVWWJBG-VYDXJSESSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCc2ccccc2C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603533 1042038503 /nfs/dbraw/zinc/03/85/03/1042038503.db2.gz WICIHGNPRGVDDH-BBTUJRGHSA-N 2 1 326.528 4.034 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000438087601 1042040603 /nfs/dbraw/zinc/04/06/03/1042040603.db2.gz LXNMXOLEXHIJNW-YVSFHVDLSA-N 2 1 334.470 4.455 20 0 EIADMP Cn1cc[nH+]c1CC1CC[NH+]([C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000438119252 1042048825 /nfs/dbraw/zinc/04/88/25/1042048825.db2.gz JDUVOQSSYDOWLZ-UNMCSNQZSA-N 2 1 337.511 4.185 20 0 EIADMP c1ccc(OCCCCC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000438100029 1042049143 /nfs/dbraw/zinc/04/91/43/1042049143.db2.gz YEJNBWKHWKYFNO-HXUWFJFHSA-N 2 1 330.516 4.186 20 0 EIADMP Fc1ccc2c(c1)CC[C@@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001168438773 1042066439 /nfs/dbraw/zinc/06/64/39/1042066439.db2.gz ODZJDEQHKCYARD-NHCUHLMSSA-N 2 1 330.491 4.023 20 0 EIADMP CCCCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000517547198 1042076769 /nfs/dbraw/zinc/07/67/69/1042076769.db2.gz JQOXYCWTUPIUNR-FQEVSTJZSA-N 2 1 332.532 4.466 20 0 EIADMP CC(C)N1CCc2nc(C[N@H+]3CCCC4(CCCC4)C3)sc2C1 ZINC000438350762 1042141182 /nfs/dbraw/zinc/14/11/82/1042141182.db2.gz YEFPBRNWRVQDMK-UHFFFAOYSA-N 2 1 333.545 4.066 20 0 EIADMP C[N@H+](Cc1ccc2c(c1)CCC2)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845031 1042193121 /nfs/dbraw/zinc/19/31/21/1042193121.db2.gz DBJBIYJEJOWZDS-NRFANRHFSA-N 2 1 334.507 4.129 20 0 EIADMP C[NH+](Cc1ccc2c(c1)CCC2)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464845031 1042193127 /nfs/dbraw/zinc/19/31/27/1042193127.db2.gz DBJBIYJEJOWZDS-NRFANRHFSA-N 2 1 334.507 4.129 20 0 EIADMP C[NH+](Cc1ccc2c(c1)CCC2)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464845031 1042193132 /nfs/dbraw/zinc/19/31/32/1042193132.db2.gz DBJBIYJEJOWZDS-NRFANRHFSA-N 2 1 334.507 4.129 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC2(c3cccc(F)c3F)CCCC2)[C@H](C)C1 ZINC000426055484 1042237199 /nfs/dbraw/zinc/23/71/99/1042237199.db2.gz RTVYBQCKDDKSGR-QAPCUYQASA-N 2 1 336.470 4.097 20 0 EIADMP CC(C)CCOc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000518274380 1042447498 /nfs/dbraw/zinc/44/74/98/1042447498.db2.gz ZAZLMROLWQWQCW-FQEVSTJZSA-N 2 1 332.532 4.322 20 0 EIADMP CC(C)[N@@H+](C)CCCN[C@H](c1ccc(Br)s1)C1CC1 ZINC000439142958 1042518129 /nfs/dbraw/zinc/51/81/29/1042518129.db2.gz QWNXBVYHOSVYAX-HNNXBMFYSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+][C@H](c1ccc(Br)s1)C1CC1 ZINC000439142958 1042518137 /nfs/dbraw/zinc/51/81/37/1042518137.db2.gz QWNXBVYHOSVYAX-HNNXBMFYSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](c1ccc(Br)s1)C1CC1 ZINC000439142958 1042518143 /nfs/dbraw/zinc/51/81/43/1042518143.db2.gz QWNXBVYHOSVYAX-HNNXBMFYSA-N 2 1 345.350 4.282 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(Br)s2)C2CC2)CC[N@@H+]1C ZINC000439145994 1042519490 /nfs/dbraw/zinc/51/94/90/1042519490.db2.gz KQMAMDAXGJDFIX-GMXABZIVSA-N 2 1 343.334 4.034 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(Br)s2)C2CC2)CC[N@H+]1C ZINC000439145994 1042519497 /nfs/dbraw/zinc/51/94/97/1042519497.db2.gz KQMAMDAXGJDFIX-GMXABZIVSA-N 2 1 343.334 4.034 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2ccc3[nH]cnc3c2)cc1 ZINC000518761412 1042679080 /nfs/dbraw/zinc/67/90/80/1042679080.db2.gz ULIJMJOASULBQZ-QGZVFWFLSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2ccc3nc[nH]c3c2)cc1 ZINC000518761412 1042679084 /nfs/dbraw/zinc/67/90/84/1042679084.db2.gz ULIJMJOASULBQZ-QGZVFWFLSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2ccc3nc[nH]c3c2)cc1 ZINC000518761412 1042679091 /nfs/dbraw/zinc/67/90/91/1042679091.db2.gz ULIJMJOASULBQZ-QGZVFWFLSA-N 2 1 348.494 4.227 20 0 EIADMP Cc1nc2ccc(C[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2s1 ZINC000426416014 1042679781 /nfs/dbraw/zinc/67/97/81/1042679781.db2.gz GENOXXYBPPVXIJ-APWZRJJASA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2s1 ZINC000426416014 1042679786 /nfs/dbraw/zinc/67/97/86/1042679786.db2.gz GENOXXYBPPVXIJ-APWZRJJASA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc2s1 ZINC000426416014 1042679790 /nfs/dbraw/zinc/67/97/90/1042679790.db2.gz GENOXXYBPPVXIJ-APWZRJJASA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc2s1 ZINC000426416014 1042679799 /nfs/dbraw/zinc/67/97/99/1042679799.db2.gz GENOXXYBPPVXIJ-APWZRJJASA-N 2 1 341.524 4.053 20 0 EIADMP FC(F)(F)C1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001167964760 1042684856 /nfs/dbraw/zinc/68/48/56/1042684856.db2.gz XNDFWDURSKPDRT-QLQQRZLESA-N 2 1 330.438 4.103 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309752637 1042820428 /nfs/dbraw/zinc/82/04/28/1042820428.db2.gz ALUPFKUHCUTAGG-LPHOPBHVSA-N 2 1 328.887 4.340 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309752637 1042820431 /nfs/dbraw/zinc/82/04/31/1042820431.db2.gz ALUPFKUHCUTAGG-LPHOPBHVSA-N 2 1 328.887 4.340 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310099003 1042827787 /nfs/dbraw/zinc/82/77/87/1042827787.db2.gz WRNMJHGYJZREEX-WIYYLYMNSA-N 2 1 326.459 4.389 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310099000 1042827991 /nfs/dbraw/zinc/82/79/91/1042827991.db2.gz WRNMJHGYJZREEX-GHTZIAJQSA-N 2 1 326.459 4.389 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310099001 1042828118 /nfs/dbraw/zinc/82/81/18/1042828118.db2.gz WRNMJHGYJZREEX-NQIIRXRSSA-N 2 1 326.459 4.389 20 0 EIADMP COc1ccccc1C[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000310860667 1042846656 /nfs/dbraw/zinc/84/66/56/1042846656.db2.gz KLVXTJRSUKINNP-HXUWFJFHSA-N 2 1 338.495 4.087 20 0 EIADMP COc1ccccc1C[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000310860667 1042846659 /nfs/dbraw/zinc/84/66/59/1042846659.db2.gz KLVXTJRSUKINNP-HXUWFJFHSA-N 2 1 338.495 4.087 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1OC ZINC000310985594 1042849252 /nfs/dbraw/zinc/84/92/52/1042849252.db2.gz GTHDBFODEHWHDM-CTNGQTDRSA-N 2 1 338.495 4.258 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311069187 1042852179 /nfs/dbraw/zinc/85/21/79/1042852179.db2.gz YRHGWQOOVUJSEN-HXUWFJFHSA-N 2 1 338.495 4.086 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311069187 1042852181 /nfs/dbraw/zinc/85/21/81/1042852181.db2.gz YRHGWQOOVUJSEN-HXUWFJFHSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@H]([NH2+]Cc1coc2ccccc12)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311130343 1042853965 /nfs/dbraw/zinc/85/39/65/1042853965.db2.gz WJBKMGOAOKRSBJ-PKOBYXMFSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2ncccc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311524981 1042861573 /nfs/dbraw/zinc/86/15/73/1042861573.db2.gz JZUIOWKBHLHJBI-GCJKJVERSA-N 2 1 345.490 4.235 20 0 EIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC000346027169 1042862300 /nfs/dbraw/zinc/86/23/00/1042862300.db2.gz FIBJVFQVLVGXIF-UHFFFAOYSA-N 2 1 331.410 4.039 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2cccnc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311609394 1042862755 /nfs/dbraw/zinc/86/27/55/1042862755.db2.gz DZEDYWIJGNPCND-GCJKJVERSA-N 2 1 345.490 4.235 20 0 EIADMP COc1cccc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000507770987 1042871107 /nfs/dbraw/zinc/87/11/07/1042871107.db2.gz FSGOVLNXDDDWOC-UHFFFAOYSA-N 2 1 338.495 4.039 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH+](CC)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000507784519 1042928500 /nfs/dbraw/zinc/92/85/00/1042928500.db2.gz RNPZIUSHFZEVPR-BHDDXSALSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)c1ccccc1 ZINC000089552764 1042957895 /nfs/dbraw/zinc/95/78/95/1042957895.db2.gz VLGCOSWJZFWEBE-KRWDZBQOSA-N 2 1 326.459 4.183 20 0 EIADMP Fc1ccc(C[C@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001168005140 1042958139 /nfs/dbraw/zinc/95/81/39/1042958139.db2.gz GPWLLWTUNYLQMQ-IZCSPVGOSA-N 2 1 342.502 4.238 20 0 EIADMP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000493890811 1042972582 /nfs/dbraw/zinc/97/25/82/1042972582.db2.gz HMTGJMDJNPFGOK-PGRDOPGGSA-N 2 1 340.511 4.393 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCc2ccncc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168007265 1043015223 /nfs/dbraw/zinc/01/52/23/1043015223.db2.gz ACFSPNLNUWMXJK-HATOLVCRSA-N 2 1 337.511 4.045 20 0 EIADMP C[C@@H]1C[C@@H](NCc2ccccc2F)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168007810 1043023084 /nfs/dbraw/zinc/02/30/84/1043023084.db2.gz UVKKQDRYDMCEEE-XEMDLRDOSA-N 2 1 326.459 4.357 20 0 EIADMP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000152421406 1043027142 /nfs/dbraw/zinc/02/71/42/1043027142.db2.gz OXCMLOGFHWJOTB-XCJDPYLSSA-N 2 1 342.527 4.037 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C3CCC3)C1)CCC2 ZINC000183186186 1043040084 /nfs/dbraw/zinc/04/00/84/1043040084.db2.gz WBEJTDBHONPFKX-BFYDXBDKSA-N 2 1 347.572 4.326 20 0 EIADMP FC(F)(F)c1ccc2c(NC[C@@H]3CC[N@H+](C4CC4)C3)cc[nH+]c2c1 ZINC000516143219 1043121459 /nfs/dbraw/zinc/12/14/59/1043121459.db2.gz KOVYWBYFLJSGOA-LBPRGKRZSA-N 2 1 335.373 4.150 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2cc(O)cc(F)c2)C1 ZINC000185468123 1043186139 /nfs/dbraw/zinc/18/61/39/1043186139.db2.gz OMALAQMEAXLDBB-MRXNPFEDSA-N 2 1 342.458 4.053 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2cc(O)cc(F)c2)C1 ZINC000185468123 1043186152 /nfs/dbraw/zinc/18/61/52/1043186152.db2.gz OMALAQMEAXLDBB-MRXNPFEDSA-N 2 1 342.458 4.053 20 0 EIADMP CCSc1cccc(C[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c1 ZINC000185541634 1043195988 /nfs/dbraw/zinc/19/59/88/1043195988.db2.gz BTLCTUAAACBXPW-UHFFFAOYSA-N 2 1 341.524 4.261 20 0 EIADMP c1cc2c(cccc2C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)[nH]1 ZINC000311054126 1043213577 /nfs/dbraw/zinc/21/35/77/1043213577.db2.gz VKYYOCJQGKBXOZ-IBGZPJMESA-N 2 1 333.479 4.170 20 0 EIADMP c1ccc2sc(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)nc2c1 ZINC000058518063 1043262042 /nfs/dbraw/zinc/26/20/42/1043262042.db2.gz SUGNOTOGZLURPZ-UHFFFAOYSA-N 2 1 343.540 4.384 20 0 EIADMP COc1ccccc1[C@@H](C[NH2+]C1CC[NH+](C(C)(C)C)CC1)OC(C)C ZINC000186383730 1043274003 /nfs/dbraw/zinc/27/40/03/1043274003.db2.gz RHGSWNLVZBLGNQ-HXUWFJFHSA-N 2 1 348.531 4.014 20 0 EIADMP C[C@H]([NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)c1cccc(O)c1 ZINC001168011833 1043351901 /nfs/dbraw/zinc/35/19/01/1043351901.db2.gz SWLIBAJODVIKML-KURKYZTESA-N 2 1 338.495 4.484 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]CC2=Cc3ccccc3OC2)c1 ZINC000171051735 1043414367 /nfs/dbraw/zinc/41/43/67/1043414367.db2.gz FPDHLEKKKIHOQI-UHFFFAOYSA-N 2 1 336.479 4.092 20 0 EIADMP C[C@@H]1CC([NH2+][C@@H]2CCCc3cccnc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012550 1043432398 /nfs/dbraw/zinc/43/23/98/1043432398.db2.gz BWXRMZUZGKPNTO-JBYIUTFZSA-N 2 1 349.522 4.490 20 0 EIADMP Cc1nc2ccc(C[NH2+]CCCC[N@@H+]3CCCC[C@@H]3C)cc2s1 ZINC000494385262 1043459987 /nfs/dbraw/zinc/45/99/87/1043459987.db2.gz LYODQEKDDHWVOT-HNNXBMFYSA-N 2 1 331.529 4.349 20 0 EIADMP Cc1cscc1C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000494465824 1043499498 /nfs/dbraw/zinc/49/94/98/1043499498.db2.gz NYCQACMNNREOKP-DFQSSKMNSA-N 2 1 326.509 4.057 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CC[N@@H+]1C ZINC000467439868 1043577077 /nfs/dbraw/zinc/57/70/77/1043577077.db2.gz YBRMTJZSGKCQEM-MHEUCROKSA-N 2 1 327.299 4.312 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CC[N@H+]1C ZINC000467439868 1043577110 /nfs/dbraw/zinc/57/71/10/1043577110.db2.gz YBRMTJZSGKCQEM-MHEUCROKSA-N 2 1 327.299 4.312 20 0 EIADMP CCCCc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000765972578 1043605984 /nfs/dbraw/zinc/60/59/84/1043605984.db2.gz BCXNEPZXYKOBRM-AVRDEDQJSA-N 2 1 344.543 4.323 20 0 EIADMP C[N@@H+]1CCC[C@H]1CC[NH2+][C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000543051643 1043684123 /nfs/dbraw/zinc/68/41/23/1043684123.db2.gz JMVASEPCPSWSLN-AZUAARDMSA-N 2 1 343.902 4.093 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000543051643 1043684132 /nfs/dbraw/zinc/68/41/32/1043684132.db2.gz JMVASEPCPSWSLN-AZUAARDMSA-N 2 1 343.902 4.093 20 0 EIADMP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000474033789 1043691597 /nfs/dbraw/zinc/69/15/97/1043691597.db2.gz LUTFVOUQTQHRJI-JXFKEZNVSA-N 2 1 330.516 4.128 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000190844493 1043742435 /nfs/dbraw/zinc/74/24/35/1043742435.db2.gz FFUOOVKRYNXZJK-UHFFFAOYSA-N 2 1 328.422 4.366 20 0 EIADMP CC[NH+]1CCC(CC2CC[NH+](Cc3scnc3Cl)CC2)CC1 ZINC001137825020 1043749523 /nfs/dbraw/zinc/74/95/23/1043749523.db2.gz SYFYFUQGTUIKNK-UHFFFAOYSA-N 2 1 341.952 4.131 20 0 EIADMP COCCC[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000442633210 1043772719 /nfs/dbraw/zinc/77/27/19/1043772719.db2.gz CDGXCWBEZAATNH-YLJYHZDGSA-N 2 1 336.495 4.148 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000172626937 1043809996 /nfs/dbraw/zinc/80/99/96/1043809996.db2.gz FMTNZNAXVAZLKT-RTBURBONSA-N 2 1 338.495 4.343 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000172626937 1043809997 /nfs/dbraw/zinc/80/99/97/1043809997.db2.gz FMTNZNAXVAZLKT-RTBURBONSA-N 2 1 338.495 4.343 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccsc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168014384 1043827178 /nfs/dbraw/zinc/82/71/78/1043827178.db2.gz KVFMGYFOBRQZKB-XEMDLRDOSA-N 2 1 328.525 4.322 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCCOC(C)(C)C)CC1 ZINC000674907464 1043935762 /nfs/dbraw/zinc/93/57/62/1043935762.db2.gz UIQMYSUIWFAPEE-UHFFFAOYSA-N 2 1 332.532 4.036 20 0 EIADMP C[C@@H]([NH2+]CCc1ccc(F)cc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000428271202 1044064469 /nfs/dbraw/zinc/06/44/69/1044064469.db2.gz YHMKTQBJKAQMKQ-ZBFHGGJFSA-N 2 1 338.898 4.264 20 0 EIADMP C[C@H]([NH2+]C1CCC2(CC2(F)F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000658265793 1044198217 /nfs/dbraw/zinc/19/82/17/1044198217.db2.gz PXOAUMDXURDDIG-YUKKFIBKSA-N 2 1 348.481 4.455 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H]1CCc2ccc(Cl)cc21 ZINC000429251297 1044283764 /nfs/dbraw/zinc/28/37/64/1044283764.db2.gz CPQNWUKIRYHYKI-GOSISDBHSA-N 2 1 331.891 4.498 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H]1CCc2ccc(Cl)cc21 ZINC000429251297 1044283779 /nfs/dbraw/zinc/28/37/79/1044283779.db2.gz CPQNWUKIRYHYKI-GOSISDBHSA-N 2 1 331.891 4.498 20 0 EIADMP COc1ccc2cc(C[N@H+](C)CCCCn3cc[nH+]c3C)ccc2c1 ZINC000348041575 1044371552 /nfs/dbraw/zinc/37/15/52/1044371552.db2.gz HVCSTDLXGHOTLS-UHFFFAOYSA-N 2 1 337.467 4.266 20 0 EIADMP COc1ccc2cc(C[N@@H+](C)CCCCn3cc[nH+]c3C)ccc2c1 ZINC000348041575 1044371566 /nfs/dbraw/zinc/37/15/66/1044371566.db2.gz HVCSTDLXGHOTLS-UHFFFAOYSA-N 2 1 337.467 4.266 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)cc1 ZINC000348066898 1044387399 /nfs/dbraw/zinc/38/73/99/1044387399.db2.gz BTGUEEUVWHFNKK-VVHHDAOASA-N 2 1 339.483 4.035 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)Cc1ccccc1 ZINC000542518628 1044450639 /nfs/dbraw/zinc/45/06/39/1044450639.db2.gz YAQCJYSMFXEDPK-REWPJTCUSA-N 2 1 336.523 4.019 20 0 EIADMP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000675752485 1044466286 /nfs/dbraw/zinc/46/62/86/1044466286.db2.gz XJMPTKVKZHEKCW-WQGACYEGSA-N 2 1 325.283 4.197 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCc2c(Cl)cccc2Cl)CC[N@@H+]1C ZINC000428283426 1044475810 /nfs/dbraw/zinc/47/58/10/1044475810.db2.gz HXJKOPJKQAHWEV-UONOGXRCSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCc2c(Cl)cccc2Cl)CC[N@H+]1C ZINC000428283426 1044475824 /nfs/dbraw/zinc/47/58/24/1044475824.db2.gz HXJKOPJKQAHWEV-UONOGXRCSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)CCCc2c(Cl)cccc2Cl)CC[NH+]1C ZINC000428283426 1044475835 /nfs/dbraw/zinc/47/58/35/1044475835.db2.gz HXJKOPJKQAHWEV-UONOGXRCSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)CCCc2c(Cl)cccc2Cl)CC[NH+]1C ZINC000428283426 1044475843 /nfs/dbraw/zinc/47/58/43/1044475843.db2.gz HXJKOPJKQAHWEV-UONOGXRCSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000675790080 1044502614 /nfs/dbraw/zinc/50/26/14/1044502614.db2.gz RCMADJNBHUDIDA-UTKZUKDTSA-N 2 1 333.479 4.168 20 0 EIADMP CCC(CC)(C[NH2+][C@@H](C)C1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000675894939 1044543488 /nfs/dbraw/zinc/54/34/88/1044543488.db2.gz WFGUGAQOFCUOOK-OALUTQOASA-N 3 1 345.575 4.216 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCc3ccc(C(F)(F)F)cc3)CC[C@@H]21 ZINC000675897599 1044543577 /nfs/dbraw/zinc/54/35/77/1044543577.db2.gz HEQAPAHQZUHIOA-WMZOPIPTSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCc3ccc(C(F)(F)F)cc3)CC[C@@H]21 ZINC000675897599 1044543593 /nfs/dbraw/zinc/54/35/93/1044543593.db2.gz HEQAPAHQZUHIOA-WMZOPIPTSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCc3ccc(C(F)(F)F)cc3)CC[C@@H]21 ZINC000675897599 1044543610 /nfs/dbraw/zinc/54/36/10/1044543610.db2.gz HEQAPAHQZUHIOA-WMZOPIPTSA-N 2 1 340.433 4.054 20 0 EIADMP CS[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C ZINC000543411855 1044552548 /nfs/dbraw/zinc/55/25/48/1044552548.db2.gz BZWRZFFEHJLASS-BHIYHBOVSA-N 2 1 334.573 4.407 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c(C)s1 ZINC000443638165 1044585555 /nfs/dbraw/zinc/58/55/55/1044585555.db2.gz LAWXCTUSWZNYIC-UHFFFAOYSA-N 2 1 343.540 4.104 20 0 EIADMP Cc1cc(F)cc(C[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC001143619165 1044643431 /nfs/dbraw/zinc/64/34/31/1044643431.db2.gz KPFCKGJDLBVRJM-RTWAWAEBSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC001143619165 1044643437 /nfs/dbraw/zinc/64/34/37/1044643437.db2.gz KPFCKGJDLBVRJM-RTWAWAEBSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC001143619165 1044643440 /nfs/dbraw/zinc/64/34/40/1044643440.db2.gz KPFCKGJDLBVRJM-RTWAWAEBSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC001143619165 1044643445 /nfs/dbraw/zinc/64/34/45/1044643445.db2.gz KPFCKGJDLBVRJM-RTWAWAEBSA-N 2 1 338.470 4.088 20 0 EIADMP FC(F)(F)c1ccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000676712966 1044828247 /nfs/dbraw/zinc/82/82/47/1044828247.db2.gz VLCNDTOISKYXAR-MAUKXSAKSA-N 2 1 338.417 4.154 20 0 EIADMP FC(F)(F)c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000676712966 1044828251 /nfs/dbraw/zinc/82/82/51/1044828251.db2.gz VLCNDTOISKYXAR-MAUKXSAKSA-N 2 1 338.417 4.154 20 0 EIADMP CCCn1ccnc1CCC[N@@H+](C)[C@H]1CCc2c1cccc2Cl ZINC000429259873 1044857778 /nfs/dbraw/zinc/85/77/78/1044857778.db2.gz LHFTYKPDKOOFAF-SFHVURJKSA-N 2 1 331.891 4.498 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H]1CCc2c1cccc2Cl ZINC000429259873 1044857779 /nfs/dbraw/zinc/85/77/79/1044857779.db2.gz LHFTYKPDKOOFAF-SFHVURJKSA-N 2 1 331.891 4.498 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H]1CCc2c1cccc2Cl ZINC000429259873 1044857782 /nfs/dbraw/zinc/85/77/82/1044857782.db2.gz LHFTYKPDKOOFAF-SFHVURJKSA-N 2 1 331.891 4.498 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC000429263522 1044859625 /nfs/dbraw/zinc/85/96/25/1044859625.db2.gz XXCJHSSFHMYUPX-IBGZPJMESA-N 2 1 329.463 4.374 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H]1CCCc2ccc(F)cc21 ZINC000429263522 1044859630 /nfs/dbraw/zinc/85/96/30/1044859630.db2.gz XXCJHSSFHMYUPX-IBGZPJMESA-N 2 1 329.463 4.374 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674007447 1045178105 /nfs/dbraw/zinc/17/81/05/1045178105.db2.gz JEVZLQNBDNXNOP-KRWDZBQOSA-N 2 1 342.449 4.302 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+]1C ZINC000542567523 1045330919 /nfs/dbraw/zinc/33/09/19/1045330919.db2.gz ZTSCPPKJVFINIK-KKUMJFAQSA-N 2 1 328.422 4.271 20 0 EIADMP Clc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000237678716 1045391829 /nfs/dbraw/zinc/39/18/29/1045391829.db2.gz HEZMIULMAVVHMB-UHFFFAOYSA-N 2 1 328.887 4.137 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(SC(F)F)cc1 ZINC000762920426 1045414645 /nfs/dbraw/zinc/41/46/45/1045414645.db2.gz WLWLUIGKSBVABH-UHFFFAOYSA-N 2 1 325.428 4.028 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(SC(F)F)cc1 ZINC000762920426 1045414649 /nfs/dbraw/zinc/41/46/49/1045414649.db2.gz WLWLUIGKSBVABH-UHFFFAOYSA-N 2 1 325.428 4.028 20 0 EIADMP C([C@H]1CCCO1)[NH+]1CCC([NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000767691802 1045616409 /nfs/dbraw/zinc/61/64/09/1045616409.db2.gz VSTQPNABBOZKAZ-QETWGEEDSA-N 2 1 348.575 4.359 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)[C@H]2COc3ccccc32)cc1 ZINC000246433005 1045788168 /nfs/dbraw/zinc/78/81/68/1045788168.db2.gz NZYHVNFHVORNQK-GCKMJXCFSA-N 2 1 347.462 4.396 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1F ZINC000398042682 1045827061 /nfs/dbraw/zinc/82/70/61/1045827061.db2.gz UAMJCKRRKQBFLD-FIKGOQFSSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1F ZINC000398042682 1045827063 /nfs/dbraw/zinc/82/70/63/1045827063.db2.gz UAMJCKRRKQBFLD-FIKGOQFSSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]C2CC(C(F)F)C2)C1 ZINC000768679852 1045827452 /nfs/dbraw/zinc/82/74/52/1045827452.db2.gz XLRCIWNEGNLHQD-MYMYQCDVSA-N 2 1 336.470 4.298 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cncc3ccccc32)C1 ZINC000769148841 1045884152 /nfs/dbraw/zinc/88/41/52/1045884152.db2.gz TZMAOXHUIXPEAV-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cncc3ccccc32)C1 ZINC000769148841 1045884157 /nfs/dbraw/zinc/88/41/57/1045884157.db2.gz TZMAOXHUIXPEAV-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cncc3ccccc32)C1 ZINC000769148841 1045884163 /nfs/dbraw/zinc/88/41/63/1045884163.db2.gz TZMAOXHUIXPEAV-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cncc3ccccc32)C1 ZINC000769148841 1045884168 /nfs/dbraw/zinc/88/41/68/1045884168.db2.gz TZMAOXHUIXPEAV-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP Cc1c2[nH+]c[nH]c2ccc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001170332331 1046002546 /nfs/dbraw/zinc/00/25/46/1046002546.db2.gz CXSVLQLDIUIZFG-LDLYASANSA-N 2 1 346.478 4.479 20 0 EIADMP CCc1noc(C)c1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000769871865 1046098954 /nfs/dbraw/zinc/09/89/54/1046098954.db2.gz ZWPURAYLBRIHNC-INIZCTEOSA-N 2 1 341.499 4.382 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000261754441 1046143458 /nfs/dbraw/zinc/14/34/58/1046143458.db2.gz KKPOEVDPLISGBH-HNAYVOBHSA-N 2 1 329.513 4.111 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000261754441 1046143477 /nfs/dbraw/zinc/14/34/77/1046143477.db2.gz KKPOEVDPLISGBH-HNAYVOBHSA-N 2 1 329.513 4.111 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)C(c1ccccc1)c1ccccc1 ZINC000124379668 1046233910 /nfs/dbraw/zinc/23/39/10/1046233910.db2.gz MFHDJIAQENILBZ-MOPGFXCFSA-N 2 1 334.507 4.281 20 0 EIADMP C[N@H+](Cc1ccc2ncccc2c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000124677826 1046255079 /nfs/dbraw/zinc/25/50/79/1046255079.db2.gz CSUZSAMLOCKYFV-NRFANRHFSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2ncccc2c1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000124677826 1046255106 /nfs/dbraw/zinc/25/51/06/1046255106.db2.gz CSUZSAMLOCKYFV-NRFANRHFSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2ncccc2c1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000124677826 1046255111 /nfs/dbraw/zinc/25/51/11/1046255111.db2.gz CSUZSAMLOCKYFV-NRFANRHFSA-N 2 1 345.490 4.189 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]Cc2ccc(O)cc2)C1 ZINC000237686059 1046302309 /nfs/dbraw/zinc/30/23/09/1046302309.db2.gz QAPMKXJFXUSVHM-HDICACEKSA-N 2 1 338.495 4.160 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(C[NH2+]Cc3ccc(O)cc3)cc2)C1 ZINC000237687915 1046302404 /nfs/dbraw/zinc/30/24/04/1046302404.db2.gz UEEOZPLUKWFLFZ-HDICACEKSA-N 2 1 338.495 4.160 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000125421884 1046305789 /nfs/dbraw/zinc/30/57/89/1046305789.db2.gz ZPMBSVJLYIKFJS-KXBFYZLASA-N 2 1 327.472 4.353 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000125421884 1046305804 /nfs/dbraw/zinc/30/58/04/1046305804.db2.gz ZPMBSVJLYIKFJS-KXBFYZLASA-N 2 1 327.472 4.353 20 0 EIADMP c1csc([C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C2CC2)c1 ZINC000125869336 1046359907 /nfs/dbraw/zinc/35/99/07/1046359907.db2.gz LJUXKGFQTQWQLM-FQEVSTJZSA-N 2 1 326.509 4.453 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1OCC ZINC000125985557 1046408193 /nfs/dbraw/zinc/40/81/93/1046408193.db2.gz VVTYGTIODRYDLR-QZTJIDSGSA-N 2 1 348.531 4.255 20 0 EIADMP C[N@H+]1CC[C@H](c2ccc(NC3CC(C)(C)[NH+](C)C(C)(C)C3)cc2)C1 ZINC001170453379 1046536369 /nfs/dbraw/zinc/53/63/69/1046536369.db2.gz JSDNZSABXJSJTH-KRWDZBQOSA-N 2 1 329.532 4.169 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c3ccccc23)C[C@H]1C ZINC000536659333 1046609267 /nfs/dbraw/zinc/60/92/67/1046609267.db2.gz WUPZOLPGGRKQMT-AEFFLSMTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OC)c3ccccc23)C[C@H]1C ZINC000536659333 1046609272 /nfs/dbraw/zinc/60/92/72/1046609272.db2.gz WUPZOLPGGRKQMT-AEFFLSMTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(OC)c3ccccc23)C[C@H]1C ZINC000536659333 1046609276 /nfs/dbraw/zinc/60/92/76/1046609276.db2.gz WUPZOLPGGRKQMT-AEFFLSMTSA-N 2 1 326.484 4.153 20 0 EIADMP CCOc1cc(C[N@H+](C)[C@@H]2CCN(C)[C@H](C)C2)ccc1OCC(C)C ZINC000536658656 1046622359 /nfs/dbraw/zinc/62/23/59/1046622359.db2.gz PMXMAAFICKTECU-IEBWSBKVSA-N 2 1 348.531 4.035 20 0 EIADMP CCOc1cc(C[N@@H+](C)[C@@H]2CCN(C)[C@H](C)C2)ccc1OCC(C)C ZINC000536658656 1046622367 /nfs/dbraw/zinc/62/23/67/1046622367.db2.gz PMXMAAFICKTECU-IEBWSBKVSA-N 2 1 348.531 4.035 20 0 EIADMP CCCOc1c(CN(C)[C@H]2CC[N@@H+](CC)C[C@@H]2C)cccc1OCC ZINC000536662513 1046626963 /nfs/dbraw/zinc/62/69/63/1046626963.db2.gz HKVDGMJRQYYLMW-HKUYNNGSSA-N 2 1 348.531 4.036 20 0 EIADMP CCCOc1c(CN(C)[C@@H]2CC[N@@H+](CC)C[C@H]2C)cccc1OCC ZINC000536662514 1046627537 /nfs/dbraw/zinc/62/75/37/1046627537.db2.gz HKVDGMJRQYYLMW-IEBWSBKVSA-N 2 1 348.531 4.036 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CCN(Cc2cc(C)c(C)cc2OC(F)F)C1 ZINC000536663327 1046632082 /nfs/dbraw/zinc/63/20/82/1046632082.db2.gz FMSOENBCRRZMDE-INIZCTEOSA-N 2 1 340.458 4.069 20 0 EIADMP FC1(F)CCC(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)CC1 ZINC000459427245 1046661256 /nfs/dbraw/zinc/66/12/56/1046661256.db2.gz BAISOMNJHKVVNG-UHFFFAOYSA-N 2 1 337.458 4.224 20 0 EIADMP Cc1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc(C)c1O ZINC000379615158 1046700940 /nfs/dbraw/zinc/70/09/40/1046700940.db2.gz AFXKGXWHSUNYHN-RXVVDRJESA-N 2 1 338.495 4.152 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3ncccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379644942 1046736652 /nfs/dbraw/zinc/73/66/52/1046736652.db2.gz HLTZUMXKXGYXQU-AVRDEDQJSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3ncccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379644942 1046736662 /nfs/dbraw/zinc/73/66/62/1046736662.db2.gz HLTZUMXKXGYXQU-AVRDEDQJSA-N 2 1 345.490 4.378 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379641557 1046746027 /nfs/dbraw/zinc/74/60/27/1046746027.db2.gz YKEBXQKZHBLVLA-WFXMLNOXSA-N 2 1 338.495 4.399 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379657625 1046759362 /nfs/dbraw/zinc/75/93/62/1046759362.db2.gz UAPVFNOKVQHUJN-WFXMLNOXSA-N 2 1 338.495 4.399 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379657625 1046759375 /nfs/dbraw/zinc/75/93/75/1046759375.db2.gz UAPVFNOKVQHUJN-WFXMLNOXSA-N 2 1 338.495 4.399 20 0 EIADMP CCc1nc(CN2CCC(CC[N@H+](CC)CC(C)C)CC2)cs1 ZINC000536887819 1046847938 /nfs/dbraw/zinc/84/79/38/1046847938.db2.gz BWTJUKTYSOMXCB-UHFFFAOYSA-N 2 1 337.577 4.286 20 0 EIADMP CCc1nc(C[NH+]2CCC(CC[N@@H+](CC)CC(C)C)CC2)cs1 ZINC000536887819 1046847940 /nfs/dbraw/zinc/84/79/40/1046847940.db2.gz BWTJUKTYSOMXCB-UHFFFAOYSA-N 2 1 337.577 4.286 20 0 EIADMP CCc1nc(C[NH+]2CCC(CC[N@H+](CC)CC(C)C)CC2)cs1 ZINC000536887819 1046847944 /nfs/dbraw/zinc/84/79/44/1046847944.db2.gz BWTJUKTYSOMXCB-UHFFFAOYSA-N 2 1 337.577 4.286 20 0 EIADMP COc1ccccc1[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)C1CCCC1 ZINC000537016900 1046887427 /nfs/dbraw/zinc/88/74/27/1046887427.db2.gz ZETMDPSXBMXEPC-IERDGZPVSA-N 2 1 341.499 4.357 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000537013243 1046895276 /nfs/dbraw/zinc/89/52/76/1046895276.db2.gz WQYCXHLSAQYORA-WWMYMODYSA-N 2 1 329.532 4.338 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1 ZINC000537012366 1046895592 /nfs/dbraw/zinc/89/55/92/1046895592.db2.gz NLUPBYLGVCGYIS-ABSDTBQOSA-N 2 1 329.532 4.338 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](COc1c(C)cccc1C)c1ccccc1 ZINC000537123731 1046954195 /nfs/dbraw/zinc/95/41/95/1046954195.db2.gz DMVQBKSFGRPCPK-OAQYLSRUSA-N 2 1 349.478 4.218 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@@H]3CCC[N@H+](CC(C)C)C3)oc21 ZINC000537305924 1047088554 /nfs/dbraw/zinc/08/85/54/1047088554.db2.gz CRDOZOLEGWVXMP-IRXDYDNUSA-N 2 1 344.499 4.460 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@@H]3CCC[N@@H+](CC(C)C)C3)oc21 ZINC000537305924 1047088567 /nfs/dbraw/zinc/08/85/67/1047088567.db2.gz CRDOZOLEGWVXMP-IRXDYDNUSA-N 2 1 344.499 4.460 20 0 EIADMP FC(F)(F)c1cc(C[NH2+]C2CC[NH+](C3CCC3)CC2)ccc1Cl ZINC000537288014 1047095532 /nfs/dbraw/zinc/09/55/32/1047095532.db2.gz ZIGYBEUKIBRDPJ-UHFFFAOYSA-N 2 1 346.824 4.465 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1cc[nH]c(=O)c1 ZINC000788530229 1047227861 /nfs/dbraw/zinc/22/78/61/1047227861.db2.gz WQMDQLIXXPNGJY-DLBZAZTESA-N 2 1 339.483 4.012 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccccc1 ZINC000129396657 1047376744 /nfs/dbraw/zinc/37/67/44/1047376744.db2.gz BGJQTYQIEDKSJL-OTWHNJEPSA-N 2 1 338.495 4.147 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1F ZINC000556119576 1047472667 /nfs/dbraw/zinc/47/26/67/1047472667.db2.gz AMKZVECWNUIPEJ-JENIJYKNSA-N 2 1 341.474 4.172 20 0 EIADMP COC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCC(C)CC1 ZINC000556178736 1047540314 /nfs/dbraw/zinc/54/03/14/1047540314.db2.gz MYQNURRZZDHKRU-PXMFUHLKSA-N 2 1 330.516 4.007 20 0 EIADMP COC1(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCC(C)CC1 ZINC000556178736 1047540323 /nfs/dbraw/zinc/54/03/23/1047540323.db2.gz MYQNURRZZDHKRU-PXMFUHLKSA-N 2 1 330.516 4.007 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@H](c3ccncc3)C3CC3)CC[N@@H+]2C2CC2)cc1 ZINC000898317069 1047622750 /nfs/dbraw/zinc/62/27/50/1047622750.db2.gz FUYRCXNUYSHMDT-PMVMPFDFSA-N 2 1 347.506 4.490 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@H](c3ccncc3)C3CC3)CC[N@H+]2C2CC2)cc1 ZINC000898317069 1047622757 /nfs/dbraw/zinc/62/27/57/1047622757.db2.gz FUYRCXNUYSHMDT-PMVMPFDFSA-N 2 1 347.506 4.490 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cccnc2Cl)CC1 ZINC000763435158 1047791411 /nfs/dbraw/zinc/79/14/11/1047791411.db2.gz ZZDTWOMNBNRNRT-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccnc2Cl)CC1 ZINC000763435158 1047791419 /nfs/dbraw/zinc/79/14/19/1047791419.db2.gz ZZDTWOMNBNRNRT-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C12CCCC2 ZINC000550665546 1047810883 /nfs/dbraw/zinc/81/08/83/1047810883.db2.gz MGCTYYAAMPUSHJ-MXEMCNAFSA-N 2 1 342.527 4.149 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C12CCCC2 ZINC000550665546 1047810885 /nfs/dbraw/zinc/81/08/85/1047810885.db2.gz MGCTYYAAMPUSHJ-MXEMCNAFSA-N 2 1 342.527 4.149 20 0 EIADMP COc1ncc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1Cl ZINC000556591830 1047835432 /nfs/dbraw/zinc/83/54/32/1047835432.db2.gz NEAROMYZHHBQKU-GJZGRUSLSA-N 2 1 339.911 4.049 20 0 EIADMP CC[C@H]1C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCO1 ZINC000824427275 1047867719 /nfs/dbraw/zinc/86/77/19/1047867719.db2.gz IBKWJSGEUFDBAW-HGHNDWQTSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001171064636 1047921928 /nfs/dbraw/zinc/92/19/28/1047921928.db2.gz SFSZBVLJPHMJNX-XJKSGUPXSA-N 2 1 341.326 4.172 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1c[nH]c2cccc(F)c12 ZINC001136985420 1048030315 /nfs/dbraw/zinc/03/03/15/1048030315.db2.gz GMUUNSGNENQQRO-IRXDYDNUSA-N 2 1 329.463 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1c[nH]c2cccc(F)c12 ZINC001136985420 1048030321 /nfs/dbraw/zinc/03/03/21/1048030321.db2.gz GMUUNSGNENQQRO-IRXDYDNUSA-N 2 1 329.463 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1c[nH]c2cccc(F)c12 ZINC001136985420 1048030325 /nfs/dbraw/zinc/03/03/25/1048030325.db2.gz GMUUNSGNENQQRO-IRXDYDNUSA-N 2 1 329.463 4.146 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000556857536 1048075427 /nfs/dbraw/zinc/07/54/27/1048075427.db2.gz CKSDQMAWLNNSAC-WSTZPKSXSA-N 2 1 346.563 4.379 20 0 EIADMP CC(C)c1ncc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)s1 ZINC000131690748 1048104844 /nfs/dbraw/zinc/10/48/44/1048104844.db2.gz ZOHDCPUBCPSCDM-UHFFFAOYSA-N 2 1 331.529 4.397 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCc2ccccc2[C@H](c2ccccc2)[C@@H]1C ZINC000499052834 1048130094 /nfs/dbraw/zinc/13/00/94/1048130094.db2.gz DKRBEDBZSYQVIC-MBSDFSHPSA-N 2 1 345.490 4.270 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCc2ccccc2[C@H](c2ccccc2)[C@@H]1C ZINC000499052834 1048130101 /nfs/dbraw/zinc/13/01/01/1048130101.db2.gz DKRBEDBZSYQVIC-MBSDFSHPSA-N 2 1 345.490 4.270 20 0 EIADMP CCCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000556926116 1048220905 /nfs/dbraw/zinc/22/09/05/1048220905.db2.gz XWRIYYFVCKSONB-FQEVSTJZSA-N 2 1 330.516 4.029 20 0 EIADMP CCCCOc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000556926116 1048220912 /nfs/dbraw/zinc/22/09/12/1048220912.db2.gz XWRIYYFVCKSONB-FQEVSTJZSA-N 2 1 330.516 4.029 20 0 EIADMP CCCCOc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1 ZINC000556926116 1048220919 /nfs/dbraw/zinc/22/09/19/1048220919.db2.gz XWRIYYFVCKSONB-FQEVSTJZSA-N 2 1 330.516 4.029 20 0 EIADMP CCCCOc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1 ZINC000556926116 1048220928 /nfs/dbraw/zinc/22/09/28/1048220928.db2.gz XWRIYYFVCKSONB-FQEVSTJZSA-N 2 1 330.516 4.029 20 0 EIADMP C[C@H](CC[N@H+]1CCC[C@]2(CC2(F)F)C1)[NH+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437265 1048333263 /nfs/dbraw/zinc/33/32/63/1048333263.db2.gz MTLKTALOLQNCTL-PMPSAXMXSA-N 2 1 348.428 4.007 20 0 EIADMP C[C@H](CC[NH+]1CCC[C@]2(CC2(F)F)C1)[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437265 1048333277 /nfs/dbraw/zinc/33/32/77/1048333277.db2.gz MTLKTALOLQNCTL-PMPSAXMXSA-N 2 1 348.428 4.007 20 0 EIADMP C[C@H](CC[NH+]1CCC[C@]2(CC2(F)F)C1)[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437265 1048333292 /nfs/dbraw/zinc/33/32/92/1048333292.db2.gz MTLKTALOLQNCTL-PMPSAXMXSA-N 2 1 348.428 4.007 20 0 EIADMP Cc1cccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000499149813 1048357564 /nfs/dbraw/zinc/35/75/64/1048357564.db2.gz UOESPUQAFULPBK-NUNAXRQHSA-N 2 1 334.507 4.323 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H]2CCc4ccccc4C2)C3)cc1 ZINC000499164509 1048372131 /nfs/dbraw/zinc/37/21/31/1048372131.db2.gz OFZVSRHICCXJAA-XQUALCHDSA-N 2 1 346.518 4.329 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171130194 1048382916 /nfs/dbraw/zinc/38/29/16/1048382916.db2.gz QPLHITKPJGOVEJ-FQEVSTJZSA-N 2 1 334.935 4.250 20 0 EIADMP c1ccc(C[C@@H]2C[C@@H]2[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000499215470 1048422218 /nfs/dbraw/zinc/42/22/18/1048422218.db2.gz QDIBNRAWADIYQP-SJSRKZJXSA-N 2 1 346.518 4.403 20 0 EIADMP CC[N@@H+](C1CCN(C)CC1)[C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171160510 1048594884 /nfs/dbraw/zinc/59/48/84/1048594884.db2.gz BUBBKHXZQIIIBM-INIZCTEOSA-N 2 1 341.326 4.267 20 0 EIADMP C[NH+]1CCC2(CCC[N@@H+](CCn3ccc4cc(Cl)ccc43)C2)CC1 ZINC000810002024 1048598972 /nfs/dbraw/zinc/59/89/72/1048598972.db2.gz QLOXNTKPSCKRCQ-UHFFFAOYSA-N 2 1 345.918 4.103 20 0 EIADMP C[N@H+](Cc1cccc2cccnc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109860 1048855270 /nfs/dbraw/zinc/85/52/70/1048855270.db2.gz CCESCVNXHYZSKE-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cccc2cccnc21)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076109860 1048855272 /nfs/dbraw/zinc/85/52/72/1048855272.db2.gz CCESCVNXHYZSKE-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cccc2cccnc21)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076109860 1048855273 /nfs/dbraw/zinc/85/52/73/1048855273.db2.gz CCESCVNXHYZSKE-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc3ncccc3c2)CC1 ZINC000134160045 1048888928 /nfs/dbraw/zinc/88/89/28/1048888928.db2.gz QVCQNHPHMVOVSG-UHFFFAOYSA-N 2 1 325.500 4.179 20 0 EIADMP [NH3+]CCc1cc2ccccc2n1-c1ccc2c(c1)[nH]c1cc[nH+]cc12 ZINC001171304767 1049149900 /nfs/dbraw/zinc/14/99/00/1049149900.db2.gz XQICQOWEZKWOLG-UHFFFAOYSA-N 2 1 326.403 4.161 20 0 EIADMP [NH3+]C1(c2ccccc2)CC[NH+]([C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911153 1049186039 /nfs/dbraw/zinc/18/60/39/1049186039.db2.gz UDJHERJZCDKWJE-GOSISDBHSA-N 2 1 340.898 4.147 20 0 EIADMP Fc1ccc2c(NC[C@H]3CC[N@@H+](CCc4ccccc4)C3)cc[nH+]c2c1 ZINC000078695520 1049272753 /nfs/dbraw/zinc/27/27/53/1049272753.db2.gz RQLZTUKQILXIOB-GOSISDBHSA-N 2 1 349.453 4.350 20 0 EIADMP C[C@H](CC[NH2+][C@H]1CCCNc2ccccc21)[N@@H+](C)Cc1ccccc1 ZINC000348097585 1049417793 /nfs/dbraw/zinc/41/77/93/1049417793.db2.gz WQQBUJDVEKAHFB-GCJKJVERSA-N 2 1 337.511 4.434 20 0 EIADMP CC(C)COC[C@H]([NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1)c1ccco1 ZINC000820808374 1049554243 /nfs/dbraw/zinc/55/42/43/1049554243.db2.gz DPIXASSLUBGTHB-PXNSSMCTSA-N 2 1 344.499 4.406 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](C2CC(OCc3ccccc3)C2)CC1 ZINC000821361997 1049628848 /nfs/dbraw/zinc/62/88/48/1049628848.db2.gz BCKCSBZRABEHPQ-UHFFFAOYSA-N 2 1 344.543 4.178 20 0 EIADMP C[N@@H+](Cc1ccc(-n2ccnc2)cc1)[C@H]1CCc2c(F)cccc2C1 ZINC001171440381 1049691351 /nfs/dbraw/zinc/69/13/51/1049691351.db2.gz IGWKFKQYDDALFK-IBGZPJMESA-N 2 1 335.426 4.001 20 0 EIADMP C[C@H](C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)CC(F)(F)F ZINC000716680011 1049702361 /nfs/dbraw/zinc/70/23/61/1049702361.db2.gz PKASZECXGJWRAE-DKIMLUQUSA-N 2 1 340.433 4.218 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2ccccc2N2CCCC2)CC1(C)C ZINC001171618810 1049767300 /nfs/dbraw/zinc/76/73/00/1049767300.db2.gz DBOZYYWFLPBVMG-UHFFFAOYSA-N 2 1 329.532 4.028 20 0 EIADMP C[NH+]1C(C)(C)CC([N@H+]2CCC[C@@H](Sc3ccncc3)C2)CC1(C)C ZINC001171639984 1049778632 /nfs/dbraw/zinc/77/86/32/1049778632.db2.gz XPQDKCGZUGCJEG-GOSISDBHSA-N 2 1 347.572 4.290 20 0 EIADMP C[C@@H]([NH3+])Cc1cn([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171733305 1049786900 /nfs/dbraw/zinc/78/69/00/1049786900.db2.gz QEARQCZLYKTWFO-DBXWQHBBSA-N 2 1 347.506 4.367 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)[C@H]2Cc3cccc(F)c3C2)CC1 ZINC001171786967 1049804884 /nfs/dbraw/zinc/80/48/84/1049804884.db2.gz FVDKOJJFZNUHSV-FHWLQOOXSA-N 2 1 330.491 4.055 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCc2ccccc2F)CC[N@H+]1Cc1ccccc1 ZINC001171963275 1049825669 /nfs/dbraw/zinc/82/56/69/1049825669.db2.gz HMSDNDGKMLSGLU-FQEVSTJZSA-N 2 1 340.486 4.401 20 0 EIADMP COc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171962431 1049825783 /nfs/dbraw/zinc/82/57/83/1049825783.db2.gz CYOVIGXDNZBAFR-HXUWFJFHSA-N 2 1 338.495 4.228 20 0 EIADMP CC1(C)C[C@H]([NH+]2CCC[C@@H](C(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171988794 1049831434 /nfs/dbraw/zinc/83/14/34/1049831434.db2.gz VRFUJMDJBBDNMD-QZTJIDSGSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CCC[C@@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171988794 1049831439 /nfs/dbraw/zinc/83/14/39/1049831439.db2.gz VRFUJMDJBBDNMD-QZTJIDSGSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CCC[C@@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171988794 1049831440 /nfs/dbraw/zinc/83/14/40/1049831440.db2.gz VRFUJMDJBBDNMD-QZTJIDSGSA-N 2 1 336.470 4.407 20 0 EIADMP Fc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000245697635 1049831654 /nfs/dbraw/zinc/83/16/54/1049831654.db2.gz LGIYGHUIYIOZNV-DKUWSORSSA-N 2 1 338.470 4.153 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH+]1CCC([NH+]2CCCC2)CC1 ZINC001171970365 1049834674 /nfs/dbraw/zinc/83/46/74/1049834674.db2.gz NQJRMUCEHAGEFA-OAHLLOKOSA-N 2 1 340.433 4.197 20 0 EIADMP C[C@H](CCCC(C)(C)O)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171972622 1049834690 /nfs/dbraw/zinc/83/46/90/1049834690.db2.gz RRDFWUDAAWBPHJ-QUCCMNQESA-N 2 1 346.559 4.349 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2CCCc3ncccc32)CC[N@H+]1Cc1ccccc1 ZINC001171982336 1049838752 /nfs/dbraw/zinc/83/87/52/1049838752.db2.gz HJOUFBCACLODOJ-KNQAVFIVSA-N 2 1 349.522 4.492 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2CCCc3cnccc32)CC[N@H+]1Cc1ccccc1 ZINC001171980487 1049839182 /nfs/dbraw/zinc/83/91/82/1049839182.db2.gz VNXRCFCSOBXWHF-UNMCSNQZSA-N 2 1 349.522 4.492 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[N@H+]2[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171986175 1049840160 /nfs/dbraw/zinc/84/01/60/1049840160.db2.gz GCAYABMUEPSNBF-JQKXYWIWSA-N 2 1 342.527 4.071 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171986175 1049840162 /nfs/dbraw/zinc/84/01/62/1049840162.db2.gz GCAYABMUEPSNBF-JQKXYWIWSA-N 2 1 342.527 4.071 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[NH+]2[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171986175 1049840163 /nfs/dbraw/zinc/84/01/63/1049840163.db2.gz GCAYABMUEPSNBF-JQKXYWIWSA-N 2 1 342.527 4.071 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[NH+]2[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171986175 1049840164 /nfs/dbraw/zinc/84/01/64/1049840164.db2.gz GCAYABMUEPSNBF-JQKXYWIWSA-N 2 1 342.527 4.071 20 0 EIADMP CC1(C)C[C@H](N2CC[C@@H]([NH3+])c3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC001171984476 1049841097 /nfs/dbraw/zinc/84/10/97/1049841097.db2.gz WBDLPIVSTRLZID-TZIWHRDSSA-N 2 1 349.522 4.340 20 0 EIADMP FCC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172075689 1049843975 /nfs/dbraw/zinc/84/39/75/1049843975.db2.gz SCYLYTZUTRNJBI-WKCHPHFGSA-N 2 1 330.491 4.254 20 0 EIADMP C[N@@H+](CCc1ccccn1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172080068 1049846241 /nfs/dbraw/zinc/84/62/41/1049846241.db2.gz SSKHAOUFIRGTJI-JKHIJQBDSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1ccccn1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172080068 1049846249 /nfs/dbraw/zinc/84/62/49/1049846249.db2.gz SSKHAOUFIRGTJI-JKHIJQBDSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1ccccn1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172080068 1049846252 /nfs/dbraw/zinc/84/62/52/1049846252.db2.gz SSKHAOUFIRGTJI-JKHIJQBDSA-N 2 1 349.522 4.142 20 0 EIADMP CO[C@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172078804 1049846460 /nfs/dbraw/zinc/84/64/60/1049846460.db2.gz IXJKXAMNDOMHJC-MRWPOJJOSA-N 2 1 342.527 4.119 20 0 EIADMP CCN(Cc1ccccn1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172082772 1049847413 /nfs/dbraw/zinc/84/74/13/1049847413.db2.gz LTHOYXXGFUYFJQ-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP CC[N@H+](Cc1ccccn1)[C@H]1C[C@H]2CCC[C@@H](C1)N2Cc1ccccc1 ZINC001172082772 1049847417 /nfs/dbraw/zinc/84/74/17/1049847417.db2.gz LTHOYXXGFUYFJQ-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP CC[N@@H+](Cc1ccccn1)[C@H]1C[C@H]2CCC[C@@H](C1)N2Cc1ccccc1 ZINC001172082772 1049847419 /nfs/dbraw/zinc/84/74/19/1049847419.db2.gz LTHOYXXGFUYFJQ-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP Cc1ccccc1[C@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172099946 1049850096 /nfs/dbraw/zinc/85/00/96/1049850096.db2.gz NVKSIITYDMAWCP-XWSHUIEDSA-N 2 1 335.495 4.084 20 0 EIADMP Cc1ccccc1[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172099946 1049850102 /nfs/dbraw/zinc/85/01/02/1049850102.db2.gz NVKSIITYDMAWCP-XWSHUIEDSA-N 2 1 335.495 4.084 20 0 EIADMP c1ccc(CC[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001172063660 1049850312 /nfs/dbraw/zinc/85/03/12/1049850312.db2.gz AYQWAVFRWBPYJH-WBDAEOGXSA-N 2 1 334.507 4.404 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]CC[C@H]2CCCCO2)C3)cc1 ZINC001172062532 1049850323 /nfs/dbraw/zinc/85/03/23/1049850323.db2.gz OZDJKRIVBBWXFB-CIAFKFPVSA-N 2 1 342.527 4.121 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](NCc1cc(F)c(Cl)cc1Cl)C2 ZINC001172100426 1049850457 /nfs/dbraw/zinc/85/04/57/1049850457.db2.gz QKPBIVHEUBHRJD-CLLJXQQHSA-N 2 1 331.262 4.237 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1Cl)C2 ZINC001172100426 1049850458 /nfs/dbraw/zinc/85/04/58/1049850458.db2.gz QKPBIVHEUBHRJD-CLLJXQQHSA-N 2 1 331.262 4.237 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1Cl)C2 ZINC001172100426 1049850462 /nfs/dbraw/zinc/85/04/62/1049850462.db2.gz QKPBIVHEUBHRJD-CLLJXQQHSA-N 2 1 331.262 4.237 20 0 EIADMP F[C@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172069819 1049852894 /nfs/dbraw/zinc/85/28/94/1049852894.db2.gz XVPIOUWFWIHORO-CZLMFIFXSA-N 2 1 330.491 4.442 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCc3cc(C(F)(F)F)ccc3C1)C2 ZINC001172127996 1049853321 /nfs/dbraw/zinc/85/33/21/1049853321.db2.gz NHDHFFCBBXHHQZ-BCDXTJNWSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCc3cc(C(F)(F)F)ccc3C1)C2 ZINC001172127996 1049853323 /nfs/dbraw/zinc/85/33/23/1049853323.db2.gz NHDHFFCBBXHHQZ-BCDXTJNWSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCc3cc(C(F)(F)F)ccc3C1)C2 ZINC001172127996 1049853326 /nfs/dbraw/zinc/85/33/26/1049853326.db2.gz NHDHFFCBBXHHQZ-BCDXTJNWSA-N 2 1 338.417 4.079 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Cc3cccc(F)c3)CC1)C2 ZINC001172129309 1049854581 /nfs/dbraw/zinc/85/45/81/1049854581.db2.gz YGATZMOWHJHRGL-AERCQKQUSA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Cc3cccc(F)c3)CC1)C2 ZINC001172129309 1049854584 /nfs/dbraw/zinc/85/45/84/1049854584.db2.gz YGATZMOWHJHRGL-AERCQKQUSA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](N[C@H](c1ccccc1)[C@H]([NH3+])c1ccccc1)C2 ZINC001172101589 1049855441 /nfs/dbraw/zinc/85/54/41/1049855441.db2.gz ZQJMJDQJRVPUSB-PFDCGNQRSA-N 2 1 349.522 4.033 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108402 1049856684 /nfs/dbraw/zinc/85/66/84/1049856684.db2.gz AAORPMLCJSBXIZ-KJJMTIBFSA-N 2 1 342.527 4.149 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108402 1049856686 /nfs/dbraw/zinc/85/66/86/1049856686.db2.gz AAORPMLCJSBXIZ-KJJMTIBFSA-N 2 1 342.527 4.149 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1Br ZINC001172105058 1049857227 /nfs/dbraw/zinc/85/72/27/1049857227.db2.gz FSDXXQABBADJTD-ZQDZILKHSA-N 2 1 337.305 4.115 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1Br ZINC001172105058 1049857228 /nfs/dbraw/zinc/85/72/28/1049857228.db2.gz FSDXXQABBADJTD-ZQDZILKHSA-N 2 1 337.305 4.115 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1cc(Cl)cc(Cl)c1)C2 ZINC001172107671 1049857712 /nfs/dbraw/zinc/85/77/12/1049857712.db2.gz GIQSJZYWJQHGGW-OSYLJGHBSA-N 2 1 327.299 4.141 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(-c3cccc(Cl)c3)no1)C2 ZINC001172117836 1049859200 /nfs/dbraw/zinc/85/92/00/1049859200.db2.gz NMVKADBDTJMGJC-BJWYYQGGSA-N 2 1 345.874 4.100 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(-c3cccc(Cl)c3)no1)C2 ZINC001172117836 1049859203 /nfs/dbraw/zinc/85/92/03/1049859203.db2.gz NMVKADBDTJMGJC-BJWYYQGGSA-N 2 1 345.874 4.100 20 0 EIADMP c1ccc2c(c1)C[C@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CS2 ZINC001172203693 1049863747 /nfs/dbraw/zinc/86/37/47/1049863747.db2.gz VDCHGTQUHDFXGG-OALUTQOASA-N 2 1 330.541 4.044 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338331 1049888262 /nfs/dbraw/zinc/88/82/62/1049888262.db2.gz YITITDVMSAJPDY-YHELAOLJSA-N 2 1 332.532 4.352 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC([NH3+])(c2ccccc2Cl)CC1 ZINC001172338930 1049888687 /nfs/dbraw/zinc/88/86/87/1049888687.db2.gz ZPTRDAJAYKVULU-CVEARBPZSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@@H](CC(C)C)[NH+]1CCC2(CC1)C[N@@H+](Cc1ccccc1)CCO2 ZINC001172398019 1049907267 /nfs/dbraw/zinc/90/72/67/1049907267.db2.gz MTKKZRKVMGGYMO-NRFANRHFSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@H](C)[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172453242 1049916332 /nfs/dbraw/zinc/91/63/32/1049916332.db2.gz FRPUHDBNGXOMTI-RBBKRZOGSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172453242 1049916335 /nfs/dbraw/zinc/91/63/35/1049916335.db2.gz FRPUHDBNGXOMTI-RBBKRZOGSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172453242 1049916338 /nfs/dbraw/zinc/91/63/38/1049916338.db2.gz FRPUHDBNGXOMTI-RBBKRZOGSA-N 2 1 344.543 4.178 20 0 EIADMP [NH3+]C1(c2cccc(F)c2)CC[NH+]([C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172558888 1049933423 /nfs/dbraw/zinc/93/34/23/1049933423.db2.gz XZZHGVKDBYIPIB-WIYYLYMNSA-N 2 1 338.470 4.412 20 0 EIADMP [NH3+][C@@H]1CC[N@H+](Cc2ccccc2Oc2cccc(Cl)c2)CC[C@H]1F ZINC001206174473 1049971216 /nfs/dbraw/zinc/97/12/16/1049971216.db2.gz NFBYGAVVGAUBSW-QZTJIDSGSA-N 2 1 348.849 4.394 20 0 EIADMP [NH3+][C@@H]1CC[N@@H+](Cc2ccccc2Oc2cccc(Cl)c2)CC[C@H]1F ZINC001206174473 1049971218 /nfs/dbraw/zinc/97/12/18/1049971218.db2.gz NFBYGAVVGAUBSW-QZTJIDSGSA-N 2 1 348.849 4.394 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2cccc(Br)c21 ZINC000247003844 1050009678 /nfs/dbraw/zinc/00/96/78/1050009678.db2.gz KVIRHUJTDJHUEY-XNJGSVPQSA-N 2 1 349.316 4.071 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC(C)(C)OC2(C)C)[C@@H]1c1cccs1 ZINC000248132766 1050043582 /nfs/dbraw/zinc/04/35/82/1050043582.db2.gz ORQUBEGJEJNYEE-DJIMGWMZSA-N 2 1 336.545 4.067 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC(C)(C)OC2(C)C)[C@@H]1c1cccs1 ZINC000248132766 1050043585 /nfs/dbraw/zinc/04/35/85/1050043585.db2.gz ORQUBEGJEJNYEE-DJIMGWMZSA-N 2 1 336.545 4.067 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)CCS2 ZINC000248893049 1050083474 /nfs/dbraw/zinc/08/34/74/1050083474.db2.gz ZGNYFVITIOGBBW-APWZRJJASA-N 2 1 348.556 4.190 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Br)cc1 ZINC000251109882 1050154611 /nfs/dbraw/zinc/15/46/11/1050154611.db2.gz TXOITUSPGAUTNC-IKGGRYGDSA-N 2 1 337.305 4.117 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)[C@H](C)C1)CC2 ZINC001172825361 1050164429 /nfs/dbraw/zinc/16/44/29/1050164429.db2.gz GLUVZEQILGDFHR-CTUHWIOQSA-N 2 1 348.534 4.495 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)[C@H](C)C1)CC2 ZINC001172825361 1050164437 /nfs/dbraw/zinc/16/44/37/1050164437.db2.gz GLUVZEQILGDFHR-CTUHWIOQSA-N 2 1 348.534 4.495 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccc(C[NH2+][C@@H]3CCC[C@@H](C)CC3)cc2)C[C@H](C)O1 ZINC001177245566 1050172954 /nfs/dbraw/zinc/17/29/54/1050172954.db2.gz XOEYBIJLQXZKNC-NXWNEQKCSA-N 2 1 344.543 4.354 20 0 EIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(F)cc2Cl)[C@@H](C)C1 ZINC001172864992 1050175492 /nfs/dbraw/zinc/17/54/92/1050175492.db2.gz JFLZOMWEYHLLBZ-IYOUNJFTSA-N 2 1 326.887 4.119 20 0 EIADMP CCOc1c(Cl)cccc1C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC001177299248 1050180801 /nfs/dbraw/zinc/18/08/01/1050180801.db2.gz METZTIGLMJEHSP-MRXNPFEDSA-N 2 1 338.923 4.340 20 0 EIADMP COc1ccc(Cl)cc1C[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC001177278359 1050188684 /nfs/dbraw/zinc/18/86/84/1050188684.db2.gz WNKBRGBRGHBMIT-UHFFFAOYSA-N 2 1 346.902 4.479 20 0 EIADMP C[C@H](CSc1ccc(Cl)cc1)n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001172881814 1050222428 /nfs/dbraw/zinc/22/24/28/1050222428.db2.gz KXMNSFMRQINSHR-CYBMUJFWSA-N 2 1 335.904 4.357 20 0 EIADMP CO[C@@H]1CCC[C@H]([N@@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172927991 1050238137 /nfs/dbraw/zinc/23/81/37/1050238137.db2.gz IETBPSYETATTOD-XSDIEEQYSA-N 2 1 330.516 4.025 20 0 EIADMP CO[C@@H]1CCC[C@@H]([N@@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)C1 ZINC001172943933 1050242956 /nfs/dbraw/zinc/24/29/56/1050242956.db2.gz VGVRMMORFWDIIV-MLMGXCOMSA-N 2 1 342.527 4.055 20 0 EIADMP CO[C@@H]1CCC[C@@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@H+](C)C(C)C)[C@H]3C2)C1 ZINC001172943933 1050242969 /nfs/dbraw/zinc/24/29/69/1050242969.db2.gz VGVRMMORFWDIIV-MLMGXCOMSA-N 2 1 342.527 4.055 20 0 EIADMP CO[C@@H]1CCC[C@@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@@H+](C)C(C)C)[C@H]3C2)C1 ZINC001172943933 1050242985 /nfs/dbraw/zinc/24/29/85/1050242985.db2.gz VGVRMMORFWDIIV-MLMGXCOMSA-N 2 1 342.527 4.055 20 0 EIADMP CC[C@@H](C[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC001177668758 1050274788 /nfs/dbraw/zinc/27/47/88/1050274788.db2.gz CNHNQGRCNOUQAM-VXKWHMMOSA-N 2 1 336.523 4.334 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccccc2Cl)[C@@H](C)C1 ZINC000252646026 1050284090 /nfs/dbraw/zinc/28/40/90/1050284090.db2.gz DFZLZGZUGJBJQP-BXWFABGCSA-N 2 1 338.923 4.128 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccccc2Cl)[C@@H](C)C1 ZINC000252646026 1050284102 /nfs/dbraw/zinc/28/41/02/1050284102.db2.gz DFZLZGZUGJBJQP-BXWFABGCSA-N 2 1 338.923 4.128 20 0 EIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+][C@@H]1CCCc2c(cccc2OC)C1 ZINC001177741879 1050292649 /nfs/dbraw/zinc/29/26/49/1050292649.db2.gz DZCQLOHBHKPSCG-UXHICEINSA-N 2 1 344.543 4.187 20 0 EIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+][C@@H]1CCCc2c(cccc2OC)C1 ZINC001177741879 1050292665 /nfs/dbraw/zinc/29/26/65/1050292665.db2.gz DZCQLOHBHKPSCG-UXHICEINSA-N 2 1 344.543 4.187 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@H](c3ccccc3OC)C2)CC1 ZINC001173109049 1050306959 /nfs/dbraw/zinc/30/69/59/1050306959.db2.gz VZRIYHKIDAVOMO-VIQWUECVSA-N 2 1 330.516 4.138 20 0 EIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)ccc2C(F)(F)F)CC1 ZINC001206311255 1050334259 /nfs/dbraw/zinc/33/42/59/1050334259.db2.gz LHWMRYRKLHGIHB-HNNXBMFYSA-N 2 1 334.813 4.310 20 0 EIADMP CCCC[C@H](CC(C)C)n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001173262100 1050386508 /nfs/dbraw/zinc/38/65/08/1050386508.db2.gz SEYPIRMKHQGRSG-QGZVFWFLSA-N 2 1 334.552 4.146 20 0 EIADMP C[N@@H+](C1CCOCC1)C1CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173344312 1050433808 /nfs/dbraw/zinc/43/38/08/1050433808.db2.gz VAVLZDUYYSAVCA-NRFANRHFSA-N 2 1 348.575 4.455 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC[C@H]1CCC[N@H+]1C ZINC001173540379 1050475767 /nfs/dbraw/zinc/47/57/67/1050475767.db2.gz WMLPRIWYNPAOML-UKRRQHHQSA-N 2 1 329.315 4.388 20 0 EIADMP Cc1cc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)cc(C)c1-c1ccc(F)cc1 ZINC001206211316 1050531402 /nfs/dbraw/zinc/53/14/02/1050531402.db2.gz NJZHDJAOCWXFKH-PMACEKPBSA-N 2 1 344.449 4.371 20 0 EIADMP Cc1cc(C[N@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)cc(C)c1-c1ccc(F)cc1 ZINC001206211316 1050531413 /nfs/dbraw/zinc/53/14/13/1050531413.db2.gz NJZHDJAOCWXFKH-PMACEKPBSA-N 2 1 344.449 4.371 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cccc3c[nH]nc32)CC[N@@H+]1Cc1ccccc1 ZINC000093318220 1050559662 /nfs/dbraw/zinc/55/96/62/1050559662.db2.gz HDEIUPFRWFGURN-DYESRHJHSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cccc3c[nH]nc32)CC[N@H+]1Cc1ccccc1 ZINC000093318220 1050559671 /nfs/dbraw/zinc/55/96/71/1050559671.db2.gz HDEIUPFRWFGURN-DYESRHJHSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2cccc3c[nH]nc32)CC[NH+]1Cc1ccccc1 ZINC000093318220 1050559682 /nfs/dbraw/zinc/55/96/82/1050559682.db2.gz HDEIUPFRWFGURN-DYESRHJHSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cccc3c[nH]nc32)CC[NH+]1Cc1ccccc1 ZINC000093318220 1050559687 /nfs/dbraw/zinc/55/96/87/1050559687.db2.gz HDEIUPFRWFGURN-DYESRHJHSA-N 2 1 348.494 4.048 20 0 EIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1C ZINC001179110019 1050634431 /nfs/dbraw/zinc/63/44/31/1050634431.db2.gz FAQOCOTYYBSIBT-NFBKMPQASA-N 2 1 336.523 4.489 20 0 EIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1C ZINC001179110019 1050634437 /nfs/dbraw/zinc/63/44/37/1050634437.db2.gz FAQOCOTYYBSIBT-NFBKMPQASA-N 2 1 336.523 4.489 20 0 EIADMP COc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1C ZINC001179205095 1050649744 /nfs/dbraw/zinc/64/97/44/1050649744.db2.gz JHIUIRRSTJJVLO-LAUBAEHRSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1C ZINC001179205095 1050649748 /nfs/dbraw/zinc/64/97/48/1050649748.db2.gz JHIUIRRSTJJVLO-LAUBAEHRSA-N 2 1 338.495 4.146 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccccc1N(C)C ZINC000093942348 1050723193 /nfs/dbraw/zinc/72/31/93/1050723193.db2.gz KKPAILRFHCQAGF-GOSISDBHSA-N 2 1 339.527 4.444 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CCC(C)(C)CO2)CC[N@@H+]1Cc1ccccc1 ZINC001179686364 1050748471 /nfs/dbraw/zinc/74/84/71/1050748471.db2.gz WMJLIOHKNRRLEQ-HLAWJBBLSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CCC(C)(C)CO2)CC[N@H+]1Cc1ccccc1 ZINC001179686364 1050748478 /nfs/dbraw/zinc/74/84/78/1050748478.db2.gz WMJLIOHKNRRLEQ-HLAWJBBLSA-N 2 1 344.543 4.224 20 0 EIADMP CCc1ccc(C[NH2+][C@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)o1 ZINC001179771408 1050768222 /nfs/dbraw/zinc/76/82/22/1050768222.db2.gz CNEBXRAPLJGOCQ-AABGKKOBSA-N 2 1 338.495 4.232 20 0 EIADMP Cc1cc(C)c(/C=C\C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1C ZINC001180082798 1050879390 /nfs/dbraw/zinc/87/93/90/1050879390.db2.gz SWBPQGADZJTFBC-RMUOZIPVSA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C\C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1C ZINC001180082798 1050879393 /nfs/dbraw/zinc/87/93/93/1050879393.db2.gz SWBPQGADZJTFBC-RMUOZIPVSA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C\C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1C ZINC001180082798 1050879396 /nfs/dbraw/zinc/87/93/96/1050879396.db2.gz SWBPQGADZJTFBC-RMUOZIPVSA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1C ZINC001180082798 1050879403 /nfs/dbraw/zinc/87/94/03/1050879403.db2.gz SWBPQGADZJTFBC-RMUOZIPVSA-N 2 1 326.528 4.289 20 0 EIADMP CO[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001180350280 1050965062 /nfs/dbraw/zinc/96/50/62/1050965062.db2.gz XOTYMGOJWPLFAR-YUXAGFNASA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@@H]1C[N@H+](C[C@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)CCO1 ZINC001180540012 1051028288 /nfs/dbraw/zinc/02/82/88/1051028288.db2.gz FKTXUWFYFRVGHF-IRLDBZIGSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@@H]1C[N@@H+](C[C@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)CCO1 ZINC001180540012 1051028301 /nfs/dbraw/zinc/02/83/01/1051028301.db2.gz FKTXUWFYFRVGHF-IRLDBZIGSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@@H]1C[NH+](C[C@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)CCO1 ZINC001180540012 1051028315 /nfs/dbraw/zinc/02/83/15/1051028315.db2.gz FKTXUWFYFRVGHF-IRLDBZIGSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@@H]1C[NH+](C[C@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC001180540012 1051028330 /nfs/dbraw/zinc/02/83/30/1051028330.db2.gz FKTXUWFYFRVGHF-IRLDBZIGSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)(C)[C@@]1(C[N@H+]2CCCSCC2)CC[NH+](Cc2ccccc2)C1 ZINC001180739737 1051071160 /nfs/dbraw/zinc/07/11/60/1051071160.db2.gz GVIAHDHXLKCABX-OAQYLSRUSA-N 2 1 346.584 4.364 20 0 EIADMP CC(C)(C)[C@@]1(C[NH+]2CCCSCC2)CC[N@H+](Cc2ccccc2)C1 ZINC001180739737 1051071175 /nfs/dbraw/zinc/07/11/75/1051071175.db2.gz GVIAHDHXLKCABX-OAQYLSRUSA-N 2 1 346.584 4.364 20 0 EIADMP CC(C)(C)[C@@]1(C[NH+]2CCCSCC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001180739737 1051071186 /nfs/dbraw/zinc/07/11/86/1051071186.db2.gz GVIAHDHXLKCABX-OAQYLSRUSA-N 2 1 346.584 4.364 20 0 EIADMP C[C@H](CCC1CCCCC1)[NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC001180802467 1051088164 /nfs/dbraw/zinc/08/81/64/1051088164.db2.gz QWLFDKWMGRIRJH-XMSQKQJNSA-N 2 1 344.543 4.092 20 0 EIADMP CC[NH+](CC)CCC[N@@H+](Cc1ccc(Br)cc1)C(C)C ZINC001190509630 1051198335 /nfs/dbraw/zinc/19/83/35/1051198335.db2.gz GPESDWQPTXKUOA-UHFFFAOYSA-N 2 1 341.337 4.391 20 0 EIADMP C[C@]1(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)CC1(Cl)Cl ZINC001190825831 1051286132 /nfs/dbraw/zinc/28/61/32/1051286132.db2.gz CXYYDJWWJLCWBG-JKSUJKDBSA-N 2 1 333.347 4.158 20 0 EIADMP C[C@]1(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)CC1(Cl)Cl ZINC001190825831 1051286143 /nfs/dbraw/zinc/28/61/43/1051286143.db2.gz CXYYDJWWJLCWBG-JKSUJKDBSA-N 2 1 333.347 4.158 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCc2ccccc2Cl)C1 ZINC001191057543 1051335641 /nfs/dbraw/zinc/33/56/41/1051335641.db2.gz KIKZWQCPXVYFGH-QZTJIDSGSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCc2ccccc2Cl)C1 ZINC001191057543 1051335651 /nfs/dbraw/zinc/33/56/51/1051335651.db2.gz KIKZWQCPXVYFGH-QZTJIDSGSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCc2ccccc2Cl)C1 ZINC001191057543 1051335658 /nfs/dbraw/zinc/33/56/58/1051335658.db2.gz KIKZWQCPXVYFGH-QZTJIDSGSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCc2ccccc2Cl)C1 ZINC001191057543 1051335667 /nfs/dbraw/zinc/33/56/67/1051335667.db2.gz KIKZWQCPXVYFGH-QZTJIDSGSA-N 2 1 334.935 4.469 20 0 EIADMP CSc1ccccc1C[C@@H](C)[NH2+][C@@H](CC(C)C)C[NH+]1CCCC1 ZINC001181935522 1051357489 /nfs/dbraw/zinc/35/74/89/1051357489.db2.gz ZJABCXMNFISGMQ-MJGOQNOKSA-N 2 1 334.573 4.440 20 0 EIADMP CC(C)CC[NH+]1CCC([NH2+]Cc2ccc(OC(F)F)c(F)c2)CC1 ZINC001181999419 1051369093 /nfs/dbraw/zinc/36/90/93/1051369093.db2.gz XLXVCVPWDNCGDX-UHFFFAOYSA-N 2 1 344.421 4.027 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](c2ccc(F)cc2)C1(C)C ZINC001175240242 1051466785 /nfs/dbraw/zinc/46/67/85/1051466785.db2.gz YRBDIVSNTSARGW-LJQANCHMSA-N 2 1 329.463 4.379 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](c2ccc(F)cc2)C1(C)C ZINC001175240242 1051466790 /nfs/dbraw/zinc/46/67/90/1051466790.db2.gz YRBDIVSNTSARGW-LJQANCHMSA-N 2 1 329.463 4.379 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCc2cccc(F)c2)CC1 ZINC001191550812 1051486953 /nfs/dbraw/zinc/48/69/53/1051486953.db2.gz MFFWAIPPKWYRLV-SFHVURJKSA-N 2 1 332.507 4.345 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158099145 1051710106 /nfs/dbraw/zinc/71/01/06/1051710106.db2.gz QPGLTDHJYHYLNR-DOTOQJQBSA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000158099145 1051710122 /nfs/dbraw/zinc/71/01/22/1051710122.db2.gz QPGLTDHJYHYLNR-DOTOQJQBSA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158121834 1051715044 /nfs/dbraw/zinc/71/50/44/1051715044.db2.gz ILBNBCXINLRJFN-ZFWWWQNUSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000158121834 1051715052 /nfs/dbraw/zinc/71/50/52/1051715052.db2.gz ILBNBCXINLRJFN-ZFWWWQNUSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158196464 1051724922 /nfs/dbraw/zinc/72/49/22/1051724922.db2.gz GRRPLLLPXRNGFU-CRAIPNDOSA-N 2 1 343.540 4.035 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000158196464 1051724935 /nfs/dbraw/zinc/72/49/35/1051724935.db2.gz GRRPLLLPXRNGFU-CRAIPNDOSA-N 2 1 343.540 4.035 20 0 EIADMP CC(C)[N@H+]1CC[C@H]1C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001182871861 1051725912 /nfs/dbraw/zinc/72/59/12/1051725912.db2.gz WFVMFXNTZNBTSN-HNNXBMFYSA-N 2 1 328.481 4.054 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@H](O)c2ccc(C)cc2)CC1)CC(C)C ZINC001192491050 1051745415 /nfs/dbraw/zinc/74/54/15/1051745415.db2.gz ZEAMAVZMBAOGCP-QFIPXVFZSA-N 2 1 346.559 4.108 20 0 EIADMP C[C@@H]1CC[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)CC[C@@H]1C[NH3+] ZINC001205602231 1051756156 /nfs/dbraw/zinc/75/61/56/1051756156.db2.gz HUAYSQCOFGMPIQ-VXGBXAGGSA-N 2 1 334.813 4.166 20 0 EIADMP COCC1([NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)CCCCC1 ZINC001183059817 1051780715 /nfs/dbraw/zinc/78/07/15/1051780715.db2.gz PEYNQZWOBYNXRV-PZJWPPBQSA-N 2 1 342.527 4.293 20 0 EIADMP COCC1([NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)CCCCC1 ZINC001183059817 1051780733 /nfs/dbraw/zinc/78/07/33/1051780733.db2.gz PEYNQZWOBYNXRV-PZJWPPBQSA-N 2 1 342.527 4.293 20 0 EIADMP C[C@@H](C[NH+](C)C)[C@H]1CCCC[N@@H+]1Cc1c(Cl)ccc2cccnc21 ZINC001183065560 1051782497 /nfs/dbraw/zinc/78/24/97/1051782497.db2.gz MBDFCQKDQJJFBW-HNAYVOBHSA-N 2 1 345.918 4.440 20 0 EIADMP C[C@@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1Cc1c(Cl)ccc2cccnc21 ZINC001183065560 1051782508 /nfs/dbraw/zinc/78/25/08/1051782508.db2.gz MBDFCQKDQJJFBW-HNAYVOBHSA-N 2 1 345.918 4.440 20 0 EIADMP COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]CCCc1c[nH+]cn1C ZINC001192690053 1051792949 /nfs/dbraw/zinc/79/29/49/1051792949.db2.gz ORCBORHRLOPCBI-SFHVURJKSA-N 2 1 349.906 4.392 20 0 EIADMP Cc1cc(C)cc(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)c1 ZINC000716715832 1051831301 /nfs/dbraw/zinc/83/13/01/1051831301.db2.gz YCFMFOGATKESSX-ZRBLBEILSA-N 2 1 334.507 4.446 20 0 EIADMP C[N@@H+]1Cc2c(Nc3ccc(C[NH3+])cc3)cccc2[C@@H](c2ccccc2)C1 ZINC001175971774 1051854182 /nfs/dbraw/zinc/85/41/82/1051854182.db2.gz OPKOCWNFZZHHKG-OAQYLSRUSA-N 2 1 343.474 4.466 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001193091731 1051874702 /nfs/dbraw/zinc/87/47/02/1051874702.db2.gz BHDIIDPAQQWFPA-CYGODWOOSA-N 2 1 347.506 4.414 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001193249483 1051890969 /nfs/dbraw/zinc/89/09/69/1051890969.db2.gz NAPLJYBWCOVLHG-HOCLYGCPSA-N 2 1 338.442 4.031 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2C[C@H](C)c3c2cccc3Br)CC1 ZINC000159305588 1051974503 /nfs/dbraw/zinc/97/45/03/1051974503.db2.gz YBNNYZJMNOIRLO-BLLLJJGKSA-N 2 1 337.305 4.071 20 0 EIADMP C[C@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263196 1051986598 /nfs/dbraw/zinc/98/65/98/1051986598.db2.gz QYJJLQWTRJERCO-PDGJWGCVSA-N 2 1 326.528 4.267 20 0 EIADMP C[C@H]1CCCC[C@@H]1C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263196 1051986612 /nfs/dbraw/zinc/98/66/12/1051986612.db2.gz QYJJLQWTRJERCO-PDGJWGCVSA-N 2 1 326.528 4.267 20 0 EIADMP C[C@H]1CCCC[C@@H]1C[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263196 1051986624 /nfs/dbraw/zinc/98/66/24/1051986624.db2.gz QYJJLQWTRJERCO-PDGJWGCVSA-N 2 1 326.528 4.267 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)c2ccccc12 ZINC000164616620 1052035400 /nfs/dbraw/zinc/03/54/00/1052035400.db2.gz PMSWFLUUDKOVSS-MRXNPFEDSA-N 2 1 337.467 4.484 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000164696863 1052036959 /nfs/dbraw/zinc/03/69/59/1052036959.db2.gz GANOEQXCNQOOJL-HNNXBMFYSA-N 2 1 340.496 4.446 20 0 EIADMP Cc1cc(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cs1 ZINC001194269920 1052122648 /nfs/dbraw/zinc/12/26/48/1052122648.db2.gz SELJFFPVLAKVBZ-FQEVSTJZSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1cc(C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cs1 ZINC001194269920 1052122654 /nfs/dbraw/zinc/12/26/54/1052122654.db2.gz SELJFFPVLAKVBZ-FQEVSTJZSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1cc(C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)cs1 ZINC001194269920 1052122665 /nfs/dbraw/zinc/12/26/65/1052122665.db2.gz SELJFFPVLAKVBZ-FQEVSTJZSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1cc(C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cs1 ZINC001194269920 1052122672 /nfs/dbraw/zinc/12/26/72/1052122672.db2.gz SELJFFPVLAKVBZ-FQEVSTJZSA-N 2 1 326.509 4.155 20 0 EIADMP C[N@H+]1CC[C@]2(C1)CCC[NH+](CCCc1ccc(C(F)(F)F)cc1)C2 ZINC001194505163 1052162395 /nfs/dbraw/zinc/16/23/95/1052162395.db2.gz LPCUOZOSZNNFBC-SFHVURJKSA-N 2 1 340.433 4.056 20 0 EIADMP C[NH+]1CC[C@]2(C1)CCC[N@H+](CCCc1ccc(C(F)(F)F)cc1)C2 ZINC001194505163 1052162397 /nfs/dbraw/zinc/16/23/97/1052162397.db2.gz LPCUOZOSZNNFBC-SFHVURJKSA-N 2 1 340.433 4.056 20 0 EIADMP C[NH+]1CC[C@]2(C1)CCC[N@@H+](CCCc1ccc(C(F)(F)F)cc1)C2 ZINC001194505163 1052162405 /nfs/dbraw/zinc/16/24/05/1052162405.db2.gz LPCUOZOSZNNFBC-SFHVURJKSA-N 2 1 340.433 4.056 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cc(C)cc(Br)c2)C[C@@H]1C ZINC000774903345 1052269317 /nfs/dbraw/zinc/26/93/17/1052269317.db2.gz MKSNUMMUCOJKBU-WMLDXEAASA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)cc(Br)c2)C[C@@H]1C ZINC000774903345 1052269320 /nfs/dbraw/zinc/26/93/20/1052269320.db2.gz MKSNUMMUCOJKBU-WMLDXEAASA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C)cc(Br)c2)C[C@@H]1C ZINC000774903345 1052269330 /nfs/dbraw/zinc/26/93/30/1052269330.db2.gz MKSNUMMUCOJKBU-WMLDXEAASA-N 2 1 339.321 4.062 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000339069032 1052551741 /nfs/dbraw/zinc/55/17/41/1052551741.db2.gz QJXPYHUQLBFOPO-SVFBPWRDSA-N 2 1 330.516 4.008 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)C1 ZINC000339069043 1052552194 /nfs/dbraw/zinc/55/21/94/1052552194.db2.gz QMTQCNBNPDQVNN-SJBKTWHCSA-N 2 1 344.543 4.256 20 0 EIADMP COc1cc([C@@H](C)[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349599 1052629750 /nfs/dbraw/zinc/62/97/50/1052629750.db2.gz GFVBJKDFFPRKOM-WBVHZDCISA-N 2 1 334.504 4.006 20 0 EIADMP COc1cc([C@@H](C)[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349599 1052629753 /nfs/dbraw/zinc/62/97/53/1052629753.db2.gz GFVBJKDFFPRKOM-WBVHZDCISA-N 2 1 334.504 4.006 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2cccc3n[nH]cc32)cc1 ZINC000623357509 1052632422 /nfs/dbraw/zinc/63/24/22/1052632422.db2.gz SQSUXTHUOMPMIB-KRWDZBQOSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623382628 1052640438 /nfs/dbraw/zinc/64/04/38/1052640438.db2.gz NQGYSOUHKZLTGJ-BBRMVZONSA-N 2 1 328.422 4.099 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)CC1(C)C ZINC000623502764 1052668102 /nfs/dbraw/zinc/66/81/02/1052668102.db2.gz ZROXQPHMMZGAQL-MRXNPFEDSA-N 2 1 340.433 4.199 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000623526033 1052672416 /nfs/dbraw/zinc/67/24/16/1052672416.db2.gz HTSDRMDCLTWKJB-FUHWJXTLSA-N 2 1 339.483 4.397 20 0 EIADMP Cc1cnc(Cl)c(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1 ZINC000921508106 1052789958 /nfs/dbraw/zinc/78/99/58/1052789958.db2.gz VMIQRUHELMQEPK-UHFFFAOYSA-N 2 1 343.902 4.319 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCc2c3cc(Cl)ccc3[nH]c21 ZINC000623867804 1052825858 /nfs/dbraw/zinc/82/58/58/1052825858.db2.gz LHKPIIJRVMWXQG-SFHVURJKSA-N 2 1 342.874 4.384 20 0 EIADMP c1nc2c(s1)CCC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000623855159 1052826464 /nfs/dbraw/zinc/82/64/64/1052826464.db2.gz RORAFDHNNXFPFG-GOSISDBHSA-N 2 1 341.524 4.296 20 0 EIADMP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000623854705 1052826775 /nfs/dbraw/zinc/82/67/75/1052826775.db2.gz GTMFHKLIJHUEQA-IBGZPJMESA-N 2 1 343.902 4.415 20 0 EIADMP Cc1csc([C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)n1 ZINC000623924197 1052839057 /nfs/dbraw/zinc/83/90/57/1052839057.db2.gz VLRCZIRXESRYOW-LNLFQRSKSA-N 2 1 343.540 4.403 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624121279 1052867192 /nfs/dbraw/zinc/86/71/92/1052867192.db2.gz SCYUWCGFGVJXEN-OWCLPIDISA-N 2 1 331.529 4.110 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)CC[N@H+]1C ZINC000181798891 1052898427 /nfs/dbraw/zinc/89/84/27/1052898427.db2.gz KQODMOVTXGVFBR-CJNGLKHVSA-N 2 1 349.931 4.078 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)CC[N@H+]1C ZINC000181798849 1052898536 /nfs/dbraw/zinc/89/85/36/1052898536.db2.gz KQODMOVTXGVFBR-CZUORRHYSA-N 2 1 349.931 4.078 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCC[C@@H]2CCCCO2)cc1 ZINC000183989242 1052989042 /nfs/dbraw/zinc/98/90/42/1052989042.db2.gz RMUKVYZBMRWVBY-UZLBHIALSA-N 2 1 327.472 4.181 20 0 EIADMP FC(F)(F)c1cccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000381184595 1053057431 /nfs/dbraw/zinc/05/74/31/1053057431.db2.gz LMHMFXSTXULEEL-SFHVURJKSA-N 2 1 348.412 4.317 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000381210906 1053058787 /nfs/dbraw/zinc/05/87/87/1053058787.db2.gz UMPYGVHSJCBSQG-FGSXEWAUSA-N 2 1 338.495 4.084 20 0 EIADMP CO[C@@H](C)C[N@H+]1CCCCC[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001194940899 1053190874 /nfs/dbraw/zinc/19/08/74/1053190874.db2.gz CZCUHPVLRNEPBN-SIKLNZKXSA-N 2 1 344.543 4.178 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCC[N@H+](C)C(C)C)ccc1SC(F)F ZINC000764805215 1053318155 /nfs/dbraw/zinc/31/81/55/1053318155.db2.gz DCTOWTSPGXPNST-ZDUSSCGKSA-N 2 1 346.487 4.391 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCC[N@@H+](C)C(C)C)ccc1SC(F)F ZINC000764805215 1053318170 /nfs/dbraw/zinc/31/81/70/1053318170.db2.gz DCTOWTSPGXPNST-ZDUSSCGKSA-N 2 1 346.487 4.391 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)C1 ZINC000339070112 1053319949 /nfs/dbraw/zinc/31/99/49/1053319949.db2.gz WPWCKUPRTRSTIP-DYQZNNLLSA-N 2 1 344.543 4.112 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000383360170 1053329346 /nfs/dbraw/zinc/32/93/46/1053329346.db2.gz SHQAORAQKSFPSW-RDJZCZTQSA-N 2 1 330.422 4.138 20 0 EIADMP COc1ccc(CC[C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000764961020 1053399727 /nfs/dbraw/zinc/39/97/27/1053399727.db2.gz GJEVUWXMXUFTJL-RTBURBONSA-N 2 1 332.532 4.118 20 0 EIADMP c1cc2c(s1)CCC[C@@H]2[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000102196045 1053505150 /nfs/dbraw/zinc/50/51/50/1053505150.db2.gz WBPCLGZKKWPKJK-IBGZPJMESA-N 2 1 326.509 4.380 20 0 EIADMP CSCC1CCC([NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000385424947 1053522846 /nfs/dbraw/zinc/52/28/46/1053522846.db2.gz LCMVAGVBCYGMHR-AFVILVPDSA-N 2 1 346.584 4.408 20 0 EIADMP CC(C)(C)OC1CCC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000865697689 1053573857 /nfs/dbraw/zinc/57/38/57/1053573857.db2.gz BUDSFDRZDDIIIE-UHFFFAOYSA-N 2 1 344.543 4.367 20 0 EIADMP CCC(CC)(C[NH2+]Cc1ncc(C[NH+](C)C)s1)c1ccc(F)cc1 ZINC000853095859 1053645487 /nfs/dbraw/zinc/64/54/87/1053645487.db2.gz BMGKJVSFHHSOQT-UHFFFAOYSA-N 2 1 349.519 4.191 20 0 EIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cc2c(ccnc2Cl)o1 ZINC000866214868 1053653356 /nfs/dbraw/zinc/65/33/56/1053653356.db2.gz HEUGQCAYIGDVEP-NSHDSACASA-N 2 1 335.879 4.441 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)CCc1cccnc1 ZINC000866233189 1053657917 /nfs/dbraw/zinc/65/79/17/1053657917.db2.gz SGRDREPNVNFFFO-SFHVURJKSA-N 2 1 325.500 4.033 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000866281406 1053677353 /nfs/dbraw/zinc/67/73/53/1053677353.db2.gz HTYBNRFKIZIFIF-WOIUINJBSA-N 2 1 337.511 4.045 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000866281406 1053677355 /nfs/dbraw/zinc/67/73/55/1053677355.db2.gz HTYBNRFKIZIFIF-WOIUINJBSA-N 2 1 337.511 4.045 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc2c(ccnc2Cl)o1 ZINC000866392354 1053712767 /nfs/dbraw/zinc/71/27/67/1053712767.db2.gz AQFMHBJZWQCBQR-UKRRQHHQSA-N 2 1 347.890 4.254 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc2c(ccnc2Cl)o1 ZINC000866392354 1053712779 /nfs/dbraw/zinc/71/27/79/1053712779.db2.gz AQFMHBJZWQCBQR-UKRRQHHQSA-N 2 1 347.890 4.254 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC[C@@H]2CCSC2)CC1 ZINC000866402255 1053714877 /nfs/dbraw/zinc/71/48/77/1053714877.db2.gz ISFCSLZUDDYPBF-XEVCZEQESA-N 2 1 332.557 4.162 20 0 EIADMP FC(F)(F)[C@@H]1CC=CC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000866606827 1053801805 /nfs/dbraw/zinc/80/18/05/1053801805.db2.gz INRQZQIEXBUTKX-QZTJIDSGSA-N 2 1 338.417 4.138 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000386686416 1053820467 /nfs/dbraw/zinc/82/04/67/1053820467.db2.gz ZCRDBFWRGGDAMF-LVCYWYKZSA-N 2 1 338.495 4.084 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000386686416 1053820469 /nfs/dbraw/zinc/82/04/69/1053820469.db2.gz ZCRDBFWRGGDAMF-LVCYWYKZSA-N 2 1 338.495 4.084 20 0 EIADMP Cc1nc(C[N@H+](C)CCCC[NH+]2CCCCC2)sc1C(C)(C)C ZINC001197283305 1053875161 /nfs/dbraw/zinc/87/51/61/1053875161.db2.gz APRJEHWWQXFHGZ-UHFFFAOYSA-N 2 1 337.577 4.447 20 0 EIADMP Cc1nc(C[N@@H+](C)CCCC[NH+]2CCCCC2)sc1C(C)(C)C ZINC001197283305 1053875164 /nfs/dbraw/zinc/87/51/64/1053875164.db2.gz APRJEHWWQXFHGZ-UHFFFAOYSA-N 2 1 337.577 4.447 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000429533264 1054082846 /nfs/dbraw/zinc/08/28/46/1054082846.db2.gz ZSEZYQLJZXOVFH-OAQYLSRUSA-N 2 1 338.495 4.182 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000429533264 1054082861 /nfs/dbraw/zinc/08/28/61/1054082861.db2.gz ZSEZYQLJZXOVFH-OAQYLSRUSA-N 2 1 338.495 4.182 20 0 EIADMP CC1(C)CC[C@@H](C[NH+]2CCC(c3ccccc3)([NH+]3CCCC3)CC2)O1 ZINC001198203130 1054095583 /nfs/dbraw/zinc/09/55/83/1054095583.db2.gz WOMWXFIBFOCJGO-FQEVSTJZSA-N 2 1 342.527 4.031 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl ZINC000542667111 1054178866 /nfs/dbraw/zinc/17/88/66/1054178866.db2.gz WYFZVZWIYUGQNX-BJZITVGISA-N 2 1 331.891 4.407 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cccc(O)c2F)cc1 ZINC000872019163 1054333783 /nfs/dbraw/zinc/33/37/83/1054333783.db2.gz UGFOHJJLOGTUQD-OAHLLOKOSA-N 2 1 330.447 4.224 20 0 EIADMP CC[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000872082696 1054383012 /nfs/dbraw/zinc/38/30/12/1054383012.db2.gz ZUBKGWYSNOZCGB-ZACQAIPSSA-N 2 1 328.422 4.043 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc3ccc(F)c(F)c3n2)C1 ZINC001199344869 1054388671 /nfs/dbraw/zinc/38/86/71/1054388671.db2.gz LSFOQKLXGCJHPL-HNNXBMFYSA-N 2 1 347.453 4.115 20 0 EIADMP CC(C)Cc1ncc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC001199319960 1054390202 /nfs/dbraw/zinc/39/02/02/1054390202.db2.gz GIRMPLDZZQFKRL-CALCHBBNSA-N 2 1 337.577 4.189 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2ccsc2C(F)(F)F)C1 ZINC001199329166 1054393247 /nfs/dbraw/zinc/39/32/47/1054393247.db2.gz OIRUBPTVYDLVEA-BETUJISGSA-N 2 1 334.451 4.225 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccsc2C(F)(F)F)C1 ZINC001199329166 1054393249 /nfs/dbraw/zinc/39/32/49/1054393249.db2.gz OIRUBPTVYDLVEA-BETUJISGSA-N 2 1 334.451 4.225 20 0 EIADMP [NH3+][C@H](C[C@@H]1CCC[N@@H+](Cc2csc(C3CC3)n2)C1)C1CCCC1 ZINC000872156693 1054411952 /nfs/dbraw/zinc/41/19/52/1054411952.db2.gz LFYVEBYXQZGNLJ-KBXCAEBGSA-N 2 1 333.545 4.140 20 0 EIADMP COc1ccc(CC[C@@H](C)[NH2+]CC(C)(C)[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001199760308 1054463810 /nfs/dbraw/zinc/46/38/10/1054463810.db2.gz PSZOPWJJRUCZSB-CEXWTWQISA-N 2 1 346.559 4.362 20 0 EIADMP C[C@@]1(CN[C@@H]2CCCc3scnc32)CC[N@@H+](Cc2ccccc2)C1 ZINC000858414666 1054485494 /nfs/dbraw/zinc/48/54/94/1054485494.db2.gz FWWSCRMYXDMFKV-XLIONFOSSA-N 2 1 341.524 4.022 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000347536462 1054534253 /nfs/dbraw/zinc/53/42/53/1054534253.db2.gz HYJJZXMJOPNMNW-GOSISDBHSA-N 2 1 343.490 4.361 20 0 EIADMP C[N@@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](C[C@@H]1CC=CCC1)CC2 ZINC001201410351 1054803331 /nfs/dbraw/zinc/80/33/31/1054803331.db2.gz JNPWZSICIFPOQF-LJQANCHMSA-N 2 1 339.527 4.114 20 0 EIADMP Cc1ccc2[nH+]c(N)n(C3=C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2c1 ZINC001201470247 1054813806 /nfs/dbraw/zinc/81/38/06/1054813806.db2.gz PBYHGKIRHOYYOC-MSOLQXFVSA-N 2 1 344.462 4.205 20 0 EIADMP CCC(CC)C[NH+]1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201525630 1054844098 /nfs/dbraw/zinc/84/40/98/1054844098.db2.gz IGBXOONESOEJPU-NRFANRHFSA-N 2 1 344.543 4.178 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201609247 1054863704 /nfs/dbraw/zinc/86/37/04/1054863704.db2.gz FEKULCPALOKNJL-PKTZIBPZSA-N 2 1 334.507 4.073 20 0 EIADMP c1ccc(CC[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201609247 1054863707 /nfs/dbraw/zinc/86/37/07/1054863707.db2.gz FEKULCPALOKNJL-PKTZIBPZSA-N 2 1 334.507 4.073 20 0 EIADMP c1ccc(CC[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201609247 1054863709 /nfs/dbraw/zinc/86/37/09/1054863709.db2.gz FEKULCPALOKNJL-PKTZIBPZSA-N 2 1 334.507 4.073 20 0 EIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+](CCCc2ccccc2)CC1 ZINC001201671526 1054870882 /nfs/dbraw/zinc/87/08/82/1054870882.db2.gz HRGRXSJVAPTRQD-UHFFFAOYSA-N 2 1 340.486 4.355 20 0 EIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+](CCCc2ccccc2)CC1 ZINC001201671526 1054870889 /nfs/dbraw/zinc/87/08/89/1054870889.db2.gz HRGRXSJVAPTRQD-UHFFFAOYSA-N 2 1 340.486 4.355 20 0 EIADMP c1ccc(CCC[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC001201672753 1054873020 /nfs/dbraw/zinc/87/30/20/1054873020.db2.gz XEWPHMPDEHYQPR-GOTSBHOMSA-N 2 1 334.507 4.073 20 0 EIADMP CSCCC[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3cccs3)[C@@H]2C1 ZINC001201680820 1054875152 /nfs/dbraw/zinc/87/51/52/1054875152.db2.gz ODLXIDZCYDFOOY-CGTJXYLNSA-N 2 1 338.586 4.034 20 0 EIADMP CSCCC[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201680820 1054875160 /nfs/dbraw/zinc/87/51/60/1054875160.db2.gz ODLXIDZCYDFOOY-CGTJXYLNSA-N 2 1 338.586 4.034 20 0 EIADMP CSCCC[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201680820 1054875166 /nfs/dbraw/zinc/87/51/66/1054875166.db2.gz ODLXIDZCYDFOOY-CGTJXYLNSA-N 2 1 338.586 4.034 20 0 EIADMP C[C@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccncc1 ZINC000671750049 1054961867 /nfs/dbraw/zinc/96/18/67/1054961867.db2.gz OENDJDXHKZOCNO-OSFYOIPJSA-N 2 1 337.511 4.218 20 0 EIADMP COc1ccc(C)cc1C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000065976553 1054980748 /nfs/dbraw/zinc/98/07/48/1054980748.db2.gz SUEBEZJMMFGPRQ-UHFFFAOYSA-N 2 1 326.484 4.134 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2nc(Cl)cs2)cc1 ZINC000876931526 1054985078 /nfs/dbraw/zinc/98/50/78/1054985078.db2.gz OAFYRQODSKTETK-CQSZACIVSA-N 2 1 349.931 4.461 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2nc(Cl)cs2)cc1 ZINC000876931526 1054985086 /nfs/dbraw/zinc/98/50/86/1054985086.db2.gz OAFYRQODSKTETK-CQSZACIVSA-N 2 1 349.931 4.461 20 0 EIADMP CSC(C)(C)CC[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000877131178 1055023106 /nfs/dbraw/zinc/02/31/06/1055023106.db2.gz WBBFYXXPVKIZSC-UHFFFAOYSA-N 2 1 335.561 4.161 20 0 EIADMP Cc1ccc(C[N@H+]2CCOC3(CC[NH+](CCC(C)(C)C)CC3)C2)cc1 ZINC001202077817 1055038012 /nfs/dbraw/zinc/03/80/12/1055038012.db2.gz LOZGHABIZBVOOL-UHFFFAOYSA-N 2 1 344.543 4.098 20 0 EIADMP COCCC1(C[NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)CCCCC1 ZINC001202185182 1055074913 /nfs/dbraw/zinc/07/49/13/1055074913.db2.gz ZHKWOSDFBULDCF-HXUWFJFHSA-N 2 1 336.564 4.360 20 0 EIADMP Cc1ccc(-c2ccc(C[NH2+]CC(C)(C)C[NH+]3CCCC3)o2)cc1 ZINC001202233279 1055109381 /nfs/dbraw/zinc/10/93/81/1055109381.db2.gz LNMMAOAPAGBEFH-UHFFFAOYSA-N 2 1 326.484 4.467 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+]2C)ccc1OCCC(C)C ZINC001168604129 1055151435 /nfs/dbraw/zinc/15/14/35/1055151435.db2.gz KYBQANZSVTWHHW-MJGOQNOKSA-N 2 1 348.531 4.255 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474473033 1055883779 /nfs/dbraw/zinc/88/37/79/1055883779.db2.gz PLWYKDMHWRBJGI-SQHUISNBSA-N 2 1 331.426 4.174 20 0 EIADMP CSC[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(C(F)(F)F)cc1 ZINC000542844117 1056221876 /nfs/dbraw/zinc/22/18/76/1056221876.db2.gz NNMVDUYNLWJBND-INIZCTEOSA-N 2 1 346.462 4.185 20 0 EIADMP Cc1ccc([C@@H](C)Nc2ccc3c(c2)[nH+]cn3[C@@H]2CCC[NH2+]CC2)nc1 ZINC001168855023 1060462312 /nfs/dbraw/zinc/46/23/12/1060462312.db2.gz SKPZZGROGCVNNY-SJLPKXTDSA-N 2 1 349.482 4.227 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CCCc3c(Br)cccc31)C2 ZINC001169118260 1060646958 /nfs/dbraw/zinc/64/69/58/1060646958.db2.gz GEZJYGDACRZKHT-FLTUCWPJSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)Cc1ccccc1C(F)(F)F)C2 ZINC001169119391 1060647804 /nfs/dbraw/zinc/64/78/04/1060647804.db2.gz SIVRZKFGCRUFFF-MUJYYYPQSA-N 2 1 340.433 4.241 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccccc1Br)C2 ZINC001169124261 1060649462 /nfs/dbraw/zinc/64/94/62/1060649462.db2.gz BFCXBWYXSHPULW-BORJPKMPSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccccc1Br)C2 ZINC001169124261 1060649469 /nfs/dbraw/zinc/64/94/69/1060649469.db2.gz BFCXBWYXSHPULW-BORJPKMPSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1ccccc1Br)C2 ZINC001169124261 1060649474 /nfs/dbraw/zinc/64/94/74/1060649474.db2.gz BFCXBWYXSHPULW-BORJPKMPSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1ccccc1Br)C2 ZINC001169124261 1060649480 /nfs/dbraw/zinc/64/94/80/1060649480.db2.gz BFCXBWYXSHPULW-BORJPKMPSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccccc1Br)C2 ZINC001169124264 1060651127 /nfs/dbraw/zinc/65/11/27/1060651127.db2.gz BFCXBWYXSHPULW-KRXQYRFLSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccccc1Br)C2 ZINC001169124264 1060651133 /nfs/dbraw/zinc/65/11/33/1060651133.db2.gz BFCXBWYXSHPULW-KRXQYRFLSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1ccccc1Br)C2 ZINC001169124264 1060651137 /nfs/dbraw/zinc/65/11/37/1060651137.db2.gz BFCXBWYXSHPULW-KRXQYRFLSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1ccccc1Br)C2 ZINC001169124264 1060651141 /nfs/dbraw/zinc/65/11/41/1060651141.db2.gz BFCXBWYXSHPULW-KRXQYRFLSA-N 2 1 349.316 4.211 20 0 EIADMP Cc1cc(C(F)(F)F)cc(N[C@@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)[nH+]1 ZINC001169137302 1060653312 /nfs/dbraw/zinc/65/33/12/1060653312.db2.gz KRQXWCGWKZLIAA-CJNGLKHVSA-N 2 1 329.410 4.364 20 0 EIADMP Cc1ccc2c(c1)c(C1CC[NH2+]CC1)cn2[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169152675 1060670899 /nfs/dbraw/zinc/67/08/99/1060670899.db2.gz DFTOVYDWPSHTDL-BWTSREIZSA-N 2 1 337.511 4.214 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(Cc3cnc4ccccc4c3)CC1)C2 ZINC001169160035 1060672595 /nfs/dbraw/zinc/67/25/95/1060672595.db2.gz AKXPXKUMCRCEOF-ZBYYUNFXSA-N 2 1 349.522 4.115 20 0 EIADMP C[C@@H](c1cccc(Br)c1)[N@@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169162477 1060673974 /nfs/dbraw/zinc/67/39/74/1060673974.db2.gz TZKBJVHQKJIXTQ-KKBVYLPWSA-N 2 1 337.305 4.067 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1CCC(Cc2ccccc2)CC1)c1ccccn1 ZINC001169188648 1060679860 /nfs/dbraw/zinc/67/98/60/1060679860.db2.gz ZZGIZBPEOVMQIW-IBGZPJMESA-N 2 1 337.511 4.077 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@@H](C)C3)C[C@H]2C)CC1 ZINC001169233952 1060706453 /nfs/dbraw/zinc/70/64/53/1060706453.db2.gz YRCMSQTYZSKORT-TVASPAASSA-N 3 1 349.607 4.019 20 0 EIADMP CC[NH+]1CCC([N@@H+]2C[C@H]3C[C@@]3(c3ccc(Cl)c(Cl)c3)C2)CC1 ZINC001169262123 1060711259 /nfs/dbraw/zinc/71/12/59/1060711259.db2.gz SGTHBWSYZGOUPT-KDOFPFPSSA-N 2 1 339.310 4.051 20 0 EIADMP CC[NH+]1CCC([N@H+]2C[C@H]3C[C@@]3(c3ccc(Cl)c(Cl)c3)C2)CC1 ZINC001169262123 1060711280 /nfs/dbraw/zinc/71/12/80/1060711280.db2.gz SGTHBWSYZGOUPT-KDOFPFPSSA-N 2 1 339.310 4.051 20 0 EIADMP Cc1ccccc1CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC001169566937 1060860144 /nfs/dbraw/zinc/86/01/44/1060860144.db2.gz KUAROABLZDJOEM-NFBKMPQASA-N 2 1 336.523 4.428 20 0 EIADMP Cc1ccccc1CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC001169566937 1060860148 /nfs/dbraw/zinc/86/01/48/1060860148.db2.gz KUAROABLZDJOEM-NFBKMPQASA-N 2 1 336.523 4.428 20 0 EIADMP Cc1cc(C)c2c(c1)[C@H]([NH2+]C1CC[NH+](CC(C)C)CC1)CCCO2 ZINC000532198168 1032084123 /nfs/dbraw/zinc/08/41/23/1032084123.db2.gz KJSQLKGZMYBWHP-HXUWFJFHSA-N 2 1 330.516 4.227 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000532225076 1032102693 /nfs/dbraw/zinc/10/26/93/1032102693.db2.gz KFTFQOYVURGCFD-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Sc3ccccc3)cc2)CC[N@H+]1C ZINC000532804314 1032322404 /nfs/dbraw/zinc/32/24/04/1032322404.db2.gz BEVNNXQPISFUKI-AEFFLSMTSA-N 2 1 326.509 4.410 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)s1 ZINC000245594483 1032336618 /nfs/dbraw/zinc/33/66/18/1032336618.db2.gz RGCXYAPLSABFQA-DXCKQFNASA-N 2 1 335.542 4.247 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)s1 ZINC000245594483 1032336630 /nfs/dbraw/zinc/33/66/30/1032336630.db2.gz RGCXYAPLSABFQA-DXCKQFNASA-N 2 1 335.542 4.247 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000173386145 1032361197 /nfs/dbraw/zinc/36/11/97/1032361197.db2.gz WQFJNABANNHMRJ-QWHCGFSZSA-N 2 1 325.378 4.197 20 0 EIADMP Clc1ccc(OCCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533077436 1032476715 /nfs/dbraw/zinc/47/67/15/1032476715.db2.gz BMXLLAHCDCNYPG-OXJNMPFZSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533077436 1032476727 /nfs/dbraw/zinc/47/67/27/1032476727.db2.gz BMXLLAHCDCNYPG-OXJNMPFZSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000533077436 1032476734 /nfs/dbraw/zinc/47/67/34/1032476734.db2.gz BMXLLAHCDCNYPG-OXJNMPFZSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000533077436 1032476747 /nfs/dbraw/zinc/47/67/47/1032476747.db2.gz BMXLLAHCDCNYPG-OXJNMPFZSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533077437 1032478303 /nfs/dbraw/zinc/47/83/03/1032478303.db2.gz BMXLLAHCDCNYPG-OXQOHEQNSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533077437 1032478314 /nfs/dbraw/zinc/47/83/14/1032478314.db2.gz BMXLLAHCDCNYPG-OXQOHEQNSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000533077437 1032478322 /nfs/dbraw/zinc/47/83/22/1032478322.db2.gz BMXLLAHCDCNYPG-OXQOHEQNSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000533077437 1032478330 /nfs/dbraw/zinc/47/83/30/1032478330.db2.gz BMXLLAHCDCNYPG-OXQOHEQNSA-N 2 1 348.918 4.058 20 0 EIADMP CN1CCC([NH+]2CCC(CC[N@@H+](C)CCC3=CCCCC3)CC2)CC1 ZINC000450475979 1032521826 /nfs/dbraw/zinc/52/18/26/1032521826.db2.gz LYKYFAAXAKSUNV-UHFFFAOYSA-N 2 1 347.591 4.005 20 0 EIADMP C[N@@H+](CCC1=CCCCC1)CCC1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000450475979 1032521835 /nfs/dbraw/zinc/52/18/35/1032521835.db2.gz LYKYFAAXAKSUNV-UHFFFAOYSA-N 3 1 347.591 4.005 20 0 EIADMP C[N@H+](CCC1=CCCCC1)CCC1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000450475979 1032521848 /nfs/dbraw/zinc/52/18/48/1032521848.db2.gz LYKYFAAXAKSUNV-UHFFFAOYSA-N 3 1 347.591 4.005 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2)cc1 ZINC000178134656 1032528803 /nfs/dbraw/zinc/52/88/03/1032528803.db2.gz ANKMRMAMGNKVTM-JKSUJKDBSA-N 2 1 337.471 4.370 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)cc1 ZINC000347353443 1032532890 /nfs/dbraw/zinc/53/28/90/1032532890.db2.gz ZKHRTCHYNOIGPT-LDQXTDLNSA-N 2 1 341.499 4.425 20 0 EIADMP CCC[C@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619757 1032726136 /nfs/dbraw/zinc/72/61/36/1032726136.db2.gz UQRIWIGODPXZCC-ICSRJNTNSA-N 2 1 325.500 4.423 20 0 EIADMP CCC[C@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619757 1032726141 /nfs/dbraw/zinc/72/61/41/1032726141.db2.gz UQRIWIGODPXZCC-ICSRJNTNSA-N 2 1 325.500 4.423 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000430153504 1018881437 /nfs/dbraw/zinc/88/14/37/1018881437.db2.gz YKIUTYASICHIHX-KAPURRDVSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH+]1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000430153504 1018881439 /nfs/dbraw/zinc/88/14/39/1018881439.db2.gz YKIUTYASICHIHX-KAPURRDVSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000430153504 1018881441 /nfs/dbraw/zinc/88/14/41/1018881441.db2.gz YKIUTYASICHIHX-KAPURRDVSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000430153504 1018881444 /nfs/dbraw/zinc/88/14/44/1018881444.db2.gz YKIUTYASICHIHX-KAPURRDVSA-N 2 1 338.417 4.136 20 0 EIADMP Cc1cccc([C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2cccc(F)c2)c1 ZINC000643547869 1018930960 /nfs/dbraw/zinc/93/09/60/1018930960.db2.gz KAQYGXRDKYOTQC-RTWAWAEBSA-N 2 1 338.470 4.488 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000512454022 1032821394 /nfs/dbraw/zinc/82/13/94/1032821394.db2.gz NKIGCFLPSIFGOR-RTWAWAEBSA-N 2 1 336.479 4.079 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000512454022 1032821396 /nfs/dbraw/zinc/82/13/96/1032821396.db2.gz NKIGCFLPSIFGOR-RTWAWAEBSA-N 2 1 336.479 4.079 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH+]2CCC[C@@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614631 1019486108 /nfs/dbraw/zinc/48/61/08/1019486108.db2.gz FCDSIUBPQNLEHT-RHSMWYFYSA-N 2 1 342.405 4.064 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH+]2CCC[C@@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614631 1019486123 /nfs/dbraw/zinc/48/61/23/1019486123.db2.gz FCDSIUBPQNLEHT-RHSMWYFYSA-N 2 1 342.405 4.064 20 0 EIADMP C[NH+]1CCC[C@@H](C[N@@H+]2CCC[C@@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614631 1019486141 /nfs/dbraw/zinc/48/61/41/1019486141.db2.gz FCDSIUBPQNLEHT-RHSMWYFYSA-N 2 1 342.405 4.064 20 0 EIADMP C[NH+]1CCC[C@@H](C[N@H+]2CCC[C@@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614631 1019486156 /nfs/dbraw/zinc/48/61/56/1019486156.db2.gz FCDSIUBPQNLEHT-RHSMWYFYSA-N 2 1 342.405 4.064 20 0 EIADMP c1ccc(CSCCC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000535627065 1020012261 /nfs/dbraw/zinc/01/22/61/1020012261.db2.gz RPBWSOVUWQQMQL-TZIWHRDSSA-N 2 1 344.568 4.259 20 0 EIADMP c1ccc(CSCCC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000535627065 1020012275 /nfs/dbraw/zinc/01/22/75/1020012275.db2.gz RPBWSOVUWQQMQL-TZIWHRDSSA-N 2 1 344.568 4.259 20 0 EIADMP c1ccc(CSCCC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000535627065 1020012284 /nfs/dbraw/zinc/01/22/84/1020012284.db2.gz RPBWSOVUWQQMQL-TZIWHRDSSA-N 2 1 344.568 4.259 20 0 EIADMP FC(F)Oc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000237875666 1020847244 /nfs/dbraw/zinc/84/72/44/1020847244.db2.gz RXPLJKIMUOCNMC-UHFFFAOYSA-N 2 1 338.442 4.175 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)s2)cc1C ZINC000655711520 1020906749 /nfs/dbraw/zinc/90/67/49/1020906749.db2.gz KUNZOEMOSMEAAJ-ROUUACIJSA-N 2 1 341.524 4.143 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)s2)cc1C ZINC000655711520 1020906754 /nfs/dbraw/zinc/90/67/54/1020906754.db2.gz KUNZOEMOSMEAAJ-ROUUACIJSA-N 2 1 341.524 4.143 20 0 EIADMP Cc1ccccc1[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)C(C)(C)C ZINC000655721286 1020915407 /nfs/dbraw/zinc/91/54/07/1020915407.db2.gz MMAVLFAZDVXCCT-FPOVZHCZSA-N 2 1 344.543 4.315 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)s2)cc1C ZINC000655779209 1020951898 /nfs/dbraw/zinc/95/18/98/1020951898.db2.gz FTOTZXDDLBNAOT-AYHJJNSGSA-N 2 1 341.524 4.142 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)s2)cc1C ZINC000655779209 1020951902 /nfs/dbraw/zinc/95/19/02/1020951902.db2.gz FTOTZXDDLBNAOT-AYHJJNSGSA-N 2 1 341.524 4.142 20 0 EIADMP C[N@@H+](C[C@@H]1CN(Cc2ccccc2)CCCO1)C1CCCCCCC1 ZINC001167302630 1020979377 /nfs/dbraw/zinc/97/93/77/1020979377.db2.gz RMUKCWJRLUXUTJ-JOCHJYFZSA-N 2 1 344.543 4.322 20 0 EIADMP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000655839148 1021005295 /nfs/dbraw/zinc/00/52/95/1021005295.db2.gz NXHGOVHJRSLDBU-GZYGRNMYSA-N 2 1 342.527 4.118 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000340466007 1021068695 /nfs/dbraw/zinc/06/86/95/1021068695.db2.gz KHFFKUFMLNFWLY-OAQYLSRUSA-N 2 1 338.495 4.400 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000340473001 1021085087 /nfs/dbraw/zinc/08/50/87/1021085087.db2.gz JHCFBUZNEDBAOW-GOSISDBHSA-N 3 1 340.515 4.097 20 0 EIADMP C([C@H]1CCC[N@@H+](CC2([C@@H]3CCCCO3)CCC2)C1)[NH+]1CCCCCC1 ZINC001167326742 1021129541 /nfs/dbraw/zinc/12/95/41/1021129541.db2.gz PZNQJMKXBZEGJD-RTWAWAEBSA-N 2 1 348.575 4.314 20 0 EIADMP Clc1ccccc1CC[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001167326870 1021129911 /nfs/dbraw/zinc/12/99/11/1021129911.db2.gz VTUSENMWZIOMBB-SFHVURJKSA-N 2 1 334.935 4.471 20 0 EIADMP Clc1ccccc1CC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001167326870 1021129914 /nfs/dbraw/zinc/12/99/14/1021129914.db2.gz VTUSENMWZIOMBB-SFHVURJKSA-N 2 1 334.935 4.471 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2COCc3ccccc32)cc1 ZINC000340521892 1021183925 /nfs/dbraw/zinc/18/39/25/1021183925.db2.gz XESKBYAAOSXDJA-BTYIYWSLSA-N 2 1 333.435 4.103 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2COCc3ccccc32)cc1 ZINC000340521907 1021184936 /nfs/dbraw/zinc/18/49/36/1021184936.db2.gz XESKBYAAOSXDJA-YCRPNKLZSA-N 2 1 333.435 4.103 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ccc(O)cc32)c1 ZINC000340519543 1021187642 /nfs/dbraw/zinc/18/76/42/1021187642.db2.gz MLMXSXZAJOOEDF-QFIPXVFZSA-N 2 1 338.495 4.400 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCOc2cccc3ccccc32)C[C@H]1C ZINC000531140876 1021251317 /nfs/dbraw/zinc/25/13/17/1021251317.db2.gz MCHAGDIHZULHQR-MJGOQNOKSA-N 2 1 326.484 4.023 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]Cc3ccc4cnccc4c3)CC2)cc1 ZINC000683765026 1021374890 /nfs/dbraw/zinc/37/48/90/1021374890.db2.gz BHTTXPXIPOGYNI-UHFFFAOYSA-N 2 1 345.490 4.032 20 0 EIADMP Cc1cccnc1[C@H]1CCC[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C1 ZINC000376132116 1021545369 /nfs/dbraw/zinc/54/53/69/1021545369.db2.gz LGZLNQOQNXFCNN-XIBWBMNSSA-N 2 1 327.516 4.021 20 0 EIADMP Cc1cccnc1[C@H]1CCC[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)C1 ZINC000376132116 1021545385 /nfs/dbraw/zinc/54/53/85/1021545385.db2.gz LGZLNQOQNXFCNN-XIBWBMNSSA-N 2 1 327.516 4.021 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)Cc1ccc(-c2ccccc2)cc1F ZINC000580059981 1021586595 /nfs/dbraw/zinc/58/65/95/1021586595.db2.gz JSXSFOISMNNZTG-IIBYNOLFSA-N 2 1 326.459 4.265 20 0 EIADMP CC[C@H]1C[N@H+](Cc2ccc(-c3nc4ccccc4s3)o2)CC[C@H]1[NH3+] ZINC000647497291 1021597223 /nfs/dbraw/zinc/59/72/23/1021597223.db2.gz BWZPWMXBNDCDKU-DZGCQCFKSA-N 2 1 341.480 4.116 20 0 EIADMP CC[C@H]1C[N@@H+](Cc2ccc(-c3nc4ccccc4s3)o2)CC[C@H]1[NH3+] ZINC000647497291 1021597239 /nfs/dbraw/zinc/59/72/39/1021597239.db2.gz BWZPWMXBNDCDKU-DZGCQCFKSA-N 2 1 341.480 4.116 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3cccc(Cl)c3)CC2)[nH+]c1 ZINC000163496996 1021716249 /nfs/dbraw/zinc/71/62/49/1021716249.db2.gz AVMUTNJLEFNFQL-OAHLLOKOSA-N 2 1 329.875 4.363 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000580225597 1021779819 /nfs/dbraw/zinc/77/98/19/1021779819.db2.gz UTMDEGDQYQEHMI-HKUYNNGSSA-N 2 1 332.536 4.133 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@@H](C)c2cccc(Cl)c2)cn1 ZINC000187692182 1021790624 /nfs/dbraw/zinc/79/06/24/1021790624.db2.gz RFBVBJZKYLYMCW-CQSZACIVSA-N 2 1 340.858 4.122 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(N(C)c2ccccc2)cc1 ZINC000613266671 1021839841 /nfs/dbraw/zinc/83/98/41/1021839841.db2.gz UKISGSDEFPZFDH-UHFFFAOYSA-N 2 1 334.467 4.139 20 0 EIADMP C[NH+](C/C=C\C[N@H+](C)Cc1ccc(F)cc1)Cc1ccc(F)cc1 ZINC000613391078 1021938813 /nfs/dbraw/zinc/93/88/13/1021938813.db2.gz JCXIERXLPYNVKR-ARJAWSKDSA-N 2 1 330.422 4.085 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1csc(-c2ccccc2)n1 ZINC000414147440 1021966055 /nfs/dbraw/zinc/96/60/55/1021966055.db2.gz MGIWSMGSQIOFBC-OAHLLOKOSA-N 2 1 329.513 4.335 20 0 EIADMP COc1ccc(CC[N@@H+](CC[C@@H]2CCC[NH+]2C)CC(C)(C)C)cc1 ZINC001167401617 1022031766 /nfs/dbraw/zinc/03/17/66/1022031766.db2.gz BKCSBGDTZOKJNO-IBGZPJMESA-N 2 1 332.532 4.070 20 0 EIADMP COc1ccc(CC[NH+](CC[C@@H]2CCC[N@@H+]2C)CC(C)(C)C)cc1 ZINC001167401617 1022031784 /nfs/dbraw/zinc/03/17/84/1022031784.db2.gz BKCSBGDTZOKJNO-IBGZPJMESA-N 2 1 332.532 4.070 20 0 EIADMP COc1ccc(CC[NH+](CC[C@@H]2CCC[N@H+]2C)CC(C)(C)C)cc1 ZINC001167401617 1022031805 /nfs/dbraw/zinc/03/18/05/1022031805.db2.gz BKCSBGDTZOKJNO-IBGZPJMESA-N 2 1 332.532 4.070 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1cccc(O)c1 ZINC000580444284 1022033258 /nfs/dbraw/zinc/03/32/58/1022033258.db2.gz BIUAISIRGMSFDT-FXAWDEMLSA-N 2 1 336.479 4.240 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1cccc(O)c1 ZINC000580444284 1022033277 /nfs/dbraw/zinc/03/32/77/1022033277.db2.gz BIUAISIRGMSFDT-FXAWDEMLSA-N 2 1 336.479 4.240 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000340693201 1022042353 /nfs/dbraw/zinc/04/23/53/1022042353.db2.gz ZQQNTRKWFJFMET-QFIPXVFZSA-N 2 1 349.453 4.162 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)C[C@@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000580579096 1022225904 /nfs/dbraw/zinc/22/59/04/1022225904.db2.gz WXOBWQBZFPIJNY-BHIYHBOVSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)C[C@@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000580579096 1022225938 /nfs/dbraw/zinc/22/59/38/1022225938.db2.gz WXOBWQBZFPIJNY-BHIYHBOVSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)C[C@@H]2CCC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000580579096 1022225975 /nfs/dbraw/zinc/22/59/75/1022225975.db2.gz WXOBWQBZFPIJNY-BHIYHBOVSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)C[C@@H]2CCC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000580579096 1022225994 /nfs/dbraw/zinc/22/59/94/1022225994.db2.gz WXOBWQBZFPIJNY-BHIYHBOVSA-N 2 1 336.470 4.407 20 0 EIADMP c1sc(-c2ccccc2)nc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000047968477 1022299375 /nfs/dbraw/zinc/29/93/75/1022299375.db2.gz FKNSVMISHKQMCC-UHFFFAOYSA-N 2 1 341.524 4.118 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)sc1C ZINC000892580726 1022316526 /nfs/dbraw/zinc/31/65/26/1022316526.db2.gz NWUNVWPNYAEVSM-HNNXBMFYSA-N 2 1 343.540 4.282 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)sc1C ZINC000892580726 1022316546 /nfs/dbraw/zinc/31/65/46/1022316546.db2.gz NWUNVWPNYAEVSM-HNNXBMFYSA-N 2 1 343.540 4.282 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC(C)(C)OCC2CC2)cc1 ZINC000414252145 1022322944 /nfs/dbraw/zinc/32/29/44/1022322944.db2.gz CGLNGUCBJBNREA-HNNXBMFYSA-N 2 1 327.472 4.037 20 0 EIADMP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2csc(C(F)(F)F)n2)C1 ZINC000892590180 1022357979 /nfs/dbraw/zinc/35/79/79/1022357979.db2.gz RSXCFPLELMEWBU-STQMWFEESA-N 2 1 349.466 4.010 20 0 EIADMP Cc1cccc(N2CCC([NH2+]C[C@@H](C)c3cccc(Cl)c3)CC2)[nH+]1 ZINC000187932306 1022364429 /nfs/dbraw/zinc/36/44/29/1022364429.db2.gz FZARPMWIZGXYTK-OAHLLOKOSA-N 2 1 343.902 4.406 20 0 EIADMP [NH3+][C@@H]1C[C@H](NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000261629368 1022364763 /nfs/dbraw/zinc/36/47/63/1022364763.db2.gz VTYNMQHREBQRHS-PTUXOGIPSA-N 2 1 349.522 4.023 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3ccccc3C3CC3)CC2)n2c1CCCC2 ZINC000684026844 1022378873 /nfs/dbraw/zinc/37/88/73/1022378873.db2.gz SAQOFFUTGYDRMV-UHFFFAOYSA-N 2 1 335.495 4.476 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC(C)(C)OCC2CC2)CC1 ZINC000414279327 1022391747 /nfs/dbraw/zinc/39/17/47/1022391747.db2.gz ZWFYSJXRDSQDBS-UHFFFAOYSA-N 2 1 344.543 4.224 20 0 EIADMP Cc1ccc(N2CCC([NH2+]C[C@@H](C)c3cccc(Cl)c3)CC2)[nH+]c1 ZINC000188023615 1022410613 /nfs/dbraw/zinc/41/06/13/1022410613.db2.gz IPFIVHFBESQLKK-MRXNPFEDSA-N 2 1 343.902 4.406 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000414341052 1022639033 /nfs/dbraw/zinc/63/90/33/1022639033.db2.gz UVOJFHIYIOSJRB-WIYYLYMNSA-N 2 1 337.511 4.002 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000414341052 1022639069 /nfs/dbraw/zinc/63/90/69/1022639069.db2.gz UVOJFHIYIOSJRB-WIYYLYMNSA-N 2 1 337.511 4.002 20 0 EIADMP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000581005975 1022799222 /nfs/dbraw/zinc/79/92/22/1022799222.db2.gz LLXMZVULGLUTLH-BPUTZDHNSA-N 2 1 345.487 4.044 20 0 EIADMP CC[C@H](OCC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001167443280 1022809000 /nfs/dbraw/zinc/80/90/00/1022809000.db2.gz RDSJKIJLSZJUQM-SFTDATJTSA-N 2 1 330.516 4.105 20 0 EIADMP CC[C@H](OCC[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001167443280 1022809001 /nfs/dbraw/zinc/80/90/01/1022809001.db2.gz RDSJKIJLSZJUQM-SFTDATJTSA-N 2 1 330.516 4.105 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548153698 1022829011 /nfs/dbraw/zinc/82/90/11/1022829011.db2.gz DGZUSAJFZAPPRF-RXVVDRJESA-N 2 1 338.495 4.004 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1Br ZINC000378489595 1022842756 /nfs/dbraw/zinc/84/27/56/1022842756.db2.gz CTXBTYNBLSYSPU-NUEKZKHPSA-N 2 1 337.305 4.035 20 0 EIADMP C[C@@]1(C[NH2+]Cc2cncc3ccccc32)CC[N@@H+](Cc2ccccc2)C1 ZINC000311366693 1023128448 /nfs/dbraw/zinc/12/84/48/1023128448.db2.gz KHKSZDVIJYPLOR-QHCPKHFHSA-N 2 1 345.490 4.237 20 0 EIADMP C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687840 1023188956 /nfs/dbraw/zinc/18/89/56/1023188956.db2.gz PXEIDOKANLTINQ-HNAYVOBHSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687840 1023188962 /nfs/dbraw/zinc/18/89/62/1023188962.db2.gz PXEIDOKANLTINQ-HNAYVOBHSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687840 1023188972 /nfs/dbraw/zinc/18/89/72/1023188972.db2.gz PXEIDOKANLTINQ-HNAYVOBHSA-N 2 1 328.431 4.002 20 0 EIADMP CC(C)CC[NH+]1CCC([NH2+][C@@H](C)c2ccc(C(F)(F)F)nc2)CC1 ZINC000926836301 1023326857 /nfs/dbraw/zinc/32/68/57/1023326857.db2.gz LVKOMBZECWRXSU-AWEZNQCLSA-N 2 1 343.437 4.262 20 0 EIADMP C[C@H](C[N@@H+](C)C1CCN(CCc2ccccn2)CC1)C1CCCCC1 ZINC000549472639 1023337581 /nfs/dbraw/zinc/33/75/81/1023337581.db2.gz XYVBVOPGYLFGBH-LJQANCHMSA-N 2 1 343.559 4.237 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCN(c3ccccc3)C2)cc1 ZINC000153857111 1023350442 /nfs/dbraw/zinc/35/04/42/1023350442.db2.gz AURFVGHRHOUMBD-PXNSSMCTSA-N 2 1 346.478 4.110 20 0 EIADMP Clc1csc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000309697143 1023400705 /nfs/dbraw/zinc/40/07/05/1023400705.db2.gz FINUGCRLXFDSGC-MRXNPFEDSA-N 2 1 334.916 4.403 20 0 EIADMP [NH3+]CCC[C@@H]([NH2+][C@@H](CCc1ccccc1)C(F)F)c1ccccc1 ZINC000415052411 1023409449 /nfs/dbraw/zinc/40/94/49/1023409449.db2.gz LDNRUHHXNRPNNK-MOPGFXCFSA-N 2 1 332.438 4.323 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc3c2CCCN3)CC[N@H+]1Cc1ccccc1 ZINC000415046494 1023409876 /nfs/dbraw/zinc/40/98/76/1023409876.db2.gz ZTYLDQFIAXMZEM-WIYYLYMNSA-N 2 1 349.522 4.187 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)CCCC1 ZINC000415094466 1023439437 /nfs/dbraw/zinc/43/94/37/1023439437.db2.gz XPJQTGISCNYBGH-UXHICEINSA-N 2 1 330.516 4.056 20 0 EIADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@H+]2Cc2cccc(C3CCCC3)c2)C1 ZINC000656785845 1023528894 /nfs/dbraw/zinc/52/88/94/1023528894.db2.gz KEENGOPTWCDCCA-FSSWDIPSSA-N 2 1 342.527 4.205 20 0 EIADMP c1nc(-c2ccccc2)sc1C[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656785936 1023534811 /nfs/dbraw/zinc/53/48/11/1023534811.db2.gz NNNHCPCUVISDRZ-GOSISDBHSA-N 2 1 341.524 4.022 20 0 EIADMP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)C1 ZINC000684370478 1023544287 /nfs/dbraw/zinc/54/42/87/1023544287.db2.gz VLQINWURUKZIDY-DZFGPLHGSA-N 2 1 330.516 4.108 20 0 EIADMP C[N@H+]1CCCC2(CC[NH+](CCc3ccccc3C(F)(F)F)CC2)C1 ZINC001279244561 1023571735 /nfs/dbraw/zinc/57/17/35/1023571735.db2.gz PQJUFDNESURYFC-UHFFFAOYSA-N 2 1 340.433 4.056 20 0 EIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390744206 1023819476 /nfs/dbraw/zinc/81/94/76/1023819476.db2.gz OMYRZDVLVWTWEV-WBVHZDCISA-N 2 1 328.422 4.219 20 0 EIADMP Cc1occc1[C@H](Cc1ccccc1Cl)[NH2+]CCc1c[nH+]cn1C ZINC000926205441 1023849073 /nfs/dbraw/zinc/84/90/73/1023849073.db2.gz ZRZQTOCEGKFVDZ-IBGZPJMESA-N 2 1 343.858 4.091 20 0 EIADMP CC[C@@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccccc1OC(F)F ZINC000341626502 1023963755 /nfs/dbraw/zinc/96/37/55/1023963755.db2.gz MRFQITXWHDRONF-GOEBONIOSA-N 2 1 326.431 4.203 20 0 EIADMP CC[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccccc1OC(F)F ZINC000341626502 1023963769 /nfs/dbraw/zinc/96/37/69/1023963769.db2.gz MRFQITXWHDRONF-GOEBONIOSA-N 2 1 326.431 4.203 20 0 EIADMP CC[C@@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccccc1OC(F)F ZINC000341626480 1023964188 /nfs/dbraw/zinc/96/41/88/1023964188.db2.gz MRFQITXWHDRONF-GDBMZVCRSA-N 2 1 326.431 4.203 20 0 EIADMP CC[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccccc1OC(F)F ZINC000341626480 1023964199 /nfs/dbraw/zinc/96/41/99/1023964199.db2.gz MRFQITXWHDRONF-GDBMZVCRSA-N 2 1 326.431 4.203 20 0 EIADMP CC(C)CCOc1ccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc1 ZINC000510541110 1024009030 /nfs/dbraw/zinc/00/90/30/1024009030.db2.gz ZEXDRIDAKWXHSM-GOSISDBHSA-N 2 1 327.472 4.214 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510671957 1024209965 /nfs/dbraw/zinc/20/99/65/1024209965.db2.gz ROOZVPMIOSWFJY-DOTOQJQBSA-N 2 1 342.449 4.348 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)CCCOc2ccc(Cl)c(C)c2)CC1 ZINC000510730620 1024361204 /nfs/dbraw/zinc/36/12/04/1024361204.db2.gz FXKANKUPYPGKSS-MRXNPFEDSA-N 2 1 338.923 4.270 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)ccc1Cl ZINC000510738281 1024379808 /nfs/dbraw/zinc/37/98/08/1024379808.db2.gz VGMPBVKTDJRKKI-ULQDDVLXSA-N 2 1 338.923 4.268 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1Cl ZINC000510738281 1024379826 /nfs/dbraw/zinc/37/98/26/1024379826.db2.gz VGMPBVKTDJRKKI-ULQDDVLXSA-N 2 1 338.923 4.268 20 0 EIADMP CC(C)c1ccc([C@H](C)[N@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)cc1 ZINC000652350436 1024701927 /nfs/dbraw/zinc/70/19/27/1024701927.db2.gz YMHSDDVBIKOYEF-DVWBAYGPSA-N 2 1 330.516 4.089 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(Br)s1 ZINC000164611537 1024706478 /nfs/dbraw/zinc/70/64/78/1024706478.db2.gz ZOVNKGVKEYXNAT-LLVKDONJSA-N 2 1 342.306 4.147 20 0 EIADMP CC(C)(C)OC1CC(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000432245556 1024729723 /nfs/dbraw/zinc/72/97/23/1024729723.db2.gz IQMOQDVKVNBCFA-UHFFFAOYSA-N 2 1 344.543 4.224 20 0 EIADMP COC1(C[C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000510937502 1024849091 /nfs/dbraw/zinc/84/90/91/1024849091.db2.gz YDNHPOCWMOPHTQ-AZUAARDMSA-N 2 1 344.543 4.224 20 0 EIADMP COC1(C[C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000510937502 1024849094 /nfs/dbraw/zinc/84/90/94/1024849094.db2.gz YDNHPOCWMOPHTQ-AZUAARDMSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H](CC1CCOCC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510954629 1024864908 /nfs/dbraw/zinc/86/49/08/1024864908.db2.gz YIBMAARKOBCDLS-RXVVDRJESA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H](CC1CCOCC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510954629 1024864918 /nfs/dbraw/zinc/86/49/18/1024864918.db2.gz YIBMAARKOBCDLS-RXVVDRJESA-N 2 1 344.543 4.082 20 0 EIADMP Cc1cncc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000510963992 1024870044 /nfs/dbraw/zinc/87/00/44/1024870044.db2.gz BOZXZBADFBZVRP-GHTZIAJQSA-N 2 1 337.511 4.341 20 0 EIADMP Cc1cncc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000510963992 1024870045 /nfs/dbraw/zinc/87/00/45/1024870045.db2.gz BOZXZBADFBZVRP-GHTZIAJQSA-N 2 1 337.511 4.341 20 0 EIADMP Cc1cncc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000510964029 1024870395 /nfs/dbraw/zinc/87/03/95/1024870395.db2.gz BOZXZBADFBZVRP-RXVVDRJESA-N 2 1 337.511 4.341 20 0 EIADMP Cc1cncc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000510964029 1024870397 /nfs/dbraw/zinc/87/03/97/1024870397.db2.gz BOZXZBADFBZVRP-RXVVDRJESA-N 2 1 337.511 4.341 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248490698 1024871393 /nfs/dbraw/zinc/87/13/93/1024871393.db2.gz IGAVCYDGDUFXDE-ILXRZTDVSA-N 2 1 336.907 4.349 20 0 EIADMP C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295629 1025046507 /nfs/dbraw/zinc/04/65/07/1025046507.db2.gz VYYDMTBTTWHOLV-LPHOPBHVSA-N 2 1 339.483 4.114 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cccc(OCc3ccccc3)c2)C1 ZINC000062426984 1025058094 /nfs/dbraw/zinc/05/80/94/1025058094.db2.gz RUDYZHGXKLBYKN-NRFANRHFSA-N 2 1 338.495 4.086 20 0 EIADMP Clc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c2ncccc12 ZINC000663346533 1025146146 /nfs/dbraw/zinc/14/61/46/1025146146.db2.gz TWLXQMGPPTVWEF-INIZCTEOSA-N 2 1 343.902 4.100 20 0 EIADMP FC(F)(F)[C@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC000663435086 1025337013 /nfs/dbraw/zinc/33/70/13/1025337013.db2.gz POWISNCARFLGPM-KRWDZBQOSA-N 2 1 326.406 4.057 20 0 EIADMP C[C@H](Cc1coc2ccccc12)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663466258 1025392661 /nfs/dbraw/zinc/39/26/61/1025392661.db2.gz QDVIOSJHQTXFLR-AEFFLSMTSA-N 2 1 326.484 4.075 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)ccc1SC ZINC000663466979 1025401635 /nfs/dbraw/zinc/40/16/35/1025401635.db2.gz CIPIPSTWEQQFFB-NVXWUHKLSA-N 2 1 348.556 4.190 20 0 EIADMP Fc1ccc2c(c1)[C@H](NC[C@@H]1CCC[N@@H+](CC3CC3)C1)CCS2 ZINC000663467761 1025407586 /nfs/dbraw/zinc/40/75/86/1025407586.db2.gz HZBSOABAFSPTNQ-MAUKXSAKSA-N 2 1 334.504 4.074 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC3CC3)C1)CCS2 ZINC000663467761 1025407601 /nfs/dbraw/zinc/40/76/01/1025407601.db2.gz HZBSOABAFSPTNQ-MAUKXSAKSA-N 2 1 334.504 4.074 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC3CC3)C1)CCS2 ZINC000663467761 1025407609 /nfs/dbraw/zinc/40/76/09/1025407609.db2.gz HZBSOABAFSPTNQ-MAUKXSAKSA-N 2 1 334.504 4.074 20 0 EIADMP C[C@@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469906 1025415848 /nfs/dbraw/zinc/41/58/48/1025415848.db2.gz RREQOHPAMNBVOG-GDBMZVCRSA-N 2 1 338.442 4.061 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469906 1025415861 /nfs/dbraw/zinc/41/58/61/1025415861.db2.gz RREQOHPAMNBVOG-GDBMZVCRSA-N 2 1 338.442 4.061 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469906 1025415879 /nfs/dbraw/zinc/41/58/79/1025415879.db2.gz RREQOHPAMNBVOG-GDBMZVCRSA-N 2 1 338.442 4.061 20 0 EIADMP c1ccc2cc(CC[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)ccc2c1 ZINC001167965835 1025517329 /nfs/dbraw/zinc/51/73/29/1025517329.db2.gz NNJDDZCCCOVTPV-NOTZXAQLSA-N 2 1 334.507 4.377 20 0 EIADMP Cc1ccc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1F ZINC001167505553 1025541111 /nfs/dbraw/zinc/54/11/11/1025541111.db2.gz UIQRYNRAPBHQBI-HXUWFJFHSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1F ZINC001167505553 1025541130 /nfs/dbraw/zinc/54/11/30/1025541130.db2.gz UIQRYNRAPBHQBI-HXUWFJFHSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC001167505553 1025541152 /nfs/dbraw/zinc/54/11/52/1025541152.db2.gz UIQRYNRAPBHQBI-HXUWFJFHSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC001167505553 1025541172 /nfs/dbraw/zinc/54/11/72/1025541172.db2.gz UIQRYNRAPBHQBI-HXUWFJFHSA-N 2 1 326.459 4.088 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(Cl)cc1F ZINC000925784316 1025637373 /nfs/dbraw/zinc/63/73/73/1025637373.db2.gz QSZBZIXOVDPAKX-NHYWBVRUSA-N 2 1 334.813 4.011 20 0 EIADMP C[C@@H]1C[N@H+](CCC[NH2+]Cc2ccc(-c3ccccc3)s2)CCCO1 ZINC000432349052 1025716678 /nfs/dbraw/zinc/71/66/78/1025716678.db2.gz UNEWOBXUTRPNNO-QGZVFWFLSA-N 2 1 344.524 4.006 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+]Cc2ccc(-c3ccccc3)s2)CCCO1 ZINC000432349052 1025716700 /nfs/dbraw/zinc/71/67/00/1025716700.db2.gz UNEWOBXUTRPNNO-QGZVFWFLSA-N 2 1 344.524 4.006 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)n1ccc([C@@H](C)[NH2+]Cc2ccccc2)n1 ZINC001167833538 1025794838 /nfs/dbraw/zinc/79/48/38/1025794838.db2.gz CFBREMRMJUJQIE-RBUKOAKNSA-N 2 1 342.531 4.417 20 0 EIADMP CCc1ccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cn1 ZINC000512047149 1025843117 /nfs/dbraw/zinc/84/31/17/1025843117.db2.gz XRMRDKQSQYBOHP-QUCCMNQESA-N 2 1 337.511 4.034 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+]CC2CCC(c3ccccc3)CC2)s1 ZINC000512052631 1025852148 /nfs/dbraw/zinc/85/21/48/1025852148.db2.gz MVMGNEXCWBSQHL-UHFFFAOYSA-N 2 1 343.540 4.268 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cc2ccncc2s1 ZINC000657308928 1025864027 /nfs/dbraw/zinc/86/40/27/1025864027.db2.gz YXRSIVNNDAMGIZ-UHFFFAOYSA-N 2 1 339.508 4.426 20 0 EIADMP CCOC(=O)C[N@H+]([C@H](C)c1ccccc1)[C@@H](C)CCC[NH+](CC)CC ZINC001167842438 1025915253 /nfs/dbraw/zinc/91/52/53/1025915253.db2.gz XIICLOQCDBFPRP-RBUKOAKNSA-N 2 1 348.531 4.123 20 0 EIADMP Clc1ccc2c(c1)CC[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)C2 ZINC001167971282 1026057106 /nfs/dbraw/zinc/05/71/06/1026057106.db2.gz VZMKVMXNCPNNKF-WVVQBRDUSA-N 2 1 344.930 4.192 20 0 EIADMP c1sc2ccccc2c1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167973843 1026185495 /nfs/dbraw/zinc/18/54/95/1026185495.db2.gz OVZBDZMWBVRQGO-AYHJJNSGSA-N 2 1 326.509 4.396 20 0 EIADMP Cc1ccccc1CC(C)(C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167975867 1026305076 /nfs/dbraw/zinc/30/50/76/1026305076.db2.gz XVQNVGAUVQQFQN-SEJPIABJSA-N 2 1 326.528 4.311 20 0 EIADMP CSc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167981625 1026378735 /nfs/dbraw/zinc/37/87/35/1026378735.db2.gz BZVQPRDYVGLDMF-AQXGTKIOSA-N 2 1 330.541 4.465 20 0 EIADMP Clc1ccc([C@H]2C[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167982174 1026390353 /nfs/dbraw/zinc/39/03/53/1026390353.db2.gz ZLDWSDAWESBIHG-DGDSNLKDSA-N 2 1 330.903 4.191 20 0 EIADMP CCOc1ccc([C@H](CC)[NH2+]C2CC[NH+](C3CC3)CC2)cc1OCC ZINC000119718804 1026396644 /nfs/dbraw/zinc/39/66/44/1026396644.db2.gz XQMQZGBHOMWVNE-IBGZPJMESA-N 2 1 346.515 4.152 20 0 EIADMP Fc1ccc([C@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167982804 1026401073 /nfs/dbraw/zinc/40/10/73/1026401073.db2.gz AVWUYKNQKXMVTO-JGUMPVPUSA-N 2 1 328.475 4.368 20 0 EIADMP Fc1ccc([C@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167982804 1026401078 /nfs/dbraw/zinc/40/10/78/1026401078.db2.gz AVWUYKNQKXMVTO-JGUMPVPUSA-N 2 1 328.475 4.368 20 0 EIADMP Fc1ccc([C@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167982804 1026401086 /nfs/dbraw/zinc/40/10/86/1026401086.db2.gz AVWUYKNQKXMVTO-JGUMPVPUSA-N 2 1 328.475 4.368 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(-c2cccc(F)c2C)o1 ZINC000344533206 1026442358 /nfs/dbraw/zinc/44/23/58/1026442358.db2.gz OOJNSMWHIWLHFA-UHFFFAOYSA-N 2 1 341.430 4.469 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cnc(C(C)(C)C)s2)CC1 ZINC000506879399 1026484122 /nfs/dbraw/zinc/48/41/22/1026484122.db2.gz CYOHZIXSIDMDMO-UHFFFAOYSA-N 2 1 337.577 4.385 20 0 EIADMP C[NH+](C)C1CC[NH+](CC(C)(C)Sc2ccc(Cl)cc2)CC1 ZINC001207295624 1026644802 /nfs/dbraw/zinc/64/48/02/1026644802.db2.gz WXCZJTLRJOARDA-UHFFFAOYSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@H](N[C@@H]1CCc2c1c(F)ccc2F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512312360 1026681783 /nfs/dbraw/zinc/68/17/83/1026681783.db2.gz DOONYDLLOFPKEA-CKFHNAJUSA-N 2 1 334.454 4.195 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2c1c(F)ccc2F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512312360 1026681784 /nfs/dbraw/zinc/68/17/84/1026681784.db2.gz DOONYDLLOFPKEA-CKFHNAJUSA-N 2 1 334.454 4.195 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2c1c(F)ccc2F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512312360 1026681785 /nfs/dbraw/zinc/68/17/85/1026681785.db2.gz DOONYDLLOFPKEA-CKFHNAJUSA-N 2 1 334.454 4.195 20 0 EIADMP Cc1ccccc1C[NH+]1CCN(c2cc[nH+]c3cc(F)ccc32)CC1 ZINC000500477958 1026779948 /nfs/dbraw/zinc/77/99/48/1026779948.db2.gz CXUWQHLYHPNZLE-UHFFFAOYSA-N 2 1 335.426 4.005 20 0 EIADMP CCC(CC)(C[NH2+][C@H](C)[C@H]1CCCOC1)[NH2+][C@@H](C)c1ccccc1 ZINC000507523761 1026826803 /nfs/dbraw/zinc/82/68/03/1026826803.db2.gz DIHGUZFQXRVDBV-HBFSDRIKSA-N 2 1 332.532 4.301 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCOc2cccc3ccccc32)C[C@@H]1C ZINC001167589379 1026859764 /nfs/dbraw/zinc/85/97/64/1026859764.db2.gz DKKYOBPXNIBJDQ-ICSRJNTNSA-N 2 1 340.511 4.413 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCOc2cccc3ccccc32)C[C@@H]1C ZINC001167589379 1026859771 /nfs/dbraw/zinc/85/97/71/1026859771.db2.gz DKKYOBPXNIBJDQ-ICSRJNTNSA-N 2 1 340.511 4.413 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3cccnc32)C1 ZINC000684953660 1026889398 /nfs/dbraw/zinc/88/93/98/1026889398.db2.gz QQSJSTXCMJWDET-AVRDEDQJSA-N 2 1 349.522 4.481 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582665309 1026916134 /nfs/dbraw/zinc/91/61/34/1026916134.db2.gz ZWWILIKGKPKDMH-MJGOQNOKSA-N 2 1 340.536 4.466 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582665309 1026916142 /nfs/dbraw/zinc/91/61/42/1026916142.db2.gz ZWWILIKGKPKDMH-MJGOQNOKSA-N 2 1 340.536 4.466 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2C[C@H](C)c3c2cccc3C)cn1 ZINC000153077624 1026983404 /nfs/dbraw/zinc/98/34/04/1026983404.db2.gz QNLDTEKJPMDGJQ-KXBFYZLASA-N 2 1 332.451 4.222 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2noc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000657534227 1026986728 /nfs/dbraw/zinc/98/67/28/1026986728.db2.gz UTBJKTNWFAJNQO-IEBWSBKVSA-N 2 1 349.478 4.013 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2noc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000657534227 1026986732 /nfs/dbraw/zinc/98/67/32/1026986732.db2.gz UTBJKTNWFAJNQO-IEBWSBKVSA-N 2 1 349.478 4.013 20 0 EIADMP CC[NH+](CC)CCO[C@@H]1CC[N@H+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC001167603781 1026993239 /nfs/dbraw/zinc/99/32/39/1026993239.db2.gz ZQDGHSMBHIROQW-WOJBJXKFSA-N 2 1 332.532 4.106 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470902 1027095485 /nfs/dbraw/zinc/09/54/85/1027095485.db2.gz KIZUVPRIQVBXOW-PAPYEOQZSA-N 2 1 337.920 4.324 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470899 1027097199 /nfs/dbraw/zinc/09/71/99/1027097199.db2.gz KIZUVPRIQVBXOW-NZBPQXDJSA-N 2 1 337.920 4.324 20 0 EIADMP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CC(C)(C)[NH+]2CCCCC2)cc1OC ZINC000474482837 1027116166 /nfs/dbraw/zinc/11/61/66/1027116166.db2.gz PKNQAJBWAPLRNZ-DLBZAZTESA-N 2 1 348.531 4.050 20 0 EIADMP CCc1c(C)[nH+]c2ccccc2c1N1CCC(Cc2[nH+]ccn2C)CC1 ZINC000302050897 1027199595 /nfs/dbraw/zinc/19/95/95/1027199595.db2.gz OSRYLLUUEWAOTP-UHFFFAOYSA-N 2 1 348.494 4.298 20 0 EIADMP COc1ccc(C[N@H+](CCCn2cc[nH+]c2C)Cc2ccccc2)cc1 ZINC000342858543 1027329633 /nfs/dbraw/zinc/32/96/33/1027329633.db2.gz AIDCIULZZAUTGY-UHFFFAOYSA-N 2 1 349.478 4.293 20 0 EIADMP COc1ccc(C[N@@H+](CCCn2cc[nH+]c2C)Cc2ccccc2)cc1 ZINC000342858543 1027329654 /nfs/dbraw/zinc/32/96/54/1027329654.db2.gz AIDCIULZZAUTGY-UHFFFAOYSA-N 2 1 349.478 4.293 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CC[N@H+](C)C2CCCCC2)cc1OC ZINC000474629207 1027335783 /nfs/dbraw/zinc/33/57/83/1027335783.db2.gz CSVUBWNXCXJIII-IAGOWNOFSA-N 2 1 348.531 4.050 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CC[N@@H+](C)C2CCCCC2)cc1OC ZINC000474629207 1027335802 /nfs/dbraw/zinc/33/58/02/1027335802.db2.gz CSVUBWNXCXJIII-IAGOWNOFSA-N 2 1 348.531 4.050 20 0 EIADMP CC(C)C[C@@H](C[NH2+]CC1([NH+]2CCCC2)CCOCC1)c1ccccc1 ZINC000474722805 1027440695 /nfs/dbraw/zinc/44/06/95/1027440695.db2.gz MPHFRTSQUMEUMW-NRFANRHFSA-N 2 1 344.543 4.051 20 0 EIADMP Cc1cc([NH+]2CCCCC2)ccc1N1C(C)(C)CC([NH3+])CC1(C)C ZINC001167626267 1027489678 /nfs/dbraw/zinc/48/96/78/1027489678.db2.gz CDVQHRQONDSNDN-UHFFFAOYSA-N 2 1 329.532 4.470 20 0 EIADMP c1ccc2cc(CC[N@H+]3CC[C@H]4[C@@H](CCCN4C4CC4)C3)ccc2c1 ZINC000441398269 1027520388 /nfs/dbraw/zinc/52/03/88/1027520388.db2.gz HDSPGEKHWRJJKG-GMAHTHKFSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[N@@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441398269 1027520407 /nfs/dbraw/zinc/52/04/07/1027520407.db2.gz HDSPGEKHWRJJKG-GMAHTHKFSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[N@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441398269 1027520432 /nfs/dbraw/zinc/52/04/32/1027520432.db2.gz HDSPGEKHWRJJKG-GMAHTHKFSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[NH+]3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)ccc2c1 ZINC000441398269 1027520457 /nfs/dbraw/zinc/52/04/57/1027520457.db2.gz HDSPGEKHWRJJKG-GMAHTHKFSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[NH+]3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)ccc2c1 ZINC000441398269 1027520467 /nfs/dbraw/zinc/52/04/67/1027520467.db2.gz HDSPGEKHWRJJKG-GMAHTHKFSA-N 2 1 334.507 4.331 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(Cl)c2)[C@H](C)C1 ZINC000152443749 1027545514 /nfs/dbraw/zinc/54/55/14/1027545514.db2.gz IFFUOJWXWREOBG-GJYPPUQNSA-N 2 1 338.923 4.128 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(O)cc32)CC[N@@H+]1Cc1ccccc1 ZINC000657693533 1027578332 /nfs/dbraw/zinc/57/83/32/1027578332.db2.gz MSMLXDZEWSFSFR-GTCCEBARSA-N 2 1 336.479 4.022 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(O)cc32)CC[N@H+]1Cc1ccccc1 ZINC000657693533 1027578341 /nfs/dbraw/zinc/57/83/41/1027578341.db2.gz MSMLXDZEWSFSFR-GTCCEBARSA-N 2 1 336.479 4.022 20 0 EIADMP CO[C@]1(C)CCC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC000475552718 1027595236 /nfs/dbraw/zinc/59/52/36/1027595236.db2.gz DFGWHBQNNFBYNC-OAQYLSRUSA-N 2 1 332.532 4.036 20 0 EIADMP Cc1cccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000582896374 1027604063 /nfs/dbraw/zinc/60/40/63/1027604063.db2.gz UOESPUQAFULPBK-NOTZXAQLSA-N 2 1 334.507 4.323 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1CCSCC1 ZINC000474879491 1027711743 /nfs/dbraw/zinc/71/17/43/1027711743.db2.gz QSEBCSBXVSYDQW-WSTZPKSXSA-N 2 1 346.584 4.408 20 0 EIADMP Fc1ccccc1[C@@H]1CC[N@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)C1 ZINC001167995640 1027793150 /nfs/dbraw/zinc/79/31/50/1027793150.db2.gz MCOPMQVTBIFADW-KAKFPZCNSA-N 2 1 328.475 4.020 20 0 EIADMP Fc1ccccc1[C@@H]1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C1 ZINC001167995640 1027793172 /nfs/dbraw/zinc/79/31/72/1027793172.db2.gz MCOPMQVTBIFADW-KAKFPZCNSA-N 2 1 328.475 4.020 20 0 EIADMP Fc1ccccc1[C@@H]1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C1 ZINC001167995640 1027793189 /nfs/dbraw/zinc/79/31/89/1027793189.db2.gz MCOPMQVTBIFADW-KAKFPZCNSA-N 2 1 328.475 4.020 20 0 EIADMP Fc1ccc2c(C3=CC[N@H+](CCC[NH+]4CCCCC4)CC3)c[nH]c2c1 ZINC000444621137 1027898650 /nfs/dbraw/zinc/89/86/50/1027898650.db2.gz QUUMNFZQVKQQCD-UHFFFAOYSA-N 2 1 341.474 4.272 20 0 EIADMP Fc1ccc2c(C3=CC[N@@H+](CCC[NH+]4CCCCC4)CC3)c[nH]c2c1 ZINC000444621137 1027898653 /nfs/dbraw/zinc/89/86/53/1027898653.db2.gz QUUMNFZQVKQQCD-UHFFFAOYSA-N 2 1 341.474 4.272 20 0 EIADMP C[C@@H](c1ccccn1)[NH+](C)CCCCC[N@H+](C)[C@@H](C)c1ccccn1 ZINC000091702932 1027901238 /nfs/dbraw/zinc/90/12/38/1027901238.db2.gz ZQYBDWGAHIUQIV-OALUTQOASA-N 2 1 340.515 4.333 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000520460116 1028046956 /nfs/dbraw/zinc/04/69/56/1028046956.db2.gz XUCYOUUHUYTUOZ-APIJFGDWSA-N 2 1 326.937 4.213 20 0 EIADMP Cc1ccc2cc(C[NH2+]CCCC[N@@H+]3CCC[C@@H](C)C3)ccc2n1 ZINC000189256319 1028111034 /nfs/dbraw/zinc/11/10/34/1028111034.db2.gz WOFLPISZFPWNLP-QGZVFWFLSA-N 2 1 325.500 4.145 20 0 EIADMP CCc1nc2c(s1)[C@@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)CCC2 ZINC000123944861 1028152720 /nfs/dbraw/zinc/15/27/20/1028152720.db2.gz NPNRYQAFVSKFMU-KRWDZBQOSA-N 2 1 343.540 4.324 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000280809196 1028194152 /nfs/dbraw/zinc/19/41/52/1028194152.db2.gz LUJDGBMYZOMMTP-QIJZBDPFSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000280809196 1028194161 /nfs/dbraw/zinc/19/41/61/1028194161.db2.gz LUJDGBMYZOMMTP-QIJZBDPFSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC001167659936 1028264376 /nfs/dbraw/zinc/26/43/76/1028264376.db2.gz XTZFJCMFKLFAPR-MRXNPFEDSA-N 2 1 336.470 4.441 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000346142349 1028277854 /nfs/dbraw/zinc/27/78/54/1028277854.db2.gz ALCLKRGNYRSRGQ-CQSZACIVSA-N 2 1 342.393 4.047 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000346142349 1028277868 /nfs/dbraw/zinc/27/78/68/1028277868.db2.gz ALCLKRGNYRSRGQ-CQSZACIVSA-N 2 1 342.393 4.047 20 0 EIADMP C[C@H]([NH2+]C1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cncc(F)c1 ZINC000124717875 1028292045 /nfs/dbraw/zinc/29/20/45/1028292045.db2.gz WYOBNXHURKUDDL-VDXVPGQCSA-N 2 1 341.474 4.028 20 0 EIADMP C[C@H]([NH2+]C1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1cncc(F)c1 ZINC000124717875 1028292073 /nfs/dbraw/zinc/29/20/73/1028292073.db2.gz WYOBNXHURKUDDL-VDXVPGQCSA-N 2 1 341.474 4.028 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1ccccc1)CC1CCC1 ZINC000346188113 1028297856 /nfs/dbraw/zinc/29/78/56/1028297856.db2.gz UPAREFQNFGAILC-UHFFFAOYSA-N 2 1 346.478 4.378 20 0 EIADMP CC[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1ccc(Cl)cc1 ZINC000346226667 1028336408 /nfs/dbraw/zinc/33/64/08/1028336408.db2.gz XVHJDDDQWYWOSZ-UHFFFAOYSA-N 2 1 340.858 4.251 20 0 EIADMP FC1(F)CC[C@@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000281080519 1028379174 /nfs/dbraw/zinc/37/91/74/1028379174.db2.gz JGEPWXACDHOWRX-MKXGPGLRSA-N 2 1 334.454 4.207 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000583395824 1028657831 /nfs/dbraw/zinc/65/78/31/1028657831.db2.gz NZPPOTNBWWOBQX-VGWHQZGPSA-N 2 1 327.299 4.027 20 0 EIADMP c1cc2c(cccc2C[N@H+]2C[C@@H]3CC[NH+](Cc4ccccc4)C[C@@H]3C2)[nH]1 ZINC000583423338 1028714469 /nfs/dbraw/zinc/71/44/69/1028714469.db2.gz FEADJNLCWBKOGV-PZJWPPBQSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2c(cccc2C[NH+]2C[C@@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C2)[nH]1 ZINC000583423338 1028714504 /nfs/dbraw/zinc/71/45/04/1028714504.db2.gz FEADJNLCWBKOGV-PZJWPPBQSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2c(cccc2C[NH+]2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)[nH]1 ZINC000583423338 1028714523 /nfs/dbraw/zinc/71/45/23/1028714523.db2.gz FEADJNLCWBKOGV-PZJWPPBQSA-N 2 1 345.490 4.122 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC[C@H]2CCO[C@H](C)C2)cc1 ZINC000346858959 1028798359 /nfs/dbraw/zinc/79/83/59/1028798359.db2.gz HLGJXNJQTZCOJU-RYRKJORJSA-N 2 1 327.472 4.037 20 0 EIADMP COCc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)o1 ZINC000127932573 1028842329 /nfs/dbraw/zinc/84/23/29/1028842329.db2.gz IFBSPQQMSAVAGP-UHFFFAOYSA-N 2 1 342.483 4.092 20 0 EIADMP COCC[C@@H]1CCCC[N@@H+]1C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168050435 1028874614 /nfs/dbraw/zinc/87/46/14/1028874614.db2.gz ANHHGSXHRHIYOX-ZJOUEHCJSA-N 2 1 344.543 4.319 20 0 EIADMP COCC[C@@H]1CCCC[N@H+]1C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168050435 1028874616 /nfs/dbraw/zinc/87/46/16/1028874616.db2.gz ANHHGSXHRHIYOX-ZJOUEHCJSA-N 2 1 344.543 4.319 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000647302743 1029022228 /nfs/dbraw/zinc/02/22/28/1029022228.db2.gz PFMZVYUGWPSDPR-SFHVURJKSA-N 2 1 336.470 4.455 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000647302743 1029022242 /nfs/dbraw/zinc/02/22/42/1029022242.db2.gz PFMZVYUGWPSDPR-SFHVURJKSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@H](c3ccccn3)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168051809 1029066385 /nfs/dbraw/zinc/06/63/85/1029066385.db2.gz ISBVQZHYSFCBEA-MXNKGDRCSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@H](c3ccccn3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168051809 1029066406 /nfs/dbraw/zinc/06/64/06/1029066406.db2.gz ISBVQZHYSFCBEA-MXNKGDRCSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3ccccn3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168051809 1029066421 /nfs/dbraw/zinc/06/64/21/1029066421.db2.gz ISBVQZHYSFCBEA-MXNKGDRCSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cnc(-c2ccco2)s1 ZINC000278395098 1029103892 /nfs/dbraw/zinc/10/38/92/1029103892.db2.gz MYZJOTPYWWUYFT-HNNXBMFYSA-N 2 1 333.501 4.147 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000469980251 1029207130 /nfs/dbraw/zinc/20/71/30/1029207130.db2.gz DVHXQSPCKUADKV-HZPDHXFCSA-N 2 1 329.513 4.111 20 0 EIADMP CC(C)CCn1cccc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475218834 1029453150 /nfs/dbraw/zinc/45/31/50/1029453150.db2.gz HDWPIZNTEYGBSX-NRFANRHFSA-N 2 1 339.527 4.146 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@@H]3c3ccccc3)C2)cc1 ZINC000475274046 1029478933 /nfs/dbraw/zinc/47/89/33/1029478933.db2.gz HKAOSXPXPKMLRO-MZYLBHOOSA-N 2 1 334.507 4.434 20 0 EIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000475291260 1029503360 /nfs/dbraw/zinc/50/33/60/1029503360.db2.gz NRATXTNUWIULCC-QYZOEREBSA-N 2 1 332.557 4.018 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2c(OC(F)F)ccc3ccccc32)CC[N@@H+]1C ZINC000525195096 1029518952 /nfs/dbraw/zinc/51/89/52/1029518952.db2.gz PBLMXMVQPXKHGJ-DZGCQCFKSA-N 2 1 334.410 4.014 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2c(OC(F)F)ccc3ccccc32)CC[N@H+]1C ZINC000525195096 1029518961 /nfs/dbraw/zinc/51/89/61/1029518961.db2.gz PBLMXMVQPXKHGJ-DZGCQCFKSA-N 2 1 334.410 4.014 20 0 EIADMP CC(C)COc1ccc(C(C)(C)C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000166534644 1029524269 /nfs/dbraw/zinc/52/42/69/1029524269.db2.gz GKTMFPVRUSMESE-WOJBJXKFSA-N 2 1 344.543 4.215 20 0 EIADMP COC[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CCCC1 ZINC000446830786 1029596778 /nfs/dbraw/zinc/59/67/78/1029596778.db2.gz WVZNOPDKOOQLOH-UWJYYQICSA-N 2 1 330.516 4.007 20 0 EIADMP CC1(C)CCC[C@@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)O1 ZINC000714342889 1029627489 /nfs/dbraw/zinc/62/74/89/1029627489.db2.gz FOEVQODATGRZDI-PMACEKPBSA-N 2 1 344.543 4.224 20 0 EIADMP CC1(C)CCC[C@@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)O1 ZINC000714342889 1029627492 /nfs/dbraw/zinc/62/74/92/1029627492.db2.gz FOEVQODATGRZDI-PMACEKPBSA-N 2 1 344.543 4.224 20 0 EIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H](C)c2ccc(F)cc2)CC1 ZINC000447077297 1029688251 /nfs/dbraw/zinc/68/82/51/1029688251.db2.gz MYOXUQZNGKBYQL-MRXNPFEDSA-N 2 1 328.431 4.176 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cc3ccccc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000090577298 1029867593 /nfs/dbraw/zinc/86/75/93/1029867593.db2.gz ZCWWCQNRPHHISF-WIYYLYMNSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000090577298 1029867596 /nfs/dbraw/zinc/86/75/96/1029867596.db2.gz ZCWWCQNRPHHISF-WIYYLYMNSA-N 2 1 347.506 4.353 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccc(OC)c(OC)c1 ZINC000090586270 1029867731 /nfs/dbraw/zinc/86/77/31/1029867731.db2.gz ZLTFGVIRUJHFKJ-HKUYNNGSSA-N 2 1 348.531 4.113 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000091287734 1029882374 /nfs/dbraw/zinc/88/23/74/1029882374.db2.gz QKFXDEDQGIWJGV-SUMWQHHRSA-N 2 1 326.406 4.088 20 0 EIADMP CC(C)[C@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1ccccc1 ZINC000091265949 1029882616 /nfs/dbraw/zinc/88/26/16/1029882616.db2.gz PSCQSJPHIZTQGB-QFIPXVFZSA-N 2 1 338.495 4.006 20 0 EIADMP CC(C)[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C(C)C)c1cccnc1 ZINC000091285233 1029882631 /nfs/dbraw/zinc/88/26/31/1029882631.db2.gz SDUTVYCMARHVRD-OAQYLSRUSA-N 2 1 325.500 4.409 20 0 EIADMP C[C@H](C[N@H+]1CCC[C@H](c2ncc[nH]2)C1)c1cccc(Br)c1 ZINC000092073655 1029900626 /nfs/dbraw/zinc/90/06/26/1029900626.db2.gz HSOJHHPLCPHDLW-HIFRSBDPSA-N 2 1 348.288 4.155 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccc(F)cn1 ZINC000092748921 1029944591 /nfs/dbraw/zinc/94/45/91/1029944591.db2.gz KGRJRDVULYWJQA-QGZVFWFLSA-N 2 1 341.474 4.448 20 0 EIADMP CCc1ncc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)s1 ZINC000093006740 1029963221 /nfs/dbraw/zinc/96/32/21/1029963221.db2.gz VKEURDRAKNKGMF-UHFFFAOYSA-N 2 1 343.540 4.050 20 0 EIADMP C[N@@H+](CCc1c(Cl)cccc1Cl)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000450983296 1030156177 /nfs/dbraw/zinc/15/61/77/1030156177.db2.gz PSOGMUTWDJLAIW-PBWFPOADSA-N 2 1 327.299 4.093 20 0 EIADMP C[NH+](CCc1c(Cl)cccc1Cl)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000450983296 1030156187 /nfs/dbraw/zinc/15/61/87/1030156187.db2.gz PSOGMUTWDJLAIW-PBWFPOADSA-N 2 1 327.299 4.093 20 0 EIADMP C[NH+](CCc1c(Cl)cccc1Cl)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000450983296 1030156199 /nfs/dbraw/zinc/15/61/99/1030156199.db2.gz PSOGMUTWDJLAIW-PBWFPOADSA-N 2 1 327.299 4.093 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H](c2cccnc2)C2CC2)C3)cc1 ZINC000447588804 1030189055 /nfs/dbraw/zinc/18/90/55/1030189055.db2.gz VNTDPFGVYHXBDI-BJESRGMDSA-N 2 1 347.506 4.318 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657887330 1030227061 /nfs/dbraw/zinc/22/70/61/1030227061.db2.gz GZSZUFGMQRCRIN-MDZLAQPJSA-N 2 1 345.712 4.236 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657887330 1030227081 /nfs/dbraw/zinc/22/70/81/1030227081.db2.gz GZSZUFGMQRCRIN-MDZLAQPJSA-N 2 1 345.712 4.236 20 0 EIADMP FC1(F)CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000447578775 1030206958 /nfs/dbraw/zinc/20/69/58/1030206958.db2.gz HHPZPIHSPBNQDP-AKHDSKFASA-N 2 1 334.454 4.350 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447579679 1030208267 /nfs/dbraw/zinc/20/82/67/1030208267.db2.gz LIYQORLFAAVAOQ-MVWVFHAYSA-N 2 1 349.522 4.490 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000447601018 1030220696 /nfs/dbraw/zinc/22/06/96/1030220696.db2.gz OLWXYLCKDDCTBF-WAOWUJCRSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000447601018 1030220709 /nfs/dbraw/zinc/22/07/09/1030220709.db2.gz OLWXYLCKDDCTBF-WAOWUJCRSA-N 2 1 338.495 4.399 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCCc3c(C)ccc(C)c32)cn1 ZINC000186117341 1030252192 /nfs/dbraw/zinc/25/21/92/1030252192.db2.gz URNLLXOKSPYABQ-HXUWFJFHSA-N 2 1 346.478 4.360 20 0 EIADMP C/C=C\COc1ccc(CC[C@H](C)[NH2+]C[C@H]2CC[N@H+](C(C)C)C2)cc1 ZINC000685455690 1030341759 /nfs/dbraw/zinc/34/17/59/1030341759.db2.gz LFXUHYOGVFTFRB-LJQWKTEUSA-N 2 1 344.543 4.283 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)o1 ZINC000685470263 1030352177 /nfs/dbraw/zinc/35/21/77/1030352177.db2.gz BYSVLDNMPCHONK-HNAYVOBHSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@@H]2C)o1 ZINC000685470263 1030352194 /nfs/dbraw/zinc/35/21/94/1030352194.db2.gz BYSVLDNMPCHONK-HNAYVOBHSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)o1 ZINC000685470263 1030352206 /nfs/dbraw/zinc/35/22/06/1030352206.db2.gz BYSVLDNMPCHONK-HNAYVOBHSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)o1 ZINC000685470263 1030352224 /nfs/dbraw/zinc/35/22/24/1030352224.db2.gz BYSVLDNMPCHONK-HNAYVOBHSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)C2CCSCC2)cc1 ZINC000187290810 1030353443 /nfs/dbraw/zinc/35/34/43/1030353443.db2.gz AFGRMYUCRKCMQS-CABCVRRESA-N 2 1 329.513 4.363 20 0 EIADMP CCC(CC)C[N@H+](C)C1CCN(Cc2[nH+]cc(C)c(OC)c2C)CC1 ZINC000685468568 1030355590 /nfs/dbraw/zinc/35/55/90/1030355590.db2.gz ANUKCHPLFLUNOB-UHFFFAOYSA-N 2 1 347.547 4.039 20 0 EIADMP CCC(CC)C[N@@H+](C)C1CCN(Cc2[nH+]cc(C)c(OC)c2C)CC1 ZINC000685468568 1030355611 /nfs/dbraw/zinc/35/56/11/1030355611.db2.gz ANUKCHPLFLUNOB-UHFFFAOYSA-N 2 1 347.547 4.039 20 0 EIADMP C([C@@H]1CCC2(CCCC2)O1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000530410442 1030380524 /nfs/dbraw/zinc/38/05/24/1030380524.db2.gz SOSOOMKJSPFJDI-PMACEKPBSA-N 2 1 334.548 4.066 20 0 EIADMP c1nc(C2CC2)oc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000628210153 1030382008 /nfs/dbraw/zinc/38/20/08/1030382008.db2.gz IXYLIFLADXDVAY-UHFFFAOYSA-N 2 1 339.483 4.218 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cc2cnccc2o1 ZINC000657896610 1030402138 /nfs/dbraw/zinc/40/21/38/1030402138.db2.gz AIQIARRBKIVAQB-HNNXBMFYSA-N 2 1 327.472 4.276 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2c(F)cccc2F)o1 ZINC000115616384 1030689599 /nfs/dbraw/zinc/68/95/99/1030689599.db2.gz RUOHPIDGLMHVTF-ZDUSSCGKSA-N 2 1 345.393 4.156 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3c(F)cccc3F)o2)CCN1C ZINC000093644180 1030740740 /nfs/dbraw/zinc/74/07/40/1030740740.db2.gz KJHJAGJMJGFZQR-KBPBESRZSA-N 2 1 334.410 4.139 20 0 EIADMP Clc1cnccc1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000527630906 1030788865 /nfs/dbraw/zinc/78/88/65/1030788865.db2.gz BYDHGXYAXOYIIS-UHFFFAOYSA-N 2 1 329.875 4.011 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@@H]1c1cccs1 ZINC000527669028 1030806572 /nfs/dbraw/zinc/80/65/72/1030806572.db2.gz WSPZSNIJISZGCE-FXAWDEMLSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@@H]1c1cccs1 ZINC000527669028 1030806583 /nfs/dbraw/zinc/80/65/83/1030806583.db2.gz WSPZSNIJISZGCE-FXAWDEMLSA-N 2 1 339.508 4.402 20 0 EIADMP c1ccc([C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C2CCC2)nc1 ZINC000527769574 1030851106 /nfs/dbraw/zinc/85/11/06/1030851106.db2.gz AJBGUCUBOOMUIT-OAQYLSRUSA-N 2 1 327.516 4.310 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCSc2ccccc2Cl)CC[N@@H+]1C ZINC000531143398 1030917938 /nfs/dbraw/zinc/91/79/38/1030917938.db2.gz IZOICXCKQWSUAQ-CABCVRRESA-N 2 1 326.937 4.237 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCSc2ccccc2Cl)CC[N@H+]1C ZINC000531143398 1030917961 /nfs/dbraw/zinc/91/79/61/1030917961.db2.gz IZOICXCKQWSUAQ-CABCVRRESA-N 2 1 326.937 4.237 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCSc2ccccc2Cl)CC[NH+]1C ZINC000531143398 1030917989 /nfs/dbraw/zinc/91/79/89/1030917989.db2.gz IZOICXCKQWSUAQ-CABCVRRESA-N 2 1 326.937 4.237 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCSc2ccccc2Cl)CC[NH+]1C ZINC000531143398 1030918017 /nfs/dbraw/zinc/91/80/17/1030918017.db2.gz IZOICXCKQWSUAQ-CABCVRRESA-N 2 1 326.937 4.237 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccccn1 ZINC000658320159 1030979560 /nfs/dbraw/zinc/97/95/60/1030979560.db2.gz OVZJZDZZTIAJMU-AZUAARDMSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccccn1 ZINC000658320159 1030979571 /nfs/dbraw/zinc/97/95/71/1030979571.db2.gz OVZJZDZZTIAJMU-AZUAARDMSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CCc3cccnc3CC2)CC1 ZINC000421830393 1031034506 /nfs/dbraw/zinc/03/45/06/1031034506.db2.gz JUUDDVRAZPSZLW-NQIIRXRSSA-N 2 1 349.522 4.144 20 0 EIADMP C[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310081721 1031038638 /nfs/dbraw/zinc/03/86/38/1031038638.db2.gz JTWWQSHTFVIRIJ-UWJYYQICSA-N 2 1 326.459 4.389 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2ccccc2OC(F)(F)F)CC1 ZINC000532451942 1031085974 /nfs/dbraw/zinc/08/59/74/1031085974.db2.gz KECAHKFBKUZKGV-AWEZNQCLSA-N 2 1 344.421 4.356 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCOc1ccc(Cl)cc1Cl ZINC000532464686 1031126281 /nfs/dbraw/zinc/12/62/81/1031126281.db2.gz ZIBFIHXMECYVNM-DVOMOZLQSA-N 2 1 345.314 4.081 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)CCOc2c(Cl)cccc2Cl)C[C@H]1C ZINC000531378173 1031138333 /nfs/dbraw/zinc/13/83/33/1031138333.db2.gz DGFJXBFNTLNZHK-KGLIPLIRSA-N 2 1 345.314 4.177 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCOc2c(Cl)cccc2Cl)C[C@H]1C ZINC000531378173 1031138354 /nfs/dbraw/zinc/13/83/54/1031138354.db2.gz DGFJXBFNTLNZHK-KGLIPLIRSA-N 2 1 345.314 4.177 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCOc2c(Cl)cccc2Cl)C[C@H]1C ZINC000531378173 1031138370 /nfs/dbraw/zinc/13/83/70/1031138370.db2.gz DGFJXBFNTLNZHK-KGLIPLIRSA-N 2 1 345.314 4.177 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCOc2c(Cl)cccc2Cl)C[C@H]1C ZINC000531378173 1031138384 /nfs/dbraw/zinc/13/83/84/1031138384.db2.gz DGFJXBFNTLNZHK-KGLIPLIRSA-N 2 1 345.314 4.177 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CCCO2 ZINC000532548874 1031261824 /nfs/dbraw/zinc/26/18/24/1031261824.db2.gz ADQWYWCGMNAEDJ-FQEVSTJZSA-N 2 1 346.490 4.426 20 0 EIADMP COc1ccccc1C[N@@H+](C1CCC(C)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168205983 1031270515 /nfs/dbraw/zinc/27/05/15/1031270515.db2.gz OAAGEKFWHSOXDJ-YAEFEIELSA-N 2 1 330.516 4.346 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)C2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000897451802 1031342546 /nfs/dbraw/zinc/34/25/46/1031342546.db2.gz QCJCPMQDXFCAAO-WIYYLYMNSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)C2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000897451802 1031342563 /nfs/dbraw/zinc/34/25/63/1031342563.db2.gz QCJCPMQDXFCAAO-WIYYLYMNSA-N 2 1 344.543 4.082 20 0 EIADMP COc1cc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)cc2ccccc21 ZINC000449008932 1031355527 /nfs/dbraw/zinc/35/55/27/1031355527.db2.gz LVKNFEDLCPCSLW-UHFFFAOYSA-N 2 1 326.484 4.153 20 0 EIADMP COc1cc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc2ccccc21 ZINC000449008932 1031355540 /nfs/dbraw/zinc/35/55/40/1031355540.db2.gz LVKNFEDLCPCSLW-UHFFFAOYSA-N 2 1 326.484 4.153 20 0 EIADMP CC[N@H+](Cc1cc2cccnc2o1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000449038587 1031377548 /nfs/dbraw/zinc/37/75/48/1031377548.db2.gz VYPNWYRPLNDNKY-IBGZPJMESA-N 2 1 349.478 4.172 20 0 EIADMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cnn1C ZINC000449071906 1031425783 /nfs/dbraw/zinc/42/57/83/1031425783.db2.gz CKEJWCUKNCKYQJ-HNNXBMFYSA-N 2 1 334.552 4.058 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449076529 1031429948 /nfs/dbraw/zinc/42/99/48/1031429948.db2.gz TZDLROHNRJKMKR-KRWDZBQOSA-N 3 1 348.579 4.096 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@@H]2CCOC3(CCC3)C2)cc1 ZINC000449080392 1031434749 /nfs/dbraw/zinc/43/47/49/1031434749.db2.gz VTTAYHOTQNXRDC-WIYYLYMNSA-N 2 1 342.527 4.252 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CSCCc3ccccc32)C1 ZINC000531681414 1031474448 /nfs/dbraw/zinc/47/44/48/1031474448.db2.gz VHWIFIOIVVOQKZ-PXNSSMCTSA-N 2 1 332.557 4.119 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](Cc1cccc(F)c1)c1cccc(F)c1 ZINC000531708085 1031493251 /nfs/dbraw/zinc/49/32/51/1031493251.db2.gz NOZJRPOKVVWCHX-HXUWFJFHSA-N 2 1 341.405 4.043 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cc2cccnc2o1 ZINC000449181027 1031519070 /nfs/dbraw/zinc/51/90/70/1031519070.db2.gz DNPPQZXYNJKPDE-LFUKPOHLSA-N 2 1 349.478 4.074 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cc2cccnc2o1 ZINC000449181027 1031519082 /nfs/dbraw/zinc/51/90/82/1031519082.db2.gz DNPPQZXYNJKPDE-LFUKPOHLSA-N 2 1 349.478 4.074 20 0 EIADMP COCC1CCC([NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000449216235 1031549939 /nfs/dbraw/zinc/54/99/39/1031549939.db2.gz QQJAFAMENNRVIF-PMJAUZGISA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1nc(C(F)(F)F)cs1 ZINC000343824236 1031556393 /nfs/dbraw/zinc/55/63/93/1031556393.db2.gz ABBBTLNRILVVTG-NSHDSACASA-N 2 1 343.418 4.074 20 0 EIADMP CC(C)[N@@H+](C)CCCN[C@H](C)c1ccc(Oc2ccccc2)cn1 ZINC000453088993 1031579915 /nfs/dbraw/zinc/57/99/15/1031579915.db2.gz ZSIXXJVXYLWSAB-QGZVFWFLSA-N 2 1 327.472 4.255 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)CCCc2cccnc2)c1 ZINC000453107482 1031597992 /nfs/dbraw/zinc/59/79/92/1031597992.db2.gz LELYOUNGXLHLAN-GOSISDBHSA-N 2 1 325.500 4.034 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000453122041 1031615774 /nfs/dbraw/zinc/61/57/74/1031615774.db2.gz DYKKGSXCDRARBX-OKZBNKHCSA-N 2 1 339.483 4.397 20 0 EIADMP c1cc2cccc(C[NH+]3CCC(c4[nH+]cc5n4CCCC5)CC3)c2o1 ZINC000449292875 1031620395 /nfs/dbraw/zinc/62/03/95/1031620395.db2.gz SHAQDOMTIWBVRY-UHFFFAOYSA-N 2 1 335.451 4.345 20 0 EIADMP CC[C@@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccncc1 ZINC000453153554 1031630173 /nfs/dbraw/zinc/63/01/73/1031630173.db2.gz VKGGJTCVKCEZRL-OSZJIOELSA-N 2 1 337.511 4.279 20 0 EIADMP CC(C)OCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453194480 1031701703 /nfs/dbraw/zinc/70/17/03/1031701703.db2.gz NNTVXDIWILJMOG-BDTNDASRSA-N 2 1 344.543 4.224 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccncc2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449417512 1031702391 /nfs/dbraw/zinc/70/23/91/1031702391.db2.gz YOTGVOHOVWQSCD-JOCHJYFZSA-N 2 1 349.522 4.204 20 0 EIADMP COCCC(C)(C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453198905 1031708778 /nfs/dbraw/zinc/70/87/78/1031708778.db2.gz PESYJQNADREOQK-NJYVYQBISA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1cc(F)ccc1F ZINC000128119449 1031726428 /nfs/dbraw/zinc/72/64/28/1031726428.db2.gz UEQROEHJQATOOV-IBGZPJMESA-N 2 1 345.437 4.378 20 0 EIADMP COc1ccc2oc([C@@H](C)NC3C[C@H]4CC[C@@H](C3)[N@@H+]4C)c(C)c2c1 ZINC000453341979 1031867193 /nfs/dbraw/zinc/86/71/93/1031867193.db2.gz HVXUUJJGPJMZJP-WZYMTQMTSA-N 2 1 328.456 4.026 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)c(C)c2c1 ZINC000453341979 1031867200 /nfs/dbraw/zinc/86/72/00/1031867200.db2.gz HVXUUJJGPJMZJP-WZYMTQMTSA-N 2 1 328.456 4.026 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453344910 1031870642 /nfs/dbraw/zinc/87/06/42/1031870642.db2.gz JJZNKHIKURKFJZ-CSNJMZFVSA-N 2 1 339.527 4.439 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531963218 1031883510 /nfs/dbraw/zinc/88/35/10/1031883510.db2.gz CTLJBTYWOUYBOW-XKQJLSEDSA-N 2 1 328.422 4.475 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531963218 1031883515 /nfs/dbraw/zinc/88/35/15/1031883515.db2.gz CTLJBTYWOUYBOW-XKQJLSEDSA-N 2 1 328.422 4.475 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CCOCC1 ZINC000531967644 1031888777 /nfs/dbraw/zinc/88/87/77/1031888777.db2.gz RCTVHNLTXPTACP-UWJYYQICSA-N 2 1 330.516 4.007 20 0 EIADMP CCn1cc([C@@H](C)[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cn1 ZINC000449678445 1031924400 /nfs/dbraw/zinc/92/44/00/1031924400.db2.gz PRXQFOIMNDTJMQ-MRXNPFEDSA-N 2 1 334.552 4.233 20 0 EIADMP C[C@@H]1C[C@H](NCc2ccc(Oc3ccccc3F)c(F)c2)CC[N@H+]1C ZINC000531980815 1031925863 /nfs/dbraw/zinc/92/58/63/1031925863.db2.gz SJRBQFYSZUUVNW-GDBMZVCRSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CCN1C ZINC000531980815 1031925874 /nfs/dbraw/zinc/92/58/74/1031925874.db2.gz SJRBQFYSZUUVNW-GDBMZVCRSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CC[N@@H+]1C ZINC000531980815 1031925882 /nfs/dbraw/zinc/92/58/82/1031925882.db2.gz SJRBQFYSZUUVNW-GDBMZVCRSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CC[N@H+]1C ZINC000531980815 1031925887 /nfs/dbraw/zinc/92/58/87/1031925887.db2.gz SJRBQFYSZUUVNW-GDBMZVCRSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)[C@H](C)c1nc2ccccc2s1 ZINC000453417584 1031952133 /nfs/dbraw/zinc/95/21/33/1031952133.db2.gz XVEGFGIYBKHQFZ-LSDHHAIUSA-N 2 1 331.529 4.252 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000512646590 1033612742 /nfs/dbraw/zinc/61/27/42/1033612742.db2.gz BMWAUGSCCQIEGO-LWYYNNOASA-N 2 1 348.481 4.455 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000512653433 1033622298 /nfs/dbraw/zinc/62/22/98/1033622298.db2.gz FHIFODHMDTVILA-RCCFBDPRSA-N 2 1 340.433 4.219 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CC3CCC(F)(F)CC3)C2)CC1 ZINC001307440779 1033751210 /nfs/dbraw/zinc/75/12/10/1033751210.db2.gz SUVIIVWKPJMILI-GOSISDBHSA-N 2 1 328.491 4.256 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H](c3cnn(C)c3)C(C)(C)C)CC2)C1 ZINC000513326330 1034880018 /nfs/dbraw/zinc/88/00/18/1034880018.db2.gz PECDWYSAFXXOHW-AHRSYUTCSA-N 2 1 346.563 4.140 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)c1 ZINC000513365059 1034893141 /nfs/dbraw/zinc/89/31/41/1034893141.db2.gz KFHQLTHSOYYYJE-IBGZPJMESA-N 2 1 330.422 4.194 20 0 EIADMP Cc1cc(F)ccc1CN(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513490388 1034981992 /nfs/dbraw/zinc/98/19/92/1034981992.db2.gz NINHXJQURFHWQY-UHFFFAOYSA-N 2 1 326.459 4.231 20 0 EIADMP C[C@H](CCc1ccccc1)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501066457 1035366764 /nfs/dbraw/zinc/36/67/64/1035366764.db2.gz CQJSPKUHTYTRKQ-LJQANCHMSA-N 2 1 337.511 4.251 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000501380169 1035434421 /nfs/dbraw/zinc/43/44/21/1035434421.db2.gz CUIZLRKKNOWIDT-BAAYTWLHSA-N 2 1 338.417 4.183 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000501425133 1035443269 /nfs/dbraw/zinc/44/32/69/1035443269.db2.gz OAWPEBGNPJYANS-JKTUTYCYSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000501425133 1035443277 /nfs/dbraw/zinc/44/32/77/1035443277.db2.gz OAWPEBGNPJYANS-JKTUTYCYSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000501425134 1035443300 /nfs/dbraw/zinc/44/33/00/1035443300.db2.gz OAWPEBGNPJYANS-PLUODVSUSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000501425134 1035443303 /nfs/dbraw/zinc/44/33/03/1035443303.db2.gz OAWPEBGNPJYANS-PLUODVSUSA-N 2 1 338.417 4.325 20 0 EIADMP C[C@@H]1CCC[C@](C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)([NH+](C)C)C1 ZINC000501466972 1035449125 /nfs/dbraw/zinc/44/91/25/1035449125.db2.gz MEJQJPDWNCIPCX-JYRKZWEQSA-N 2 1 329.532 4.208 20 0 EIADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3nc(-c4ccccc4Cl)cs3)C[C@@H]21 ZINC000420302379 1035501639 /nfs/dbraw/zinc/50/16/39/1035501639.db2.gz FUOFVAXWRFCLFU-DUVNUKRYSA-N 2 1 347.915 4.023 20 0 EIADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3nc(-c4ccccc4Cl)cs3)C[C@@H]21 ZINC000420302379 1035501649 /nfs/dbraw/zinc/50/16/49/1035501649.db2.gz FUOFVAXWRFCLFU-DUVNUKRYSA-N 2 1 347.915 4.023 20 0 EIADMP FC(F)(F)CCCC[N@@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000420301817 1035501696 /nfs/dbraw/zinc/50/16/96/1035501696.db2.gz BANIHVNCCOAQCN-OAHLLOKOSA-N 2 1 346.462 4.425 20 0 EIADMP FC(F)(F)CCCC[N@@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000420301816 1035502805 /nfs/dbraw/zinc/50/28/05/1035502805.db2.gz BANIHVNCCOAQCN-HNNXBMFYSA-N 2 1 346.462 4.425 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315682 1035510175 /nfs/dbraw/zinc/51/01/75/1035510175.db2.gz XEPDGSZYZDPIMX-SDNTUTLCSA-N 2 1 345.874 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315682 1035510185 /nfs/dbraw/zinc/51/01/85/1035510185.db2.gz XEPDGSZYZDPIMX-SDNTUTLCSA-N 2 1 345.874 4.034 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccnc(Cl)c1 ZINC000156215116 1035515213 /nfs/dbraw/zinc/51/52/13/1035515213.db2.gz XGOBLZSYEQHTTG-JKSUJKDBSA-N 2 1 331.891 4.296 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccnc(Cl)c1 ZINC000156215116 1035515244 /nfs/dbraw/zinc/51/52/44/1035515244.db2.gz XGOBLZSYEQHTTG-JKSUJKDBSA-N 2 1 331.891 4.296 20 0 EIADMP [NH3+]C[C@@H]1C[N@H+]([C@@H]2CCc3c2cccc3Cl)C[C@H]1c1ccccc1 ZINC000420315846 1035515693 /nfs/dbraw/zinc/51/56/93/1035515693.db2.gz MVQOMNXGDPLRQU-MOXGXCLJSA-N 2 1 326.871 4.002 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CCN(Cc2cnc(Cl)s2)CC1 ZINC000151166294 1035544454 /nfs/dbraw/zinc/54/44/54/1035544454.db2.gz URQWISNVSVAYFE-AWEZNQCLSA-N 2 1 341.952 4.273 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000595073426 1035554062 /nfs/dbraw/zinc/55/40/62/1035554062.db2.gz SLDWDSCGUNGRBI-IEBWSBKVSA-N 2 1 332.557 4.020 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@H+](C)CCCn1cc[nH+]c1C ZINC000575219065 1035727700 /nfs/dbraw/zinc/72/77/00/1035727700.db2.gz SFABAPXKQVATAY-UHFFFAOYSA-N 2 1 349.478 4.389 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)CCCn1cc[nH+]c1C ZINC000575219065 1035727728 /nfs/dbraw/zinc/72/77/28/1035727728.db2.gz SFABAPXKQVATAY-UHFFFAOYSA-N 2 1 349.478 4.389 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc3sccc3c2)[C@H](C)C1 ZINC000575222289 1035729979 /nfs/dbraw/zinc/72/99/79/1035729979.db2.gz ZMWVFJIJQRIMIX-VQIMIIECSA-N 2 1 346.540 4.128 20 0 EIADMP Cc1cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cnc1Cl ZINC000760664917 1036009541 /nfs/dbraw/zinc/00/95/41/1036009541.db2.gz YJULMXXAOQGFEQ-UHFFFAOYSA-N 2 1 331.891 4.173 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000502285036 1036041639 /nfs/dbraw/zinc/04/16/39/1036041639.db2.gz SWPJOXCVANDCNI-UVQBRAAOSA-N 2 1 340.433 4.382 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000502285036 1036041663 /nfs/dbraw/zinc/04/16/63/1036041663.db2.gz SWPJOXCVANDCNI-UVQBRAAOSA-N 2 1 340.433 4.382 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000502285036 1036041700 /nfs/dbraw/zinc/04/17/00/1036041700.db2.gz SWPJOXCVANDCNI-UVQBRAAOSA-N 2 1 340.433 4.382 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000502285036 1036041720 /nfs/dbraw/zinc/04/17/20/1036041720.db2.gz SWPJOXCVANDCNI-UVQBRAAOSA-N 2 1 340.433 4.382 20 0 EIADMP FC1(F)CCC[C@H](C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000502318915 1036077544 /nfs/dbraw/zinc/07/75/44/1036077544.db2.gz QILMQNJUDOHKPD-SFHVURJKSA-N 2 1 336.470 4.109 20 0 EIADMP C[N@@H+](Cc1cccc(C2CC2)c1)C1CCN(CCc2ccccn2)CC1 ZINC000421319357 1036263123 /nfs/dbraw/zinc/26/31/23/1036263123.db2.gz MHXLAWDEBYWRSM-UHFFFAOYSA-N 2 1 349.522 4.098 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000502696046 1036512760 /nfs/dbraw/zinc/51/27/60/1036512760.db2.gz BMJSLHZGLUHBPA-BVYCBKJFSA-N 2 1 344.543 4.213 20 0 EIADMP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1cc(C)c(C)o1 ZINC000502707940 1036548805 /nfs/dbraw/zinc/54/88/05/1036548805.db2.gz OLTNFWSZNKLYGT-QGZVFWFLSA-N 2 1 344.499 4.468 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CC1 ZINC000602709891 1036581144 /nfs/dbraw/zinc/58/11/44/1036581144.db2.gz JKAKYPCQCGQEFL-QUCCMNQESA-N 2 1 344.568 4.477 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CC1 ZINC000602709891 1036581157 /nfs/dbraw/zinc/58/11/57/1036581157.db2.gz JKAKYPCQCGQEFL-QUCCMNQESA-N 2 1 344.568 4.477 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000502725583 1036587060 /nfs/dbraw/zinc/58/70/60/1036587060.db2.gz XUVKLZSTDGHCGE-IPJJNNNSSA-N 2 1 344.543 4.213 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cccc(F)c2)CC1 ZINC000513758667 1036731458 /nfs/dbraw/zinc/73/14/58/1036731458.db2.gz AWQRFZDPEKMFKH-UHFFFAOYSA-N 2 1 326.459 4.359 20 0 EIADMP C[C@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000486719639 1036825223 /nfs/dbraw/zinc/82/52/23/1036825223.db2.gz HMXVBOGXCOTLFH-GOEBONIOSA-N 2 1 329.463 4.050 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cccc3[nH]ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000503123229 1036921933 /nfs/dbraw/zinc/92/19/33/1036921933.db2.gz RMWSXKGBFUCZLY-GHTZIAJQSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cccc3[nH]ccc32)CC[N@H+]1Cc1ccccc1 ZINC000503123229 1036921945 /nfs/dbraw/zinc/92/19/45/1036921945.db2.gz RMWSXKGBFUCZLY-GHTZIAJQSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000272265916 1037146980 /nfs/dbraw/zinc/14/69/80/1037146980.db2.gz AKVPTBQQKHUFBX-BXWFABGCSA-N 2 1 343.902 4.296 20 0 EIADMP COc1ccc(C)cc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000590819112 1037185959 /nfs/dbraw/zinc/18/59/59/1037185959.db2.gz SBHSNCHEKQYOCY-IBGZPJMESA-N 2 1 330.516 4.092 20 0 EIADMP COc1ccc(C)cc1C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000590819112 1037185961 /nfs/dbraw/zinc/18/59/61/1037185961.db2.gz SBHSNCHEKQYOCY-IBGZPJMESA-N 2 1 330.516 4.092 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)COC2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000272691535 1037267946 /nfs/dbraw/zinc/26/79/46/1037267946.db2.gz PQQGJUYLHSHXRI-JZXOWHBKSA-N 2 1 328.500 4.020 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=[NH2+])Nc3ccccc3)cc2)C1 ZINC000057887941 1037289474 /nfs/dbraw/zinc/28/94/74/1037289474.db2.gz PUHFTIOFWUZEBE-QGZVFWFLSA-N 2 1 336.483 4.055 20 0 EIADMP Cc1cnc([C@H](C)C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000273508581 1037488002 /nfs/dbraw/zinc/48/80/02/1037488002.db2.gz ZZDNCGACKAIKLA-GPMSIDNRSA-N 2 1 343.540 4.055 20 0 EIADMP C[C@H]([NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000488551030 1037662296 /nfs/dbraw/zinc/66/22/96/1037662296.db2.gz ZOHQJIUJKFPPCB-OJAHFUOMSA-N 2 1 346.584 4.407 20 0 EIADMP C[C@@H]1C[C@@H](C[N@H+]2CCc3sccc3[C@@H]2c2cccs2)CC[NH2+]1 ZINC000414680355 1037793648 /nfs/dbraw/zinc/79/36/48/1037793648.db2.gz MYGTWSVJFFXDLF-QWQRMKEZSA-N 2 1 332.538 4.145 20 0 EIADMP COCCSc1ccc([C@H](C)[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422709438 1037805101 /nfs/dbraw/zinc/80/51/01/1037805101.db2.gz DISJIJVJKZJDCL-GKCIPKSASA-N 2 1 342.508 4.221 20 0 EIADMP Cc1cc(Br)cc(C)c1C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422831102 1037843278 /nfs/dbraw/zinc/84/32/78/1037843278.db2.gz WGYRSJKZHWNHBV-MSOLQXFVSA-N 2 1 345.284 4.300 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000311123376 1037858093 /nfs/dbraw/zinc/85/80/93/1037858093.db2.gz HPZJHEKDDHEXNG-XMSQKQJNSA-N 2 1 338.495 4.258 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@H](C)C[C@H]3CCCCC[NH2+]3)o2)cs1 ZINC000422947075 1037885172 /nfs/dbraw/zinc/88/51/72/1037885172.db2.gz PSDSTPMVNGOMBV-UKRRQHHQSA-N 2 1 333.501 4.112 20 0 EIADMP Cc1cc(Cl)ccc1C[N@H+](Cc1ccccn1)[C@@H]1CCC[NH2+]CC1 ZINC000414711963 1037905524 /nfs/dbraw/zinc/90/55/24/1037905524.db2.gz IJJBDEIKJNDTJQ-HXUWFJFHSA-N 2 1 343.902 4.188 20 0 EIADMP Cc1cc(Cl)ccc1C[N@@H+](Cc1ccccn1)[C@@H]1CCC[NH2+]CC1 ZINC000414711963 1037905546 /nfs/dbraw/zinc/90/55/46/1037905546.db2.gz IJJBDEIKJNDTJQ-HXUWFJFHSA-N 2 1 343.902 4.188 20 0 EIADMP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423052560 1037937651 /nfs/dbraw/zinc/93/76/51/1037937651.db2.gz QSANYEQCZBHXHY-ZOWXZIJZSA-N 2 1 333.476 4.042 20 0 EIADMP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423092383 1037948154 /nfs/dbraw/zinc/94/81/54/1037948154.db2.gz BSJSMMMOWHZOFQ-GALXQHASSA-N 2 1 328.887 4.134 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2nccc3ccccc32)c1 ZINC000607167340 1037980666 /nfs/dbraw/zinc/98/06/66/1037980666.db2.gz KEHLOVXNXRPZHP-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP CCOc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1Cl ZINC000423110471 1037991684 /nfs/dbraw/zinc/99/16/84/1037991684.db2.gz UTPCLYPIKPRQKW-IEBWSBKVSA-N 2 1 344.886 4.322 20 0 EIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000423183751 1038017947 /nfs/dbraw/zinc/01/79/47/1038017947.db2.gz GWGPHSMMVVTYEF-INIZCTEOSA-N 2 1 337.467 4.221 20 0 EIADMP c1csc([C@H]([NH2+]CCC[NH2+]Cc2cccnc2)C2CCCC2)c1 ZINC000423184391 1038018008 /nfs/dbraw/zinc/01/80/08/1038018008.db2.gz HUCQEOUDKIDIMI-LJQANCHMSA-N 2 1 329.513 4.144 20 0 EIADMP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cc(Cl)cc(Cl)c1 ZINC000423180337 1038035575 /nfs/dbraw/zinc/03/55/75/1038035575.db2.gz ATWGMOIMBLNKLM-ZDUSSCGKSA-N 2 1 338.282 4.219 20 0 EIADMP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cc2ccccc2s1 ZINC000423191791 1038046676 /nfs/dbraw/zinc/04/66/76/1038046676.db2.gz TZTPFVYPBGCHJC-OAHLLOKOSA-N 2 1 325.481 4.127 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cc2ccccc2o1 ZINC000423193124 1038051035 /nfs/dbraw/zinc/05/10/35/1038051035.db2.gz WOXCAMJWAYTFBU-NRFANRHFSA-N 2 1 337.467 4.294 20 0 EIADMP c1csc(C[N@H+](CC2CCCCCC2)[C@@H]2CC23CC[NH2+]CC3)n1 ZINC000414725797 1038056565 /nfs/dbraw/zinc/05/65/65/1038056565.db2.gz WXSCDRQFBJYRBY-QGZVFWFLSA-N 2 1 333.545 4.058 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Br)c(F)c1 ZINC000489489130 1038082063 /nfs/dbraw/zinc/08/20/63/1038082063.db2.gz YSWKSRZVKYCRKM-FPMFFAJLSA-N 2 1 343.284 4.112 20 0 EIADMP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@H](C[NH3+])CC(C)C)s2)cc1 ZINC000423258117 1038087490 /nfs/dbraw/zinc/08/74/90/1038087490.db2.gz BAWHBSIDHDSCKL-BBRMVZONSA-N 2 1 347.528 4.151 20 0 EIADMP Cc1ccc(C)c(OCCC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000606540422 1038123817 /nfs/dbraw/zinc/12/38/17/1038123817.db2.gz NHVPYCPJCNUKGF-FQEVSTJZSA-N 2 1 330.516 4.023 20 0 EIADMP C[C@H]([NH2+][C@H]1CCCc2cc(N)ccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000423362805 1038179703 /nfs/dbraw/zinc/17/97/03/1038179703.db2.gz YGTOHOUOXBFCQJ-WGGBDISSSA-N 2 1 349.522 4.146 20 0 EIADMP CC[C@H]([NH3+])C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423478947 1038249815 /nfs/dbraw/zinc/24/98/15/1038249815.db2.gz UYKHXSSPDUXXCQ-UONOGXRCSA-N 2 1 335.904 4.168 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)[C@H](C)[NH3+] ZINC000423454646 1038252933 /nfs/dbraw/zinc/25/29/33/1038252933.db2.gz ZHRIHOYPAZFEAQ-MISXGVKJSA-N 2 1 335.904 4.166 20 0 EIADMP C[C@@H]1C[C@H](C[N@H+]2CCC[C@H]2c2ccc(Br)s2)CC[NH2+]1 ZINC000414760294 1038350222 /nfs/dbraw/zinc/35/02/22/1038350222.db2.gz QHDJGKJAWFSZHV-UPJWGTAASA-N 2 1 343.334 4.036 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000490173784 1038369149 /nfs/dbraw/zinc/36/91/49/1038369149.db2.gz XVENYHLMWDTRJC-LJQANCHMSA-N 2 1 343.833 4.363 20 0 EIADMP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000480758668 1038799768 /nfs/dbraw/zinc/79/97/68/1038799768.db2.gz NRWBESLRUYPHRP-KBXCAEBGSA-N 2 1 326.509 4.353 20 0 EIADMP c1csc([C@@H](Cc2ccncc2)[NH2+]C2CC([NH+]3CCCCC3)C2)c1 ZINC000424359227 1038822931 /nfs/dbraw/zinc/82/29/31/1038822931.db2.gz YCLSRIYXTYVYJX-CTWPCTMYSA-N 2 1 341.524 4.033 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424378988 1038839320 /nfs/dbraw/zinc/83/93/20/1038839320.db2.gz UUGOOVIVNZRSCW-HFBAOOFYSA-N 2 1 333.476 4.178 20 0 EIADMP C[NH+](C)CCC1CC[NH+](Cc2csc(Nc3ccccc3)n2)CC1 ZINC000056522977 1038849107 /nfs/dbraw/zinc/84/91/07/1038849107.db2.gz VNOOLOIUOYCPBG-UHFFFAOYSA-N 2 1 344.528 4.050 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(C)cc2C)[C@@H](C)C1 ZINC000480887606 1038853973 /nfs/dbraw/zinc/85/39/73/1038853973.db2.gz FMIFRNMICOYHPG-ZJOUEHCJSA-N 2 1 332.532 4.091 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C3CC(c4ccccc4)C3)CC2)cc1 ZINC000118950836 1038854599 /nfs/dbraw/zinc/85/45/99/1038854599.db2.gz ZXZGBIBGQPCUNT-UHFFFAOYSA-N 2 1 334.507 4.229 20 0 EIADMP C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cccc(OCC[NH+](C)C)c1 ZINC000480904322 1038859899 /nfs/dbraw/zinc/85/98/99/1038859899.db2.gz VZGGUVHZSRGCJQ-HUUCEWRRSA-N 2 1 348.437 4.317 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]CC(C)(C)C[NH+]3CCCC3)s2)cc1 ZINC000480930787 1038878801 /nfs/dbraw/zinc/87/88/01/1038878801.db2.gz SDJUEGWRISXCLL-UHFFFAOYSA-N 2 1 343.540 4.330 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCC[N@H+]2C)cc1OC ZINC000539252281 1038896671 /nfs/dbraw/zinc/89/66/71/1038896671.db2.gz ILKJDAFIPRPSJX-WMZOPIPTSA-N 2 1 334.504 4.009 20 0 EIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CCC([NH+](C)C)CC1 ZINC001168328442 1038942485 /nfs/dbraw/zinc/94/24/85/1038942485.db2.gz GROMMTSXTVZZGB-UHFFFAOYSA-N 2 1 328.422 4.400 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CCSCc1ccc(Cl)cc1Cl ZINC000539296771 1038946811 /nfs/dbraw/zinc/94/68/11/1038946811.db2.gz LCWGAQDDCUDUBA-BLLLJJGKSA-N 2 1 347.355 4.156 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000481024739 1038962078 /nfs/dbraw/zinc/96/20/78/1038962078.db2.gz OQTDSOJOKCVWHG-GJZGRUSLSA-N 2 1 344.421 4.010 20 0 EIADMP CN1CCC([NH+]2CCC(CC[N@@H+](C)CC3CCCCCC3)CC2)CC1 ZINC000537621045 1038982416 /nfs/dbraw/zinc/98/24/16/1038982416.db2.gz SAAUWBVSNCZJAP-UHFFFAOYSA-N 2 1 349.607 4.085 20 0 EIADMP C[N@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)CC1CCCCCC1 ZINC000537621045 1038982439 /nfs/dbraw/zinc/98/24/39/1038982439.db2.gz SAAUWBVSNCZJAP-UHFFFAOYSA-N 3 1 349.607 4.085 20 0 EIADMP C[N@@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)CC1CCCCCC1 ZINC000537621045 1038982460 /nfs/dbraw/zinc/98/24/60/1038982460.db2.gz SAAUWBVSNCZJAP-UHFFFAOYSA-N 3 1 349.607 4.085 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccc3c[nH]nc32)CC1 ZINC000537622152 1038986602 /nfs/dbraw/zinc/98/66/02/1038986602.db2.gz PCKDETAKCLGPRW-QGZVFWFLSA-N 2 1 340.515 4.039 20 0 EIADMP c1ccc(CC(Cc2ccccc2)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000378931084 1039038967 /nfs/dbraw/zinc/03/89/67/1039038967.db2.gz YIYROVRNYOVJIR-GMAHTHKFSA-N 2 1 334.507 4.057 20 0 EIADMP COc1ccc(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000537629485 1039087660 /nfs/dbraw/zinc/08/76/60/1039087660.db2.gz IVOBBHDREQHQQH-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000537629485 1039087689 /nfs/dbraw/zinc/08/76/89/1039087689.db2.gz IVOBBHDREQHQQH-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000537629485 1039087709 /nfs/dbraw/zinc/08/77/09/1039087709.db2.gz IVOBBHDREQHQQH-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000537629485 1039087725 /nfs/dbraw/zinc/08/77/25/1039087725.db2.gz IVOBBHDREQHQQH-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccsc1 ZINC000481185339 1039088268 /nfs/dbraw/zinc/08/82/68/1039088268.db2.gz GEJARYXQCORFNZ-XLIONFOSSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccsc1 ZINC000481185339 1039088289 /nfs/dbraw/zinc/08/82/89/1039088289.db2.gz GEJARYXQCORFNZ-XLIONFOSSA-N 2 1 328.525 4.181 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cnc(C3CCCCC3)s2)C[C@H]1C ZINC000552071571 1039093992 /nfs/dbraw/zinc/09/39/92/1039093992.db2.gz PIUOXVGACWSHQS-NVXWUHKLSA-N 2 1 335.561 4.495 20 0 EIADMP Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000555422769 1039179180 /nfs/dbraw/zinc/17/91/80/1039179180.db2.gz FOGQAIWSMYBRLQ-VQIMIIECSA-N 2 1 329.532 4.256 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(OCc3ccccc3)c2)C1 ZINC000481294924 1039230126 /nfs/dbraw/zinc/23/01/26/1039230126.db2.gz MZQGGPMAXWLLAT-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)c(C)c1OC ZINC000552225098 1039276967 /nfs/dbraw/zinc/27/69/67/1039276967.db2.gz AICKNZZEGWEGDU-AEFFLSMTSA-N 2 1 348.531 4.175 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000481436704 1039411941 /nfs/dbraw/zinc/41/19/41/1039411941.db2.gz OEQMQWBVLKOCFH-CYBMUJFWSA-N 2 1 342.405 4.253 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000555598410 1039421724 /nfs/dbraw/zinc/42/17/24/1039421724.db2.gz ZACGXEKXCIHKNQ-WMLDXEAASA-N 2 1 342.405 4.064 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000555598410 1039421750 /nfs/dbraw/zinc/42/17/50/1039421750.db2.gz ZACGXEKXCIHKNQ-WMLDXEAASA-N 2 1 342.405 4.064 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000555598410 1039421764 /nfs/dbraw/zinc/42/17/64/1039421764.db2.gz ZACGXEKXCIHKNQ-WMLDXEAASA-N 2 1 342.405 4.064 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC000481513511 1039536563 /nfs/dbraw/zinc/53/65/63/1039536563.db2.gz FLIUKSXAJFFZKU-GOSISDBHSA-N 2 1 329.463 4.381 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC000481513511 1039536586 /nfs/dbraw/zinc/53/65/86/1039536586.db2.gz FLIUKSXAJFFZKU-GOSISDBHSA-N 2 1 329.463 4.381 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000514087936 1039588108 /nfs/dbraw/zinc/58/81/08/1039588108.db2.gz JHRCZCHKILILQC-OALUTQOASA-N 2 1 337.511 4.473 20 0 EIADMP COc1cccc(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000514086143 1039589952 /nfs/dbraw/zinc/58/99/52/1039589952.db2.gz YVRXEHUTAKRZTD-UHFFFAOYSA-N 2 1 338.495 4.228 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCc2ccsc2)CC1 ZINC000514090977 1039594604 /nfs/dbraw/zinc/59/46/04/1039594604.db2.gz XRAFKBZDFOUSIL-UHFFFAOYSA-N 2 1 328.525 4.323 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@H+]1C ZINC000122161323 1039605197 /nfs/dbraw/zinc/60/51/97/1039605197.db2.gz QHKXXMRBHYNJQP-PBHICJAKSA-N 2 1 340.433 4.199 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000514097966 1039634090 /nfs/dbraw/zinc/63/40/90/1039634090.db2.gz CHLSOGABQDBQPF-XPWALMASSA-N 2 1 349.522 4.170 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)Cc1ccccc1C(F)(F)F ZINC000481650582 1039686986 /nfs/dbraw/zinc/68/69/86/1039686986.db2.gz BILWXBVJPOCPKZ-KBPBESRZSA-N 2 1 339.405 4.067 20 0 EIADMP COc1ccc2cc(C[N@H+]3CC[C@@H](C[NH+](C)CC4CC4)C3)ccc2c1 ZINC000537647425 1039806654 /nfs/dbraw/zinc/80/66/54/1039806654.db2.gz QEGSYDFFWRBRFI-IBGZPJMESA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc2cc(C[NH+]3CC[C@@H](C[N@H+](C)CC4CC4)C3)ccc2c1 ZINC000537647425 1039806656 /nfs/dbraw/zinc/80/66/56/1039806656.db2.gz QEGSYDFFWRBRFI-IBGZPJMESA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc2cc(C[NH+]3CC[C@@H](C[N@@H+](C)CC4CC4)C3)ccc2c1 ZINC000537647425 1039806664 /nfs/dbraw/zinc/80/66/64/1039806664.db2.gz QEGSYDFFWRBRFI-IBGZPJMESA-N 2 1 338.495 4.012 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000537647239 1039808581 /nfs/dbraw/zinc/80/85/81/1039808581.db2.gz IEQRTQVFPGOIIX-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000537647239 1039808583 /nfs/dbraw/zinc/80/85/83/1039808583.db2.gz IEQRTQVFPGOIIX-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000537647239 1039808587 /nfs/dbraw/zinc/80/85/87/1039808587.db2.gz IEQRTQVFPGOIIX-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000537647239 1039808588 /nfs/dbraw/zinc/80/85/88/1039808588.db2.gz IEQRTQVFPGOIIX-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+]C[C@H]3CCC[C@@H](C)[C@H]3C)sc2C1 ZINC000481823497 1039849592 /nfs/dbraw/zinc/84/95/92/1039849592.db2.gz KJKHGCHOQCKQPY-BZUAXINKSA-N 2 1 335.561 4.072 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+]C[C@H]3CCC[C@@H](C)[C@H]3C)sc2C1 ZINC000481823497 1039849596 /nfs/dbraw/zinc/84/95/96/1039849596.db2.gz KJKHGCHOQCKQPY-BZUAXINKSA-N 2 1 335.561 4.072 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000550977037 1039849986 /nfs/dbraw/zinc/84/99/86/1039849986.db2.gz BIDZTNNCIUHALN-PMACEKPBSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000550977037 1039849988 /nfs/dbraw/zinc/84/99/88/1039849988.db2.gz BIDZTNNCIUHALN-PMACEKPBSA-N 2 1 328.887 4.308 20 0 EIADMP Cc1nc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cs1 ZINC000552920143 1039868873 /nfs/dbraw/zinc/86/88/73/1039868873.db2.gz SSSAPUUFJWJSTJ-JTDSTZFVSA-N 2 1 343.540 4.403 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cl)cc1 ZINC000481923494 1039898360 /nfs/dbraw/zinc/89/83/60/1039898360.db2.gz OQOFGLIBMMFBKR-MGPUTAFESA-N 2 1 328.887 4.437 20 0 EIADMP Cc1cc2[nH]c(C[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)cc2c(C)c1 ZINC000482002678 1039943303 /nfs/dbraw/zinc/94/33/03/1039943303.db2.gz BIZSYCRKYKZKCA-SFHVURJKSA-N 2 1 325.500 4.093 20 0 EIADMP Cc1cc2[nH]c(C[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)cc2c(C)c1 ZINC000482002678 1039943345 /nfs/dbraw/zinc/94/33/45/1039943345.db2.gz BIZSYCRKYKZKCA-SFHVURJKSA-N 2 1 325.500 4.093 20 0 EIADMP c1cc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)cs1 ZINC000537695354 1040003110 /nfs/dbraw/zinc/00/31/10/1040003110.db2.gz LZEZVVGXAVJMKS-VQTJNVASSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)cs1 ZINC000537695354 1040003125 /nfs/dbraw/zinc/00/31/25/1040003125.db2.gz LZEZVVGXAVJMKS-VQTJNVASSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)cs1 ZINC000537695354 1040003146 /nfs/dbraw/zinc/00/31/46/1040003146.db2.gz LZEZVVGXAVJMKS-VQTJNVASSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)cs1 ZINC000537695354 1040003169 /nfs/dbraw/zinc/00/31/69/1040003169.db2.gz LZEZVVGXAVJMKS-VQTJNVASSA-N 2 1 326.509 4.235 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000482137201 1040029378 /nfs/dbraw/zinc/02/93/78/1040029378.db2.gz ILYPSMHDXFWQAX-LRDDRELGSA-N 2 1 329.315 4.201 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)CC[N@@H+]1C ZINC000482246483 1040092623 /nfs/dbraw/zinc/09/26/23/1040092623.db2.gz SBLQQUFUWRYHIF-CZAAIQMYSA-N 2 1 326.459 4.182 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)CC[N@H+]1C ZINC000482246483 1040092642 /nfs/dbraw/zinc/09/26/42/1040092642.db2.gz SBLQQUFUWRYHIF-CZAAIQMYSA-N 2 1 326.459 4.182 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@H](CO)CCC(C)(C)C)CC1 ZINC000551276300 1040132972 /nfs/dbraw/zinc/13/29/72/1040132972.db2.gz BCCSGFFCIAKWLJ-KBWCOIMZSA-N 2 1 346.559 4.206 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)[C@]1(C)CCCO1 ZINC000551268556 1040134386 /nfs/dbraw/zinc/13/43/86/1040134386.db2.gz XYHOSQDLBSAECN-OPYAIIAOSA-N 2 1 330.516 4.108 20 0 EIADMP Clc1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167958128 1040139531 /nfs/dbraw/zinc/13/95/31/1040139531.db2.gz CFFTYIGXYQYBOH-YQQQUEKLSA-N 2 1 330.903 4.324 20 0 EIADMP Clc1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)cc1 ZINC001167958128 1040139541 /nfs/dbraw/zinc/13/95/41/1040139541.db2.gz CFFTYIGXYQYBOH-YQQQUEKLSA-N 2 1 330.903 4.324 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2c3cc(F)ccc3C[C@H]2C)c1 ZINC000482323921 1040168597 /nfs/dbraw/zinc/16/85/97/1040168597.db2.gz UJJGFRKNQMULGQ-QVKFZJNVSA-N 2 1 326.459 4.301 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1OC(F)F ZINC000482331041 1040178645 /nfs/dbraw/zinc/17/86/45/1040178645.db2.gz VLRHBSDHGGUXFG-DOTOQJQBSA-N 2 1 340.458 4.449 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1OC(F)F ZINC000482331041 1040178653 /nfs/dbraw/zinc/17/86/53/1040178653.db2.gz VLRHBSDHGGUXFG-DOTOQJQBSA-N 2 1 340.458 4.449 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](CN[C@H](C)c2ccccc2Br)C1 ZINC000482362199 1040201549 /nfs/dbraw/zinc/20/15/49/1040201549.db2.gz VSZBVVZWTSTGKC-HUUCEWRRSA-N 2 1 339.321 4.220 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(-c2ccccc2F)s1 ZINC000553439251 1040219434 /nfs/dbraw/zinc/21/94/34/1040219434.db2.gz UDKDPPJBNQZMRO-CQSZACIVSA-N 2 1 330.472 4.467 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000482434323 1040242911 /nfs/dbraw/zinc/24/29/11/1040242911.db2.gz FNKLMMJLDYXELO-HKUYNNGSSA-N 2 1 326.459 4.041 20 0 EIADMP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482456275 1040254786 /nfs/dbraw/zinc/25/47/86/1040254786.db2.gz ZGWQUNFJGWFIJH-XQFWAAQXSA-N 2 1 334.507 4.074 20 0 EIADMP Cc1ccc(N2CCC([NH2+]Cc3ccc4c(c3)CCCC4)CC2)[nH+]c1 ZINC000491246028 1040356103 /nfs/dbraw/zinc/35/61/03/1040356103.db2.gz BGEZMTONOISXNE-UHFFFAOYSA-N 2 1 335.495 4.027 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(OC)c1 ZINC000479461734 1040367935 /nfs/dbraw/zinc/36/79/35/1040367935.db2.gz DLJDMMGEBSUECV-SIKLNZKXSA-N 2 1 338.495 4.258 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000479461027 1040369126 /nfs/dbraw/zinc/36/91/26/1040369126.db2.gz AQMLGMKUMBHULA-GHTZIAJQSA-N 2 1 341.474 4.030 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000479461027 1040369142 /nfs/dbraw/zinc/36/91/42/1040369142.db2.gz AQMLGMKUMBHULA-GHTZIAJQSA-N 2 1 341.474 4.030 20 0 EIADMP CC[N@H+]1CC[C@@H](NCc2cnc(-c3ccc(Cl)cc3)s2)[C@@H](C)C1 ZINC000551537066 1040395595 /nfs/dbraw/zinc/39/55/95/1040395595.db2.gz ZTASCQSZKNNQHE-SUMWQHHRSA-N 2 1 349.931 4.283 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)[C@@H](C)C1 ZINC000551537066 1040395606 /nfs/dbraw/zinc/39/56/06/1040395606.db2.gz ZTASCQSZKNNQHE-SUMWQHHRSA-N 2 1 349.931 4.283 20 0 EIADMP CNc1ccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000712218040 1040421650 /nfs/dbraw/zinc/42/16/50/1040421650.db2.gz HVJLVQUPSKBEEC-UHFFFAOYSA-N 2 1 349.522 4.216 20 0 EIADMP Clc1ccc(-c2ccc(C[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)o2)cc1 ZINC000666998217 1040437629 /nfs/dbraw/zinc/43/76/29/1040437629.db2.gz INTRFMCBHBZXAM-MRXNPFEDSA-N 2 1 330.859 4.364 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C3[C@@H](C)CCC[C@@H]3C)CC2)cs1 ZINC000482874300 1040531721 /nfs/dbraw/zinc/53/17/21/1040531721.db2.gz NQLNOQIZGVASGL-HOTGVXAUSA-N 2 1 349.588 4.332 20 0 EIADMP CSc1cc(C[NH2+]CC(C)(C)C[N@H+](C)Cc2ccccc2)ccn1 ZINC000539710200 1040720030 /nfs/dbraw/zinc/72/00/30/1040720030.db2.gz ODTJUICYMUYNGH-UHFFFAOYSA-N 2 1 343.540 4.051 20 0 EIADMP CSc1cc(C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)ccn1 ZINC000539710200 1040720048 /nfs/dbraw/zinc/72/00/48/1040720048.db2.gz ODTJUICYMUYNGH-UHFFFAOYSA-N 2 1 343.540 4.051 20 0 EIADMP C[C@]1(C[NH2+]Cc2cccc3cnccc32)CC[N@@H+](Cc2ccccc2)C1 ZINC000311581911 1040733741 /nfs/dbraw/zinc/73/37/41/1040733741.db2.gz DAEGVTZCQOBTKN-HSZRJFAPSA-N 2 1 345.490 4.237 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)ccc1SC ZINC000479898543 1040757350 /nfs/dbraw/zinc/75/73/50/1040757350.db2.gz DKBTUCXQLORHEH-JKSUJKDBSA-N 2 1 336.545 4.332 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)ccc1SC ZINC000479898543 1040757367 /nfs/dbraw/zinc/75/73/67/1040757367.db2.gz DKBTUCXQLORHEH-JKSUJKDBSA-N 2 1 336.545 4.332 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@@H]1C ZINC000539820932 1040817665 /nfs/dbraw/zinc/81/76/65/1040817665.db2.gz MABFMRKCGFJNEY-HKUYNNGSSA-N 2 1 348.531 4.035 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@@H]1C ZINC000539820932 1040817668 /nfs/dbraw/zinc/81/76/68/1040817668.db2.gz MABFMRKCGFJNEY-HKUYNNGSSA-N 2 1 348.531 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@@H]1C ZINC000539820932 1040817677 /nfs/dbraw/zinc/81/76/77/1040817677.db2.gz MABFMRKCGFJNEY-HKUYNNGSSA-N 2 1 348.531 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@@H]1C ZINC000539820932 1040817682 /nfs/dbraw/zinc/81/76/82/1040817682.db2.gz MABFMRKCGFJNEY-HKUYNNGSSA-N 2 1 348.531 4.035 20 0 EIADMP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000669846975 1040850808 /nfs/dbraw/zinc/85/08/08/1040850808.db2.gz UIKYOLMWUFUGSM-QHAWAJNXSA-N 2 1 332.507 4.407 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCC[C@@H]1CCc1ccccc1 ZINC000537966072 1040968452 /nfs/dbraw/zinc/96/84/52/1040968452.db2.gz SXIUWNXFIJJYDL-UIFIKXQLSA-N 2 1 325.500 4.219 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCC[C@H]1CCc1ccccc1 ZINC000537966071 1040969259 /nfs/dbraw/zinc/96/92/59/1040969259.db2.gz SXIUWNXFIJJYDL-QMMLZNLJSA-N 2 1 325.500 4.219 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)Cc1cccs1 ZINC000483760724 1041003382 /nfs/dbraw/zinc/00/33/82/1041003382.db2.gz WSHSLUSKWHWXFS-WFXMLNOXSA-N 2 1 342.552 4.427 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)Cc1cccs1 ZINC000483760724 1041003391 /nfs/dbraw/zinc/00/33/91/1041003391.db2.gz WSHSLUSKWHWXFS-WFXMLNOXSA-N 2 1 342.552 4.427 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Sc2ccc(F)cc2)cc1 ZINC000538097058 1041046805 /nfs/dbraw/zinc/04/68/05/1041046805.db2.gz OHMYDKFSQMEMBG-QRWLVFNGSA-N 2 1 344.499 4.407 20 0 EIADMP CC(C)[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1cccnc1 ZINC000538115699 1041067681 /nfs/dbraw/zinc/06/76/81/1041067681.db2.gz AWLKXZWBWGWDFY-GHTZIAJQSA-N 2 1 325.500 4.279 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)CCC2 ZINC000540148314 1041160493 /nfs/dbraw/zinc/16/04/93/1041160493.db2.gz YVPQNKRDNLQWPH-LAUBAEHRSA-N 2 1 330.516 4.030 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)CCC2 ZINC000540148313 1041160914 /nfs/dbraw/zinc/16/09/14/1041160914.db2.gz YVPQNKRDNLQWPH-DYESRHJHSA-N 2 1 330.516 4.030 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@@H]3C[C@H](C)CC[C@@H]3C(C)C)CC2)nc(C)[nH+]1 ZINC000484302732 1041191165 /nfs/dbraw/zinc/19/11/65/1041191165.db2.gz QXVSENIEKXXPLG-CDHQVMDDSA-N 2 1 344.547 4.113 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)C[C@H]1C ZINC000667664401 1041235344 /nfs/dbraw/zinc/23/53/44/1041235344.db2.gz KDPCUOVIJUOZTH-BEFAXECRSA-N 2 1 343.540 4.423 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)C[C@H]1C ZINC000667664401 1041235359 /nfs/dbraw/zinc/23/53/59/1041235359.db2.gz KDPCUOVIJUOZTH-BEFAXECRSA-N 2 1 343.540 4.423 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3scnc3C)cc2)C[C@H]1C ZINC000667664401 1041235376 /nfs/dbraw/zinc/23/53/76/1041235376.db2.gz KDPCUOVIJUOZTH-BEFAXECRSA-N 2 1 343.540 4.423 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(-c3scnc3C)cc2)C[C@H]1C ZINC000667664401 1041235395 /nfs/dbraw/zinc/23/53/95/1041235395.db2.gz KDPCUOVIJUOZTH-BEFAXECRSA-N 2 1 343.540 4.423 20 0 EIADMP c1cc(OCC2CC2)ccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000480380540 1041254283 /nfs/dbraw/zinc/25/42/83/1041254283.db2.gz XPJZALXYOFMCSD-UHFFFAOYSA-N 2 1 342.527 4.362 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c1 ZINC000484485143 1041255632 /nfs/dbraw/zinc/25/56/32/1041255632.db2.gz JBPWCEQQCPPJEN-KKUMJFAQSA-N 2 1 326.431 4.120 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccccc1OC(F)(F)F ZINC000484487183 1041259683 /nfs/dbraw/zinc/25/96/83/1041259683.db2.gz MFYLABSGJZVQQK-MELADBBJSA-N 2 1 330.394 4.109 20 0 EIADMP Cc1ccc(N2CCC([NH2+]C3CC(C)(c4ccccc4)C3)CC2)[nH+]c1 ZINC000436471442 1041269600 /nfs/dbraw/zinc/26/96/00/1041269600.db2.gz SCJPZRMQMPNVIH-UHFFFAOYSA-N 2 1 335.495 4.069 20 0 EIADMP CSc1ccccc1[C@H](C)[NH2+]C1CCN(c2cccc(C)[nH+]2)CC1 ZINC000194894298 1041281945 /nfs/dbraw/zinc/28/19/45/1041281945.db2.gz ASMFUGKLHGBZHF-INIZCTEOSA-N 2 1 341.524 4.432 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667672893 1041284052 /nfs/dbraw/zinc/28/40/52/1041284052.db2.gz KEZUMQQXEMFNFK-GOSISDBHSA-N 2 1 343.540 4.282 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667672893 1041284066 /nfs/dbraw/zinc/28/40/66/1041284066.db2.gz KEZUMQQXEMFNFK-GOSISDBHSA-N 2 1 343.540 4.282 20 0 EIADMP CSc1ccccc1[C@H](C)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000194899971 1041293104 /nfs/dbraw/zinc/29/31/04/1041293104.db2.gz DYXRDAULOAWOPY-INIZCTEOSA-N 2 1 341.524 4.432 20 0 EIADMP COCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CCCC1 ZINC000484508611 1041293763 /nfs/dbraw/zinc/29/37/63/1041293763.db2.gz PZOPMQYWSOVDFT-PZJWPPBQSA-N 2 1 344.543 4.084 20 0 EIADMP Clc1ccccc1CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463113417 1041341088 /nfs/dbraw/zinc/34/10/88/1041341088.db2.gz CHSRNYWUKGQJPE-UHFFFAOYSA-N 2 1 342.914 4.179 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000540301593 1041352271 /nfs/dbraw/zinc/35/22/71/1041352271.db2.gz LQUYJOUCDUESDK-SJKOYZFVSA-N 2 1 327.299 4.376 20 0 EIADMP CCCCn1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)c(C)n1 ZINC000540317774 1041364749 /nfs/dbraw/zinc/36/47/49/1041364749.db2.gz FMTUXAMLDOYUGC-UWJYYQICSA-N 2 1 346.563 4.124 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](CCC(=O)c2ccc(C)cc2)CC1 ZINC000480519959 1041365817 /nfs/dbraw/zinc/36/58/17/1041365817.db2.gz CBIXSJCVQRPZIX-UHFFFAOYSA-N 2 1 330.516 4.012 20 0 EIADMP CC[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000463146207 1041366446 /nfs/dbraw/zinc/36/64/46/1041366446.db2.gz NAUMZOGZIWNDIP-LJQANCHMSA-N 2 1 343.559 4.146 20 0 EIADMP CC[C@@H]1CCC[N@H+](C(C)(C)C[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000463146207 1041366457 /nfs/dbraw/zinc/36/64/57/1041366457.db2.gz NAUMZOGZIWNDIP-LJQANCHMSA-N 2 1 343.559 4.146 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463155556 1041387514 /nfs/dbraw/zinc/38/75/14/1041387514.db2.gz OAXCISMVKFWALT-YJSIEXFISA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C[C@@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000463155556 1041387525 /nfs/dbraw/zinc/38/75/25/1041387525.db2.gz OAXCISMVKFWALT-YJSIEXFISA-N 2 1 334.507 4.433 20 0 EIADMP COc1ccc(C2([NH2+]C3CC[NH+]([C@H]4CCCC[C@@H]4C)CC3)CC2)cc1 ZINC000538524307 1041392809 /nfs/dbraw/zinc/39/28/09/1041392809.db2.gz MHWNSXOBKWNNIH-UWJYYQICSA-N 2 1 342.527 4.317 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000463207405 1041419459 /nfs/dbraw/zinc/41/94/59/1041419459.db2.gz SQVYGBXETXBYRB-WIYYLYMNSA-N 2 1 338.495 4.146 20 0 EIADMP CC(C)(C)OCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000554843883 1041443867 /nfs/dbraw/zinc/44/38/67/1041443867.db2.gz QTVLKKSMTPGDGV-HXUWFJFHSA-N 2 1 346.559 4.472 20 0 EIADMP CC(C)(C)OCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000554843883 1041443871 /nfs/dbraw/zinc/44/38/71/1041443871.db2.gz QTVLKKSMTPGDGV-HXUWFJFHSA-N 2 1 346.559 4.472 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+]C3CCC4(CC4)CC3)CC2)cc1 ZINC000463239053 1041446562 /nfs/dbraw/zinc/44/65/62/1041446562.db2.gz TYRAQUCPPHWGQI-UHFFFAOYSA-N 2 1 330.491 4.145 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCc2ccccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463248225 1041453090 /nfs/dbraw/zinc/45/30/90/1041453090.db2.gz RQHUKUACBXWZJK-RXVVDRJESA-N 2 1 340.486 4.401 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCc2ccccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463248225 1041453094 /nfs/dbraw/zinc/45/30/94/1041453094.db2.gz RQHUKUACBXWZJK-RXVVDRJESA-N 2 1 340.486 4.401 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCCC2CCOCC2)CC1 ZINC000463284746 1041474064 /nfs/dbraw/zinc/47/40/64/1041474064.db2.gz WDOGCXQZLWLNJU-IBGZPJMESA-N 2 1 336.564 4.170 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2c(F)cccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000401998634 1041474482 /nfs/dbraw/zinc/47/44/82/1041474482.db2.gz DGDVMFGZWCGHSV-FUHWJXTLSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2c(F)cccc2F)CC[N@H+]1Cc1ccccc1 ZINC000401998634 1041474485 /nfs/dbraw/zinc/47/44/85/1041474485.db2.gz DGDVMFGZWCGHSV-FUHWJXTLSA-N 2 1 344.449 4.150 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(C)(C)C2=CCCCC2)[C@H](C)C1 ZINC000480693759 1041475683 /nfs/dbraw/zinc/47/56/83/1041475683.db2.gz NDDNXLGUXHNUAM-QUCCMNQESA-N 2 1 336.564 4.240 20 0 EIADMP COCCC[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480693542 1041476296 /nfs/dbraw/zinc/47/62/96/1041476296.db2.gz CMYZSRXIODLASE-OTWHNJEPSA-N 2 1 332.532 4.069 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000195132195 1041484738 /nfs/dbraw/zinc/48/47/38/1041484738.db2.gz WJKCORPLOJQRGP-AEFFLSMTSA-N 2 1 342.458 4.007 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C)c(Br)c2)C[C@@H]1C ZINC000538718943 1041490762 /nfs/dbraw/zinc/49/07/62/1041490762.db2.gz YBRDCWWMOVARIR-HOCLYGCPSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C)c(Br)c2)C[C@@H]1C ZINC000538718943 1041490768 /nfs/dbraw/zinc/49/07/68/1041490768.db2.gz YBRDCWWMOVARIR-HOCLYGCPSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(C)c(Br)c2)C[C@@H]1C ZINC000538718943 1041490772 /nfs/dbraw/zinc/49/07/72/1041490772.db2.gz YBRDCWWMOVARIR-HOCLYGCPSA-N 2 1 339.321 4.062 20 0 EIADMP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1F ZINC000480714260 1041493043 /nfs/dbraw/zinc/49/30/43/1041493043.db2.gz YGMDWABIOPVABH-DMUMMCEESA-N 2 1 346.490 4.077 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@H]1CCOC1 ZINC000480732589 1041494681 /nfs/dbraw/zinc/49/46/81/1041494681.db2.gz ZFZAYCFHVHXCDI-UDKICSLYSA-N 2 1 344.543 4.069 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000480733986 1041496816 /nfs/dbraw/zinc/49/68/16/1041496816.db2.gz BLHRAZKPJLFGAW-BRWVUGGUSA-N 2 1 338.948 4.427 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccccc2OC2CCCC2)[C@H](C)C1 ZINC000538738293 1041512592 /nfs/dbraw/zinc/51/25/92/1041512592.db2.gz LRPRUKRMVPGWLD-YLJYHZDGSA-N 2 1 330.516 4.170 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2OC2CCCC2)[C@H](C)C1 ZINC000538738293 1041512610 /nfs/dbraw/zinc/51/26/10/1041512610.db2.gz LRPRUKRMVPGWLD-YLJYHZDGSA-N 2 1 330.516 4.170 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2OC2CCCC2)[C@H](C)C1 ZINC000538738293 1041512623 /nfs/dbraw/zinc/51/26/23/1041512623.db2.gz LRPRUKRMVPGWLD-YLJYHZDGSA-N 2 1 330.516 4.170 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2OC2CCCC2)[C@H](C)C1 ZINC000538738293 1041512637 /nfs/dbraw/zinc/51/26/37/1041512637.db2.gz LRPRUKRMVPGWLD-YLJYHZDGSA-N 2 1 330.516 4.170 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538752362 1041527666 /nfs/dbraw/zinc/52/76/66/1041527666.db2.gz DDFWPFAXNMWAOZ-MRXNPFEDSA-N 2 1 340.458 4.069 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538752362 1041527686 /nfs/dbraw/zinc/52/76/86/1041527686.db2.gz DDFWPFAXNMWAOZ-MRXNPFEDSA-N 2 1 340.458 4.069 20 0 EIADMP CC[N@H+](Cc1ccc(OC)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538761882 1041536607 /nfs/dbraw/zinc/53/66/07/1041536607.db2.gz IUEOQTNFRBUIQR-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1ccc(OC)cc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000538761882 1041536619 /nfs/dbraw/zinc/53/66/19/1041536619.db2.gz IUEOQTNFRBUIQR-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1ccc(OC)cc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000538761882 1041536628 /nfs/dbraw/zinc/53/66/28/1041536628.db2.gz IUEOQTNFRBUIQR-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP c1ccc(CC[C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000461799871 1041592947 /nfs/dbraw/zinc/59/29/47/1041592947.db2.gz XEAKXVZMZKISIX-SMIHKQSGSA-N 2 1 348.534 4.447 20 0 EIADMP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000540708395 1041607685 /nfs/dbraw/zinc/60/76/85/1041607685.db2.gz WMIAPMCCSXQCHM-GIUOSPMZSA-N 2 1 330.516 4.182 20 0 EIADMP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000540708395 1041607690 /nfs/dbraw/zinc/60/76/90/1041607690.db2.gz WMIAPMCCSXQCHM-GIUOSPMZSA-N 2 1 330.516 4.182 20 0 EIADMP Cn1c[nH+]cc1CCC[NH2+][C@](C)(Cc1ccccc1)c1ccccc1 ZINC000516782694 1041751536 /nfs/dbraw/zinc/75/15/36/1041751536.db2.gz ZQMYMUYZACDGNO-JOCHJYFZSA-N 2 1 333.479 4.100 20 0 EIADMP CC[C@H](C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402486991 1041819403 /nfs/dbraw/zinc/81/94/03/1041819403.db2.gz ASRVHNKRKAKRDR-RYRKJORJSA-N 2 1 342.449 4.465 20 0 EIADMP C[C@H](CCC(F)(F)F)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000541555753 1042011969 /nfs/dbraw/zinc/01/19/69/1042011969.db2.gz IRZJHNOWVWWJBG-INMHGKMJSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCOCc2ccccc2)C1 ZINC000541579336 1042013722 /nfs/dbraw/zinc/01/37/22/1042013722.db2.gz WQKWBZKFLLMJIS-RBBKRZOGSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCOCc2ccccc2)C1 ZINC000541579336 1042013730 /nfs/dbraw/zinc/01/37/30/1042013730.db2.gz WQKWBZKFLLMJIS-RBBKRZOGSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCOCc2ccccc2)C1 ZINC000541579336 1042013737 /nfs/dbraw/zinc/01/37/37/1042013737.db2.gz WQKWBZKFLLMJIS-RBBKRZOGSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCOCc2ccccc2)C1 ZINC000541579339 1042014733 /nfs/dbraw/zinc/01/47/33/1042014733.db2.gz WQKWBZKFLLMJIS-UNMCSNQZSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCOCc2ccccc2)C1 ZINC000541579339 1042014740 /nfs/dbraw/zinc/01/47/40/1042014740.db2.gz WQKWBZKFLLMJIS-UNMCSNQZSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCOCc2ccccc2)C1 ZINC000541579339 1042014747 /nfs/dbraw/zinc/01/47/47/1042014747.db2.gz WQKWBZKFLLMJIS-UNMCSNQZSA-N 2 1 344.543 4.180 20 0 EIADMP FC1(F)CC(C[NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000425940695 1042017380 /nfs/dbraw/zinc/01/73/80/1042017380.db2.gz XNIPNMOUVJKIMA-SLFFLAALSA-N 2 1 348.481 4.312 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)CC(F)(F)F ZINC000402779453 1042030036 /nfs/dbraw/zinc/03/00/36/1042030036.db2.gz OPTRCZYNELXCEZ-ZOBUZTSGSA-N 2 1 328.422 4.075 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)CC(F)(F)F ZINC000402779453 1042030043 /nfs/dbraw/zinc/03/00/43/1042030043.db2.gz OPTRCZYNELXCEZ-ZOBUZTSGSA-N 2 1 328.422 4.075 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000438087599 1042040182 /nfs/dbraw/zinc/04/01/82/1042040182.db2.gz LXNMXOLEXHIJNW-TWMKSMIVSA-N 2 1 334.470 4.455 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]CC[C@H]3CCCC[N@@H+]3C)c(C)c2c1 ZINC000541653726 1042058472 /nfs/dbraw/zinc/05/84/72/1042058472.db2.gz PFBJTIKVSWWYTE-HZPDHXFCSA-N 2 1 330.472 4.275 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]CC[C@H]3CCCC[N@H+]3C)c(C)c2c1 ZINC000541653726 1042058475 /nfs/dbraw/zinc/05/84/75/1042058475.db2.gz PFBJTIKVSWWYTE-HZPDHXFCSA-N 2 1 330.472 4.275 20 0 EIADMP C[C@@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000438206035 1042088013 /nfs/dbraw/zinc/08/80/13/1042088013.db2.gz ZRTQPOIYRIIRPG-DLBZAZTESA-N 2 1 346.515 4.320 20 0 EIADMP C[C@@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000438206035 1042088019 /nfs/dbraw/zinc/08/80/19/1042088019.db2.gz ZRTQPOIYRIIRPG-DLBZAZTESA-N 2 1 346.515 4.320 20 0 EIADMP CSc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC000623137139 1042120038 /nfs/dbraw/zinc/12/00/38/1042120038.db2.gz KKKXMDAHIVYREK-IBGZPJMESA-N 2 1 332.557 4.352 20 0 EIADMP CSc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC000623137139 1042120048 /nfs/dbraw/zinc/12/00/48/1042120048.db2.gz KKKXMDAHIVYREK-IBGZPJMESA-N 2 1 332.557 4.352 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCCOc2cccc3ccccc32)C1 ZINC000464776222 1042158308 /nfs/dbraw/zinc/15/83/08/1042158308.db2.gz KWPCDNSDTKQVGJ-IBGZPJMESA-N 2 1 340.511 4.272 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](CCCSc2ccccc2Cl)C1 ZINC000464792244 1042169546 /nfs/dbraw/zinc/16/95/46/1042169546.db2.gz WCRXDXGUHJTXFC-HNNXBMFYSA-N 2 1 326.937 4.096 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](CCCSc2ccccc2Cl)C1 ZINC000464792244 1042169550 /nfs/dbraw/zinc/16/95/50/1042169550.db2.gz WCRXDXGUHJTXFC-HNNXBMFYSA-N 2 1 326.937 4.096 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](CCCSc2ccccc2Cl)C1 ZINC000464792244 1042169554 /nfs/dbraw/zinc/16/95/54/1042169554.db2.gz WCRXDXGUHJTXFC-HNNXBMFYSA-N 2 1 326.937 4.096 20 0 EIADMP C[N@@H+](CCSc1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464833802 1042180416 /nfs/dbraw/zinc/18/04/16/1042180416.db2.gz GCIMVBJBGAPILU-HXUWFJFHSA-N 2 1 340.536 4.233 20 0 EIADMP C[NH+](CCSc1ccccc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464833802 1042180423 /nfs/dbraw/zinc/18/04/23/1042180423.db2.gz GCIMVBJBGAPILU-HXUWFJFHSA-N 2 1 340.536 4.233 20 0 EIADMP C[NH+](CCSc1ccccc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464833802 1042180429 /nfs/dbraw/zinc/18/04/29/1042180429.db2.gz GCIMVBJBGAPILU-HXUWFJFHSA-N 2 1 340.536 4.233 20 0 EIADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+][C@@H](c1ccccc1)C1CCCCC1 ZINC000542084070 1042271095 /nfs/dbraw/zinc/27/10/95/1042271095.db2.gz AJFCAXCQVRZOPK-YADHBBJMSA-N 2 1 344.543 4.135 20 0 EIADMP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000467373039 1042304387 /nfs/dbraw/zinc/30/43/87/1042304387.db2.gz ISBODDPRFRAERA-DXJOGWAWSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000467373039 1042304393 /nfs/dbraw/zinc/30/43/93/1042304393.db2.gz ISBODDPRFRAERA-DXJOGWAWSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000542164962 1042312162 /nfs/dbraw/zinc/31/21/62/1042312162.db2.gz HIEWKDVYUVNJLF-HGHGUNKESA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000542164962 1042312169 /nfs/dbraw/zinc/31/21/69/1042312169.db2.gz HIEWKDVYUVNJLF-HGHGUNKESA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000542164962 1042312177 /nfs/dbraw/zinc/31/21/77/1042312177.db2.gz HIEWKDVYUVNJLF-HGHGUNKESA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000542164962 1042312180 /nfs/dbraw/zinc/31/21/80/1042312180.db2.gz HIEWKDVYUVNJLF-HGHGUNKESA-N 2 1 330.491 4.096 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000506372529 1042360578 /nfs/dbraw/zinc/36/05/78/1042360578.db2.gz WBGHLXCUEGGEEE-UHFFFAOYSA-N 2 1 330.447 4.390 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000506372529 1042360589 /nfs/dbraw/zinc/36/05/89/1042360589.db2.gz WBGHLXCUEGGEEE-UHFFFAOYSA-N 2 1 330.447 4.390 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCc2c3cc(C)ccc3[nH]c21 ZINC000438829872 1042372352 /nfs/dbraw/zinc/37/23/52/1042372352.db2.gz LQFYTPRVKZMNHY-FQEVSTJZSA-N 2 1 336.483 4.429 20 0 EIADMP C[C@H](Cc1ccsc1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000518156609 1042376926 /nfs/dbraw/zinc/37/69/26/1042376926.db2.gz BPTMXDQAOGIPLV-OAHLLOKOSA-N 2 1 329.513 4.092 20 0 EIADMP Fc1cccc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)s2)c1 ZINC000509573135 1042385541 /nfs/dbraw/zinc/38/55/41/1042385541.db2.gz ZAKVTVPFASGJLJ-DLBZAZTESA-N 2 1 330.472 4.271 20 0 EIADMP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000414971008 1042435345 /nfs/dbraw/zinc/43/53/45/1042435345.db2.gz LAHMCROTYHNIOC-QGZVFWFLSA-N 2 1 341.480 4.034 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)cc1F ZINC000304618827 1042578961 /nfs/dbraw/zinc/57/89/61/1042578961.db2.gz NUUBBMIYQPFZPS-MRXNPFEDSA-N 2 1 330.447 4.007 20 0 EIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(F)(c2cccc(Cl)c2)CC1 ZINC000439316846 1042581051 /nfs/dbraw/zinc/58/10/51/1042581051.db2.gz OETQMNCRJGAZCE-UHFFFAOYSA-N 2 1 335.854 4.196 20 0 EIADMP CC(C)Oc1ccc(C[NH2+]CCC[N@@H+](C)Cc2ccccc2)cc1 ZINC000304728535 1042587062 /nfs/dbraw/zinc/58/70/62/1042587062.db2.gz XHYHGSXRKKEWQW-UHFFFAOYSA-N 2 1 326.484 4.086 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccc2[nH]cnc2c1 ZINC000518765609 1042675507 /nfs/dbraw/zinc/67/55/07/1042675507.db2.gz QCKCQNXWVRMDBT-QGZVFWFLSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccc2nc[nH]c2c1 ZINC000518765609 1042675510 /nfs/dbraw/zinc/67/55/10/1042675510.db2.gz QCKCQNXWVRMDBT-QGZVFWFLSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccc2nc[nH]c2c1 ZINC000518765609 1042675517 /nfs/dbraw/zinc/67/55/17/1042675517.db2.gz QCKCQNXWVRMDBT-QGZVFWFLSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@H](C[NH2+]Cc1ccc(OC(F)F)c(Cl)c1)C[NH+]1CCCCC1 ZINC000518759757 1042678306 /nfs/dbraw/zinc/67/83/06/1042678306.db2.gz HSSHNMPFUOXKNB-CYBMUJFWSA-N 2 1 346.849 4.153 20 0 EIADMP CC1CC[NH+](CCC[NH2+]Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000518770217 1042685437 /nfs/dbraw/zinc/68/54/37/1042685437.db2.gz CTVPMNHMYQGYTC-UHFFFAOYSA-N 2 1 346.849 4.153 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cccc2c1NCCC2 ZINC000894386174 1042712460 /nfs/dbraw/zinc/71/24/60/1042712460.db2.gz ZXQSLXROIIZDGQ-UHFFFAOYSA-N 2 1 337.511 4.175 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](CNc3cc[nH+]c4ccccc34)C2)c1 ZINC000518893855 1042742144 /nfs/dbraw/zinc/74/21/44/1042742144.db2.gz ILTDTPPHBCAOLA-INIZCTEOSA-N 2 1 337.492 4.042 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)o1 ZINC000519021095 1042793633 /nfs/dbraw/zinc/79/36/33/1042793633.db2.gz BSUVGUZKDBKTDS-MRXNPFEDSA-N 2 1 330.447 4.214 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH2+]C[C@H]2CC[N@H+](C(C)C)C2)o1 ZINC000519021095 1042793640 /nfs/dbraw/zinc/79/36/40/1042793640.db2.gz BSUVGUZKDBKTDS-MRXNPFEDSA-N 2 1 330.447 4.214 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000309710701 1042819344 /nfs/dbraw/zinc/81/93/44/1042819344.db2.gz JESXOHUZMZRMCF-SJLPKXTDSA-N 2 1 328.525 4.483 20 0 EIADMP Fc1c(Cl)cccc1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309773622 1042821365 /nfs/dbraw/zinc/82/13/65/1042821365.db2.gz BOYXPOOWTWEKPF-INIZCTEOSA-N 2 1 332.850 4.091 20 0 EIADMP Fc1c(Cl)cccc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309773622 1042821368 /nfs/dbraw/zinc/82/13/68/1042821368.db2.gz BOYXPOOWTWEKPF-INIZCTEOSA-N 2 1 332.850 4.091 20 0 EIADMP C[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639051248 1042826602 /nfs/dbraw/zinc/82/66/02/1042826602.db2.gz RHWAWCMIYUPTSM-UNEWFSDZSA-N 2 1 326.406 4.285 20 0 EIADMP C[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639051248 1042826604 /nfs/dbraw/zinc/82/66/04/1042826604.db2.gz RHWAWCMIYUPTSM-UNEWFSDZSA-N 2 1 326.406 4.285 20 0 EIADMP C[C@H]([NH2+][C@H]1CSc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310241567 1042832165 /nfs/dbraw/zinc/83/21/65/1042832165.db2.gz LUQHJMUOCXVFCP-HQRMLTQVSA-N 2 1 338.520 4.334 20 0 EIADMP C[C@H]([NH2+][C@H]1CSc2ccccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310241567 1042832166 /nfs/dbraw/zinc/83/21/66/1042832166.db2.gz LUQHJMUOCXVFCP-HQRMLTQVSA-N 2 1 338.520 4.334 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000177295701 1042833240 /nfs/dbraw/zinc/83/32/40/1042833240.db2.gz UDIDRPJYIZCMRE-KKSFZXQISA-N 2 1 337.442 4.346 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccc(OCc3ccccc3)cc2)CC1 ZINC000310322394 1042834499 /nfs/dbraw/zinc/83/44/99/1042834499.db2.gz FZZNQZVZCSCTJT-GOSISDBHSA-N 2 1 338.495 4.401 20 0 EIADMP CCc1ncc(CNC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000310422760 1042836746 /nfs/dbraw/zinc/83/67/46/1042836746.db2.gz QXTJIKRHAYEAQQ-SFHVURJKSA-N 2 1 343.540 4.097 20 0 EIADMP CCc1ncc(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000310422760 1042836747 /nfs/dbraw/zinc/83/67/47/1042836747.db2.gz QXTJIKRHAYEAQQ-SFHVURJKSA-N 2 1 343.540 4.097 20 0 EIADMP CCc1ncc(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000310422760 1042836751 /nfs/dbraw/zinc/83/67/51/1042836751.db2.gz QXTJIKRHAYEAQQ-SFHVURJKSA-N 2 1 343.540 4.097 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310970366 1042848447 /nfs/dbraw/zinc/84/84/47/1042848447.db2.gz DDQQVYWGAWSCGW-AZUAARDMSA-N 2 1 338.495 4.176 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2cc[nH]c21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311064193 1042851448 /nfs/dbraw/zinc/85/14/48/1042851448.db2.gz JCQRFOBBWYZVPE-DYESRHJHSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000311107642 1042853019 /nfs/dbraw/zinc/85/30/19/1042853019.db2.gz DNOGWAUZWYLNOY-ICSRJNTNSA-N 2 1 338.495 4.345 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000311107642 1042853021 /nfs/dbraw/zinc/85/30/21/1042853021.db2.gz DNOGWAUZWYLNOY-ICSRJNTNSA-N 2 1 338.495 4.345 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2cccnc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311609396 1042862580 /nfs/dbraw/zinc/86/25/80/1042862580.db2.gz DZEDYWIJGNPCND-XMSQKQJNSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2ccccc2n1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311621651 1042863544 /nfs/dbraw/zinc/86/35/44/1042863544.db2.gz HIEGOLHNOFKRLJ-GHTZIAJQSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2ccccc2n1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311621651 1042863545 /nfs/dbraw/zinc/86/35/45/1042863545.db2.gz HIEGOLHNOFKRLJ-GHTZIAJQSA-N 2 1 345.490 4.235 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+]2CCC(CC[N@@H+](CC)CC3CC3)CC2)CCO1 ZINC000507774388 1042875927 /nfs/dbraw/zinc/87/59/27/1042875927.db2.gz KAIQIBJWPBKJSN-NHCUHLMSSA-N 2 1 336.564 4.026 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+](CC)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000507784522 1042929087 /nfs/dbraw/zinc/92/90/87/1042929087.db2.gz RNPZIUSHFZEVPR-YPAWHYETSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000493978304 1042990765 /nfs/dbraw/zinc/99/07/65/1042990765.db2.gz RMCJMPHOFFAYNX-AVRDEDQJSA-N 2 1 340.511 4.393 20 0 EIADMP C[C@@H]1C[C@@H](n2c3ccccc3nc2C[NH3+])C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168007392 1043016929 /nfs/dbraw/zinc/01/69/29/1043016929.db2.gz RVXLTIIIXJXPQS-IZZQQSIFSA-N 2 1 348.494 4.109 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cc(F)cc(F)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168007760 1043024117 /nfs/dbraw/zinc/02/41/17/1043024117.db2.gz UJTWBFCUJKDXST-VPTLXERWSA-N 2 1 344.449 4.496 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cc(F)cc(F)c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168007760 1043024123 /nfs/dbraw/zinc/02/41/23/1043024123.db2.gz UJTWBFCUJKDXST-VPTLXERWSA-N 2 1 344.449 4.496 20 0 EIADMP Cc1nc2ccc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)cc2s1 ZINC000494175049 1043025246 /nfs/dbraw/zinc/02/52/46/1043025246.db2.gz DWRXVBLNDDOJKU-UHFFFAOYSA-N 2 1 343.540 4.349 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccccc1OC(F)F ZINC000320631099 1043031493 /nfs/dbraw/zinc/03/14/93/1043031493.db2.gz GIIVYEXFXUMLBO-HNNXBMFYSA-N 2 1 326.431 4.061 20 0 EIADMP CC[C@@H]1C[C@H](C[N@@H+](C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813144 1043058057 /nfs/dbraw/zinc/05/80/57/1043058057.db2.gz JDTJNAOBNBVIIP-PSWRPDDJSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813144 1043058073 /nfs/dbraw/zinc/05/80/73/1043058073.db2.gz JDTJNAOBNBVIIP-PSWRPDDJSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813144 1043058086 /nfs/dbraw/zinc/05/80/86/1043058086.db2.gz JDTJNAOBNBVIIP-PSWRPDDJSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813144 1043058089 /nfs/dbraw/zinc/05/80/89/1043058089.db2.gz JDTJNAOBNBVIIP-PSWRPDDJSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813144 1043058102 /nfs/dbraw/zinc/05/81/02/1043058102.db2.gz JDTJNAOBNBVIIP-PSWRPDDJSA-N 2 1 344.543 4.177 20 0 EIADMP Cc1cncc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000184278800 1043086958 /nfs/dbraw/zinc/08/69/58/1043086958.db2.gz UWRVKOANJQPJJY-PKOBYXMFSA-N 2 1 337.511 4.473 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3cc(O)cc(F)c3)cc2)C1 ZINC000185467230 1043187777 /nfs/dbraw/zinc/18/77/77/1043187777.db2.gz NRZRYQXBKZAWJY-INIZCTEOSA-N 2 1 342.458 4.053 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(F)cc2Cl)CCCC1 ZINC000427886274 1043249417 /nfs/dbraw/zinc/24/94/17/1043249417.db2.gz LOSFNZAAYVTJSF-KBXCAEBGSA-N 2 1 338.898 4.221 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(F)cc2Cl)CCCC1 ZINC000427886279 1043249434 /nfs/dbraw/zinc/24/94/34/1043249434.db2.gz LOSFNZAAYVTJSF-RDTXWAMCSA-N 2 1 338.898 4.221 20 0 EIADMP CCSc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)ccn1 ZINC000427885468 1043251704 /nfs/dbraw/zinc/25/17/04/1043251704.db2.gz MDTGMMPZMZJPIS-VQIMIIECSA-N 2 1 347.572 4.326 20 0 EIADMP COc1cccc2cc(C[NH2+]CCCC[N@H+]3CCCC[C@H]3C)oc21 ZINC000727643644 1043255236 /nfs/dbraw/zinc/25/52/36/1043255236.db2.gz IEQMPYJGRGAGFB-MRXNPFEDSA-N 2 1 330.472 4.186 20 0 EIADMP Fc1ccc(Oc2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000166042946 1043278443 /nfs/dbraw/zinc/27/84/43/1043278443.db2.gz ZYOQPAYLIYSHPN-RBUKOAKNSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1ccc(Oc2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000166042946 1043278447 /nfs/dbraw/zinc/27/84/47/1043278447.db2.gz ZYOQPAYLIYSHPN-RBUKOAKNSA-N 2 1 340.442 4.334 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000166764802 1043311483 /nfs/dbraw/zinc/31/14/83/1043311483.db2.gz WPTKUWCJBCUTSK-IAGOWNOFSA-N 2 1 342.508 4.140 20 0 EIADMP COCC(C)(C)CCC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639181392 1043332993 /nfs/dbraw/zinc/33/29/93/1043332993.db2.gz RUSCYKPNZQWFQT-TZIWHRDSSA-N 2 1 344.543 4.397 20 0 EIADMP COCC(C)(C)CCC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639181392 1043333005 /nfs/dbraw/zinc/33/30/05/1043333005.db2.gz RUSCYKPNZQWFQT-TZIWHRDSSA-N 2 1 344.543 4.397 20 0 EIADMP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000674045618 1043347028 /nfs/dbraw/zinc/34/70/28/1043347028.db2.gz JALTULAHXGPJLL-PWIZWCRZSA-N 2 1 347.522 4.024 20 0 EIADMP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000674045618 1043347038 /nfs/dbraw/zinc/34/70/38/1043347038.db2.gz JALTULAHXGPJLL-PWIZWCRZSA-N 2 1 347.522 4.024 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(O)c1 ZINC001168011834 1043352349 /nfs/dbraw/zinc/35/23/49/1043352349.db2.gz SWLIBAJODVIKML-NYUBLWNDSA-N 2 1 338.495 4.484 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(O)c1 ZINC001168011834 1043352363 /nfs/dbraw/zinc/35/23/63/1043352363.db2.gz SWLIBAJODVIKML-NYUBLWNDSA-N 2 1 338.495 4.484 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2cccnc2c1 ZINC000674067644 1043385923 /nfs/dbraw/zinc/38/59/23/1043385923.db2.gz MRFXEFYUGRPDEB-AVRDEDQJSA-N 2 1 345.490 4.235 20 0 EIADMP CC(C)Oc1cccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000520948959 1043453488 /nfs/dbraw/zinc/45/34/88/1043453488.db2.gz KSUYSYBSZIJHMJ-KDURUIRLSA-N 2 1 332.532 4.322 20 0 EIADMP CCc1nc(C)c(CN(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC000428242678 1043461398 /nfs/dbraw/zinc/46/13/98/1043461398.db2.gz WEBWELBOWQSTNO-APWZRJJASA-N 2 1 341.499 4.030 20 0 EIADMP Cc1cscc1C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC000494465825 1043500950 /nfs/dbraw/zinc/50/09/50/1043500950.db2.gz NYCQACMNNREOKP-MISYRCLQSA-N 2 1 326.509 4.057 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000543064432 1043712352 /nfs/dbraw/zinc/71/23/52/1043712352.db2.gz LUJDGBMYZOMMTP-LMEGTBPZSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000543064432 1043712364 /nfs/dbraw/zinc/71/23/64/1043712364.db2.gz LUJDGBMYZOMMTP-LMEGTBPZSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000543064423 1043714197 /nfs/dbraw/zinc/71/41/97/1043714197.db2.gz LUJDGBMYZOMMTP-AFVSCTSBSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000543064423 1043714207 /nfs/dbraw/zinc/71/42/07/1043714207.db2.gz LUJDGBMYZOMMTP-AFVSCTSBSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000681394485 1043734039 /nfs/dbraw/zinc/73/40/39/1043734039.db2.gz SHHQWXJWQPWNHM-SESVDKBCSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000681394479 1043734697 /nfs/dbraw/zinc/73/46/97/1043734697.db2.gz SHHQWXJWQPWNHM-CEWLAPEOSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H](CC[NH2+][C@@H](C)c1ccc(Br)s1)[NH+]1CCCCC1 ZINC000542488563 1043802740 /nfs/dbraw/zinc/80/27/40/1043802740.db2.gz LMSIYBKRGBCOOU-OLZOCXBDSA-N 2 1 345.350 4.426 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1Cc2[nH]c3ccccc3c2C1 ZINC000442714656 1043816200 /nfs/dbraw/zinc/81/62/00/1043816200.db2.gz KNZXCKPJXQAWKJ-LJQANCHMSA-N 2 1 347.506 4.265 20 0 EIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccccn1 ZINC000766080317 1043907374 /nfs/dbraw/zinc/90/73/74/1043907374.db2.gz CYUSSCXNYZJADG-OAQYLSRUSA-N 2 1 329.532 4.413 20 0 EIADMP COc1ccc([C@@H]2CCCCC[N@@H+]2CCCn2cc[nH+]c2C)cc1 ZINC000428266602 1043909253 /nfs/dbraw/zinc/90/92/53/1043909253.db2.gz UEFADMJFMJFGBI-FQEVSTJZSA-N 2 1 327.472 4.208 20 0 EIADMP COc1ccc([C@@H]2CCCCC[N@H+]2CCCn2cc[nH+]c2C)cc1 ZINC000428266602 1043909262 /nfs/dbraw/zinc/90/92/62/1043909262.db2.gz UEFADMJFMJFGBI-FQEVSTJZSA-N 2 1 327.472 4.208 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000443008867 1043962034 /nfs/dbraw/zinc/96/20/34/1043962034.db2.gz WBVPYZUVWWHXTF-OAHLLOKOSA-N 2 1 328.422 4.224 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000443013818 1043967553 /nfs/dbraw/zinc/96/75/53/1043967553.db2.gz ODHJMBXISHTTSQ-UHFFFAOYSA-N 2 1 326.406 4.120 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1cc(Br)cs1 ZINC000494749611 1044018811 /nfs/dbraw/zinc/01/88/11/1044018811.db2.gz RSWJBTNKWBTYHE-QWHCGFSZSA-N 2 1 345.350 4.426 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000658265849 1044197381 /nfs/dbraw/zinc/19/73/81/1044197381.db2.gz VJQIMJFKXNFMLG-IHJVYAAUSA-N 2 1 348.481 4.455 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000658265849 1044197408 /nfs/dbraw/zinc/19/74/08/1044197408.db2.gz VJQIMJFKXNFMLG-IHJVYAAUSA-N 2 1 348.481 4.455 20 0 EIADMP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000193971541 1044225704 /nfs/dbraw/zinc/22/57/04/1044225704.db2.gz ANRZKBQAYNNBRP-AWEZNQCLSA-N 2 1 340.433 4.243 20 0 EIADMP Cc1ccccc1[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)C1CCCC1 ZINC000658296197 1044266538 /nfs/dbraw/zinc/26/65/38/1044266538.db2.gz RAJJTKBUXWJVEW-IRLDBZIGSA-N 2 1 342.527 4.069 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(-c2c(F)cccc2F)o1 ZINC000174453462 1044273320 /nfs/dbraw/zinc/27/33/20/1044273320.db2.gz GWPPLRIYYOFXNO-UHFFFAOYSA-N 2 1 345.393 4.300 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cccc(F)c1 ZINC000174452228 1044273929 /nfs/dbraw/zinc/27/39/29/1044273929.db2.gz YAOWRYHOSVTRGO-UHFFFAOYSA-N 2 1 338.426 4.341 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000466343338 1044293713 /nfs/dbraw/zinc/29/37/13/1044293713.db2.gz JRCYCOVUKHXFGD-FVTFTPSCSA-N 2 1 344.543 4.082 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000326951403 1044340248 /nfs/dbraw/zinc/34/02/48/1044340248.db2.gz JVMQNRHFIVZHOK-SFHVURJKSA-N 2 1 338.495 4.053 20 0 EIADMP CCC[N@H+](CCCCn1cc[nH+]c1C)[C@H](C)c1ccccc1OC ZINC000348079078 1044378591 /nfs/dbraw/zinc/37/85/91/1044378591.db2.gz QDJMQIQRSJWXJB-QGZVFWFLSA-N 2 1 329.488 4.454 20 0 EIADMP CCC[N@@H+](CCCCn1cc[nH+]c1C)[C@H](C)c1ccccc1OC ZINC000348079078 1044378605 /nfs/dbraw/zinc/37/86/05/1044378605.db2.gz QDJMQIQRSJWXJB-QGZVFWFLSA-N 2 1 329.488 4.454 20 0 EIADMP CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000542515436 1044395219 /nfs/dbraw/zinc/39/52/19/1044395219.db2.gz YGUPKMUGHAVJQG-IAGOWNOFSA-N 2 1 345.531 4.024 20 0 EIADMP C[NH+]1CCC([NH2+][C@@H](Cc2ccccc2Cl)c2cccs2)CC1 ZINC000494876494 1044462858 /nfs/dbraw/zinc/46/28/58/1044462858.db2.gz HKLDQRWKEBQGGS-KRWDZBQOSA-N 2 1 334.916 4.369 20 0 EIADMP C[N@@H+](Cc1cc(Cl)cs1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000494925066 1044524869 /nfs/dbraw/zinc/52/48/69/1044524869.db2.gz PUXRRVGWJFKSKU-INIZCTEOSA-N 2 1 334.916 4.355 20 0 EIADMP C[N@H+](Cc1cc(Cl)cs1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000494925066 1044524885 /nfs/dbraw/zinc/52/48/85/1044524885.db2.gz PUXRRVGWJFKSKU-INIZCTEOSA-N 2 1 334.916 4.355 20 0 EIADMP C[NH+](Cc1cc(Cl)cs1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000494925066 1044524899 /nfs/dbraw/zinc/52/48/99/1044524899.db2.gz PUXRRVGWJFKSKU-INIZCTEOSA-N 2 1 334.916 4.355 20 0 EIADMP C[NH+](Cc1cc(Cl)cs1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000494925066 1044524914 /nfs/dbraw/zinc/52/49/14/1044524914.db2.gz PUXRRVGWJFKSKU-INIZCTEOSA-N 2 1 334.916 4.355 20 0 EIADMP Cc1ccccc1[C@@H](CC(C)C)[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000675879870 1044552617 /nfs/dbraw/zinc/55/26/17/1044552617.db2.gz ACIQPRHNBNUJKQ-IFMALSPDSA-N 2 1 344.543 4.315 20 0 EIADMP c1ccc(C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C2CCCCC2)cc1 ZINC000480742559 1044580796 /nfs/dbraw/zinc/58/07/96/1044580796.db2.gz CKUDWWFRSXWQEU-FSSWDIPSSA-N 2 1 326.528 4.394 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@H]1C ZINC000443650242 1044621606 /nfs/dbraw/zinc/62/16/06/1044621606.db2.gz CNRDIWCSZUYYLO-RHSMWYFYSA-N 2 1 328.422 4.318 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@H]1C ZINC000443650242 1044621622 /nfs/dbraw/zinc/62/16/22/1044621622.db2.gz CNRDIWCSZUYYLO-RHSMWYFYSA-N 2 1 328.422 4.318 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@H]1C ZINC000443650242 1044621631 /nfs/dbraw/zinc/62/16/31/1044621631.db2.gz CNRDIWCSZUYYLO-RHSMWYFYSA-N 2 1 328.422 4.318 20 0 EIADMP C[C@@H]1C[C@@H](n2cc3ccc(C[NH3+])cc3n2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168025354 1044656642 /nfs/dbraw/zinc/65/66/42/1044656642.db2.gz JRGZGOTUOXNCJY-UPHUGPLXSA-N 2 1 348.494 4.109 20 0 EIADMP FC1(F)CC(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000518977308 1044664411 /nfs/dbraw/zinc/66/44/11/1044664411.db2.gz KBMHJCQGRPQFKM-SFHVURJKSA-N 2 1 334.454 4.209 20 0 EIADMP FC1(F)CC(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000518977308 1044664424 /nfs/dbraw/zinc/66/44/24/1044664424.db2.gz KBMHJCQGRPQFKM-SFHVURJKSA-N 2 1 334.454 4.209 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000522383984 1044689382 /nfs/dbraw/zinc/68/93/82/1044689382.db2.gz WXEYBUQDGYNCOJ-HNNXBMFYSA-N 2 1 348.437 4.435 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000522383984 1044689388 /nfs/dbraw/zinc/68/93/88/1044689388.db2.gz WXEYBUQDGYNCOJ-HNNXBMFYSA-N 2 1 348.437 4.435 20 0 EIADMP Clc1cccc2c1SCC[C@@H]2[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000360501539 1044731637 /nfs/dbraw/zinc/73/16/37/1044731637.db2.gz UGMXFFUBOYQYJS-KRWDZBQOSA-N 2 1 336.932 4.483 20 0 EIADMP Clc1cc(Cl)cc(C2=CC[N@@H+](CC3CC[NH2+]CC3)CC2)c1 ZINC001205001373 1044804671 /nfs/dbraw/zinc/80/46/71/1044804671.db2.gz RAJSPXROMGBWMM-UHFFFAOYSA-N 2 1 325.283 4.082 20 0 EIADMP Clc1cccc2c1C[C@@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001168728215 1044817254 /nfs/dbraw/zinc/81/72/54/1044817254.db2.gz QPUGLCYFISCFQY-SFHVURJKSA-N 2 1 344.930 4.148 20 0 EIADMP Clc1cccc2c1C[C@@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001168728215 1044817256 /nfs/dbraw/zinc/81/72/56/1044817256.db2.gz QPUGLCYFISCFQY-SFHVURJKSA-N 2 1 344.930 4.148 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861473 1044833809 /nfs/dbraw/zinc/83/38/09/1044833809.db2.gz TVGCUDSIDLIMQX-KGLIPLIRSA-N 2 1 330.488 4.230 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861473 1044833811 /nfs/dbraw/zinc/83/38/11/1044833811.db2.gz TVGCUDSIDLIMQX-KGLIPLIRSA-N 2 1 330.488 4.230 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3ccncc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168032457 1044839930 /nfs/dbraw/zinc/83/99/30/1044839930.db2.gz GIVAUBMIBKHGGC-OXHIVJRSSA-N 2 1 349.522 4.490 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000673599494 1044858763 /nfs/dbraw/zinc/85/87/63/1044858763.db2.gz XWQAXESQCHBZEQ-SDNWHVSQSA-N 2 1 338.417 4.325 20 0 EIADMP Fc1ccccc1C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000191693369 1044915231 /nfs/dbraw/zinc/91/52/31/1044915231.db2.gz QZVQIMHCSYXDAF-HTAPYJJXSA-N 2 1 338.470 4.183 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cscc1Br ZINC000512148701 1044968741 /nfs/dbraw/zinc/96/87/41/1044968741.db2.gz XVWISMMKMHIPOS-CYBMUJFWSA-N 2 1 345.350 4.255 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836938 1044983300 /nfs/dbraw/zinc/98/33/00/1044983300.db2.gz FIBCOBMCMXYNCX-BHIYHBOVSA-N 2 1 330.541 4.057 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836938 1044983306 /nfs/dbraw/zinc/98/33/06/1044983306.db2.gz FIBCOBMCMXYNCX-BHIYHBOVSA-N 2 1 330.541 4.057 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cn2ccn(C(C)C)c2=S)CC1 ZINC000738071115 1045031892 /nfs/dbraw/zinc/03/18/92/1045031892.db2.gz IHNHDCLJGWYNOT-UHFFFAOYSA-N 2 1 338.565 4.001 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cn2ccn(C(C)C)c2=S)CC1 ZINC000738071115 1045031914 /nfs/dbraw/zinc/03/19/14/1045031914.db2.gz IHNHDCLJGWYNOT-UHFFFAOYSA-N 2 1 338.565 4.001 20 0 EIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c2ccccc21 ZINC000635005853 1045059061 /nfs/dbraw/zinc/05/90/61/1045059061.db2.gz WZVNPLBIODRIHF-MKXGPGLRSA-N 2 1 346.833 4.044 20 0 EIADMP COC1(C[C@H](C)[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000429402543 1045085383 /nfs/dbraw/zinc/08/53/83/1045085383.db2.gz IZBZQAHCIDPFQL-YOUFYPILSA-N 2 1 344.543 4.080 20 0 EIADMP C[C@@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)c1cccc2ccccc21 ZINC000495478653 1045154131 /nfs/dbraw/zinc/15/41/31/1045154131.db2.gz DGWCXVOJPCNJOJ-GOSISDBHSA-N 2 1 338.495 4.135 20 0 EIADMP CC(C)Oc1cccc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)c1 ZINC000302955593 1045215291 /nfs/dbraw/zinc/21/52/91/1045215291.db2.gz DZCVJDBLGZWSGB-UHFFFAOYSA-N 2 1 338.495 4.012 20 0 EIADMP CC(C)Oc1cccc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)c1 ZINC000302955593 1045215298 /nfs/dbraw/zinc/21/52/98/1045215298.db2.gz DZCVJDBLGZWSGB-UHFFFAOYSA-N 2 1 338.495 4.012 20 0 EIADMP C[C@@H]([NH2+]Cc1scnc1C1CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487567673 1045228253 /nfs/dbraw/zinc/22/82/53/1045228253.db2.gz YJPUMVZNOLODDQ-QAPCUYQASA-N 2 1 341.524 4.021 20 0 EIADMP C[C@@H]([NH2+]Cc1scnc1C1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487567673 1045228269 /nfs/dbraw/zinc/22/82/69/1045228269.db2.gz YJPUMVZNOLODDQ-QAPCUYQASA-N 2 1 341.524 4.021 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(F)F)cc2)C[C@H]1C ZINC000740883933 1045238604 /nfs/dbraw/zinc/23/86/04/1045238604.db2.gz QRXKLPIGKUFONG-HIFRSBDPSA-N 2 1 328.472 4.306 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(F)F)cc2)C[C@H]1C ZINC000740883933 1045238614 /nfs/dbraw/zinc/23/86/14/1045238614.db2.gz QRXKLPIGKUFONG-HIFRSBDPSA-N 2 1 328.472 4.306 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(SC(F)F)cc2)C[C@H]1C ZINC000740883933 1045238624 /nfs/dbraw/zinc/23/86/24/1045238624.db2.gz QRXKLPIGKUFONG-HIFRSBDPSA-N 2 1 328.472 4.306 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(SC(F)F)cc2)C[C@H]1C ZINC000740883933 1045238635 /nfs/dbraw/zinc/23/86/35/1045238635.db2.gz QRXKLPIGKUFONG-HIFRSBDPSA-N 2 1 328.472 4.306 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)c(C)c2c1 ZINC000161627209 1045304373 /nfs/dbraw/zinc/30/43/73/1045304373.db2.gz RZXOLPJXFOKLJW-HRCADAONSA-N 2 1 328.456 4.027 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)c(C)c2c1 ZINC000161627209 1045304379 /nfs/dbraw/zinc/30/43/79/1045304379.db2.gz RZXOLPJXFOKLJW-HRCADAONSA-N 2 1 328.456 4.027 20 0 EIADMP c1cc2c(s1)CCC[C@@H]2[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000236594970 1045360989 /nfs/dbraw/zinc/36/09/89/1045360989.db2.gz RUIPUVWWORYVGO-FQEVSTJZSA-N 2 1 340.536 4.422 20 0 EIADMP CC1(C)CC([NH2+]Cc2ccc(F)cc2C(F)(F)F)CC(C)(C)[NH2+]1 ZINC000322407066 1045479210 /nfs/dbraw/zinc/47/92/10/1045479210.db2.gz XMKYNXVHHYLREU-UHFFFAOYSA-N 2 1 332.385 4.243 20 0 EIADMP CC(=O)Nc1cccc([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000247074155 1045839362 /nfs/dbraw/zinc/83/93/62/1045839362.db2.gz OLGXFWKXISFRPE-FGTMMUONSA-N 2 1 345.531 4.054 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cncc3ccccc32)C1 ZINC000769148844 1045883851 /nfs/dbraw/zinc/88/38/51/1045883851.db2.gz TZMAOXHUIXPEAV-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cncc3ccccc32)C1 ZINC000769148844 1045883865 /nfs/dbraw/zinc/88/38/65/1045883865.db2.gz TZMAOXHUIXPEAV-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cncc3ccccc32)C1 ZINC000769148844 1045883844 /nfs/dbraw/zinc/88/38/44/1045883844.db2.gz TZMAOXHUIXPEAV-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cncc3ccccc32)C1 ZINC000769148844 1045883859 /nfs/dbraw/zinc/88/38/59/1045883859.db2.gz TZMAOXHUIXPEAV-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1cc[n+](C[C@H]2CCC3(CCCCC3)O2)cc1 ZINC000249121900 1045893419 /nfs/dbraw/zinc/89/34/19/1045893419.db2.gz UEPZIYZFRQBTPZ-PZJWPPBQSA-N 2 1 343.535 4.230 20 0 EIADMP CC[C@H]1C[C@H]([N@@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222650 1045952426 /nfs/dbraw/zinc/95/24/26/1045952426.db2.gz OMOUBGBLPIMZCG-VDWMVFLBSA-N 2 1 342.527 4.055 20 0 EIADMP CC[C@H]1C[C@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@H+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222650 1045952442 /nfs/dbraw/zinc/95/24/42/1045952442.db2.gz OMOUBGBLPIMZCG-VDWMVFLBSA-N 2 1 342.527 4.055 20 0 EIADMP CC[C@H]1C[C@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@@H+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222650 1045952461 /nfs/dbraw/zinc/95/24/61/1045952461.db2.gz OMOUBGBLPIMZCG-VDWMVFLBSA-N 2 1 342.527 4.055 20 0 EIADMP C[C@@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001170262321 1045959057 /nfs/dbraw/zinc/95/90/57/1045959057.db2.gz WWTWXTDXUNAOOR-HNNXBMFYSA-N 2 1 346.877 4.360 20 0 EIADMP CC(C)C[C@@H](C[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccccc1 ZINC000792979131 1046114936 /nfs/dbraw/zinc/11/49/36/1046114936.db2.gz YEAZNKOMKANVHH-UNMCSNQZSA-N 2 1 344.543 4.049 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000747095586 1046119001 /nfs/dbraw/zinc/11/90/01/1046119001.db2.gz PPLMRXBSAJOELZ-UXHICEINSA-N 2 1 330.516 4.362 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000747095586 1046119008 /nfs/dbraw/zinc/11/90/08/1046119008.db2.gz PPLMRXBSAJOELZ-UXHICEINSA-N 2 1 330.516 4.362 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000747095590 1046119936 /nfs/dbraw/zinc/11/99/36/1046119936.db2.gz PPLMRXBSAJOELZ-WOJBJXKFSA-N 2 1 330.516 4.362 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000747095590 1046119946 /nfs/dbraw/zinc/11/99/46/1046119946.db2.gz PPLMRXBSAJOELZ-WOJBJXKFSA-N 2 1 330.516 4.362 20 0 EIADMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000261658760 1046131732 /nfs/dbraw/zinc/13/17/32/1046131732.db2.gz BLLDDEIDVFBFJL-MAUKXSAKSA-N 2 1 344.449 4.156 20 0 EIADMP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000476006312 1046196065 /nfs/dbraw/zinc/19/60/65/1046196065.db2.gz BCSIFLTXAXHIBN-SJORKVTESA-N 2 1 345.531 4.166 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc3c[nH]nc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000124056721 1046214514 /nfs/dbraw/zinc/21/45/14/1046214514.db2.gz NFIPLXHZFKSXIP-UWJYYQICSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc3c[nH]nc3c2)CC[N@H+]1Cc1ccccc1 ZINC000124056721 1046214529 /nfs/dbraw/zinc/21/45/29/1046214529.db2.gz NFIPLXHZFKSXIP-UWJYYQICSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc3c[nH]nc3c2)CC[NH+]1Cc1ccccc1 ZINC000124056721 1046214542 /nfs/dbraw/zinc/21/45/42/1046214542.db2.gz NFIPLXHZFKSXIP-UWJYYQICSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc3c[nH]nc3c2)CC[NH+]1Cc1ccccc1 ZINC000124056721 1046214557 /nfs/dbraw/zinc/21/45/57/1046214557.db2.gz NFIPLXHZFKSXIP-UWJYYQICSA-N 2 1 348.494 4.048 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(Cl)nc2)CC1)CC1CC1 ZINC000770598032 1046234316 /nfs/dbraw/zinc/23/43/16/1046234316.db2.gz VPAVEBZFWSJQGV-UHFFFAOYSA-N 2 1 335.923 4.069 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)C1 ZINC000125974231 1046399430 /nfs/dbraw/zinc/39/94/30/1046399430.db2.gz LUAGKWYTEXZGFO-UONOGXRCSA-N 2 1 344.421 4.198 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)C1 ZINC000125974231 1046399442 /nfs/dbraw/zinc/39/94/42/1046399442.db2.gz LUAGKWYTEXZGFO-UONOGXRCSA-N 2 1 344.421 4.198 20 0 EIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CCCO2 ZINC000126535510 1046494668 /nfs/dbraw/zinc/49/46/68/1046494668.db2.gz XDDJVTJLBSAVKD-JXFKEZNVSA-N 2 1 328.500 4.098 20 0 EIADMP Cc1[nH+]ccc(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1Cl ZINC000497251758 1046517314 /nfs/dbraw/zinc/51/73/14/1046517314.db2.gz ZWHMYUZBWDUWEV-GUYCJALGSA-N 2 1 335.904 4.022 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000508762427 1046549578 /nfs/dbraw/zinc/54/95/78/1046549578.db2.gz CJCVUMPVKPUZAE-IAERKFLBSA-N 2 1 342.527 4.044 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000508762427 1046549591 /nfs/dbraw/zinc/54/95/91/1046549591.db2.gz CJCVUMPVKPUZAE-IAERKFLBSA-N 2 1 342.527 4.044 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)cc1 ZINC000126875517 1046578053 /nfs/dbraw/zinc/57/80/53/1046578053.db2.gz BGHQYWRUORUJCS-IRXDYDNUSA-N 2 1 344.524 4.320 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cc1 ZINC000126875517 1046578066 /nfs/dbraw/zinc/57/80/66/1046578066.db2.gz BGHQYWRUORUJCS-IRXDYDNUSA-N 2 1 344.524 4.320 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000459459451 1046697620 /nfs/dbraw/zinc/69/76/20/1046697620.db2.gz HQGLMZGFCPJDBB-UHFFFAOYSA-N 2 1 336.479 4.022 20 0 EIADMP C[C@@H]([NH2+]C1CC(C)(c2ccccc2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000459467879 1046703882 /nfs/dbraw/zinc/70/38/82/1046703882.db2.gz QQUSBCWKZZXLKD-IYVCXYCASA-N 2 1 326.528 4.349 20 0 EIADMP C[C@H]1C[C@@H](NCc2ccc(F)cc2F)CC[N@H+]1Cc1ccccc1 ZINC000379622202 1046716547 /nfs/dbraw/zinc/71/65/47/1046716547.db2.gz GEOHMLPKQHEPCZ-KXBFYZLASA-N 2 1 330.422 4.108 20 0 EIADMP CC[C@@H](NCC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000379636734 1046725081 /nfs/dbraw/zinc/72/50/81/1046725081.db2.gz XTBZBTZYCLBUJQ-QFBILLFUSA-N 2 1 329.463 4.172 20 0 EIADMP C[N@H+](C/C=C/c1ccccc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000536729686 1046725590 /nfs/dbraw/zinc/72/55/90/1046725590.db2.gz MQOLZXHQMDDQOX-VMPITWQZSA-N 2 1 335.495 4.333 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379630281 1046732255 /nfs/dbraw/zinc/73/22/55/1046732255.db2.gz PKRPOZRVBJGGCM-QWFCFKBJSA-N 2 1 326.484 4.243 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379630281 1046732270 /nfs/dbraw/zinc/73/22/70/1046732270.db2.gz PKRPOZRVBJGGCM-QWFCFKBJSA-N 2 1 326.484 4.243 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3ncccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379644944 1046738507 /nfs/dbraw/zinc/73/85/07/1046738507.db2.gz HLTZUMXKXGYXQU-PGRDOPGGSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3ncccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379644944 1046738521 /nfs/dbraw/zinc/73/85/21/1046738521.db2.gz HLTZUMXKXGYXQU-PGRDOPGGSA-N 2 1 345.490 4.378 20 0 EIADMP CC[N@H+](CCC1CC[NH+]([C@@H](C)c2nc(C(C)C)no2)CC1)CC1CC1 ZINC000536736440 1046744979 /nfs/dbraw/zinc/74/49/79/1046744979.db2.gz MMEMAKHEJPNKFS-INIZCTEOSA-N 2 1 348.535 4.088 20 0 EIADMP CC[N@@H+](CCC1CC[NH+]([C@@H](C)c2nc(C(C)C)no2)CC1)CC1CC1 ZINC000536736440 1046744994 /nfs/dbraw/zinc/74/49/94/1046744994.db2.gz MMEMAKHEJPNKFS-INIZCTEOSA-N 2 1 348.535 4.088 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379641554 1046746759 /nfs/dbraw/zinc/74/67/59/1046746759.db2.gz YKEBXQKZHBLVLA-LQWHRVPQSA-N 2 1 338.495 4.399 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+]C1CCN(c2cccc(C)[nH+]2)CC1 ZINC000128218192 1046782737 /nfs/dbraw/zinc/78/27/37/1046782737.db2.gz OYTLTJUCTLRXLP-KRWDZBQOSA-N 2 1 339.483 4.108 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000536833503 1046809514 /nfs/dbraw/zinc/80/95/14/1046809514.db2.gz PTOCXSMJNMKQNP-GUDVDZBRSA-N 2 1 332.532 4.145 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2OCc2ccccc2)[C@@H](C)C1 ZINC000536853816 1046823276 /nfs/dbraw/zinc/82/32/76/1046823276.db2.gz VKXIFJNBZJUDMT-RXVVDRJESA-N 2 1 338.495 4.086 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccccc2OCc2ccccc2)[C@@H](C)C1 ZINC000536853816 1046823277 /nfs/dbraw/zinc/82/32/77/1046823277.db2.gz VKXIFJNBZJUDMT-RXVVDRJESA-N 2 1 338.495 4.086 20 0 EIADMP CC(C)CCC[C@H](C)[NH+]1CCC2(CC1)C[N@@H+](Cc1ccoc1)CCO2 ZINC001170077259 1047049589 /nfs/dbraw/zinc/04/95/89/1047049589.db2.gz HQRJJENVDAYDIY-IBGZPJMESA-N 2 1 348.531 4.161 20 0 EIADMP CC(C)CCC[C@H](C)[NH+]1CCC2(CC1)C[N@H+](Cc1ccoc1)CCO2 ZINC001170077259 1047049575 /nfs/dbraw/zinc/04/95/75/1047049575.db2.gz HQRJJENVDAYDIY-IBGZPJMESA-N 2 1 348.531 4.161 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2nc(Cl)ccc21 ZINC000806131036 1047155351 /nfs/dbraw/zinc/15/53/51/1047155351.db2.gz FPYYJZKDYWFBBI-GOSISDBHSA-N 2 1 343.902 4.352 20 0 EIADMP Clc1ccc2c(n1)CC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000806140867 1047165104 /nfs/dbraw/zinc/16/51/04/1047165104.db2.gz CZYIETABHBLMPK-KRWDZBQOSA-N 2 1 333.907 4.109 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H]2COCc3cccc(Cl)c32)C1 ZINC000788525001 1047202850 /nfs/dbraw/zinc/20/28/50/1047202850.db2.gz ADTAJWLIMVPGOI-YJBOKZPZSA-N 2 1 336.907 4.013 20 0 EIADMP COc1ccc(CCC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556058597 1047421658 /nfs/dbraw/zinc/42/16/58/1047421658.db2.gz ABNDWSSEBUJJAJ-IFMALSPDSA-N 2 1 338.495 4.053 20 0 EIADMP COc1ccc(CCC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556058597 1047421668 /nfs/dbraw/zinc/42/16/68/1047421668.db2.gz ABNDWSSEBUJJAJ-IFMALSPDSA-N 2 1 338.495 4.053 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccccc2Cl)C[C@H]1c1ccccc1 ZINC000556062148 1047427787 /nfs/dbraw/zinc/42/77/87/1047427787.db2.gz NKDAHKBEOCVUJQ-QUCCMNQESA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccccc2Cl)C[C@H]1c1ccccc1 ZINC000556062148 1047427794 /nfs/dbraw/zinc/42/77/94/1047427794.db2.gz NKDAHKBEOCVUJQ-QUCCMNQESA-N 2 1 328.887 4.308 20 0 EIADMP CCS[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556104891 1047457120 /nfs/dbraw/zinc/45/71/20/1047457120.db2.gz MYKWVCTVYZPANO-IYWMVGAKSA-N 2 1 332.557 4.476 20 0 EIADMP CCS[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556104891 1047457125 /nfs/dbraw/zinc/45/71/25/1047457125.db2.gz MYKWVCTVYZPANO-IYWMVGAKSA-N 2 1 332.557 4.476 20 0 EIADMP CCOc1cccc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000556117629 1047470741 /nfs/dbraw/zinc/47/07/41/1047470741.db2.gz FDVVGCMEOKRENS-RBBKRZOGSA-N 2 1 338.495 4.053 20 0 EIADMP CCOc1cccc(CC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000556117629 1047470746 /nfs/dbraw/zinc/47/07/46/1047470746.db2.gz FDVVGCMEOKRENS-RBBKRZOGSA-N 2 1 338.495 4.053 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000129725485 1047495645 /nfs/dbraw/zinc/49/56/45/1047495645.db2.gz JZQMFMKZEQMDBW-DLBZAZTESA-N 2 1 328.422 4.349 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]C[C@H]3CCc4ccccc43)C2)c1 ZINC000790050333 1047510256 /nfs/dbraw/zinc/51/02/56/1047510256.db2.gz ZJWDZGJUZPPMQQ-IEBWSBKVSA-N 2 1 340.536 4.280 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]C[C@H]3CCc4ccccc43)C2)c1 ZINC000790050333 1047510239 /nfs/dbraw/zinc/51/02/39/1047510239.db2.gz ZJWDZGJUZPPMQQ-IEBWSBKVSA-N 2 1 340.536 4.280 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CCC([NH2+]C3CCC3)CC2)cc1 ZINC000897980598 1047526357 /nfs/dbraw/zinc/52/63/57/1047526357.db2.gz DHXVBACXJDPJKD-UHFFFAOYSA-N 2 1 341.524 4.225 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccnc(Cl)c2)CC1 ZINC000763430856 1047589408 /nfs/dbraw/zinc/58/94/08/1047589408.db2.gz FWMICTZSFKLAQH-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccnc(Cl)c2)CC1 ZINC000763430856 1047589438 /nfs/dbraw/zinc/58/94/38/1047589438.db2.gz FWMICTZSFKLAQH-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP C[NH+](C)CC1CC[NH+](Cn2c(-c3ccccc3)csc2=S)CC1 ZINC000747457851 1047604045 /nfs/dbraw/zinc/60/40/45/1047604045.db2.gz UWRFKPWOHOOILP-UHFFFAOYSA-N 2 1 347.553 4.177 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)cc1 ZINC000898319483 1047611725 /nfs/dbraw/zinc/61/17/25/1047611725.db2.gz GLOODLNQEZTNMK-QVKFZJNVSA-N 2 1 332.451 4.378 20 0 EIADMP C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000898322422 1047615057 /nfs/dbraw/zinc/61/50/57/1047615057.db2.gz KZRGPLZIMLCPAU-HSQYWUDLSA-N 2 1 335.495 4.033 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCC(=O)c2ccccc2)CC1 ZINC000537517095 1047665887 /nfs/dbraw/zinc/66/58/87/1047665887.db2.gz YIEATYIHOJMBGC-IBGZPJMESA-N 2 1 342.527 4.236 20 0 EIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000556385427 1047723960 /nfs/dbraw/zinc/72/39/60/1047723960.db2.gz HIAPUILOFFZKCE-AWEZNQCLSA-N 2 1 349.931 4.283 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000556385427 1047723966 /nfs/dbraw/zinc/72/39/66/1047723966.db2.gz HIAPUILOFFZKCE-AWEZNQCLSA-N 2 1 349.931 4.283 20 0 EIADMP C[N@@H+](CCCN[C@H]1CC[NH+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608680 1047758441 /nfs/dbraw/zinc/75/84/41/1047758441.db2.gz LGJMVKAZCANWIW-UNMCSNQZSA-N 2 1 343.559 4.066 20 0 EIADMP C[NH+](CCCN[C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608680 1047758449 /nfs/dbraw/zinc/75/84/49/1047758449.db2.gz LGJMVKAZCANWIW-UNMCSNQZSA-N 2 1 343.559 4.066 20 0 EIADMP C[NH+](CCCN[C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608680 1047758460 /nfs/dbraw/zinc/75/84/60/1047758460.db2.gz LGJMVKAZCANWIW-UNMCSNQZSA-N 2 1 343.559 4.066 20 0 EIADMP CC(C)c1cnc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)o1 ZINC000763433499 1047789372 /nfs/dbraw/zinc/78/93/72/1047789372.db2.gz RVQJXULJAVSADL-KRWDZBQOSA-N 2 1 333.520 4.275 20 0 EIADMP CC(C)c1cnc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)o1 ZINC000763433499 1047789377 /nfs/dbraw/zinc/78/93/77/1047789377.db2.gz RVQJXULJAVSADL-KRWDZBQOSA-N 2 1 333.520 4.275 20 0 EIADMP CC(C)[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1cccnc1 ZINC000550678460 1047816389 /nfs/dbraw/zinc/81/63/89/1047816389.db2.gz GVAHBLMKQNWKHW-BHIFYINESA-N 2 1 337.511 4.246 20 0 EIADMP CC(C)[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1cccnc1 ZINC000550678460 1047816391 /nfs/dbraw/zinc/81/63/91/1047816391.db2.gz GVAHBLMKQNWKHW-BHIFYINESA-N 2 1 337.511 4.246 20 0 EIADMP COc1ncc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1Cl ZINC000556591831 1047835733 /nfs/dbraw/zinc/83/57/33/1047835733.db2.gz NEAROMYZHHBQKU-HUUCEWRRSA-N 2 1 339.911 4.049 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171058836 1047882398 /nfs/dbraw/zinc/88/23/98/1047882398.db2.gz LVMLFHUDLQKYRA-SFHVURJKSA-N 2 1 334.935 4.394 20 0 EIADMP C[C@]1(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1(Cl)Cl ZINC000824969682 1048012305 /nfs/dbraw/zinc/01/23/05/1048012305.db2.gz HXRBEXBMGWWKNA-KRWDZBQOSA-N 2 1 341.326 4.215 20 0 EIADMP Fc1cccc2[nH]cc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c21 ZINC001136983972 1048029151 /nfs/dbraw/zinc/02/91/51/1048029151.db2.gz ADVXINXROYFOCE-KRWDZBQOSA-N 2 1 329.463 4.147 20 0 EIADMP Fc1cccc2[nH]cc(C[N@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c21 ZINC001136983972 1048029161 /nfs/dbraw/zinc/02/91/61/1048029161.db2.gz ADVXINXROYFOCE-KRWDZBQOSA-N 2 1 329.463 4.147 20 0 EIADMP Fc1cccc2[nH]cc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c21 ZINC001136983973 1048029843 /nfs/dbraw/zinc/02/98/43/1048029843.db2.gz ADVXINXROYFOCE-QGZVFWFLSA-N 2 1 329.463 4.147 20 0 EIADMP Fc1cccc2[nH]cc(C[N@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c21 ZINC001136983973 1048029856 /nfs/dbraw/zinc/02/98/56/1048029856.db2.gz ADVXINXROYFOCE-QGZVFWFLSA-N 2 1 329.463 4.147 20 0 EIADMP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC4(CC[N@@H+](Cc5cccs5)C4)CC3)C[C@@H]21 ZINC001170751433 1048058016 /nfs/dbraw/zinc/05/80/16/1048058016.db2.gz DMCRUDZQDWSGTP-LUPIEILUSA-N 2 1 344.568 4.471 20 0 EIADMP CCC(CC)(CCO)C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000556869932 1048091047 /nfs/dbraw/zinc/09/10/47/1048091047.db2.gz CBIROHUABOAUJG-UHFFFAOYSA-N 2 1 346.559 4.208 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H]2CCC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000556890740 1048132413 /nfs/dbraw/zinc/13/24/13/1048132413.db2.gz RQUCCLGEJLYEIC-PILAGYSTSA-N 2 1 340.433 4.271 20 0 EIADMP COc1cccc(C2([NH2+]C3CC[NH+]([C@H]4CCC[C@H](C)C4)CC3)CC2)c1 ZINC000556914796 1048212942 /nfs/dbraw/zinc/21/29/42/1048212942.db2.gz CTWZEXFUAISYJR-PXNSSMCTSA-N 2 1 342.527 4.317 20 0 EIADMP C(=C/c1ccccc1)\C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499136338 1048332004 /nfs/dbraw/zinc/33/20/04/1048332004.db2.gz QMSQLGKQPZZYMG-ZILBUFEYSA-N 2 1 332.491 4.485 20 0 EIADMP c1ccc(C[C@@H]2C[C@@H]2[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000499215471 1048425160 /nfs/dbraw/zinc/42/51/60/1048425160.db2.gz QDIBNRAWADIYQP-VDLPQLTJSA-N 2 1 346.518 4.403 20 0 EIADMP CN1CCC([N@@H+](Cc2cc(Cl)c(F)cc2F)C2CCCC2)CC1 ZINC001144137006 1048446973 /nfs/dbraw/zinc/44/69/73/1048446973.db2.gz FEAWFQMLKGEJII-UHFFFAOYSA-N 2 1 342.861 4.457 20 0 EIADMP C[NH+]1CCC(N(Cc2cc(Cl)c(F)cc2F)C2CCCC2)CC1 ZINC001144137006 1048446982 /nfs/dbraw/zinc/44/69/82/1048446982.db2.gz FEAWFQMLKGEJII-UHFFFAOYSA-N 2 1 342.861 4.457 20 0 EIADMP Cc1cc(F)ccc1[C@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000815553337 1048505043 /nfs/dbraw/zinc/50/50/43/1048505043.db2.gz XYVIXSGVXWJBDC-KRWDZBQOSA-N 2 1 326.459 4.449 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)C/C=C\c2ccc(F)cc2F)cc1 ZINC000809738705 1048511114 /nfs/dbraw/zinc/51/11/14/1048511114.db2.gz GBFYCXWNTZAZAV-PLNGDYQASA-N 2 1 330.422 4.172 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(OCC(F)F)cc2)cc1 ZINC000809739152 1048511176 /nfs/dbraw/zinc/51/11/76/1048511176.db2.gz ZBPTWQYGXIRZAF-UHFFFAOYSA-N 2 1 348.437 4.024 20 0 EIADMP Clc1ccc2c(C[N@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c[nH]c2n1 ZINC001144414481 1048649069 /nfs/dbraw/zinc/64/90/69/1048649069.db2.gz ICWLVDXKTKDYAD-INIZCTEOSA-N 2 1 346.906 4.057 20 0 EIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(SC(F)F)cc2)C1 ZINC000174949663 1049024466 /nfs/dbraw/zinc/02/44/66/1049024466.db2.gz GLLFGBQHLBVIGW-OAHLLOKOSA-N 2 1 328.472 4.165 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(SC(F)F)cc2)C1 ZINC000174949663 1049024480 /nfs/dbraw/zinc/02/44/80/1049024480.db2.gz GLLFGBQHLBVIGW-OAHLLOKOSA-N 2 1 328.472 4.165 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(SC(F)F)cc2)C1 ZINC000174949663 1049024494 /nfs/dbraw/zinc/02/44/94/1049024494.db2.gz GLLFGBQHLBVIGW-OAHLLOKOSA-N 2 1 328.472 4.165 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(SC(F)F)cc2)C1 ZINC000174949663 1049024503 /nfs/dbraw/zinc/02/45/03/1049024503.db2.gz GLLFGBQHLBVIGW-OAHLLOKOSA-N 2 1 328.472 4.165 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C[C@H](O)c1cccc(Cl)c1 ZINC000818962347 1049215046 /nfs/dbraw/zinc/21/50/46/1049215046.db2.gz PENBANIVHAUBQA-FQEVSTJZSA-N 2 1 346.902 4.003 20 0 EIADMP CCO[C@H]1C[C@@H]([N@H+](C)CCCCn2cc[nH+]c2C)C12CCCCC2 ZINC000348185197 1049476030 /nfs/dbraw/zinc/47/60/30/1049476030.db2.gz ASLRHUHTGCOARH-MOPGFXCFSA-N 2 1 333.520 4.031 20 0 EIADMP CCO[C@H]1C[C@@H]([N@@H+](C)CCCCn2cc[nH+]c2C)C12CCCCC2 ZINC000348185197 1049476044 /nfs/dbraw/zinc/47/60/44/1049476044.db2.gz ASLRHUHTGCOARH-MOPGFXCFSA-N 2 1 333.520 4.031 20 0 EIADMP CCO[C@H]1C[C@H]([N@H+](C)CCCCn2cc[nH+]c2C)C12CCCCC2 ZINC000348185198 1049478178 /nfs/dbraw/zinc/47/81/78/1049478178.db2.gz ASLRHUHTGCOARH-OALUTQOASA-N 2 1 333.520 4.031 20 0 EIADMP CCO[C@H]1C[C@H]([N@@H+](C)CCCCn2cc[nH+]c2C)C12CCCCC2 ZINC000348185198 1049478186 /nfs/dbraw/zinc/47/81/86/1049478186.db2.gz ASLRHUHTGCOARH-OALUTQOASA-N 2 1 333.520 4.031 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@H]2CCc3cccc(F)c3C2)CC1 ZINC001170970685 1049684246 /nfs/dbraw/zinc/68/42/46/1049684246.db2.gz MGNUUCDWRBRMRU-WDSOQIARSA-N 2 1 330.491 4.198 20 0 EIADMP C[C@@H](C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)CC(F)(F)F ZINC000716680027 1049701704 /nfs/dbraw/zinc/70/17/04/1049701704.db2.gz PKASZECXGJWRAE-UBDQQSCGSA-N 2 1 340.433 4.218 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2cccc3[nH]ccc32)CC1 ZINC000237732905 1049731330 /nfs/dbraw/zinc/73/13/30/1049731330.db2.gz QMWVLMYKJVUVJU-UHFFFAOYSA-N 2 1 333.479 4.231 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001171549488 1049751995 /nfs/dbraw/zinc/75/19/95/1049751995.db2.gz BIQMJWUUJMPWAQ-WTIAFYNJSA-N 2 1 348.534 4.495 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001171549488 1049752003 /nfs/dbraw/zinc/75/20/03/1049752003.db2.gz BIQMJWUUJMPWAQ-WTIAFYNJSA-N 2 1 348.534 4.495 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]C2CC[NH+](C[C@H]3CC=CCC3)CC2)CC1(C)C ZINC001171629924 1049762020 /nfs/dbraw/zinc/76/20/20/1049762020.db2.gz ZTTBSGQMDKEKMW-SFHVURJKSA-N 3 1 347.591 4.048 20 0 EIADMP C[C@H](C[NH3+])C[N@@H+](C)C1CCC(c2ccc(Br)cc2)CC1 ZINC001171648206 1049769411 /nfs/dbraw/zinc/76/94/11/1049769411.db2.gz QNVULFCTQMFYHT-BZOOQXSSSA-N 2 1 339.321 4.002 20 0 EIADMP C[NH+]1C(C)(C)CC([N@H+]2CCSC[C@H]2c2ccccc2)CC1(C)C ZINC001171640036 1049779320 /nfs/dbraw/zinc/77/93/20/1049779320.db2.gz ZXYCUUNCSIXLQH-SFHVURJKSA-N 2 1 332.557 4.428 20 0 EIADMP C[C@@H]1C[C@H](n2cc(CCC[NH3+])c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC001171724898 1049785744 /nfs/dbraw/zinc/78/57/44/1049785744.db2.gz DWJZEQKCPYGLPQ-NQIIRXRSSA-N 2 1 347.506 4.368 20 0 EIADMP Cc1cccc(Cl)c1C(=[NH2+])N[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171742646 1049801604 /nfs/dbraw/zinc/80/16/04/1049801604.db2.gz XNPQQRWGWSPZKS-RDJZCZTQSA-N 2 1 341.886 4.226 20 0 EIADMP Cc1cccc(Cl)c1C(=[NH2+])N[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171742646 1049801606 /nfs/dbraw/zinc/80/16/06/1049801606.db2.gz XNPQQRWGWSPZKS-RDJZCZTQSA-N 2 1 341.886 4.226 20 0 EIADMP Fc1cccc2c1C[C@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001170997067 1049807518 /nfs/dbraw/zinc/80/75/18/1049807518.db2.gz QMHYUUJDASMPIQ-RBUKOAKNSA-N 2 1 330.491 4.023 20 0 EIADMP Fc1cccc2c1C[C@@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001170997062 1049808111 /nfs/dbraw/zinc/80/81/11/1049808111.db2.gz QMHYUUJDASMPIQ-MOPGFXCFSA-N 2 1 330.491 4.023 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCCc2ccncc2)CC[N@H+]1Cc1ccccc1 ZINC001171965608 1049826449 /nfs/dbraw/zinc/82/64/49/1049826449.db2.gz IJYUGEAMADSSQJ-OAQYLSRUSA-N 2 1 337.511 4.047 20 0 EIADMP CC(C)(C)OCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171974809 1049836059 /nfs/dbraw/zinc/83/60/59/1049836059.db2.gz AMPDCYBKZQYDQB-LJQANCHMSA-N 2 1 332.532 4.224 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CCCc3ccncc32)CC[N@H+]1Cc1ccccc1 ZINC001171978818 1049838376 /nfs/dbraw/zinc/83/83/76/1049838376.db2.gz LXYKHVYJZMYIQL-RBBKRZOGSA-N 2 1 349.522 4.492 20 0 EIADMP c1cc2c(o1)CCC[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245725350 1049838527 /nfs/dbraw/zinc/83/85/27/1049838527.db2.gz PIOQHRLTOHCOBX-HUUJSLGLSA-N 2 1 336.479 4.442 20 0 EIADMP c1cc2c(o1)CCC[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245725350 1049838531 /nfs/dbraw/zinc/83/85/31/1049838531.db2.gz PIOQHRLTOHCOBX-HUUJSLGLSA-N 2 1 336.479 4.442 20 0 EIADMP CC1(C)C[C@H]([NH+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171983628 1049839022 /nfs/dbraw/zinc/83/90/22/1049839022.db2.gz ZFXWOYZGPWQWFI-QRVBRYPASA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@H]([N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171983628 1049839027 /nfs/dbraw/zinc/83/90/27/1049839027.db2.gz ZFXWOYZGPWQWFI-QRVBRYPASA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171983628 1049839032 /nfs/dbraw/zinc/83/90/32/1049839032.db2.gz ZFXWOYZGPWQWFI-QRVBRYPASA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@@H](n2ncc3c2cccc3C[NH3+])CC[N@H+]1Cc1ccccc1 ZINC001171981986 1049839213 /nfs/dbraw/zinc/83/92/13/1049839213.db2.gz FSZWIBFUCBRRQG-IBGZPJMESA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@@H](N2CC[C@@H]([NH3+])c3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC001171984475 1049840594 /nfs/dbraw/zinc/84/05/94/1049840594.db2.gz WBDLPIVSTRLZID-PZJWPPBQSA-N 2 1 349.522 4.340 20 0 EIADMP CC1(C)C[C@H](n2cnc3ccc(C[NH3+])cc32)CC[N@H+]1Cc1ccccc1 ZINC001171984370 1049840885 /nfs/dbraw/zinc/84/08/85/1049840885.db2.gz VDWURTKYANVWHT-LJQANCHMSA-N 2 1 348.494 4.111 20 0 EIADMP CC[N@@H+]1CC[C@@H](Nc2cccc(Cn3cc[nH+]c3C(C)C)c2)[C@@H](C)C1 ZINC000245730097 1049841603 /nfs/dbraw/zinc/84/16/03/1049841603.db2.gz HZSOFGCGWHQBPD-FXAWDEMLSA-N 2 1 340.515 4.197 20 0 EIADMP CC[N@H+]1CC[C@@H](Nc2cccc(Cn3cc[nH+]c3C(C)C)c2)[C@@H](C)C1 ZINC000245730097 1049841606 /nfs/dbraw/zinc/84/16/06/1049841606.db2.gz HZSOFGCGWHQBPD-FXAWDEMLSA-N 2 1 340.515 4.197 20 0 EIADMP CCOC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172073847 1049843777 /nfs/dbraw/zinc/84/37/77/1049843777.db2.gz DACGTFIMTHEKFR-WKCHPHFGSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@@H]1CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172075208 1049844522 /nfs/dbraw/zinc/84/45/22/1049844522.db2.gz OROAGRMQZDFVLN-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172075208 1049844526 /nfs/dbraw/zinc/84/45/26/1049844526.db2.gz OROAGRMQZDFVLN-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172075208 1049844529 /nfs/dbraw/zinc/84/45/29/1049844529.db2.gz OROAGRMQZDFVLN-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP FC1(F)C[C@]12CC[N@H+]([C@H]1C[C@H]3CCC[C@@H](C1)[NH+]3Cc1ccccc1)C2 ZINC001172074409 1049844862 /nfs/dbraw/zinc/84/48/62/1049844862.db2.gz IRDZIINYEOOPCE-NMLBUPMWSA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)C[C@]12CC[NH+]([C@H]1C[C@H]3CCC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001172074409 1049844864 /nfs/dbraw/zinc/84/48/64/1049844864.db2.gz IRDZIINYEOOPCE-NMLBUPMWSA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)C[C@]12CC[NH+]([C@H]1C[C@H]3CCC[C@@H](C1)[N@@H+]3Cc1ccccc1)C2 ZINC001172074409 1049844869 /nfs/dbraw/zinc/84/48/69/1049844869.db2.gz IRDZIINYEOOPCE-NMLBUPMWSA-N 2 1 346.465 4.303 20 0 EIADMP c1cc(CC[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cs1 ZINC001172064680 1049850932 /nfs/dbraw/zinc/85/09/32/1049850932.db2.gz IVKCNOYSJKXWHP-MZADTFQBSA-N 2 1 340.536 4.466 20 0 EIADMP F[C@@H]1CC[C@@H](C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172067399 1049851998 /nfs/dbraw/zinc/85/19/98/1049851998.db2.gz NKDYNZFSJXWLSB-ONUIULTDSA-N 2 1 330.491 4.300 20 0 EIADMP COC[C@@H]1CCCC[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069320 1049853696 /nfs/dbraw/zinc/85/36/96/1049853696.db2.gz PAQSLIMHGKMSRJ-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@@H]1CCCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069320 1049853697 /nfs/dbraw/zinc/85/36/97/1049853697.db2.gz PAQSLIMHGKMSRJ-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@@H]1CCCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069320 1049853699 /nfs/dbraw/zinc/85/36/99/1049853699.db2.gz PAQSLIMHGKMSRJ-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@@H]1CCCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069320 1049853705 /nfs/dbraw/zinc/85/37/05/1049853705.db2.gz PAQSLIMHGKMSRJ-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP C[C@H]1C[C@@H](CF)[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172069892 1049853805 /nfs/dbraw/zinc/85/38/05/1049853805.db2.gz VITHZZRWWYBAPQ-RQUKQETFSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@H]1C[C@@H](CF)[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172069892 1049853808 /nfs/dbraw/zinc/85/38/08/1049853808.db2.gz VITHZZRWWYBAPQ-RQUKQETFSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@H]1C[C@@H](CF)[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172069892 1049853809 /nfs/dbraw/zinc/85/38/09/1049853809.db2.gz VITHZZRWWYBAPQ-RQUKQETFSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@H]1C[C@@H](CF)[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172069892 1049853811 /nfs/dbraw/zinc/85/38/11/1049853811.db2.gz VITHZZRWWYBAPQ-RQUKQETFSA-N 2 1 330.491 4.252 20 0 EIADMP FC1CCC([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172069820 1049853914 /nfs/dbraw/zinc/85/39/14/1049853914.db2.gz XVPIOUWFWIHORO-SMCZBRLRSA-N 2 1 330.491 4.442 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H](CCc3ccccc3)C1)C2 ZINC001172134697 1049854460 /nfs/dbraw/zinc/85/44/60/1049854460.db2.gz YPGCDIDIDBVSNK-YUMYIRISSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H](CCc3ccccc3)C1)C2 ZINC001172134697 1049854463 /nfs/dbraw/zinc/85/44/63/1049854463.db2.gz YPGCDIDIDBVSNK-YUMYIRISSA-N 2 1 326.528 4.347 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@H](CCc3ccccc3)C1)C2 ZINC001172134697 1049854465 /nfs/dbraw/zinc/85/44/65/1049854465.db2.gz YPGCDIDIDBVSNK-YUMYIRISSA-N 2 1 326.528 4.347 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@H](CCc3ccccc3)C1)C2 ZINC001172134697 1049854468 /nfs/dbraw/zinc/85/44/68/1049854468.db2.gz YPGCDIDIDBVSNK-YUMYIRISSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCc3cc(Br)ccc31)C2 ZINC001172104952 1049857595 /nfs/dbraw/zinc/85/75/95/1049857595.db2.gz FDJSZGYSRQHTBC-XLMAVXFVSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCc3cc(Br)ccc31)C2 ZINC001172104952 1049857600 /nfs/dbraw/zinc/85/76/00/1049857600.db2.gz FDJSZGYSRQHTBC-XLMAVXFVSA-N 2 1 349.316 4.041 20 0 EIADMP COc1ccc(CC2(C[NH2+][C@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CCC2)cc1 ZINC001172110954 1049858152 /nfs/dbraw/zinc/85/81/52/1049858152.db2.gz MOZYXYLHYPPARU-ACDBMABISA-N 2 1 342.527 4.013 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(Cc3ccc(F)cc3)CCC1)C2 ZINC001172111982 1049858244 /nfs/dbraw/zinc/85/82/44/1049858244.db2.gz YMQFVLLVWLSGFJ-OWZKRDHZSA-N 2 1 330.491 4.143 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(CCc3ccccc3)CC1)C2 ZINC001172121491 1049858469 /nfs/dbraw/zinc/85/84/69/1049858469.db2.gz KAFCVGQFZRTYPH-KOUNCHBCSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(CCc3ccccc3)CC1)C2 ZINC001172121491 1049858473 /nfs/dbraw/zinc/85/84/73/1049858473.db2.gz KAFCVGQFZRTYPH-KOUNCHBCSA-N 2 1 326.528 4.347 20 0 EIADMP COCCC[NH+]1CCC([NH2+]C2(c3ccccc3)CCCCCC2)CC1 ZINC001172244451 1049871363 /nfs/dbraw/zinc/87/13/63/1049871363.db2.gz FFVYPRGEYDWYHY-UHFFFAOYSA-N 2 1 344.543 4.327 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccnc(Cl)c2F)c1 ZINC000823716359 1049872471 /nfs/dbraw/zinc/87/24/71/1049872471.db2.gz CHIFZYUFVJAGNG-UHFFFAOYSA-N 2 1 335.854 4.004 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccnc(Cl)c2F)c1 ZINC000823716359 1049872472 /nfs/dbraw/zinc/87/24/72/1049872472.db2.gz CHIFZYUFVJAGNG-UHFFFAOYSA-N 2 1 335.854 4.004 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172320723 1049877470 /nfs/dbraw/zinc/87/74/70/1049877470.db2.gz ZXJMHTGTDVCUPE-YOUFYPILSA-N 2 1 332.532 4.223 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172320723 1049877471 /nfs/dbraw/zinc/87/74/71/1049877471.db2.gz ZXJMHTGTDVCUPE-YOUFYPILSA-N 2 1 332.532 4.223 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)C[C@H]1C ZINC001172381013 1049885627 /nfs/dbraw/zinc/88/56/27/1049885627.db2.gz ZSPZFTBVVNIWFL-SFHLNBCPSA-N 2 1 341.543 4.194 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC([NH3+])(c2ccccc2Cl)CC1 ZINC001172338933 1049888970 /nfs/dbraw/zinc/88/89/70/1049888970.db2.gz ZPTRDAJAYKVULU-HZPDHXFCSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001172344327 1049889861 /nfs/dbraw/zinc/88/98/61/1049889861.db2.gz AOXQDIUGAREQQK-SEIRJHJZSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001172344327 1049889867 /nfs/dbraw/zinc/88/98/67/1049889867.db2.gz AOXQDIUGAREQQK-SEIRJHJZSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001172344327 1049889873 /nfs/dbraw/zinc/88/98/73/1049889873.db2.gz AOXQDIUGAREQQK-SEIRJHJZSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001172347908 1049891329 /nfs/dbraw/zinc/89/13/29/1049891329.db2.gz GGMBHGFWEAHNSE-IWFBPKFRSA-N 2 1 332.532 4.080 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC001172347908 1049891332 /nfs/dbraw/zinc/89/13/32/1049891332.db2.gz GGMBHGFWEAHNSE-IWFBPKFRSA-N 2 1 332.532 4.080 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001172352515 1049892027 /nfs/dbraw/zinc/89/20/27/1049892027.db2.gz ICKJDOXABLYJDN-RTBURBONSA-N 2 1 344.543 4.103 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001172352515 1049892034 /nfs/dbraw/zinc/89/20/34/1049892034.db2.gz ICKJDOXABLYJDN-RTBURBONSA-N 2 1 344.543 4.103 20 0 EIADMP Cc1ccc(C[N@H+]([C@@H](C)CCOC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001172445536 1049914127 /nfs/dbraw/zinc/91/41/27/1049914127.db2.gz RINDMENROHRHFC-JBACZVJFSA-N 2 1 332.532 4.271 20 0 EIADMP CC(C)([NH3+])CC[NH2+]CCC(C)(C)[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172535810 1049942793 /nfs/dbraw/zinc/94/27/93/1049942793.db2.gz JKIORAYWSZSHDZ-WOJBJXKFSA-N 3 1 345.575 4.188 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1)c1cccs1 ZINC000247196606 1050016703 /nfs/dbraw/zinc/01/67/03/1050016703.db2.gz WCXUCJDFWSVSNH-LPHOPBHVSA-N 2 1 344.524 4.210 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1)c1cccs1 ZINC000247196606 1050016708 /nfs/dbraw/zinc/01/67/08/1050016708.db2.gz WCXUCJDFWSVSNH-LPHOPBHVSA-N 2 1 344.524 4.210 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000248198216 1050047046 /nfs/dbraw/zinc/04/70/46/1050047046.db2.gz XTWIDUMWLIBJAB-TWOQFEAHSA-N 2 1 344.524 4.490 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000248198216 1050047054 /nfs/dbraw/zinc/04/70/54/1050047054.db2.gz XTWIDUMWLIBJAB-TWOQFEAHSA-N 2 1 344.524 4.490 20 0 EIADMP C[N@@H+]1CC[C@@H]2CC[NH+](CCCCc3cccc(C(F)(F)F)c3)[C@H]2C1 ZINC000249106029 1050091312 /nfs/dbraw/zinc/09/13/12/1050091312.db2.gz PIDNNBGXKSLDQH-AEFFLSMTSA-N 2 1 340.433 4.054 20 0 EIADMP C[N@H+]1CC[C@@H]2CC[NH+](CCCCc3cccc(C(F)(F)F)c3)[C@H]2C1 ZINC000249106029 1050091316 /nfs/dbraw/zinc/09/13/16/1050091316.db2.gz PIDNNBGXKSLDQH-AEFFLSMTSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@H+](CCCCc3cccc(C(F)(F)F)c3)[C@H]2C1 ZINC000249106029 1050091320 /nfs/dbraw/zinc/09/13/20/1050091320.db2.gz PIDNNBGXKSLDQH-AEFFLSMTSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@@H+](CCCCc3cccc(C(F)(F)F)c3)[C@H]2C1 ZINC000249106029 1050091324 /nfs/dbraw/zinc/09/13/24/1050091324.db2.gz PIDNNBGXKSLDQH-AEFFLSMTSA-N 2 1 340.433 4.054 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)C1 ZINC000249091999 1050091631 /nfs/dbraw/zinc/09/16/31/1050091631.db2.gz DLMPSPYFIORTEK-QZTJIDSGSA-N 2 1 340.433 4.146 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)C1 ZINC000249091999 1050091635 /nfs/dbraw/zinc/09/16/35/1050091635.db2.gz DLMPSPYFIORTEK-QZTJIDSGSA-N 2 1 340.433 4.146 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cccc(OC(F)(F)F)c1 ZINC000089513054 1050120852 /nfs/dbraw/zinc/12/08/52/1050120852.db2.gz JRASQKAWYHOMAD-CYBMUJFWSA-N 2 1 344.421 4.499 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2cccs2)cc1 ZINC001177231316 1050169332 /nfs/dbraw/zinc/16/93/32/1050169332.db2.gz LGIBVDFJNFZMIN-HNNXBMFYSA-N 2 1 325.481 4.346 20 0 EIADMP Cc1c(Cl)cccc1C[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC001177244943 1050173229 /nfs/dbraw/zinc/17/32/29/1050173229.db2.gz JUEUBXGGSSASLS-UHFFFAOYSA-N 2 1 328.887 4.186 20 0 EIADMP Cc1c(Cl)cccc1C[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC001177244943 1050173243 /nfs/dbraw/zinc/17/32/43/1050173243.db2.gz JUEUBXGGSSASLS-UHFFFAOYSA-N 2 1 328.887 4.186 20 0 EIADMP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2cccc(C(F)(F)F)c2)C1 ZINC001177294004 1050177862 /nfs/dbraw/zinc/17/78/62/1050177862.db2.gz CCZLGWZCTAJBAP-HUUCEWRRSA-N 2 1 328.422 4.163 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1c(F)ccc(F)c1Cl ZINC001177299341 1050180894 /nfs/dbraw/zinc/18/08/94/1050180894.db2.gz OWVYYCLFNDFUKD-ZDUSSCGKSA-N 2 1 330.850 4.362 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3n2)C1 ZINC000090585779 1050186589 /nfs/dbraw/zinc/18/65/89/1050186589.db2.gz IKJYYYGWWKPGAV-ZWKOTPCHSA-N 2 1 325.500 4.253 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3n2)C1 ZINC000090585779 1050186596 /nfs/dbraw/zinc/18/65/96/1050186596.db2.gz IKJYYYGWWKPGAV-ZWKOTPCHSA-N 2 1 325.500 4.253 20 0 EIADMP CC(C)[N@@H+]([C@@H](C)Cc1c(F)cccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172847546 1050186808 /nfs/dbraw/zinc/18/68/08/1050186808.db2.gz KMFGNHOLLXTQPW-KKUMJFAQSA-N 2 1 326.887 4.390 20 0 EIADMP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172879103 1050219921 /nfs/dbraw/zinc/21/99/21/1050219921.db2.gz MBMYGHIKWMIKOE-DZUCGIPZSA-N 2 1 338.948 4.426 20 0 EIADMP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172879103 1050219936 /nfs/dbraw/zinc/21/99/36/1050219936.db2.gz MBMYGHIKWMIKOE-DZUCGIPZSA-N 2 1 338.948 4.426 20 0 EIADMP CCC[NH+]1C[C@@H]2C[N@H+]([C@H](C)CSc3ccc(Cl)cc3)C[C@@H]2C1 ZINC001172884354 1050225469 /nfs/dbraw/zinc/22/54/69/1050225469.db2.gz BOXRKWBGMOARQJ-OAGGEKHMSA-N 2 1 338.948 4.094 20 0 EIADMP CCC[NH+]1C[C@@H]2C[N@@H+]([C@H](C)CSc3ccc(Cl)cc3)C[C@@H]2C1 ZINC001172884354 1050225485 /nfs/dbraw/zinc/22/54/85/1050225485.db2.gz BOXRKWBGMOARQJ-OAGGEKHMSA-N 2 1 338.948 4.094 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+]Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC001177554142 1050240323 /nfs/dbraw/zinc/24/03/23/1050240323.db2.gz LQYYFLUODNGQIU-UHFFFAOYSA-N 2 1 325.843 4.302 20 0 EIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccc(Oc3ccc(Cl)cc3)cc2)CC[C@@H]1F ZINC001206187038 1050266449 /nfs/dbraw/zinc/26/64/49/1050266449.db2.gz SPPOBVFIHDKCNA-OALUTQOASA-N 2 1 348.849 4.394 20 0 EIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)C1CCC2(CCOCC2)CC1 ZINC001173049516 1050273563 /nfs/dbraw/zinc/27/35/63/1050273563.db2.gz UUJSFUCRFNEIOR-UHFFFAOYSA-N 2 1 348.575 4.455 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H](Oc3ccccc3)C2)CC1 ZINC001173112378 1050310121 /nfs/dbraw/zinc/31/01/21/1050310121.db2.gz WTITZIIEUCBGQW-GZNCHQMQSA-N 2 1 330.516 4.183 20 0 EIADMP Cc1nn(C(C)C)c(C)c1C[NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC001177961739 1050332785 /nfs/dbraw/zinc/33/27/85/1050332785.db2.gz MDTBJYKDVBKIIJ-QGZVFWFLSA-N 2 1 342.531 4.081 20 0 EIADMP Cc1nn(C(C)C)c(C)c1C[NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC001177961739 1050332804 /nfs/dbraw/zinc/33/28/04/1050332804.db2.gz MDTBJYKDVBKIIJ-QGZVFWFLSA-N 2 1 342.531 4.081 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)CC(c1ccccc1)c1ccccc1 ZINC001173206514 1050366165 /nfs/dbraw/zinc/36/61/65/1050366165.db2.gz WMNRLMZWHYWZLO-SFHVURJKSA-N 2 1 333.479 4.392 20 0 EIADMP Cc1ccc(OC(F)F)c(C[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC001178249734 1050409824 /nfs/dbraw/zinc/40/98/24/1050409824.db2.gz SQLGJTZFGIXATL-MRXNPFEDSA-N 2 1 340.458 4.054 20 0 EIADMP Cc1ccc(OC(F)F)c(C[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c1 ZINC001178249734 1050409834 /nfs/dbraw/zinc/40/98/34/1050409834.db2.gz SQLGJTZFGIXATL-MRXNPFEDSA-N 2 1 340.458 4.054 20 0 EIADMP Cc1ccc(OC(F)F)c(C[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC001178249733 1050409898 /nfs/dbraw/zinc/40/98/98/1050409898.db2.gz SQLGJTZFGIXATL-INIZCTEOSA-N 2 1 340.458 4.054 20 0 EIADMP Cc1ccc(OC(F)F)c(C[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c1 ZINC001178249733 1050409911 /nfs/dbraw/zinc/40/99/11/1050409911.db2.gz SQLGJTZFGIXATL-INIZCTEOSA-N 2 1 340.458 4.054 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H]2CC2(Cl)Cl)CC1)CC(C)C ZINC000773730254 1050415060 /nfs/dbraw/zinc/41/50/60/1050415060.db2.gz HGGIWIURGJIUHP-INIZCTEOSA-N 2 1 335.363 4.260 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2ccoc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001178330263 1050436454 /nfs/dbraw/zinc/43/64/54/1050436454.db2.gz ALMSVPXXIXCOGO-LAUBAEHRSA-N 2 1 334.463 4.433 20 0 EIADMP CCSC[C@H](C)[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001173316896 1050438533 /nfs/dbraw/zinc/43/85/33/1050438533.db2.gz ZXJXFAKGJBTVDR-AZUAARDMSA-N 2 1 332.557 4.116 20 0 EIADMP CCSC[C@H](C)[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001173316896 1050438540 /nfs/dbraw/zinc/43/85/40/1050438540.db2.gz ZXJXFAKGJBTVDR-AZUAARDMSA-N 2 1 332.557 4.116 20 0 EIADMP CCSC[C@H](C)[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001173316896 1050438548 /nfs/dbraw/zinc/43/85/48/1050438548.db2.gz ZXJXFAKGJBTVDR-AZUAARDMSA-N 2 1 332.557 4.116 20 0 EIADMP Cc1csc([C@H](C)C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)n1 ZINC001178445370 1050459799 /nfs/dbraw/zinc/45/97/99/1050459799.db2.gz VXHRNEOBIDIIFC-MRXNPFEDSA-N 2 1 345.556 4.303 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)C2Cc3cc(F)c(F)cc3C2)CC1 ZINC001173477527 1050461027 /nfs/dbraw/zinc/46/10/27/1050461027.db2.gz QKAHFVHUXWLJCO-IYARVYRRSA-N 2 1 348.481 4.194 20 0 EIADMP [NH3+][C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC[C@H]1F ZINC001206212294 1050544343 /nfs/dbraw/zinc/54/43/43/1050544343.db2.gz RKNYPRGXPPFSPW-RTBURBONSA-N 2 1 332.850 4.268 20 0 EIADMP [NH3+][C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC[C@H]1F ZINC001206212294 1050544347 /nfs/dbraw/zinc/54/43/47/1050544347.db2.gz RKNYPRGXPPFSPW-RTBURBONSA-N 2 1 332.850 4.268 20 0 EIADMP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2nc(C)cs2)ccc1OC ZINC000182291990 1050584584 /nfs/dbraw/zinc/58/45/84/1050584584.db2.gz KTDQOWYDMUPEDU-HNNXBMFYSA-N 2 1 347.528 4.153 20 0 EIADMP CC(C)[C@@H](C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC001179015938 1050612342 /nfs/dbraw/zinc/61/23/42/1050612342.db2.gz RKSWAKXMCWGYHH-ZLNRFVROSA-N 2 1 336.523 4.361 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC001179160381 1050645024 /nfs/dbraw/zinc/64/50/24/1050645024.db2.gz VYZGYRYLPGVYCZ-GOSISDBHSA-N 2 1 338.495 4.184 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC001179160381 1050645037 /nfs/dbraw/zinc/64/50/37/1050645037.db2.gz VYZGYRYLPGVYCZ-GOSISDBHSA-N 2 1 338.495 4.184 20 0 EIADMP CC(C)(C)c1ccc(CC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001179925498 1050819955 /nfs/dbraw/zinc/81/99/55/1050819955.db2.gz ROCUJSBQWQVIDE-KNQAVFIVSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001179925498 1050819959 /nfs/dbraw/zinc/81/99/59/1050819959.db2.gz ROCUJSBQWQVIDE-KNQAVFIVSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC001179925498 1050819963 /nfs/dbraw/zinc/81/99/63/1050819963.db2.gz ROCUJSBQWQVIDE-KNQAVFIVSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC001179925498 1050819971 /nfs/dbraw/zinc/81/99/71/1050819971.db2.gz ROCUJSBQWQVIDE-KNQAVFIVSA-N 2 1 340.555 4.475 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cc3ccccc3n2C)C1 ZINC001180031066 1050858897 /nfs/dbraw/zinc/85/88/97/1050858897.db2.gz UHHIJGXJULQVSV-OALUTQOASA-N 2 1 339.527 4.265 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cc3ccccc3n2C)C1 ZINC001180031066 1050858903 /nfs/dbraw/zinc/85/89/03/1050858903.db2.gz UHHIJGXJULQVSV-OALUTQOASA-N 2 1 339.527 4.265 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cc3ccccc3n2C)C1 ZINC001180031066 1050858908 /nfs/dbraw/zinc/85/89/08/1050858908.db2.gz UHHIJGXJULQVSV-OALUTQOASA-N 2 1 339.527 4.265 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cc3ccccc3n2C)C1 ZINC001180031066 1050858917 /nfs/dbraw/zinc/85/89/17/1050858917.db2.gz UHHIJGXJULQVSV-OALUTQOASA-N 2 1 339.527 4.265 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cc3ccccc3n2C)C1 ZINC001180031065 1050859495 /nfs/dbraw/zinc/85/94/95/1050859495.db2.gz UHHIJGXJULQVSV-MOPGFXCFSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cc3ccccc3n2C)C1 ZINC001180031065 1050859496 /nfs/dbraw/zinc/85/94/96/1050859496.db2.gz UHHIJGXJULQVSV-MOPGFXCFSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cc3ccccc3n2C)C1 ZINC001180031065 1050859499 /nfs/dbraw/zinc/85/94/99/1050859499.db2.gz UHHIJGXJULQVSV-MOPGFXCFSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cc3ccccc3n2C)C1 ZINC001180031065 1050859504 /nfs/dbraw/zinc/85/95/04/1050859504.db2.gz UHHIJGXJULQVSV-MOPGFXCFSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@@H]1Cc2cc(C[N@@H+]3CCC[C@@H](C[NH+]4CCCC[C@H]4C)C3)ccc2O1 ZINC001180030183 1050860314 /nfs/dbraw/zinc/86/03/14/1050860314.db2.gz JPMBHSUROZMPTK-QWFCFKBJSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[N@H+]3CCC[C@@H](C[NH+]4CCCC[C@H]4C)C3)ccc2O1 ZINC001180030183 1050860318 /nfs/dbraw/zinc/86/03/18/1050860318.db2.gz JPMBHSUROZMPTK-QWFCFKBJSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[NH+]3CCC[C@@H](C[N@@H+]4CCCC[C@H]4C)C3)ccc2O1 ZINC001180030183 1050860322 /nfs/dbraw/zinc/86/03/22/1050860322.db2.gz JPMBHSUROZMPTK-QWFCFKBJSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[NH+]3CCC[C@@H](C[N@H+]4CCCC[C@H]4C)C3)ccc2O1 ZINC001180030183 1050860326 /nfs/dbraw/zinc/86/03/26/1050860326.db2.gz JPMBHSUROZMPTK-QWFCFKBJSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000414155136 1051143348 /nfs/dbraw/zinc/14/33/48/1051143348.db2.gz MNQPZASKSYZUIG-COPCDDAFSA-N 2 1 337.511 4.218 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000414155136 1051143359 /nfs/dbraw/zinc/14/33/59/1051143359.db2.gz MNQPZASKSYZUIG-COPCDDAFSA-N 2 1 337.511 4.218 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775378988 1051169831 /nfs/dbraw/zinc/16/98/31/1051169831.db2.gz OTMRNVPXJFQJPN-SUMWQHHRSA-N 2 1 340.483 4.310 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2c3ccccc3C[C@@H]2C)cc1F ZINC000153707569 1051217266 /nfs/dbraw/zinc/21/72/66/1051217266.db2.gz POPPWNBPDPTBKU-QKKBWIMNSA-N 2 1 335.426 4.343 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cnn(C3CCC3)c2)CC1)CC(C)C ZINC001181514231 1051243686 /nfs/dbraw/zinc/24/36/86/1051243686.db2.gz BQIHNLHFNJCVPQ-UHFFFAOYSA-N 2 1 346.563 4.188 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC001181514339 1051243999 /nfs/dbraw/zinc/24/39/99/1051243999.db2.gz GCADNEFXOKPYPC-QGZVFWFLSA-N 2 1 340.433 4.178 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000163221303 1051251887 /nfs/dbraw/zinc/25/18/87/1051251887.db2.gz AXVUSPKFOGBSMF-UONOGXRCSA-N 2 1 328.472 4.036 20 0 EIADMP CCCCCOc1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000620759481 1051289175 /nfs/dbraw/zinc/28/91/75/1051289175.db2.gz AYOMMITWEHECPE-UHFFFAOYSA-N 2 1 330.516 4.362 20 0 EIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H](C)Cc1ccc(Br)cc1 ZINC001182115995 1051396240 /nfs/dbraw/zinc/39/62/40/1051396240.db2.gz YSLDKJIHZLELPM-HUUCEWRRSA-N 2 1 341.337 4.090 20 0 EIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H](C)Cc1ccc(Br)cc1 ZINC001182115995 1051396243 /nfs/dbraw/zinc/39/62/43/1051396243.db2.gz YSLDKJIHZLELPM-HUUCEWRRSA-N 2 1 341.337 4.090 20 0 EIADMP Cc1nc(C)c([C@H](C)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000268792347 1051392168 /nfs/dbraw/zinc/39/21/68/1051392168.db2.gz MOOZIEJJXIBASU-SIXWZSSISA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000268792347 1051392178 /nfs/dbraw/zinc/39/21/78/1051392178.db2.gz MOOZIEJJXIBASU-SIXWZSSISA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000268792347 1051392189 /nfs/dbraw/zinc/39/21/89/1051392189.db2.gz MOOZIEJJXIBASU-SIXWZSSISA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000268792347 1051392202 /nfs/dbraw/zinc/39/22/02/1051392202.db2.gz MOOZIEJJXIBASU-SIXWZSSISA-N 2 1 343.540 4.321 20 0 EIADMP Cc1c(C)c(C)c(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)c(C)c1C ZINC001191444109 1051460506 /nfs/dbraw/zinc/46/05/06/1051460506.db2.gz IEJFIRAZNXXCQP-OAQYLSRUSA-N 2 1 328.544 4.392 20 0 EIADMP Cc1c(C)c(C)c(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c(C)c1C ZINC001191444109 1051460513 /nfs/dbraw/zinc/46/05/13/1051460513.db2.gz IEJFIRAZNXXCQP-OAQYLSRUSA-N 2 1 328.544 4.392 20 0 EIADMP Cc1c(C)c(C)c(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c(C)c1C ZINC001191444109 1051460517 /nfs/dbraw/zinc/46/05/17/1051460517.db2.gz IEJFIRAZNXXCQP-OAQYLSRUSA-N 2 1 328.544 4.392 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000155862743 1051469693 /nfs/dbraw/zinc/46/96/93/1051469693.db2.gz NEGOSMYXOVFGLO-CKEIUWERSA-N 2 1 328.422 4.271 20 0 EIADMP Clc1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c2ncccc12 ZINC000157444430 1051637531 /nfs/dbraw/zinc/63/75/31/1051637531.db2.gz OFWWYHUOCGYYAM-KRWDZBQOSA-N 2 1 343.902 4.339 20 0 EIADMP Clc1ccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c2ncccc12 ZINC000157444430 1051637537 /nfs/dbraw/zinc/63/75/37/1051637537.db2.gz OFWWYHUOCGYYAM-KRWDZBQOSA-N 2 1 343.902 4.339 20 0 EIADMP c1ccc(C[N@@H+]2CC=C(Nc3cccc(C[NH+]4CCCC4)c3)CC2)cc1 ZINC001175506361 1051640672 /nfs/dbraw/zinc/64/06/72/1051640672.db2.gz WFLMYABRCFHLPI-UHFFFAOYSA-N 2 1 347.506 4.484 20 0 EIADMP COc1ccc(-c2csc(C[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@H]3C)c2)cc1 ZINC000157653768 1051661502 /nfs/dbraw/zinc/66/15/02/1051661502.db2.gz NYURUBODSGXAKA-STXHMFSFSA-N 2 1 344.524 4.242 20 0 EIADMP C[C@@H]1CC[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)CC[C@H]1C[NH3+] ZINC001205602228 1051756039 /nfs/dbraw/zinc/75/60/39/1051756039.db2.gz HUAYSQCOFGMPIQ-NEPJUHHUSA-N 2 1 334.813 4.166 20 0 EIADMP C[C@@H](C[NH+](C)C)[C@@H]1CCCC[N@@H+]1Cc1c(Cl)ccc2cccnc21 ZINC001183065563 1051782021 /nfs/dbraw/zinc/78/20/21/1051782021.db2.gz MBDFCQKDQJJFBW-KXBFYZLASA-N 2 1 345.918 4.440 20 0 EIADMP C[C@@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1Cc1c(Cl)ccc2cccnc21 ZINC001183065563 1051782028 /nfs/dbraw/zinc/78/20/28/1051782028.db2.gz MBDFCQKDQJJFBW-KXBFYZLASA-N 2 1 345.918 4.440 20 0 EIADMP C[C@H]1CC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)CC[C@@H]1C[NH3+] ZINC001205604866 1051792633 /nfs/dbraw/zinc/79/26/33/1051792633.db2.gz YIORDIYVIJNARP-DZGCQCFKSA-N 2 1 329.315 4.233 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@H](CC[N@H+]2C)C1 ZINC001183371729 1051838330 /nfs/dbraw/zinc/83/83/30/1051838330.db2.gz SDGHTPYUEYNMAU-RWUQBBKRSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@H](CC[N@@H+]2C)C1 ZINC001183371729 1051838335 /nfs/dbraw/zinc/83/83/35/1051838335.db2.gz SDGHTPYUEYNMAU-RWUQBBKRSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[N@@H+]1CC[C@@H]2[C@H](CC[NH+]2C)C1 ZINC001183371729 1051838339 /nfs/dbraw/zinc/83/83/39/1051838339.db2.gz SDGHTPYUEYNMAU-RWUQBBKRSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[N@H+]1CC[C@@H]2[C@H](CC[NH+]2C)C1 ZINC001183371729 1051838345 /nfs/dbraw/zinc/83/83/45/1051838345.db2.gz SDGHTPYUEYNMAU-RWUQBBKRSA-N 2 1 338.417 4.135 20 0 EIADMP CCCOc1cccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC001193251615 1051892157 /nfs/dbraw/zinc/89/21/57/1051892157.db2.gz VFFRQDNUKCHGGU-HKUYNNGSSA-N 2 1 330.516 4.218 20 0 EIADMP Cc1nc(-c2ccc(CC[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@@H]3C)s2)cs1 ZINC000164469862 1052031219 /nfs/dbraw/zinc/03/12/19/1052031219.db2.gz WFPMFNCRTBEFOW-WOSRLPQWSA-N 2 1 349.569 4.041 20 0 EIADMP COc1cc(C[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)ccc1C ZINC000580514612 1052072820 /nfs/dbraw/zinc/07/28/20/1052072820.db2.gz YLPRAZMBMRAQEM-SFHVURJKSA-N 2 1 338.495 4.319 20 0 EIADMP CCCC[C@@H](CC)C[N@@H+]1CCC[NH+](Cc2ccccc2)CCOCC1 ZINC001176496341 1052084135 /nfs/dbraw/zinc/08/41/35/1052084135.db2.gz QEBMJTXHZFXBPB-OAQYLSRUSA-N 2 1 346.559 4.427 20 0 EIADMP CCCC[C@@H](CC)C[N@H+]1CCC[NH+](Cc2ccccc2)CCOCC1 ZINC001176496341 1052084153 /nfs/dbraw/zinc/08/41/53/1052084153.db2.gz QEBMJTXHZFXBPB-OAQYLSRUSA-N 2 1 346.559 4.427 20 0 EIADMP CCCC[C@@H](CC)C[NH+]1CCC[N@H+](Cc2ccccc2)CCOCC1 ZINC001176496341 1052084173 /nfs/dbraw/zinc/08/41/73/1052084173.db2.gz QEBMJTXHZFXBPB-OAQYLSRUSA-N 2 1 346.559 4.427 20 0 EIADMP CCCC[C@@H](CC)C[NH+]1CCC[N@@H+](Cc2ccccc2)CCOCC1 ZINC001176496341 1052084187 /nfs/dbraw/zinc/08/41/87/1052084187.db2.gz QEBMJTXHZFXBPB-OAQYLSRUSA-N 2 1 346.559 4.427 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC34CCC(CC3)C4)C2)s1 ZINC001194152444 1052089230 /nfs/dbraw/zinc/08/92/30/1052089230.db2.gz BCRJKCUBJZEZDN-QPIRBTGLSA-N 2 1 332.557 4.391 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC34CCC(CC3)C4)C2)s1 ZINC001194152444 1052089248 /nfs/dbraw/zinc/08/92/48/1052089248.db2.gz BCRJKCUBJZEZDN-QPIRBTGLSA-N 2 1 332.557 4.391 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC34CCC(CC3)C4)C2)s1 ZINC001194152444 1052089258 /nfs/dbraw/zinc/08/92/58/1052089258.db2.gz BCRJKCUBJZEZDN-QPIRBTGLSA-N 2 1 332.557 4.391 20 0 EIADMP C[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1cccs1 ZINC000167466802 1052117561 /nfs/dbraw/zinc/11/75/61/1052117561.db2.gz FVKQPWVWNZJRPP-SFHVURJKSA-N 2 1 342.552 4.223 20 0 EIADMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](CCCc1ccc(C(F)(F)F)cc1)C2 ZINC001194505162 1052161862 /nfs/dbraw/zinc/16/18/62/1052161862.db2.gz LPCUOZOSZNNFBC-GOSISDBHSA-N 2 1 340.433 4.056 20 0 EIADMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](CCCc1ccc(C(F)(F)F)cc1)C2 ZINC001194505162 1052161865 /nfs/dbraw/zinc/16/18/65/1052161865.db2.gz LPCUOZOSZNNFBC-GOSISDBHSA-N 2 1 340.433 4.056 20 0 EIADMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CCCc1ccc(C(F)(F)F)cc1)C2 ZINC001194505162 1052161872 /nfs/dbraw/zinc/16/18/72/1052161872.db2.gz LPCUOZOSZNNFBC-GOSISDBHSA-N 2 1 340.433 4.056 20 0 EIADMP C[N@H+]1CCC[C@]2(CC[NH+](CCCOc3cccc(C(C)(C)C)c3)C2)C1 ZINC001194641023 1052183138 /nfs/dbraw/zinc/18/31/38/1052183138.db2.gz LEEWUXXFUFXLRO-QFIPXVFZSA-N 2 1 344.543 4.171 20 0 EIADMP C[NH+]1CCC[C@]2(CC[N@H+](CCCOc3cccc(C(C)(C)C)c3)C2)C1 ZINC001194641023 1052183144 /nfs/dbraw/zinc/18/31/44/1052183144.db2.gz LEEWUXXFUFXLRO-QFIPXVFZSA-N 2 1 344.543 4.171 20 0 EIADMP C[NH+]1CCC[C@]2(CC[N@@H+](CCCOc3cccc(C(C)(C)C)c3)C2)C1 ZINC001194641023 1052183150 /nfs/dbraw/zinc/18/31/50/1052183150.db2.gz LEEWUXXFUFXLRO-QFIPXVFZSA-N 2 1 344.543 4.171 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000339068804 1052551669 /nfs/dbraw/zinc/55/16/69/1052551669.db2.gz QJXPYHUQLBFOPO-SBHAEUEKSA-N 2 1 330.516 4.008 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000174514914 1052569192 /nfs/dbraw/zinc/56/91/92/1052569192.db2.gz NXPRJIXUDMOWLL-WMZOPIPTSA-N 2 1 326.484 4.199 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000174514914 1052569195 /nfs/dbraw/zinc/56/91/95/1052569195.db2.gz NXPRJIXUDMOWLL-WMZOPIPTSA-N 2 1 326.484 4.199 20 0 EIADMP CCCCOc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1OC ZINC000623362427 1052633470 /nfs/dbraw/zinc/63/34/70/1052633470.db2.gz STJQQECZJOAAQS-FUHWJXTLSA-N 2 1 348.531 4.398 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1OC ZINC000623362427 1052633472 /nfs/dbraw/zinc/63/34/72/1052633472.db2.gz STJQQECZJOAAQS-FUHWJXTLSA-N 2 1 348.531 4.398 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CC2)CC1(C)C ZINC000623398803 1052646916 /nfs/dbraw/zinc/64/69/16/1052646916.db2.gz PDMKDUOIPRTQNN-MRXNPFEDSA-N 2 1 340.433 4.199 20 0 EIADMP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000623755266 1052779823 /nfs/dbraw/zinc/77/98/23/1052779823.db2.gz ABWLZIDAEWAULR-KHYOSLBOSA-N 2 1 343.902 4.415 20 0 EIADMP C[N@H+]1CC[C@H](Nc2ccc(-c3ncc4n3CCCC4)cc2)CC1(C)C ZINC000623950499 1052841275 /nfs/dbraw/zinc/84/12/75/1052841275.db2.gz DTOZRGOCZMYQFQ-SFHVURJKSA-N 2 1 338.499 4.171 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)[C@H](C)c1nc2ccccc2s1 ZINC000624121277 1052867516 /nfs/dbraw/zinc/86/75/16/1052867516.db2.gz SCYUWCGFGVJXEN-HRCADAONSA-N 2 1 331.529 4.110 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1nccn1C ZINC000182960240 1052957061 /nfs/dbraw/zinc/95/70/61/1052957061.db2.gz INEAFRBVXFSCBN-FQEVSTJZSA-N 2 1 340.515 4.037 20 0 EIADMP Cc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c2ccccc2n1 ZINC000185694756 1053020582 /nfs/dbraw/zinc/02/05/82/1053020582.db2.gz MEMZAHOUNBGOPK-MSOLQXFVSA-N 2 1 337.511 4.286 20 0 EIADMP C[C@@H]([NH2+]CCSc1ccccc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185706672 1053021072 /nfs/dbraw/zinc/02/10/72/1053021072.db2.gz JJEFSPWWSXWCRU-HZPDHXFCSA-N 2 1 336.520 4.160 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000381210925 1053058307 /nfs/dbraw/zinc/05/83/07/1053058307.db2.gz UMPYGVHSJCBSQG-KGVIQGDOSA-N 2 1 338.495 4.084 20 0 EIADMP Cc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)s1 ZINC000381862483 1053106706 /nfs/dbraw/zinc/10/67/06/1053106706.db2.gz JAUMRKJKSPTQCJ-QFBILLFUSA-N 2 1 328.525 4.365 20 0 EIADMP FC1(F)CCCC[C@@H]1C[N@H+]1C[C@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000381874515 1053111708 /nfs/dbraw/zinc/11/17/08/1053111708.db2.gz JUQCFDHXBDZFCH-VAMGGRTRSA-N 2 1 348.481 4.266 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1C[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000381874515 1053111729 /nfs/dbraw/zinc/11/17/29/1053111729.db2.gz JUQCFDHXBDZFCH-VAMGGRTRSA-N 2 1 348.481 4.266 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000381874515 1053111742 /nfs/dbraw/zinc/11/17/42/1053111742.db2.gz JUQCFDHXBDZFCH-VAMGGRTRSA-N 2 1 348.481 4.266 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc2ccccc2[nH]1 ZINC000775628273 1053222485 /nfs/dbraw/zinc/22/24/85/1053222485.db2.gz QSTOMFVCZAVHFI-ICSRJNTNSA-N 2 1 347.506 4.383 20 0 EIADMP Cc1c([C@@H](C)NCCC[N@H+]2CCCC[C@H]2C)cnn1-c1ccccc1 ZINC000764627579 1053238781 /nfs/dbraw/zinc/23/87/81/1053238781.db2.gz JKQFUUUMTAZEOM-QZTJIDSGSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cnn1-c1ccccc1 ZINC000764627579 1053238808 /nfs/dbraw/zinc/23/88/08/1053238808.db2.gz JKQFUUUMTAZEOM-QZTJIDSGSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cnn1-c1ccccc1 ZINC000764627579 1053238827 /nfs/dbraw/zinc/23/88/27/1053238827.db2.gz JKQFUUUMTAZEOM-QZTJIDSGSA-N 2 1 340.515 4.096 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000383360166 1053329939 /nfs/dbraw/zinc/32/99/39/1053329939.db2.gz SHQAORAQKSFPSW-NVXWUHKLSA-N 2 1 330.422 4.138 20 0 EIADMP COc1ccc(CC[C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000764963362 1053399195 /nfs/dbraw/zinc/39/91/95/1053399195.db2.gz NRHJYGAQVXGWIT-RTBURBONSA-N 2 1 332.532 4.261 20 0 EIADMP c1ccc(CC2CC[NH+](CCC[N@H+]3CCC34CCCC4)CC2)cc1 ZINC001195843944 1053503724 /nfs/dbraw/zinc/50/37/24/1053503724.db2.gz WOVDNVLCJJNLMF-UHFFFAOYSA-N 2 1 326.528 4.350 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000385671901 1053541244 /nfs/dbraw/zinc/54/12/44/1053541244.db2.gz DXSHQXWENFQPIQ-DBXWQHBBSA-N 2 1 340.486 4.257 20 0 EIADMP c1cc2ccc(C[NH2+]C[C@@H]3CCC[N@@H+](Cc4ccccc4)C3)cc2[nH]1 ZINC000386050268 1053574741 /nfs/dbraw/zinc/57/47/41/1053574741.db2.gz BUGQAOJMHWNZCK-FQEVSTJZSA-N 2 1 333.479 4.170 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]CC[C@@H]3CCCS3)CC23CC3)cc1 ZINC000865725613 1053578921 /nfs/dbraw/zinc/57/89/21/1053578921.db2.gz NCPJRROVXDZHGU-MOPGFXCFSA-N 2 1 330.541 4.059 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]CC[C@@H]3CCCS3)CC23CC3)cc1 ZINC000865725613 1053578929 /nfs/dbraw/zinc/57/89/29/1053578929.db2.gz NCPJRROVXDZHGU-MOPGFXCFSA-N 2 1 330.541 4.059 20 0 EIADMP CC(C)([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)[C@H]1CCCCO1 ZINC000865743942 1053583179 /nfs/dbraw/zinc/58/31/79/1053583179.db2.gz KERHMOIRVNPYTN-WOJBJXKFSA-N 2 1 342.527 4.121 20 0 EIADMP CC(C)([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)[C@H]1CCCCO1 ZINC000865743942 1053583193 /nfs/dbraw/zinc/58/31/93/1053583193.db2.gz KERHMOIRVNPYTN-WOJBJXKFSA-N 2 1 342.527 4.121 20 0 EIADMP Clc1nc2ccccc2cc1C[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000852754085 1053611062 /nfs/dbraw/zinc/61/10/62/1053611062.db2.gz ONSJDEYCIBUDEF-KRWDZBQOSA-N 2 1 343.902 4.100 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)C1 ZINC000866259787 1053666732 /nfs/dbraw/zinc/66/67/32/1053666732.db2.gz GBNVVNLCWDFRAO-KGLIPLIRSA-N 2 1 335.879 4.252 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)C1 ZINC000866259787 1053666734 /nfs/dbraw/zinc/66/67/34/1053666734.db2.gz GBNVVNLCWDFRAO-KGLIPLIRSA-N 2 1 335.879 4.252 20 0 EIADMP C[C@@H](CCc1cncc2ccccc21)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000866273822 1053672999 /nfs/dbraw/zinc/67/29/99/1053672999.db2.gz CCAOKMFPQPJOBO-BRIRTLKKSA-N 2 1 337.511 4.161 20 0 EIADMP C[C@@H](CCc1cncc2ccccc21)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000866273822 1053673007 /nfs/dbraw/zinc/67/30/07/1053673007.db2.gz CCAOKMFPQPJOBO-BRIRTLKKSA-N 2 1 337.511 4.161 20 0 EIADMP C[N@H+]1CC[C@H]2CN(CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031949 1053828421 /nfs/dbraw/zinc/82/84/21/1053828421.db2.gz NFLNZDJNOSRVLI-YJBOKZPZSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@@H+]1CC[C@H]2C[NH+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031949 1053828424 /nfs/dbraw/zinc/82/84/24/1053828424.db2.gz NFLNZDJNOSRVLI-YJBOKZPZSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@H]2C[NH+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031949 1053828425 /nfs/dbraw/zinc/82/84/25/1053828425.db2.gz NFLNZDJNOSRVLI-YJBOKZPZSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2C[N@H+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031949 1053828427 /nfs/dbraw/zinc/82/84/27/1053828427.db2.gz NFLNZDJNOSRVLI-YJBOKZPZSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2C[N@@H+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031949 1053828431 /nfs/dbraw/zinc/82/84/31/1053828431.db2.gz NFLNZDJNOSRVLI-YJBOKZPZSA-N 2 1 341.326 4.342 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429515146 1053853797 /nfs/dbraw/zinc/85/37/97/1053853797.db2.gz AYHXBRLUSRFHAI-LAUBAEHRSA-N 2 1 326.459 4.041 20 0 EIADMP CCC1([NH+]2CCCCC2)CC[NH+](CCCN(C)c2ccccc2)CC1 ZINC001197360104 1053883461 /nfs/dbraw/zinc/88/34/61/1053883461.db2.gz UPDKWXCJOWWDEB-UHFFFAOYSA-N 2 1 343.559 4.243 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000429536766 1054097232 /nfs/dbraw/zinc/09/72/32/1054097232.db2.gz CJFCYFBVXDIHQI-NRFANRHFSA-N 2 1 338.495 4.182 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000429536766 1054097250 /nfs/dbraw/zinc/09/72/50/1054097250.db2.gz CJFCYFBVXDIHQI-NRFANRHFSA-N 2 1 338.495 4.182 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+]Cc1ccc(Br)cc1C ZINC001198890678 1054302046 /nfs/dbraw/zinc/30/20/46/1054302046.db2.gz HJKMKIODGTZNEJ-UHFFFAOYSA-N 2 1 341.337 4.359 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)CC1 ZINC000872025629 1054340091 /nfs/dbraw/zinc/34/00/91/1054340091.db2.gz QJJOWZGLWOEVQT-LEWJYISDSA-N 2 1 344.543 4.143 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)cc1F ZINC000872027066 1054343938 /nfs/dbraw/zinc/34/39/38/1054343938.db2.gz JOCNCEXFWSOZAN-LPHOPBHVSA-N 2 1 345.462 4.003 20 0 EIADMP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000872032510 1054351111 /nfs/dbraw/zinc/35/11/11/1054351111.db2.gz VICIDGYXKIORFS-ROUUACIJSA-N 2 1 342.449 4.262 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCOC3(CCCC3)C2)CC1 ZINC000872036358 1054353222 /nfs/dbraw/zinc/35/32/22/1054353222.db2.gz UJUJHQLUUILIJO-GHTZIAJQSA-N 2 1 342.527 4.293 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)CCO1 ZINC001199275046 1054372348 /nfs/dbraw/zinc/37/23/48/1054372348.db2.gz CGUXRPGAJZDKRD-BWAGFHJFSA-N 2 1 344.543 4.354 20 0 EIADMP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)CC1 ZINC001199265543 1054375630 /nfs/dbraw/zinc/37/56/30/1054375630.db2.gz BJYQTINGSNXSEQ-YUXAGFNASA-N 2 1 344.543 4.356 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)[C@H]1CCCOC1 ZINC000872068492 1054376623 /nfs/dbraw/zinc/37/66/23/1054376623.db2.gz GVBHATRFRANPIW-ACRUOGEOSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)[C@H]1CCCOC1 ZINC000872068492 1054376635 /nfs/dbraw/zinc/37/66/35/1054376635.db2.gz GVBHATRFRANPIW-ACRUOGEOSA-N 2 1 344.543 4.082 20 0 EIADMP COc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)c(C)c1 ZINC001199376636 1054400716 /nfs/dbraw/zinc/40/07/16/1054400716.db2.gz MZDYBGJLAIYNKA-UHFFFAOYSA-N 2 1 338.495 4.066 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc3ncccc23)c1 ZINC000873025930 1054480098 /nfs/dbraw/zinc/48/00/98/1054480098.db2.gz DZIJQUHMQLYINA-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[NH2+][C@H](C)CC[NH+](C)C ZINC001199907472 1054487718 /nfs/dbraw/zinc/48/77/18/1054487718.db2.gz XAYBTGNAWZFHPQ-QGZVFWFLSA-N 2 1 326.484 4.100 20 0 EIADMP c1ccc(CCCCCC[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000858460517 1054494661 /nfs/dbraw/zinc/49/46/61/1054494661.db2.gz BBEFUYRMXPJCJU-QFIPXVFZSA-N 2 1 344.543 4.023 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(SC(F)F)cc1 ZINC000858490898 1054498441 /nfs/dbraw/zinc/49/84/41/1054498441.db2.gz RUNKDZPYWUVZSI-ZIAGYGMSSA-N 2 1 328.472 4.384 20 0 EIADMP CSc1ccc(CN[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC001200880370 1054564883 /nfs/dbraw/zinc/56/48/83/1054564883.db2.gz SIMJNHSDFTZRMG-RDJZCZTQSA-N 2 1 330.497 4.144 20 0 EIADMP CCc1oc2ccccc2c1C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC001200923180 1054577512 /nfs/dbraw/zinc/57/75/12/1054577512.db2.gz RBVMRCLEXIETFQ-UHFFFAOYSA-N 2 1 326.484 4.492 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[NH+](CC3CCCCC3)C[C@H]21 ZINC001201397861 1054774056 /nfs/dbraw/zinc/77/40/56/1054774056.db2.gz VITGYLMICPSTTD-KSEOMHKRSA-N 2 1 341.543 4.194 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[NH+](CC3CCCCC3)C[C@H]21 ZINC001201397861 1054774072 /nfs/dbraw/zinc/77/40/72/1054774072.db2.gz VITGYLMICPSTTD-KSEOMHKRSA-N 2 1 341.543 4.194 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[N@H+](CC3CCCCC3)C[C@H]21 ZINC001201397861 1054774086 /nfs/dbraw/zinc/77/40/86/1054774086.db2.gz VITGYLMICPSTTD-KSEOMHKRSA-N 2 1 341.543 4.194 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[N@@H+](CC3CCCCC3)C[C@H]21 ZINC001201397861 1054774104 /nfs/dbraw/zinc/77/41/04/1054774104.db2.gz VITGYLMICPSTTD-KSEOMHKRSA-N 2 1 341.543 4.194 20 0 EIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000062427164 1054783769 /nfs/dbraw/zinc/78/37/69/1054783769.db2.gz ALEPHJFIQDYVEO-HNNXBMFYSA-N 2 1 348.437 4.261 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000062427164 1054783782 /nfs/dbraw/zinc/78/37/82/1054783782.db2.gz ALEPHJFIQDYVEO-HNNXBMFYSA-N 2 1 348.437 4.261 20 0 EIADMP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201549376 1054839079 /nfs/dbraw/zinc/83/90/79/1054839079.db2.gz AWHIVGAWEUMRSI-FMWKFLBASA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201549376 1054839082 /nfs/dbraw/zinc/83/90/82/1054839082.db2.gz AWHIVGAWEUMRSI-FMWKFLBASA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201549376 1054839086 /nfs/dbraw/zinc/83/90/86/1054839086.db2.gz AWHIVGAWEUMRSI-FMWKFLBASA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201549376 1054839088 /nfs/dbraw/zinc/83/90/88/1054839088.db2.gz AWHIVGAWEUMRSI-FMWKFLBASA-N 2 1 329.532 4.050 20 0 EIADMP CCCC[C@@H](CC)C[NH+]1CCC2(CC1)C[N@H+](Cc1ccoc1)CCO2 ZINC001201559087 1054848715 /nfs/dbraw/zinc/84/87/15/1054848715.db2.gz IRXGLNGLKWCNOH-LJQANCHMSA-N 2 1 348.531 4.163 20 0 EIADMP CCCC[C@@H](CC)C[NH+]1CCC2(CC1)C[N@@H+](Cc1ccoc1)CCO2 ZINC001201559087 1054848720 /nfs/dbraw/zinc/84/87/20/1054848720.db2.gz IRXGLNGLKWCNOH-LJQANCHMSA-N 2 1 348.531 4.163 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccccc2CC(F)(F)F)C1 ZINC001201566938 1054852123 /nfs/dbraw/zinc/85/21/23/1054852123.db2.gz QJBLCRULSRMEAL-MRXNPFEDSA-N 2 1 342.449 4.249 20 0 EIADMP COc1cccc(C[N@H+]2CCC3(C2)CC[NH+](CCC(C)C)CC3)c1 ZINC001201620541 1054866790 /nfs/dbraw/zinc/86/67/90/1054866790.db2.gz PWTTZAWVBPNJID-UHFFFAOYSA-N 2 1 330.516 4.029 20 0 EIADMP C[C@H]([NH2+]C/C=C\c1cccc(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001201705274 1054882815 /nfs/dbraw/zinc/88/28/15/1054882815.db2.gz XGJFNCNFSCXVHX-SHRNERHNSA-N 2 1 338.470 4.339 20 0 EIADMP CSCCC[NH+]1CCC2(CCC[N@@H+](Cc3ccc(C)cc3)C2)CC1 ZINC001201689065 1054888895 /nfs/dbraw/zinc/88/88/95/1054888895.db2.gz SZKHCEUHIVEKBQ-UHFFFAOYSA-N 2 1 346.584 4.426 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+]Cc1ccc(Oc2cc(F)cc(F)c2)cc1 ZINC000065981495 1054983737 /nfs/dbraw/zinc/98/37/37/1054983737.db2.gz GBYVBHHQBDWOLS-CQSZACIVSA-N 2 1 334.410 4.187 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc3c(ccnc3Cl)o2)C1 ZINC000876933410 1054985975 /nfs/dbraw/zinc/98/59/75/1054985975.db2.gz OKPYOSUFNPDUIJ-CQSZACIVSA-N 2 1 335.879 4.083 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)C(C)(C)c2ccccc2)cn1 ZINC000126310616 1055002960 /nfs/dbraw/zinc/00/29/60/1055002960.db2.gz UXMFXCCCAFIKGL-INIZCTEOSA-N 2 1 334.467 4.032 20 0 EIADMP COc1ccc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)c(Cl)c1 ZINC001202073976 1055036019 /nfs/dbraw/zinc/03/60/19/1055036019.db2.gz HAVKFLGBEURHJS-UHFFFAOYSA-N 2 1 338.923 4.483 20 0 EIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3ccsc3C(F)(F)F)C2)CC1 ZINC000862352288 1055051395 /nfs/dbraw/zinc/05/13/95/1055051395.db2.gz CKJDUPCZTZLRQY-UHFFFAOYSA-N 2 1 332.435 4.075 20 0 EIADMP FC(F)(F)CC[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001202356351 1055148469 /nfs/dbraw/zinc/14/84/69/1055148469.db2.gz VZXRABCOVUWNMB-UHFFFAOYSA-N 2 1 340.433 4.317 20 0 EIADMP c1ccc([C@H]2CCC[C@H](C[NH+]3CCC([NH+]4CCCCC4)CC3)O2)cc1 ZINC000877971079 1055164680 /nfs/dbraw/zinc/16/46/80/1055164680.db2.gz GQMIYOLYYKLZLX-FGZHOGPDSA-N 2 1 342.527 4.247 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccnc(Cl)c1 ZINC000126844838 1055176858 /nfs/dbraw/zinc/17/68/58/1055176858.db2.gz PPVULDUTGGKNCS-HUUCEWRRSA-N 2 1 349.931 4.359 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccnc(Cl)c1 ZINC000126844838 1055176866 /nfs/dbraw/zinc/17/68/66/1055176866.db2.gz PPVULDUTGGKNCS-HUUCEWRRSA-N 2 1 349.931 4.359 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2nc3ccccc3o2)CC1 ZINC000057843877 1056379482 /nfs/dbraw/zinc/37/94/82/1056379482.db2.gz FDPWHKSKVFIXRI-UHFFFAOYSA-N 2 1 349.478 4.172 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CC[C@@H]3COCC[C@@H]3C2)CC1 ZINC000921750454 1056415996 /nfs/dbraw/zinc/41/59/96/1056415996.db2.gz WPXSOKDLMYLNAG-JWUVWSEFSA-N 2 1 342.527 4.007 20 0 EIADMP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000180137941 1058372077 /nfs/dbraw/zinc/37/20/77/1058372077.db2.gz LZOGSTFYARKRAZ-BBWFWOEESA-N 2 1 340.515 4.047 20 0 EIADMP FC(F)(F)c1cccc(C2([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000182331422 1059811817 /nfs/dbraw/zinc/81/18/17/1059811817.db2.gz SCHWLBLEPDEOJM-DLBZAZTESA-N 2 1 338.417 4.301 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cnccc32)C1 ZINC000183201063 1059950053 /nfs/dbraw/zinc/95/00/53/1059950053.db2.gz TWOMJUITTMQFJZ-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+]Cc3ccc4cnccc4c3)C2)cc1 ZINC000388244821 1060277738 /nfs/dbraw/zinc/27/77/38/1060277738.db2.gz FRQWUVJKBABADU-OAQYLSRUSA-N 2 1 345.490 4.237 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2cnccc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000388982827 1060283210 /nfs/dbraw/zinc/28/32/10/1060283210.db2.gz RCJPPVGROIXVEJ-JPYJTQIMSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000766460875 1060366174 /nfs/dbraw/zinc/36/61/74/1060366174.db2.gz HVGUYIKLKULYRY-LMMKCTJWSA-N 2 1 334.573 4.407 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000766460875 1060366192 /nfs/dbraw/zinc/36/61/92/1060366192.db2.gz HVGUYIKLKULYRY-LMMKCTJWSA-N 2 1 334.573 4.407 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(F)F)cc2)[C@H](C)C1 ZINC000746469511 1060373574 /nfs/dbraw/zinc/37/35/74/1060373574.db2.gz COFBAFZSOXPIOW-CJNGLKHVSA-N 2 1 328.472 4.163 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(SC(F)F)cc2)[C@H](C)C1 ZINC000746469511 1060373586 /nfs/dbraw/zinc/37/35/86/1060373586.db2.gz COFBAFZSOXPIOW-CJNGLKHVSA-N 2 1 328.472 4.163 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(SC(F)F)cc2)[C@H](C)C1 ZINC000746469511 1060373617 /nfs/dbraw/zinc/37/36/17/1060373617.db2.gz COFBAFZSOXPIOW-CJNGLKHVSA-N 2 1 328.472 4.163 20 0 EIADMP CO[C@@H](C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1)c1ccc(Cl)cc1 ZINC001168836793 1060444356 /nfs/dbraw/zinc/44/43/56/1060444356.db2.gz FMIDTWOLVVQWHF-FQEVSTJZSA-N 2 1 346.902 4.221 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCC(c1ccccc1)c1ccccc1)C2 ZINC001169098612 1060637497 /nfs/dbraw/zinc/63/74/97/1060637497.db2.gz JSFIIWLFRAGESC-KOUNCHBCSA-N 2 1 334.507 4.423 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(SC(F)(F)F)cc1)C2 ZINC001169091391 1060643629 /nfs/dbraw/zinc/64/36/29/1060643629.db2.gz QBYJQMRCNWLOOS-ZSOGYDGISA-N 2 1 330.419 4.013 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(SC(F)(F)F)cc1)C2 ZINC001169091391 1060643637 /nfs/dbraw/zinc/64/36/37/1060643637.db2.gz QBYJQMRCNWLOOS-ZSOGYDGISA-N 2 1 330.419 4.013 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc3nc(-c4ccccc4)oc3c1)C2 ZINC001169118103 1060646469 /nfs/dbraw/zinc/64/64/69/1060646469.db2.gz DQJOGEGAMXSKRF-LDLYASANSA-N 2 1 347.462 4.210 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc3nc(-c4ccccc4)oc3c1)C2 ZINC001169118103 1060646474 /nfs/dbraw/zinc/64/64/74/1060646474.db2.gz DQJOGEGAMXSKRF-LDLYASANSA-N 2 1 347.462 4.210 20 0 EIADMP Cc1ccc(Cl)c(O[C@H]2CCC[NH+]([C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4C)C2)c1 ZINC001169142743 1060662873 /nfs/dbraw/zinc/66/28/73/1060662873.db2.gz VEGFRBAJIJUTDW-MLHJIOFPSA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@H]2CCC[NH+]([C@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4C)C2)c1 ZINC001169142743 1060662883 /nfs/dbraw/zinc/66/28/83/1060662883.db2.gz VEGFRBAJIJUTDW-MLHJIOFPSA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@H]2CCC[N@@H+]([C@H]3C[C@H]4CC[C@@H](C3)[NH+]4C)C2)c1 ZINC001169142743 1060662886 /nfs/dbraw/zinc/66/28/86/1060662886.db2.gz VEGFRBAJIJUTDW-MLHJIOFPSA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@H]2CCC[N@H+]([C@H]3C[C@H]4CC[C@@H](C3)[NH+]4C)C2)c1 ZINC001169142743 1060662893 /nfs/dbraw/zinc/66/28/93/1060662893.db2.gz VEGFRBAJIJUTDW-MLHJIOFPSA-N 2 1 348.918 4.117 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(c3ccc(F)cc3)CCC(F)(F)CC2)CC1 ZINC001169241104 1060718182 /nfs/dbraw/zinc/71/81/82/1060718182.db2.gz HBZOUFRMTUEYGK-UHFFFAOYSA-N 2 1 340.433 4.304 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ccc([C@@H]2CC[N@H+](C)C2)cc1 ZINC001169690531 1060902153 /nfs/dbraw/zinc/90/21/53/1060902153.db2.gz WSWYFEDAXUMUDI-NQIIRXRSSA-N 2 1 335.495 4.346 20 0 EIADMP Clc1ccc(C2([NH2+]CCC[NH+]3CCCCC3)CC2)cc1Cl ZINC001169704083 1060911055 /nfs/dbraw/zinc/91/10/55/1060911055.db2.gz HUFNLFNIYIDDSZ-UHFFFAOYSA-N 2 1 327.299 4.448 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(Br)s1 ZINC000038003494 202081210 /nfs/dbraw/zinc/08/12/10/202081210.db2.gz QZHJLTCTJVYFRI-LLVKDONJSA-N 2 1 345.350 4.424 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Br)s2)CC1 ZINC000038002097 202383512 /nfs/dbraw/zinc/38/35/12/202383512.db2.gz XVANHCZULPZVLG-NSHDSACASA-N 2 1 331.323 4.036 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1ccc(Br)cc1)Cc1ccccc1 ZINC000019913201 212083286 /nfs/dbraw/zinc/08/32/86/212083286.db2.gz UMRXAJCCJDQSEQ-UHFFFAOYSA-N 2 1 347.300 4.061 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)C1CCOCC1 ZINC000532192758 1032081489 /nfs/dbraw/zinc/08/14/89/1032081489.db2.gz KTJZSDOJBXNXNT-GCJKJVERSA-N 2 1 344.543 4.356 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2ccc(F)cc2)o1 ZINC000171764803 1032272519 /nfs/dbraw/zinc/27/25/19/1032272519.db2.gz BVCOCUUJILJGFU-CQSZACIVSA-N 2 1 327.403 4.017 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529575082 1032456130 /nfs/dbraw/zinc/45/61/30/1032456130.db2.gz PTTVBMCICXBFGK-AEFFLSMTSA-N 2 1 336.470 4.312 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCO3)cc1 ZINC000177791475 1032505786 /nfs/dbraw/zinc/50/57/86/1032505786.db2.gz MNRCULXXEGHYJM-LSDHHAIUSA-N 2 1 349.434 4.321 20 0 EIADMP COc1cc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)ccc1C ZINC000177986738 1032516021 /nfs/dbraw/zinc/51/60/21/1032516021.db2.gz OBXCPVJOQDSIDP-INIZCTEOSA-N 2 1 335.451 4.349 20 0 EIADMP CCc1cccc(Cl)c1C[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000475725677 1032516833 /nfs/dbraw/zinc/51/68/33/1032516833.db2.gz ODHDCQZBMYHSTH-UHFFFAOYSA-N 2 1 331.891 4.091 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(Sc3ccccc3)cc2)C1 ZINC000533149453 1032519356 /nfs/dbraw/zinc/51/93/56/1032519356.db2.gz UWSZSPRXBQSVSJ-SFHVURJKSA-N 2 1 326.509 4.269 20 0 EIADMP CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccccc1OC(F)F ZINC000178704025 1032544221 /nfs/dbraw/zinc/54/42/21/1032544221.db2.gz MMFIPKGASXCVPN-XJKSGUPXSA-N 2 1 337.414 4.170 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](CC(C)C)C2)cc1 ZINC000347353630 1032548028 /nfs/dbraw/zinc/54/80/28/1032548028.db2.gz ZKHRTCHYNOIGPT-NBHGPNQESA-N 2 1 341.499 4.425 20 0 EIADMP C[N@@H+](C[C@@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1 ZINC000450569483 1032561715 /nfs/dbraw/zinc/56/17/15/1032561715.db2.gz WUQOOUBBXLQHOJ-SFHVURJKSA-N 2 1 336.470 4.408 20 0 EIADMP C[N@H+](C[C@@H]1CCCCC1(F)F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000450569483 1032561722 /nfs/dbraw/zinc/56/17/22/1032561722.db2.gz WUQOOUBBXLQHOJ-SFHVURJKSA-N 2 1 336.470 4.408 20 0 EIADMP C[N@@H+](C[C@@H]1CCCCC1(F)F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000450569483 1032561725 /nfs/dbraw/zinc/56/17/25/1032561725.db2.gz WUQOOUBBXLQHOJ-SFHVURJKSA-N 2 1 336.470 4.408 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](CC)c2ccc(F)cc2)[C@@H](C)C1 ZINC000121298637 1032625135 /nfs/dbraw/zinc/62/51/35/1032625135.db2.gz ADSMFFUVCAJAEV-DBVUQKKJSA-N 2 1 336.495 4.003 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512421914 1032729628 /nfs/dbraw/zinc/72/96/28/1032729628.db2.gz NDYXPASSZAGEPV-SFHVURJKSA-N 2 1 338.495 4.184 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512421914 1032729647 /nfs/dbraw/zinc/72/96/47/1032729647.db2.gz NDYXPASSZAGEPV-SFHVURJKSA-N 2 1 338.495 4.184 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)cn1 ZINC000274794985 1019567241 /nfs/dbraw/zinc/56/72/41/1019567241.db2.gz SSUVZQWOUATOLP-XYJFISCASA-N 2 1 343.902 4.296 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)cn1 ZINC000274794985 1019567250 /nfs/dbraw/zinc/56/72/50/1019567250.db2.gz SSUVZQWOUATOLP-XYJFISCASA-N 2 1 343.902 4.296 20 0 EIADMP CC[C@H](N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1nc(C)cs1 ZINC000274895911 1019841105 /nfs/dbraw/zinc/84/11/05/1019841105.db2.gz KEXFROIPLNLWLA-WDSOQIARSA-N 2 1 343.540 4.403 20 0 EIADMP CS[C@H]1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000180141830 1020065633 /nfs/dbraw/zinc/06/56/33/1020065633.db2.gz RFUHKMZCLCDMOQ-QNXAMLQOSA-N 2 1 344.568 4.446 20 0 EIADMP COc1ccc([C@H]([NH2+]C[C@H](C)Cn2cc[nH+]c2C)c2ccccc2)cc1 ZINC000180442153 1020114994 /nfs/dbraw/zinc/11/49/94/1020114994.db2.gz PCHXJTOOBZSSSB-HTAPYJJXSA-N 2 1 349.478 4.215 20 0 EIADMP COc1ccc([C@@H]([NH2+]CCCCn2cc[nH+]c2C)c2ccccc2)cc1 ZINC000180626597 1020156866 /nfs/dbraw/zinc/15/68/66/1020156866.db2.gz PTXQMTOPBSOJBN-QFIPXVFZSA-N 2 1 349.478 4.360 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+]([C@H]3CCc4ccc(F)cc43)C2)CC1 ZINC001167256252 1020683608 /nfs/dbraw/zinc/68/36/08/1020683608.db2.gz UFIOHYIHHBURPV-UWJYYQICSA-N 2 1 330.491 4.257 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+]([C@H]3CCc4ccc(F)cc43)C2)CC1 ZINC001167256252 1020683613 /nfs/dbraw/zinc/68/36/13/1020683613.db2.gz UFIOHYIHHBURPV-UWJYYQICSA-N 2 1 330.491 4.257 20 0 EIADMP CC(C)(C)[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccccc1 ZINC000655688116 1020895186 /nfs/dbraw/zinc/89/51/86/1020895186.db2.gz LVFIJAYAPWEPIB-PMACEKPBSA-N 2 1 330.516 4.007 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc3[nH]ccc3c2)[C@@H]1c1cccs1 ZINC000655742634 1020930910 /nfs/dbraw/zinc/93/09/10/1020930910.db2.gz AWZXFZCVMNLMIU-YLJYHZDGSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc3[nH]ccc3c2)[C@@H]1c1cccs1 ZINC000655742634 1020930917 /nfs/dbraw/zinc/93/09/17/1020930917.db2.gz AWZXFZCVMNLMIU-YLJYHZDGSA-N 2 1 339.508 4.402 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C2CC2)[C@@H]2CCCCO2)cc1 ZINC000655789075 1020963325 /nfs/dbraw/zinc/96/33/25/1020963325.db2.gz VFPXBBGCDBOYDC-ONGXBYRLSA-N 2 1 339.483 4.179 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccncc1F ZINC000340469446 1021072869 /nfs/dbraw/zinc/07/28/69/1021072869.db2.gz JRMTVAAEYVEIHA-IRXDYDNUSA-N 2 1 341.474 4.303 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccncc1F ZINC000340469446 1021072874 /nfs/dbraw/zinc/07/28/74/1021072874.db2.gz JRMTVAAEYVEIHA-IRXDYDNUSA-N 2 1 341.474 4.303 20 0 EIADMP c1cc2ccc(C[N@@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)cc2[nH]1 ZINC001167326856 1021130063 /nfs/dbraw/zinc/13/00/63/1021130063.db2.gz UWVMUIZNRBZRSR-IBGZPJMESA-N 2 1 325.500 4.256 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1ccn(C)n1 ZINC000414068377 1021782785 /nfs/dbraw/zinc/78/27/85/1021782785.db2.gz JQQIOPUBBARSIS-QGZVFWFLSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)c1ccn(C)n1 ZINC000414068377 1021782798 /nfs/dbraw/zinc/78/27/98/1021782798.db2.gz JQQIOPUBBARSIS-QGZVFWFLSA-N 2 1 340.515 4.035 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1csc(-c2ccccc2)n1 ZINC000414086348 1021825903 /nfs/dbraw/zinc/82/59/03/1021825903.db2.gz ZKEJPMKDYRIZBE-AWEZNQCLSA-N 2 1 326.469 4.056 20 0 EIADMP C[C@@H]([NH2+]CC(C)(C)C(F)(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000549032162 1022160296 /nfs/dbraw/zinc/16/02/96/1022160296.db2.gz LNPKMDUPMZZCSE-ZBFHGGJFSA-N 2 1 328.422 4.075 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)s1 ZINC000245572056 1033035850 /nfs/dbraw/zinc/03/58/50/1033035850.db2.gz CCMFRKIOLJHHHY-OAGGEKHMSA-N 2 1 343.540 4.259 20 0 EIADMP CCCCCOc1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000580637148 1022332946 /nfs/dbraw/zinc/33/29/46/1022332946.db2.gz VTGTXIGXFLRKPC-YOFSQIOKSA-N 2 1 330.516 4.313 20 0 EIADMP CCCCCOc1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000580637148 1022332963 /nfs/dbraw/zinc/33/29/63/1022332963.db2.gz VTGTXIGXFLRKPC-YOFSQIOKSA-N 2 1 330.516 4.313 20 0 EIADMP CCCCCOc1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000580637148 1022332980 /nfs/dbraw/zinc/33/29/80/1022332980.db2.gz VTGTXIGXFLRKPC-YOFSQIOKSA-N 2 1 330.516 4.313 20 0 EIADMP C[NH+](C)CCC1CC[NH+](Cc2cc(C(F)(F)F)ccc2F)CC1 ZINC000511537366 1022362629 /nfs/dbraw/zinc/36/26/29/1022362629.db2.gz NSAVGTNIEFLGQY-UHFFFAOYSA-N 2 1 332.385 4.008 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000564435585 1022395281 /nfs/dbraw/zinc/39/52/81/1022395281.db2.gz JMNJOAOUXSCSLL-CABCVRRESA-N 2 1 328.422 4.130 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398165573 1022408423 /nfs/dbraw/zinc/40/84/23/1022408423.db2.gz GSYBSAHFRJSWIH-JBYIUTFZSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398165573 1022408442 /nfs/dbraw/zinc/40/84/42/1022408442.db2.gz GSYBSAHFRJSWIH-JBYIUTFZSA-N 2 1 340.486 4.257 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3)C2(C)C)cn1 ZINC000181012233 1022574674 /nfs/dbraw/zinc/57/46/74/1022574674.db2.gz ONYHJGJCUAZPLE-UXHICEINSA-N 2 1 346.478 4.248 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CC2 ZINC000134313661 1022650940 /nfs/dbraw/zinc/65/09/40/1022650940.db2.gz YWBCFUISXMKDCD-BDJLRTHQSA-N 2 1 325.283 4.055 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CC2 ZINC000134313661 1022650944 /nfs/dbraw/zinc/65/09/44/1022650944.db2.gz YWBCFUISXMKDCD-BDJLRTHQSA-N 2 1 325.283 4.055 20 0 EIADMP Cc1csc([C@@H](C)C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)n1 ZINC000186568721 1022675291 /nfs/dbraw/zinc/67/52/91/1022675291.db2.gz LQVTZTOONZTEKR-DZGCQCFKSA-N 2 1 340.496 4.400 20 0 EIADMP C[NH+]1CCC([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000182234530 1022789775 /nfs/dbraw/zinc/78/97/75/1022789775.db2.gz VZZXXYXGZMYMLJ-INIZCTEOSA-N 2 1 326.456 4.063 20 0 EIADMP c1sc(-c2ccccc2)nc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543412 1022794562 /nfs/dbraw/zinc/79/45/62/1022794562.db2.gz MXXAHMSQWSYYQT-ZWKOTPCHSA-N 2 1 341.524 4.022 20 0 EIADMP CC[C@@H](OCC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001167443278 1022806403 /nfs/dbraw/zinc/80/64/03/1022806403.db2.gz RDSJKIJLSZJUQM-NHCUHLMSSA-N 2 1 330.516 4.105 20 0 EIADMP CC[C@@H](OCC[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001167443278 1022806406 /nfs/dbraw/zinc/80/64/06/1022806406.db2.gz RDSJKIJLSZJUQM-NHCUHLMSSA-N 2 1 330.516 4.105 20 0 EIADMP Brc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CC2)cc1 ZINC000378431632 1022816684 /nfs/dbraw/zinc/81/66/84/1022816684.db2.gz ODKQNFPVEZOZLG-KZNAEPCWSA-N 2 1 349.316 4.117 20 0 EIADMP C[N@H+](Cc1ccc(Cl)cc1C(F)(F)F)CC1CC[NH+](C)CC1 ZINC001143505847 1022979936 /nfs/dbraw/zinc/97/99/36/1022979936.db2.gz POTJRLGFHRRHIW-UHFFFAOYSA-N 2 1 334.813 4.132 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H]4CCC[C@@H]43)cc2)cs1 ZINC000581326326 1023023523 /nfs/dbraw/zinc/02/35/23/1023023523.db2.gz TWKUHOPVVGUNGE-QWFCFKBJSA-N 2 1 341.524 4.081 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000584581444 1023036327 /nfs/dbraw/zinc/03/63/27/1023036327.db2.gz VNRAMWUDGAKDEF-QNWVGRARSA-N 2 1 349.522 4.081 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCN(c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000584581444 1023036340 /nfs/dbraw/zinc/03/63/40/1023036340.db2.gz VNRAMWUDGAKDEF-QNWVGRARSA-N 2 1 349.522 4.081 20 0 EIADMP CCn1cc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)cn1 ZINC000156181227 1023087005 /nfs/dbraw/zinc/08/70/05/1023087005.db2.gz HVBCAFDYUAKRLT-ZWKOTPCHSA-N 2 1 340.515 4.128 20 0 EIADMP Cc1ccccc1SC[C@H](C)C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC001167457588 1023099680 /nfs/dbraw/zinc/09/96/80/1023099680.db2.gz FXWIEXUNKHSYHR-MJGOQNOKSA-N 2 1 332.557 4.141 20 0 EIADMP CC[C@@H](CC(F)F)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000660167146 1023190343 /nfs/dbraw/zinc/19/03/43/1023190343.db2.gz ZMKBGHLEUACPRT-INIZCTEOSA-N 2 1 339.474 4.301 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417347038 1023274483 /nfs/dbraw/zinc/27/44/83/1023274483.db2.gz VOFFRVCFZYDUPB-AFQPOQBFSA-N 2 1 332.557 4.483 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2COCc4ccccc42)C3)cc1 ZINC000417364531 1023290741 /nfs/dbraw/zinc/29/07/41/1023290741.db2.gz MXFOBAADCNYXOC-ADYITMSISA-N 2 1 348.490 4.043 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2COCc4ccccc42)C3)cc1 ZINC000417364531 1023290752 /nfs/dbraw/zinc/29/07/52/1023290752.db2.gz MXFOBAADCNYXOC-ADYITMSISA-N 2 1 348.490 4.043 20 0 EIADMP C[C@H]([NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310067395 1023346233 /nfs/dbraw/zinc/34/62/33/1023346233.db2.gz BYZLFJGPBUEYET-LAUBAEHRSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310067395 1023346238 /nfs/dbraw/zinc/34/62/38/1023346238.db2.gz BYZLFJGPBUEYET-LAUBAEHRSA-N 2 1 326.459 4.389 20 0 EIADMP CC[NH+](CC)CCC[N@@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000549140715 1023370659 /nfs/dbraw/zinc/37/06/59/1023370659.db2.gz INIDHGFUUCSLLB-MRXNPFEDSA-N 2 1 331.529 4.208 20 0 EIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000549140715 1023370671 /nfs/dbraw/zinc/37/06/71/1023370671.db2.gz INIDHGFUUCSLLB-MRXNPFEDSA-N 2 1 331.529 4.208 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]C2C[C@H]3CC[C@@H](C2)S3)C[N@H+]1Cc1ccccc1 ZINC000925617564 1023411095 /nfs/dbraw/zinc/41/10/95/1023411095.db2.gz XGNRCHOAPCEBGI-AHSZXGJYSA-N 2 1 344.568 4.303 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]C[C@@H]3C[C@H]3c3ccccc3)C2)c1 ZINC000417883339 1023444146 /nfs/dbraw/zinc/44/41/46/1023444146.db2.gz SMMJDHSDZHQSOO-LMNJBCLMSA-N 2 1 340.536 4.353 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]C[C@@H]3C[C@H]3c3ccccc3)C2)c1 ZINC000417883339 1023444155 /nfs/dbraw/zinc/44/41/55/1023444155.db2.gz SMMJDHSDZHQSOO-LMNJBCLMSA-N 2 1 340.536 4.353 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000415121016 1023452038 /nfs/dbraw/zinc/45/20/38/1023452038.db2.gz YSKPEYXAAKBRNR-WIBUTAKZSA-N 2 1 330.422 4.151 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500077005 1023483663 /nfs/dbraw/zinc/48/36/63/1023483663.db2.gz VVPQDPXBAIKMFR-HZPDHXFCSA-N 2 1 342.449 4.473 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Br)c(C)c2)C[C@H]1C ZINC000500088698 1023495156 /nfs/dbraw/zinc/49/51/56/1023495156.db2.gz FQDAPNMFPWXYDZ-GDBMZVCRSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Br)c(C)c2)C[C@H]1C ZINC000500088698 1023495165 /nfs/dbraw/zinc/49/51/65/1023495165.db2.gz FQDAPNMFPWXYDZ-GDBMZVCRSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Br)c(C)c2)C[C@H]1C ZINC000500088698 1023495170 /nfs/dbraw/zinc/49/51/70/1023495170.db2.gz FQDAPNMFPWXYDZ-GDBMZVCRSA-N 2 1 339.321 4.062 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000364312267 1023604221 /nfs/dbraw/zinc/60/42/21/1023604221.db2.gz BTBQEGLLVHVWBE-ZVZYQTTQSA-N 2 1 330.497 4.100 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCCNc1cc[nH+]c(C2(C(F)(F)F)CC2)c1 ZINC001167752642 1023626671 /nfs/dbraw/zinc/62/66/71/1023626671.db2.gz HIUUDCDDFJRFMP-CQSZACIVSA-N 2 1 341.421 4.352 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCNc1cc[nH+]c(C2(C(F)(F)F)CC2)c1 ZINC001167752642 1023626678 /nfs/dbraw/zinc/62/66/78/1023626678.db2.gz HIUUDCDDFJRFMP-CQSZACIVSA-N 2 1 341.421 4.352 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000377629040 1023644101 /nfs/dbraw/zinc/64/41/01/1023644101.db2.gz PBABHVVHQHQAEG-RDGKXADDSA-N 2 1 326.406 4.323 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000377629040 1023644104 /nfs/dbraw/zinc/64/41/04/1023644104.db2.gz PBABHVVHQHQAEG-RDGKXADDSA-N 2 1 326.406 4.323 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000377629040 1023644128 /nfs/dbraw/zinc/64/41/28/1023644128.db2.gz PBABHVVHQHQAEG-RDGKXADDSA-N 2 1 326.406 4.323 20 0 EIADMP Cc1ccncc1CCC[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000377654960 1023660433 /nfs/dbraw/zinc/66/04/33/1023660433.db2.gz PHRSIGWMYFGXCP-IBGZPJMESA-N 2 1 337.511 4.138 20 0 EIADMP Cc1c([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cnn1C(C)C ZINC000364467977 1023804352 /nfs/dbraw/zinc/80/43/52/1023804352.db2.gz WSROPOXYKFETSX-SCWSEQNSSA-N 2 1 340.515 4.116 20 0 EIADMP C[N@@H+]1CCCC12CC[NH+](CCCOc1ccc3ccccc3c1)CC2 ZINC000544131818 1023860318 /nfs/dbraw/zinc/86/03/18/1023860318.db2.gz CYXQVMLULHOHBY-UHFFFAOYSA-N 2 1 338.495 4.169 20 0 EIADMP C[N@H+]1CCCC12CC[NH+](CCCOc1ccc3ccccc3c1)CC2 ZINC000544131818 1023860321 /nfs/dbraw/zinc/86/03/21/1023860321.db2.gz CYXQVMLULHOHBY-UHFFFAOYSA-N 2 1 338.495 4.169 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+]CC[C@@H]3CCC[N@H+]3C)cc2)cs1 ZINC000341588623 1023895622 /nfs/dbraw/zinc/89/56/22/1023895622.db2.gz BXJBIMBPUBSSLY-KSSFIOAISA-N 2 1 329.513 4.253 20 0 EIADMP COc1c(C)cc([C@@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1Cl ZINC000796684179 1024007531 /nfs/dbraw/zinc/00/75/31/1024007531.db2.gz PVGJTQZBALUYER-OAHLLOKOSA-N 2 1 338.923 4.428 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2nn(CC)c3ccccc23)CC1 ZINC000473140033 1024398876 /nfs/dbraw/zinc/39/88/76/1024398876.db2.gz QXBJKFBCZPMPJD-UHFFFAOYSA-N 2 1 342.531 4.000 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000341758503 1024617571 /nfs/dbraw/zinc/61/75/71/1024617571.db2.gz QEXCFMSMXUKCOV-GOSISDBHSA-N 2 1 336.907 4.264 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000341758504 1024617609 /nfs/dbraw/zinc/61/76/09/1024617609.db2.gz QEXCFMSMXUKCOV-SFHVURJKSA-N 2 1 336.907 4.264 20 0 EIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652347859 1024687165 /nfs/dbraw/zinc/68/71/65/1024687165.db2.gz NGVKBXAPAJGLOC-JCHJZTRSSA-N 2 1 336.907 4.009 20 0 EIADMP C[C@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000511909683 1024746998 /nfs/dbraw/zinc/74/69/98/1024746998.db2.gz FRJMJEVRSDFNCZ-XQONNYOLSA-N 2 1 334.454 4.221 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)[C@H](C)c1nc2ccccc2s1 ZINC000164647427 1024762400 /nfs/dbraw/zinc/76/24/00/1024762400.db2.gz SWNPEPBWACMYPL-LSDHHAIUSA-N 2 1 342.512 4.363 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1 ZINC000164668034 1024774827 /nfs/dbraw/zinc/77/48/27/1024774827.db2.gz WOUNACCQCQWRGC-CYBMUJFWSA-N 2 1 325.378 4.341 20 0 EIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccccc1OC(F)F ZINC000164674458 1024784688 /nfs/dbraw/zinc/78/46/88/1024784688.db2.gz ROJPLXZPNQHWHX-INIZCTEOSA-N 2 1 337.414 4.314 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000548483352 1024830381 /nfs/dbraw/zinc/83/03/81/1024830381.db2.gz NPJZKVMHVJGIBO-HQRMLTQVSA-N 2 1 342.552 4.488 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510969979 1024871378 /nfs/dbraw/zinc/87/13/78/1024871378.db2.gz SRHPQNOYKMWVIL-PCCBWWKXSA-N 2 1 344.543 4.082 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510969979 1024871380 /nfs/dbraw/zinc/87/13/80/1024871380.db2.gz SRHPQNOYKMWVIL-PCCBWWKXSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cccc2c1CC[NH2+]C2 ZINC000662258839 1025011124 /nfs/dbraw/zinc/01/11/24/1025011124.db2.gz LYZCMDMAHPJDCM-AWEZNQCLSA-N 2 1 337.492 4.135 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cccc2c1CC[NH2+]C2 ZINC000662258839 1025011137 /nfs/dbraw/zinc/01/11/37/1025011137.db2.gz LYZCMDMAHPJDCM-AWEZNQCLSA-N 2 1 337.492 4.135 20 0 EIADMP Cc1oc(-c2ccsc2)nc1C[N@@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000662314011 1025070022 /nfs/dbraw/zinc/07/00/22/1025070022.db2.gz BCEWAZHWOFEULJ-CXAGYDPISA-N 2 1 333.501 4.051 20 0 EIADMP Clc1ccc2cccnc2c1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663346933 1025142369 /nfs/dbraw/zinc/14/23/69/1025142369.db2.gz XZJWZTBLHRHDSB-MRXNPFEDSA-N 2 1 343.902 4.100 20 0 EIADMP Clc1ccc2cccnc2c1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663346933 1025142383 /nfs/dbraw/zinc/14/23/83/1025142383.db2.gz XZJWZTBLHRHDSB-MRXNPFEDSA-N 2 1 343.902 4.100 20 0 EIADMP Nc1cccc2c1cc[nH+]c2NCc1cccc(C[NH+]2CCCC2)c1 ZINC000663383877 1025236976 /nfs/dbraw/zinc/23/69/76/1025236976.db2.gz MOLACUYYQJAYKZ-UHFFFAOYSA-N 2 1 332.451 4.025 20 0 EIADMP COCC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000510993679 1025271178 /nfs/dbraw/zinc/27/11/78/1025271178.db2.gz GEZQVOSMCFXMIE-MXEMCNAFSA-N 2 1 344.543 4.223 20 0 EIADMP COCC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000510994270 1025331541 /nfs/dbraw/zinc/33/15/41/1025331541.db2.gz GEZQVOSMCFXMIE-PLACYPQZSA-N 2 1 344.543 4.223 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(C(C)C)nc1CC ZINC000549612196 1025336890 /nfs/dbraw/zinc/33/68/90/1025336890.db2.gz NRIQYADESSRKRG-UHFFFAOYSA-N 2 1 342.531 4.439 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(C(C)C)nc1CC ZINC000549612196 1025336910 /nfs/dbraw/zinc/33/69/10/1025336910.db2.gz NRIQYADESSRKRG-UHFFFAOYSA-N 2 1 342.531 4.439 20 0 EIADMP CSc1ccccc1C[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467335 1025397136 /nfs/dbraw/zinc/39/71/36/1025397136.db2.gz DWCAFYHQDXYNPX-WMZOPIPTSA-N 2 1 332.557 4.051 20 0 EIADMP C[C@H]1C[C@H](NC[C@H]2CCC[N@@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469480 1025415158 /nfs/dbraw/zinc/41/51/58/1025415158.db2.gz PRZWXLCTGPLFCM-LXZKKBNFSA-N 2 1 336.570 4.385 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469480 1025415171 /nfs/dbraw/zinc/41/51/71/1025415171.db2.gz PRZWXLCTGPLFCM-LXZKKBNFSA-N 2 1 336.570 4.385 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469480 1025415187 /nfs/dbraw/zinc/41/51/87/1025415187.db2.gz PRZWXLCTGPLFCM-LXZKKBNFSA-N 2 1 336.570 4.385 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(OCCC(C)C)cc1 ZINC000511002467 1025416163 /nfs/dbraw/zinc/41/61/63/1025416163.db2.gz SPUZWEYSXJBWBO-QGZVFWFLSA-N 2 1 329.488 4.357 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H](Oc2ccccc2OC)C1 ZINC001167827181 1025632552 /nfs/dbraw/zinc/63/25/52/1025632552.db2.gz UMYFNHCHSMEUCU-MOPGFXCFSA-N 2 1 348.531 4.049 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H](Oc2ccccc2OC)C1 ZINC001167827183 1025635970 /nfs/dbraw/zinc/63/59/70/1025635970.db2.gz UMYFNHCHSMEUCU-OALUTQOASA-N 2 1 348.531 4.049 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(Cl)cc1F ZINC000925784319 1025640551 /nfs/dbraw/zinc/64/05/51/1025640551.db2.gz QSZBZIXOVDPAKX-XHDPSFHLSA-N 2 1 334.813 4.011 20 0 EIADMP C[C@@H]([NH3+])C[NH2+][C@@H](C)c1ccc(-c2ccccc2Br)s1 ZINC000643527111 1025692975 /nfs/dbraw/zinc/69/29/75/1025692975.db2.gz DDOAXZNROGSVQG-MNOVXSKESA-N 2 1 339.302 4.175 20 0 EIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCc3[nH+]ccn3C1)CCCS2 ZINC000278933294 1025721734 /nfs/dbraw/zinc/72/17/34/1025721734.db2.gz JKFFDRZDYKGTDT-BBRMVZONSA-N 2 1 347.915 4.316 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](Cc1ccccc1F)c1ccccc1 ZINC000511035455 1025763704 /nfs/dbraw/zinc/76/37/04/1025763704.db2.gz DSFQRFWIFBUIGX-NRFANRHFSA-N 2 1 337.442 4.294 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C/C=C\c2ccc(F)c(F)c2)c1 ZINC000512036364 1025816853 /nfs/dbraw/zinc/81/68/53/1025816853.db2.gz HQAXKJMEXSTOSF-YVMONPNESA-N 2 1 330.422 4.220 20 0 EIADMP CCC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc(-n2ccnc2)cc1 ZINC000585749509 1025817799 /nfs/dbraw/zinc/81/77/99/1025817799.db2.gz MKYLDSUBUWFXQA-UHFFFAOYSA-N 2 1 335.451 4.293 20 0 EIADMP Cc1noc(C)c1[C@@H](C)[NH2+]Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000663597969 1025831343 /nfs/dbraw/zinc/83/13/43/1025831343.db2.gz LGSJUVWWMDNAGH-OAHLLOKOSA-N 2 1 327.472 4.128 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCOC[C@@H]1c1ccc(Cl)cc1 ZINC001167839899 1025854874 /nfs/dbraw/zinc/85/48/74/1025854874.db2.gz COSOXEBHSLPHAN-VQIMIIECSA-N 2 1 338.923 4.224 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCOC[C@@H]1c1ccc(Cl)cc1 ZINC001167839899 1025854875 /nfs/dbraw/zinc/85/48/75/1025854875.db2.gz COSOXEBHSLPHAN-VQIMIIECSA-N 2 1 338.923 4.224 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)C(c1ccccc1)c1ccccc1 ZINC000278955970 1025865490 /nfs/dbraw/zinc/86/54/90/1025865490.db2.gz LVLYXNODVCPAEX-RTBURBONSA-N 2 1 345.490 4.256 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)cc1 ZINC000511052778 1025885297 /nfs/dbraw/zinc/88/52/97/1025885297.db2.gz ZHMBATLGOFEXQA-OXQOHEQNSA-N 2 1 347.462 4.225 20 0 EIADMP CCOC(=O)C[N@@H+]([C@H](C)CCC[NH+](CC)CC)[C@H](C)c1ccccc1 ZINC001167842439 1025913284 /nfs/dbraw/zinc/91/32/84/1025913284.db2.gz XIICLOQCDBFPRP-RTBURBONSA-N 2 1 348.531 4.123 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000344066920 1025942731 /nfs/dbraw/zinc/94/27/31/1025942731.db2.gz IEHJSMWMVCPHHI-UHFFFAOYSA-N 2 1 344.418 4.126 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(Cl)cc1Cl ZINC000344089056 1025990791 /nfs/dbraw/zinc/99/07/91/1025990791.db2.gz LKGRBGSUKLPBPM-LRDDRELGSA-N 2 1 338.282 4.493 20 0 EIADMP CC(C)Sc1ccc([C@H](C)[NH2+]C[C@@H]2CCc3[nH+]ccn3C2)cc1 ZINC000279035239 1025992078 /nfs/dbraw/zinc/99/20/78/1025992078.db2.gz WRFGCTUBCYUBOV-HOTGVXAUSA-N 2 1 329.513 4.297 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(C)c(Br)s2)C1 ZINC000512130021 1026077556 /nfs/dbraw/zinc/07/75/56/1026077556.db2.gz MNMSTUIGANKHDT-OLZOCXBDSA-N 2 1 345.350 4.202 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CCCc4ccc(F)cc43)CC2)[nH+]1 ZINC000344156542 1026082553 /nfs/dbraw/zinc/08/25/53/1026082553.db2.gz AGIZJDVMQXBNEP-HXUWFJFHSA-N 2 1 339.458 4.165 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1cc(F)cc(Br)c1 ZINC000344175750 1026092286 /nfs/dbraw/zinc/09/22/86/1026092286.db2.gz SSSQEXPQHGNLOW-LYRGGWFBSA-N 2 1 343.284 4.112 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cc(F)cc(Br)c1 ZINC000344175750 1026092294 /nfs/dbraw/zinc/09/22/94/1026092294.db2.gz SSSQEXPQHGNLOW-LYRGGWFBSA-N 2 1 343.284 4.112 20 0 EIADMP CC[C@@](C)(NCc1cc(-n2ccnc2)cs1)c1nc(C)cs1 ZINC000344239202 1026171207 /nfs/dbraw/zinc/17/12/07/1026171207.db2.gz YCRHJPZYFRKNRA-MRXNPFEDSA-N 2 1 332.498 4.114 20 0 EIADMP Clc1cncc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)c1 ZINC001167975031 1026220158 /nfs/dbraw/zinc/22/01/58/1026220158.db2.gz FWGSBQPCHJIAKS-NXEWRWPSSA-N 2 1 345.918 4.181 20 0 EIADMP CC[C@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)c1cccs1 ZINC000162746835 1026303583 /nfs/dbraw/zinc/30/35/83/1026303583.db2.gz LHPYFNDBLMFYKD-KRWDZBQOSA-N 2 1 347.528 4.306 20 0 EIADMP CCC(CC)[N@H+](C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001167975897 1026306917 /nfs/dbraw/zinc/30/69/17/1026306917.db2.gz ZNXJGVUQGLKOAY-LTKMZVMPSA-N 3 1 347.591 4.152 20 0 EIADMP CCC(CC)[NH+](C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001167975897 1026306932 /nfs/dbraw/zinc/30/69/32/1026306932.db2.gz ZNXJGVUQGLKOAY-LTKMZVMPSA-N 3 1 347.591 4.152 20 0 EIADMP CCC(CC)[NH+](C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001167975897 1026306943 /nfs/dbraw/zinc/30/69/43/1026306943.db2.gz ZNXJGVUQGLKOAY-LTKMZVMPSA-N 3 1 347.591 4.152 20 0 EIADMP CCC(CC)[N@@H+](C1C[C@H]2CC[C@@H](C1)N2CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001167975897 1026306957 /nfs/dbraw/zinc/30/69/57/1026306957.db2.gz ZNXJGVUQGLKOAY-LTKMZVMPSA-N 2 1 347.591 4.152 20 0 EIADMP CCC(CC)[N@H+](C1C[C@H]2CC[C@@H](C1)N2CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001167975897 1026306971 /nfs/dbraw/zinc/30/69/71/1026306971.db2.gz ZNXJGVUQGLKOAY-LTKMZVMPSA-N 2 1 347.591 4.152 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cc(Cl)cc4cccnc43)C2)CC1 ZINC000550200411 1026334594 /nfs/dbraw/zinc/33/45/94/1026334594.db2.gz IVKZSZDJVLZVCD-KRWDZBQOSA-N 2 1 343.902 4.052 20 0 EIADMP Fc1c(Cl)cccc1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167978529 1026346287 /nfs/dbraw/zinc/34/62/87/1026346287.db2.gz OKXAADOLDMUNIS-ALOPSCKCSA-N 2 1 336.882 4.017 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)CCC2 ZINC001167981741 1026367925 /nfs/dbraw/zinc/36/79/25/1026367925.db2.gz HUEPIUPQOCHDQY-SOUXKNCUSA-N 2 1 340.511 4.068 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3cc(F)c(F)c(F)c3)CC2)[nH+]c1 ZINC000163487771 1026381255 /nfs/dbraw/zinc/38/12/55/1026381255.db2.gz FZNLFQPRPYITOM-ZDUSSCGKSA-N 2 1 349.400 4.127 20 0 EIADMP Cc1ccc(COc2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000608061368 1026407470 /nfs/dbraw/zinc/40/74/70/1026407470.db2.gz RGXOILJNFWAARJ-GHTZIAJQSA-N 2 1 338.495 4.146 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc3ncccc3c2)C1 ZINC000512196603 1026408036 /nfs/dbraw/zinc/40/80/36/1026408036.db2.gz OROIQBPFEBFNTK-ICSRJNTNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc3ncccc3c2)C1 ZINC000512196603 1026408040 /nfs/dbraw/zinc/40/80/40/1026408040.db2.gz OROIQBPFEBFNTK-ICSRJNTNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc3ncccc3c2)C1 ZINC000512196603 1026408044 /nfs/dbraw/zinc/40/80/44/1026408044.db2.gz OROIQBPFEBFNTK-ICSRJNTNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc3ncccc3c2)C1 ZINC000512196603 1026408053 /nfs/dbraw/zinc/40/80/53/1026408053.db2.gz OROIQBPFEBFNTK-ICSRJNTNSA-N 2 1 337.511 4.321 20 0 EIADMP CC[NH+](CC)CCC[NH2+]C1(c2cccc(Br)c2)CCC1 ZINC001167876325 1026492557 /nfs/dbraw/zinc/49/25/57/1026492557.db2.gz PCMIZYSTBBZNOK-UHFFFAOYSA-N 2 1 339.321 4.150 20 0 EIADMP c1cc(C[N@H+]2CC[C@@H](c3ccncc3)C2)cc(C[NH+]2CCCCC2)c1 ZINC000563363148 1026674324 /nfs/dbraw/zinc/67/43/24/1026674324.db2.gz HNTQOUVNFTVUPY-JOCHJYFZSA-N 2 1 335.495 4.057 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000507447448 1026796743 /nfs/dbraw/zinc/79/67/43/1026796743.db2.gz HUIWZBCSJJATQT-WFXMLNOXSA-N 2 1 337.511 4.205 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000507447448 1026796752 /nfs/dbraw/zinc/79/67/52/1026796752.db2.gz HUIWZBCSJJATQT-WFXMLNOXSA-N 2 1 337.511 4.205 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000507506131 1026819940 /nfs/dbraw/zinc/81/99/40/1026819940.db2.gz FGDOEMJZILTWKW-LVCYWYKZSA-N 2 1 337.511 4.348 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000507520671 1026827117 /nfs/dbraw/zinc/82/71/17/1026827117.db2.gz SFKXZDIRAAPHOB-KRWDZBQOSA-N 2 1 325.500 4.335 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]CCCC[N@H+](C)C2CC2)cc1 ZINC000657489347 1026849787 /nfs/dbraw/zinc/84/97/87/1026849787.db2.gz ZVBODFMQMJKWTP-UHFFFAOYSA-N 2 1 329.513 4.083 20 0 EIADMP Cc1cc(C)cc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000152812554 1026853393 /nfs/dbraw/zinc/85/33/93/1026853393.db2.gz TVUJWFJARVIHIZ-LJQANCHMSA-N 2 1 337.511 4.056 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCCc4cccnc43)cc2)C1 ZINC000684954079 1026888709 /nfs/dbraw/zinc/88/87/09/1026888709.db2.gz PJDFCSLTKCFGES-XMSQKQJNSA-N 2 1 349.522 4.481 20 0 EIADMP C[C@@H]([NH2+]CC1([NH3+])C2CC3CC(C2)CC1C3)c1cnc2ccsc2c1 ZINC000519641811 1026937467 /nfs/dbraw/zinc/93/74/67/1026937467.db2.gz VMNXBIOMQCDYSL-FGSOGITGSA-N 2 1 341.524 4.101 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2ccccc2Cl)o1 ZINC000075819421 1027067481 /nfs/dbraw/zinc/06/74/81/1027067481.db2.gz HLRVLKITRHLJSK-UHFFFAOYSA-N 2 1 329.831 4.285 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)C1CCOCC1 ZINC000474483448 1027120982 /nfs/dbraw/zinc/12/09/82/1027120982.db2.gz AAALBMQDAJBZBG-OTWHNJEPSA-N 2 1 344.543 4.069 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)C1CCOCC1 ZINC000474484329 1027121106 /nfs/dbraw/zinc/12/11/06/1027121106.db2.gz HXOKRCNVJMDSJM-CEXWTWQISA-N 2 1 344.543 4.069 20 0 EIADMP c1sc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1-c1ccccc1 ZINC000536659132 1027170871 /nfs/dbraw/zinc/17/08/71/1027170871.db2.gz HCTLIQGBWYADJA-KRWDZBQOSA-N 2 1 326.509 4.333 20 0 EIADMP c1sc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1-c1ccccc1 ZINC000536659132 1027170884 /nfs/dbraw/zinc/17/08/84/1027170884.db2.gz HCTLIQGBWYADJA-KRWDZBQOSA-N 2 1 326.509 4.333 20 0 EIADMP c1ccc2c(c1)cccc2CSCC[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000166278200 1027251193 /nfs/dbraw/zinc/25/11/93/1027251193.db2.gz PSHBKXVINBBEIP-VQTJNVASSA-N 2 1 340.536 4.289 20 0 EIADMP c1cc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc(OC2CCCC2)c1 ZINC000520217254 1027327593 /nfs/dbraw/zinc/32/75/93/1027327593.db2.gz NZEGTVNZSNMOJL-UHFFFAOYSA-N 2 1 328.500 4.115 20 0 EIADMP COC1CC[NH+](C2(C[NH2+]CC[C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000582825343 1027426664 /nfs/dbraw/zinc/42/66/64/1027426664.db2.gz UUKNYWWWDGENQR-LJQANCHMSA-N 2 1 344.543 4.193 20 0 EIADMP CC1(C)CC([NH3+])CC(C)(C)N1c1cc[nH+]c(C2(C(F)(F)F)CC2)c1 ZINC001167624863 1027462773 /nfs/dbraw/zinc/46/27/73/1027462773.db2.gz HRMJYPIHBFPBAF-UHFFFAOYSA-N 2 1 341.421 4.160 20 0 EIADMP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]C1CC[NH+](CCc2ccncc2)CC1 ZINC000153468879 1027479619 /nfs/dbraw/zinc/47/96/19/1027479619.db2.gz PQMQJKDGTHNLGA-XMSQKQJNSA-N 2 1 349.522 4.235 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CCC2 ZINC000475513609 1027521410 /nfs/dbraw/zinc/52/14/10/1027521410.db2.gz SWPOJLNNGOQCJC-QFIPXVFZSA-N 2 1 338.470 4.457 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)C1CCSCC1 ZINC000474803258 1027522058 /nfs/dbraw/zinc/52/20/58/1027522058.db2.gz ZGLUKMGNTQCIDV-HLIPFELVSA-N 2 1 332.557 4.018 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)C1CCSCC1 ZINC000474803258 1027522071 /nfs/dbraw/zinc/52/20/71/1027522071.db2.gz ZGLUKMGNTQCIDV-HLIPFELVSA-N 2 1 332.557 4.018 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC[N@H+]1C ZINC000474813334 1027538032 /nfs/dbraw/zinc/53/80/32/1027538032.db2.gz GVCJIMONCACQAH-DZGCQCFKSA-N 2 1 329.315 4.388 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@@H]3CCC[C@@H](CC(C)C)C3)CC2)nc(C)[nH+]1 ZINC000474881712 1027726966 /nfs/dbraw/zinc/72/69/66/1027726966.db2.gz WKXKXQNNSOLCBV-AZUAARDMSA-N 2 1 344.547 4.257 20 0 EIADMP C[C@@H](Cc1ccsc1)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000582956528 1027767197 /nfs/dbraw/zinc/76/71/97/1027767197.db2.gz CCQJDPGDNBFELS-INIZCTEOSA-N 2 1 346.515 4.115 20 0 EIADMP FC1(F)CC12CCC([NH2+]C1CC[NH+](CCc3ccccc3)CC1)CC2 ZINC000657716048 1027836870 /nfs/dbraw/zinc/83/68/70/1027836870.db2.gz GJQQQCGZCWZUOZ-UHFFFAOYSA-N 2 1 348.481 4.251 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccsc4)cc3)CC[C@@H]21 ZINC001167648120 1027843454 /nfs/dbraw/zinc/84/34/54/1027843454.db2.gz RIYKVYBVUJUIQP-QUCCMNQESA-N 2 1 326.509 4.331 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(-c4ccsc4)cc3)CC[C@@H]21 ZINC001167648120 1027843456 /nfs/dbraw/zinc/84/34/56/1027843456.db2.gz RIYKVYBVUJUIQP-QUCCMNQESA-N 2 1 326.509 4.331 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4ccsc4)cc3)CC[C@@H]21 ZINC001167648120 1027843474 /nfs/dbraw/zinc/84/34/74/1027843474.db2.gz RIYKVYBVUJUIQP-QUCCMNQESA-N 2 1 326.509 4.331 20 0 EIADMP CC(F)(F)CCC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167648718 1027852546 /nfs/dbraw/zinc/85/25/46/1027852546.db2.gz XLXFZCVLFLCJPK-MOPGFXCFSA-N 2 1 336.470 4.408 20 0 EIADMP CC(F)(F)CCC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001167648718 1027852547 /nfs/dbraw/zinc/85/25/47/1027852547.db2.gz XLXFZCVLFLCJPK-MOPGFXCFSA-N 2 1 336.470 4.408 20 0 EIADMP CC(F)(F)CCC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001167648718 1027852549 /nfs/dbraw/zinc/85/25/49/1027852549.db2.gz XLXFZCVLFLCJPK-MOPGFXCFSA-N 2 1 336.470 4.408 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2ccc(Cl)nc2)cc1 ZINC000122764775 1027942304 /nfs/dbraw/zinc/94/23/04/1027942304.db2.gz YMCPNRQGHKLEDG-CQSZACIVSA-N 2 1 340.858 4.122 20 0 EIADMP 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 1027963939 /nfs/dbraw/zinc/96/39/39/1027963939.db2.gz LJMHOEHYZHJOGR-LHDHZVESSA-N 2 1 348.481 4.405 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000384022460 1027983110 /nfs/dbraw/zinc/98/31/10/1027983110.db2.gz KFFYVQVPZPUDFJ-IEBWSBKVSA-N 2 1 326.459 4.389 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCOc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000583099510 1028000700 /nfs/dbraw/zinc/00/07/00/1028000700.db2.gz MMBSJDPBDQVICB-AZUAARDMSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCOc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000583099510 1028000722 /nfs/dbraw/zinc/00/07/22/1028000722.db2.gz MMBSJDPBDQVICB-AZUAARDMSA-N 2 1 344.886 4.144 20 0 EIADMP C(=C/C[N@H+]1CCC[C@H]1c1ccncc1)\C[NH+]1CCC[C@@H]1c1ccncc1 ZINC000153967963 1028068114 /nfs/dbraw/zinc/06/81/14/1028068114.db2.gz MMSJPTZXSMTSFJ-XFDDJKQHSA-N 2 1 348.494 4.007 20 0 EIADMP C(=C/C[N@@H+]1CCC[C@@H]1c1ccncc1)\C[NH+]1CCC[C@H]1c1ccncc1 ZINC000153967963 1028068135 /nfs/dbraw/zinc/06/81/35/1028068135.db2.gz MMSJPTZXSMTSFJ-XFDDJKQHSA-N 2 1 348.494 4.007 20 0 EIADMP C(=C/C[N@H+]1CCC[C@@H]1c1ccncc1)\C[NH+]1CCC[C@H]1c1ccncc1 ZINC000153967963 1028068157 /nfs/dbraw/zinc/06/81/57/1028068157.db2.gz MMSJPTZXSMTSFJ-XFDDJKQHSA-N 2 1 348.494 4.007 20 0 EIADMP Cc1ccc2cc(C[NH2+][C@@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)ccc2n1 ZINC000189427169 1028134621 /nfs/dbraw/zinc/13/46/21/1028134621.db2.gz CAJGRTOOAQKREW-PXNSSMCTSA-N 2 1 337.511 4.286 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](CCO)C2CCCCC2)cc1 ZINC000343093751 1028187403 /nfs/dbraw/zinc/18/74/03/1028187403.db2.gz BUCJIVBXPVYPJY-IIBYNOLFSA-N 2 1 341.499 4.163 20 0 EIADMP Cc1cccc([C@H](O)C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1 ZINC001167660090 1028268109 /nfs/dbraw/zinc/26/81/09/1028268109.db2.gz ZFKIRFZPWGYURR-SIKLNZKXSA-N 2 1 344.543 4.005 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000346132383 1028273386 /nfs/dbraw/zinc/27/33/86/1028273386.db2.gz BWYYVVKMKXQPBB-HXUWFJFHSA-N 2 1 346.478 4.030 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000346142345 1028279045 /nfs/dbraw/zinc/27/90/45/1028279045.db2.gz ALCLKRGNYRSRGQ-AWEZNQCLSA-N 2 1 342.393 4.047 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000346142345 1028279065 /nfs/dbraw/zinc/27/90/65/1028279065.db2.gz ALCLKRGNYRSRGQ-AWEZNQCLSA-N 2 1 342.393 4.047 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000280995070 1028314238 /nfs/dbraw/zinc/31/42/38/1028314238.db2.gz XETVQZPTLZQUOZ-OFNKIYASSA-N 2 1 349.522 4.077 20 0 EIADMP CC(C)n1cc([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cn1 ZINC000156224604 1028676129 /nfs/dbraw/zinc/67/61/29/1028676129.db2.gz OCGRJJPCOSEXHQ-QZTJIDSGSA-N 2 1 328.504 4.025 20 0 EIADMP CC(C)n1cc([C@@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)cn1 ZINC000156224604 1028676138 /nfs/dbraw/zinc/67/61/38/1028676138.db2.gz OCGRJJPCOSEXHQ-QZTJIDSGSA-N 2 1 328.504 4.025 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cnc(C(F)(F)F)s2)C1 ZINC000443991942 1028711580 /nfs/dbraw/zinc/71/15/80/1028711580.db2.gz XJEAHAHGWWJEEX-BETUJISGSA-N 2 1 349.466 4.010 20 0 EIADMP c1cc2c(cccc2C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)[nH]1 ZINC000583423339 1028716860 /nfs/dbraw/zinc/71/68/60/1028716860.db2.gz FEADJNLCWBKOGV-TZIWHRDSSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2c(cccc2C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)[nH]1 ZINC000583423339 1028716876 /nfs/dbraw/zinc/71/68/76/1028716876.db2.gz FEADJNLCWBKOGV-TZIWHRDSSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2c(cccc2C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)[nH]1 ZINC000583423339 1028716891 /nfs/dbraw/zinc/71/68/91/1028716891.db2.gz FEADJNLCWBKOGV-TZIWHRDSSA-N 2 1 345.490 4.122 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCOc2cccc3ccccc32)CC1 ZINC000524156299 1028723324 /nfs/dbraw/zinc/72/33/24/1028723324.db2.gz OJMSUGODUVBNQO-UHFFFAOYSA-N 2 1 340.511 4.271 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC[C@@H]2CCO[C@@H](C)C2)cc1 ZINC000346858964 1028795958 /nfs/dbraw/zinc/79/59/58/1028795958.db2.gz HLGJXNJQTZCOJU-XYJFISCASA-N 2 1 327.472 4.037 20 0 EIADMP Clc1ccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1Cl ZINC000281644675 1028821793 /nfs/dbraw/zinc/82/17/93/1028821793.db2.gz PEJBTUTTXLYPJY-YHUYYLMFSA-N 2 1 339.310 4.456 20 0 EIADMP C[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccc(-c4ccccc4F)o3)C2)C1 ZINC000583505310 1028825070 /nfs/dbraw/zinc/82/50/70/1028825070.db2.gz ADAPQEXDWAFGJO-HXUWFJFHSA-N 2 1 328.431 4.003 20 0 EIADMP C[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccc(-c4ccccc4F)o3)C2)C1 ZINC000583505310 1028825077 /nfs/dbraw/zinc/82/50/77/1028825077.db2.gz ADAPQEXDWAFGJO-HXUWFJFHSA-N 2 1 328.431 4.003 20 0 EIADMP C[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccc(-c4ccccc4F)o3)C2)C1 ZINC000583505310 1028825083 /nfs/dbraw/zinc/82/50/83/1028825083.db2.gz ADAPQEXDWAFGJO-HXUWFJFHSA-N 2 1 328.431 4.003 20 0 EIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccc(-c4ccccc4F)o3)C2)C1 ZINC000583505310 1028825086 /nfs/dbraw/zinc/82/50/86/1028825086.db2.gz ADAPQEXDWAFGJO-HXUWFJFHSA-N 2 1 328.431 4.003 20 0 EIADMP Clc1ccc(OCCC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000524594816 1029098518 /nfs/dbraw/zinc/09/85/18/1029098518.db2.gz WZKKRBNYAFSNNK-GOSISDBHSA-N 2 1 336.907 4.059 20 0 EIADMP CCc1nc(C)c([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)s1 ZINC000157514469 1029114207 /nfs/dbraw/zinc/11/42/07/1029114207.db2.gz PREDSGMLTREYCZ-AWEZNQCLSA-N 2 1 335.561 4.462 20 0 EIADMP Cc1cc2cc([C@@H](C)[NH2+]Cc3ccc(C[NH3+])cc3F)oc2cc1C ZINC000650752944 1029147530 /nfs/dbraw/zinc/14/75/30/1029147530.db2.gz CXOZRMPZOBVKLV-CQSZACIVSA-N 2 1 326.415 4.498 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000524728161 1029195286 /nfs/dbraw/zinc/19/52/86/1029195286.db2.gz UOVPIPUGJVRPSG-NHCUHLMSSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000524728161 1029195295 /nfs/dbraw/zinc/19/52/95/1029195295.db2.gz UOVPIPUGJVRPSG-NHCUHLMSSA-N 2 1 336.479 4.079 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCSCc2cccc3ccccc32)CC[N@H+]1C ZINC000151159371 1029217052 /nfs/dbraw/zinc/21/70/52/1029217052.db2.gz QMXJVMOVDKUQIQ-QFBILLFUSA-N 2 1 328.525 4.145 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)CCS2 ZINC000343493591 1029357999 /nfs/dbraw/zinc/35/79/99/1029357999.db2.gz DCBDPCXJCHHLIS-APWZRJJASA-N 2 1 348.556 4.476 20 0 EIADMP COC(C)(C)[C@@H]1CCC[N@@H+]1C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168058676 1029370755 /nfs/dbraw/zinc/37/07/55/1029370755.db2.gz BQXZDKBPOOBKGM-WFXMLNOXSA-N 2 1 344.543 4.317 20 0 EIADMP COC(C)(C)[C@@H]1CCC[N@H+]1C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168058676 1029370772 /nfs/dbraw/zinc/37/07/72/1029370772.db2.gz BQXZDKBPOOBKGM-WFXMLNOXSA-N 2 1 344.543 4.317 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000151269449 1029452109 /nfs/dbraw/zinc/45/21/09/1029452109.db2.gz BAMQUSNITUXUDE-NEWSRXKRSA-N 2 1 328.525 4.413 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000151269449 1029452114 /nfs/dbraw/zinc/45/21/14/1029452114.db2.gz BAMQUSNITUXUDE-NEWSRXKRSA-N 2 1 328.525 4.413 20 0 EIADMP CC(C)CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccoc1 ZINC000428448246 1029468954 /nfs/dbraw/zinc/46/89/54/1029468954.db2.gz OQJSHWHYOLOXAM-PWRODBHTSA-N 2 1 348.531 4.114 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(-c3ccccc3OC)cc2)CC1 ZINC000525180952 1029499240 /nfs/dbraw/zinc/49/92/40/1029499240.db2.gz PIONWNUCBXCBGL-UHFFFAOYSA-N 2 1 338.495 4.326 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)CC(F)F ZINC000647319347 1029521779 /nfs/dbraw/zinc/52/17/79/1029521779.db2.gz WVDMGSMTBDSFAC-GDAAHCPNSA-N 2 1 336.470 4.168 20 0 EIADMP CC(=O)Nc1cccc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000158563720 1029523749 /nfs/dbraw/zinc/52/37/49/1029523749.db2.gz OLGXFWKXISFRPE-KSZLIROESA-N 2 1 345.531 4.054 20 0 EIADMP C[C@H](CC[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)OCc1ccccc1 ZINC000475313366 1029525719 /nfs/dbraw/zinc/52/57/19/1029525719.db2.gz PDYWFZLWAWGFBN-DYXWJJEUSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000655710802 1029572317 /nfs/dbraw/zinc/57/23/17/1029572317.db2.gz FSTUBCMALRSBBL-NTHMGXEOSA-N 2 1 330.541 4.056 20 0 EIADMP Cc1ccc([C@@H]([NH2+]CCCC[N@H+]2CCC[C@H]2CO)C2CCCC2)cc1 ZINC000446820467 1029588963 /nfs/dbraw/zinc/58/89/63/1029588963.db2.gz CWETZLZQBMBPDW-VXKWHMMOSA-N 2 1 344.543 4.053 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)CCCO2 ZINC000359938932 1029602944 /nfs/dbraw/zinc/60/29/44/1029602944.db2.gz AMPAWYZQWOAJIZ-PXNSSMCTSA-N 2 1 346.515 4.153 20 0 EIADMP CCC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccn1 ZINC000158990757 1029635482 /nfs/dbraw/zinc/63/54/82/1029635482.db2.gz VAUBDZYTUBWTSU-LEWJYISDSA-N 2 1 337.511 4.077 20 0 EIADMP CCC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccn1 ZINC000158990757 1029635490 /nfs/dbraw/zinc/63/54/90/1029635490.db2.gz VAUBDZYTUBWTSU-LEWJYISDSA-N 2 1 337.511 4.077 20 0 EIADMP FC(F)(F)C1CCC([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000192927839 1029648247 /nfs/dbraw/zinc/64/82/47/1029648247.db2.gz NHHDXNSBWWBEIS-AOCRQIFASA-N 2 1 340.433 4.219 20 0 EIADMP CC(C)N1CCc2nc(C[N@@H+](C)[C@@H](C)C3CCCCC3)sc2C1 ZINC000447069639 1029686922 /nfs/dbraw/zinc/68/69/22/1029686922.db2.gz STCHPSQGLXDWSU-HNNXBMFYSA-N 2 1 335.561 4.310 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH+](C)[C@@H](C)C3CCCCC3)sc2C1 ZINC000447069639 1029686925 /nfs/dbraw/zinc/68/69/25/1029686925.db2.gz STCHPSQGLXDWSU-HNNXBMFYSA-N 2 1 335.561 4.310 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH+](C)[C@@H](C)C3CCCCC3)sc2C1 ZINC000447069639 1029686929 /nfs/dbraw/zinc/68/69/29/1029686929.db2.gz STCHPSQGLXDWSU-HNNXBMFYSA-N 2 1 335.561 4.310 20 0 EIADMP CC(C)[NH+]1CCc2nc(C[N@@H+](C)[C@@H](C)C3CCCCC3)sc2C1 ZINC000447069639 1029686938 /nfs/dbraw/zinc/68/69/38/1029686938.db2.gz STCHPSQGLXDWSU-HNNXBMFYSA-N 2 1 335.561 4.310 20 0 EIADMP Cc1cnccc1OC1CCN(Cc2ccc([C@@H]3C[C@H]3C)o2)CC1 ZINC000447099346 1029694884 /nfs/dbraw/zinc/69/48/84/1029694884.db2.gz RANBUOBLXUGPIG-RDTXWAMCSA-N 2 1 326.440 4.150 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000708510417 1029743310 /nfs/dbraw/zinc/74/33/10/1029743310.db2.gz JXVSRBSVBCUHFN-JXFKEZNVSA-N 2 1 344.449 4.482 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000301754468 1029804305 /nfs/dbraw/zinc/80/43/05/1029804305.db2.gz CMYYCTCIDYMQPF-KUHUBIRLSA-N 2 1 341.886 4.341 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000301754468 1029804306 /nfs/dbraw/zinc/80/43/06/1029804306.db2.gz CMYYCTCIDYMQPF-KUHUBIRLSA-N 2 1 341.886 4.341 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)c2c1 ZINC000301763404 1029805489 /nfs/dbraw/zinc/80/54/89/1029805489.db2.gz GOJMHBLYQYLONF-LIRRHRJNSA-N 2 1 341.886 4.341 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000301763404 1029805494 /nfs/dbraw/zinc/80/54/94/1029805494.db2.gz GOJMHBLYQYLONF-LIRRHRJNSA-N 2 1 341.886 4.341 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cccc3cnccc32)C1 ZINC000248390306 1029807607 /nfs/dbraw/zinc/80/76/07/1029807607.db2.gz TWOMJUITTMQFJZ-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cccc3cnccc32)C1 ZINC000248390306 1029807610 /nfs/dbraw/zinc/80/76/10/1029807610.db2.gz TWOMJUITTMQFJZ-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cccc3cnccc32)C1 ZINC000248390306 1029807611 /nfs/dbraw/zinc/80/76/11/1029807611.db2.gz TWOMJUITTMQFJZ-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000081635363 1029811187 /nfs/dbraw/zinc/81/11/87/1029811187.db2.gz HRPNMCLSNRNDHY-INIZCTEOSA-N 2 1 343.902 4.052 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000081635363 1029811190 /nfs/dbraw/zinc/81/11/90/1029811190.db2.gz HRPNMCLSNRNDHY-INIZCTEOSA-N 2 1 343.902 4.052 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000081635363 1029811194 /nfs/dbraw/zinc/81/11/94/1029811194.db2.gz HRPNMCLSNRNDHY-INIZCTEOSA-N 2 1 343.902 4.052 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000081635363 1029811197 /nfs/dbraw/zinc/81/11/97/1029811197.db2.gz HRPNMCLSNRNDHY-INIZCTEOSA-N 2 1 343.902 4.052 20 0 EIADMP Cc1cc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)cc(C)c1OC(F)F ZINC000092072038 1029898705 /nfs/dbraw/zinc/89/87/05/1029898705.db2.gz JKJSBAIZTOTIMU-HNNXBMFYSA-N 2 1 335.398 4.008 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc1 ZINC000092072859 1029899542 /nfs/dbraw/zinc/89/95/42/1029899542.db2.gz DMSQHTKSJWTHRD-LJQANCHMSA-N 2 1 347.462 4.465 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1ccc(F)cn1 ZINC000092739200 1029931662 /nfs/dbraw/zinc/93/16/62/1029931662.db2.gz IINWQCKZOMSQAU-IRXDYDNUSA-N 2 1 341.474 4.446 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)CCc1cc(Cl)cc(Cl)c1 ZINC000447302343 1029998983 /nfs/dbraw/zinc/99/89/83/1029998983.db2.gz ASRIXWJURLRDQM-UHFFFAOYSA-N 2 1 326.271 4.063 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)CCc1cc(Cl)cc(Cl)c1 ZINC000447302343 1029998991 /nfs/dbraw/zinc/99/89/91/1029998991.db2.gz ASRIXWJURLRDQM-UHFFFAOYSA-N 2 1 326.271 4.063 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657887329 1030227406 /nfs/dbraw/zinc/22/74/06/1030227406.db2.gz GZSZUFGMQRCRIN-GVXVVHGQSA-N 2 1 345.712 4.236 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657887329 1030227433 /nfs/dbraw/zinc/22/74/33/1030227433.db2.gz GZSZUFGMQRCRIN-GVXVVHGQSA-N 2 1 345.712 4.236 20 0 EIADMP Clc1ccc(/C=C\C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000526056937 1030251756 /nfs/dbraw/zinc/25/17/56/1030251756.db2.gz RWZBQOISOJWSHK-HIIGXIJFSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C\C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000526056937 1030251778 /nfs/dbraw/zinc/25/17/78/1030251778.db2.gz RWZBQOISOJWSHK-HIIGXIJFSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C\C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000526056937 1030251792 /nfs/dbraw/zinc/25/17/92/1030251792.db2.gz RWZBQOISOJWSHK-HIIGXIJFSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C\C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000526056937 1030251812 /nfs/dbraw/zinc/25/18/12/1030251812.db2.gz RWZBQOISOJWSHK-HIIGXIJFSA-N 2 1 330.903 4.302 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358419 1030337986 /nfs/dbraw/zinc/33/79/86/1030337986.db2.gz ZQKPMSQORVLIAF-AQNXPRMDSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358419 1030338009 /nfs/dbraw/zinc/33/80/09/1030338009.db2.gz ZQKPMSQORVLIAF-AQNXPRMDSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358419 1030338027 /nfs/dbraw/zinc/33/80/27/1030338027.db2.gz ZQKPMSQORVLIAF-AQNXPRMDSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358419 1030338047 /nfs/dbraw/zinc/33/80/47/1030338047.db2.gz ZQKPMSQORVLIAF-AQNXPRMDSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358419 1030338065 /nfs/dbraw/zinc/33/80/65/1030338065.db2.gz ZQKPMSQORVLIAF-AQNXPRMDSA-N 2 1 334.548 4.065 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(Oc4ccccc4)o3)C2)CC1 ZINC000685462860 1030343432 /nfs/dbraw/zinc/34/34/32/1030343432.db2.gz VFXUMRJATBYWMD-GOSISDBHSA-N 2 1 340.467 4.236 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000708566638 1030384566 /nfs/dbraw/zinc/38/45/66/1030384566.db2.gz RHWMYNHBYYZAGA-DBXWQHBBSA-N 2 1 340.486 4.114 20 0 EIADMP C[C@H]([NH2+]CCc1ccc(F)c(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527041847 1030421276 /nfs/dbraw/zinc/42/12/76/1030421276.db2.gz BSTWTEHIJUHSFI-QFBILLFUSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]([NH2+]CCCc1ccccc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000530477272 1030447065 /nfs/dbraw/zinc/44/70/65/1030447065.db2.gz XBPRETQYAMNESR-RXVVDRJESA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)c1cccc(CO)c1 ZINC000121856865 1030461561 /nfs/dbraw/zinc/46/15/61/1030461561.db2.gz GHVJHCXJVAJRRL-ROUUACIJSA-N 2 1 338.495 4.055 20 0 EIADMP Cc1[nH+]ccn1CCCCN1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000189494622 1030472608 /nfs/dbraw/zinc/47/26/08/1030472608.db2.gz NIYCUVXXUYJCJW-KXBFYZLASA-N 2 1 347.890 4.087 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3csc(Cl)c3)CC2)[nH+]c1 ZINC000191306243 1030615258 /nfs/dbraw/zinc/61/52/58/1030615258.db2.gz OMCWWSXGGKAPKJ-ZDUSSCGKSA-N 2 1 335.904 4.425 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCOc2ccc3ccccc3c2)C[C@H]1C ZINC000530662947 1030620320 /nfs/dbraw/zinc/62/03/20/1030620320.db2.gz RXDWRDXVDHATOU-YLJYHZDGSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCOc2ccc3ccccc3c2)C[C@H]1C ZINC000530662947 1030620340 /nfs/dbraw/zinc/62/03/40/1030620340.db2.gz RXDWRDXVDHATOU-YLJYHZDGSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCOc2ccc3ccccc3c2)C[C@H]1C ZINC000530662947 1030620353 /nfs/dbraw/zinc/62/03/53/1030620353.db2.gz RXDWRDXVDHATOU-YLJYHZDGSA-N 2 1 326.484 4.023 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3ccncc3s2)C1 ZINC000657932147 1030637203 /nfs/dbraw/zinc/63/72/03/1030637203.db2.gz UQPQMHBWDDNADY-CVEARBPZSA-N 2 1 331.529 4.315 20 0 EIADMP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000657939003 1030650322 /nfs/dbraw/zinc/65/03/22/1030650322.db2.gz SRVYFQRIFYIWDJ-LBPRGKRZSA-N 2 1 346.824 4.141 20 0 EIADMP C[C@H]([NH2+]CCCCOc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000527354936 1030661710 /nfs/dbraw/zinc/66/17/10/1030661710.db2.gz OAFPUEYSCGKFCQ-RBUKOAKNSA-N 2 1 330.516 4.088 20 0 EIADMP C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2ccccc2n1 ZINC000398109838 1030702297 /nfs/dbraw/zinc/70/22/97/1030702297.db2.gz CPLUTDVYPDDFOV-AVRDEDQJSA-N 2 1 345.490 4.235 20 0 EIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@@H](C)Cc2ccc(Cl)cc2)CC1 ZINC001168176716 1030747811 /nfs/dbraw/zinc/74/78/11/1030747811.db2.gz IRWGYOBWNXQMIC-HNNXBMFYSA-N 2 1 343.902 4.213 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(C(F)F)nc1 ZINC000657999293 1030767524 /nfs/dbraw/zinc/76/75/24/1030767524.db2.gz TXCYQKJMBFALSV-NVXWUHKLSA-N 2 1 345.437 4.192 20 0 EIADMP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccncc3Cl)cc2)CC1 ZINC000527633553 1030786137 /nfs/dbraw/zinc/78/61/37/1030786137.db2.gz DWPXOMNPYYGYER-UHFFFAOYSA-N 2 1 343.902 4.257 20 0 EIADMP Clc1cnccc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000527661082 1030804674 /nfs/dbraw/zinc/80/46/74/1030804674.db2.gz YYYHHWNUEJRTNH-UHFFFAOYSA-N 2 1 343.902 4.401 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)c1 ZINC000658208476 1030881733 /nfs/dbraw/zinc/88/17/33/1030881733.db2.gz IBZNNJAEQOUMNM-DNVCBOLYSA-N 2 1 336.545 4.027 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)CC[N@@H+]1C ZINC000658252951 1030926618 /nfs/dbraw/zinc/92/66/18/1030926618.db2.gz GEVRCDSEBYWXLR-CMPLNLGQSA-N 2 1 334.348 4.112 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)CC[N@H+]1C ZINC000658252951 1030926639 /nfs/dbraw/zinc/92/66/39/1030926639.db2.gz GEVRCDSEBYWXLR-CMPLNLGQSA-N 2 1 334.348 4.112 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1OCCC ZINC000392722151 1030946232 /nfs/dbraw/zinc/94/62/32/1030946232.db2.gz PTWYZTCJCPXEGI-ZWKOTPCHSA-N 2 1 348.531 4.257 20 0 EIADMP COc1cccc(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000531188852 1030952334 /nfs/dbraw/zinc/95/23/34/1030952334.db2.gz NHTAQWYUPAQRTH-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000531188852 1030952356 /nfs/dbraw/zinc/95/23/56/1030952356.db2.gz NHTAQWYUPAQRTH-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000531188852 1030952376 /nfs/dbraw/zinc/95/23/76/1030952376.db2.gz NHTAQWYUPAQRTH-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000531188852 1030952394 /nfs/dbraw/zinc/95/23/94/1030952394.db2.gz NHTAQWYUPAQRTH-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCSc2ccc(Cl)cc2)[C@H](C)C1 ZINC001167686155 1031029693 /nfs/dbraw/zinc/02/96/93/1031029693.db2.gz OICXACFCFZZISX-RHSMWYFYSA-N 2 1 326.937 4.094 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCSc2ccc(Cl)cc2)[C@H](C)C1 ZINC001167686155 1031029713 /nfs/dbraw/zinc/02/97/13/1031029713.db2.gz OICXACFCFZZISX-RHSMWYFYSA-N 2 1 326.937 4.094 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCSc2ccc(Cl)cc2)[C@H](C)C1 ZINC001167686155 1031029731 /nfs/dbraw/zinc/02/97/31/1031029731.db2.gz OICXACFCFZZISX-RHSMWYFYSA-N 2 1 326.937 4.094 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CSCCc2ccccc21 ZINC000532459794 1031099638 /nfs/dbraw/zinc/09/96/38/1031099638.db2.gz MGUXAHSFRAMYGF-FXAWDEMLSA-N 2 1 332.557 4.261 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCCOc1ccc(Cl)cc1Cl ZINC000532464689 1031123734 /nfs/dbraw/zinc/12/37/34/1031123734.db2.gz ZIBFIHXMECYVNM-XJKCOSOUSA-N 2 1 345.314 4.081 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccc1 ZINC000532494788 1031232473 /nfs/dbraw/zinc/23/24/73/1031232473.db2.gz DDYFWDKOMACAGC-FQEVSTJZSA-N 2 1 339.870 4.419 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000532492413 1031234099 /nfs/dbraw/zinc/23/40/99/1031234099.db2.gz ZRCGIYYLZLTYAI-HNNXBMFYSA-N 2 1 339.414 4.474 20 0 EIADMP CCC(CC)(CN[C@@H]1C[C@H](C)[N@@H+](C)C[C@H]1C)[NH2+][C@H](C)c1ccccc1 ZINC000532517023 1031249574 /nfs/dbraw/zinc/24/95/74/1031249574.db2.gz MAWIRKASXQLFEJ-RCLSDMTESA-N 2 1 345.575 4.214 20 0 EIADMP CCC(CC)(CN[C@@H]1C[C@H](C)[N@@H+](C)C[C@@H]1C)[NH2+][C@@H](C)c1ccccc1 ZINC000532517024 1031249774 /nfs/dbraw/zinc/24/97/74/1031249774.db2.gz MAWIRKASXQLFEJ-VNYTWHDVSA-N 2 1 345.575 4.214 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CCCO2 ZINC000532548875 1031261044 /nfs/dbraw/zinc/26/10/44/1031261044.db2.gz ADQWYWCGMNAEDJ-HXUWFJFHSA-N 2 1 346.490 4.426 20 0 EIADMP C[C@H](CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044072 1031395518 /nfs/dbraw/zinc/39/55/18/1031395518.db2.gz BJUZQIUZIQVOAR-SXGZJXTBSA-N 2 1 334.454 4.017 20 0 EIADMP C[C@H](C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044072 1031395525 /nfs/dbraw/zinc/39/55/25/1031395525.db2.gz BJUZQIUZIQVOAR-SXGZJXTBSA-N 2 1 334.454 4.017 20 0 EIADMP C[C@H](C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044072 1031395535 /nfs/dbraw/zinc/39/55/35/1031395535.db2.gz BJUZQIUZIQVOAR-SXGZJXTBSA-N 2 1 334.454 4.017 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+]Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000449077719 1031432594 /nfs/dbraw/zinc/43/25/94/1031432594.db2.gz WKMUOLOHAPEQGH-UHFFFAOYSA-N 2 1 347.503 4.159 20 0 EIADMP Clc1ccc(C2=CC[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000449089121 1031448843 /nfs/dbraw/zinc/44/88/43/1031448843.db2.gz JICCKKQQTOBXDY-UFYCRDLUSA-N 2 1 330.903 4.492 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CCN(Cc2ncccc2Cl)CC1 ZINC000528369070 1031452557 /nfs/dbraw/zinc/45/25/57/1031452557.db2.gz PUIMLUAHVODEID-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ncccc2Cl)CC1 ZINC000528369070 1031452564 /nfs/dbraw/zinc/45/25/64/1031452564.db2.gz PUIMLUAHVODEID-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ncccc2Cl)CC1 ZINC000528369070 1031452571 /nfs/dbraw/zinc/45/25/71/1031452571.db2.gz PUIMLUAHVODEID-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000531692290 1031462425 /nfs/dbraw/zinc/46/24/25/1031462425.db2.gz KIBKQQGOJYOFMX-KRWDZBQOSA-N 2 1 344.474 4.037 20 0 EIADMP COc1cc2ccccc2cc1C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000449133526 1031465477 /nfs/dbraw/zinc/46/54/77/1031465477.db2.gz YTCHCNCTALUZTC-QGZVFWFLSA-N 2 1 326.484 4.058 20 0 EIADMP COc1cc2ccccc2cc1C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000449133526 1031465491 /nfs/dbraw/zinc/46/54/91/1031465491.db2.gz YTCHCNCTALUZTC-QGZVFWFLSA-N 2 1 326.484 4.058 20 0 EIADMP COc1cc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)cc2ccccc21 ZINC000449184265 1031523017 /nfs/dbraw/zinc/52/30/17/1031523017.db2.gz MKZMKRRDQAKGKN-UHFFFAOYSA-N 2 1 338.495 4.345 20 0 EIADMP COc1cc2ccccc2cc1C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000449183867 1031523768 /nfs/dbraw/zinc/52/37/68/1031523768.db2.gz LPBYNVJAWBHLRH-UHFFFAOYSA-N 2 1 338.495 4.345 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)CCCc1cccnc1 ZINC000453064828 1031530335 /nfs/dbraw/zinc/53/03/35/1031530335.db2.gz ULNHPGWHKRLYKE-LJQANCHMSA-N 2 1 339.527 4.423 20 0 EIADMP CCC[C@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)C1CCCC1 ZINC000449228577 1031556901 /nfs/dbraw/zinc/55/69/01/1031556901.db2.gz ZGHAQTVQJDYEHY-IBGZPJMESA-N 2 1 330.520 4.011 20 0 EIADMP CN(Cc1ccccn1)[C@@H]1CCC[N@@H+](Cc2cccc3ccoc32)CC1 ZINC000449264333 1031601490 /nfs/dbraw/zinc/60/14/90/1031601490.db2.gz LNMOAVNTUHBVED-OAQYLSRUSA-N 2 1 349.478 4.314 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[NH+](Cc2cccc3ccoc32)CC1 ZINC000449264333 1031601505 /nfs/dbraw/zinc/60/15/05/1031601505.db2.gz LNMOAVNTUHBVED-OAQYLSRUSA-N 2 1 349.478 4.314 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[NH+](Cc2cccc3ccoc32)CC1 ZINC000449264333 1031601516 /nfs/dbraw/zinc/60/15/16/1031601516.db2.gz LNMOAVNTUHBVED-OAQYLSRUSA-N 2 1 349.478 4.314 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@H+](Cc2cccc3ccoc32)CC1 ZINC000449264333 1031601527 /nfs/dbraw/zinc/60/15/27/1031601527.db2.gz LNMOAVNTUHBVED-OAQYLSRUSA-N 2 1 349.478 4.314 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@@H+](Cc2cccc3ccoc32)CC1 ZINC000449264333 1031601537 /nfs/dbraw/zinc/60/15/37/1031601537.db2.gz LNMOAVNTUHBVED-OAQYLSRUSA-N 2 1 349.478 4.314 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453122731 1031618129 /nfs/dbraw/zinc/61/81/29/1031618129.db2.gz PKDYFHQYRJQBTC-KSZLIROESA-N 2 1 340.433 4.362 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000453234215 1031757204 /nfs/dbraw/zinc/75/72/04/1031757204.db2.gz ZQBOSQKDUWOVQR-LEWJYISDSA-N 2 1 337.511 4.423 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000453234215 1031757222 /nfs/dbraw/zinc/75/72/22/1031757222.db2.gz ZQBOSQKDUWOVQR-LEWJYISDSA-N 2 1 337.511 4.423 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)cc1 ZINC000449481585 1031778687 /nfs/dbraw/zinc/77/86/87/1031778687.db2.gz ULGWEGZTEHLURS-AEFFLSMTSA-N 2 1 339.483 4.181 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)cc1 ZINC000449481586 1031779241 /nfs/dbraw/zinc/77/92/41/1031779241.db2.gz ULGWEGZTEHLURS-FUHWJXTLSA-N 2 1 339.483 4.181 20 0 EIADMP FC1(F)CC(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)C1 ZINC000453242257 1031795578 /nfs/dbraw/zinc/79/55/78/1031795578.db2.gz PYGGRXLLNVIYBE-OTWHNJEPSA-N 2 1 334.454 4.065 20 0 EIADMP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000449560531 1031847078 /nfs/dbraw/zinc/84/70/78/1031847078.db2.gz MHYGMZJLCYFGNS-FUDCBSFHSA-N 2 1 327.299 4.139 20 0 EIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453351986 1031880766 /nfs/dbraw/zinc/88/07/66/1031880766.db2.gz NAIGBMBZPCDAOI-XYTVBORESA-N 2 1 338.948 4.426 20 0 EIADMP CC[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000531967860 1031888580 /nfs/dbraw/zinc/88/85/80/1031888580.db2.gz ZJNNTKHMSBGNEZ-YSVLISHTSA-N 2 1 328.422 4.476 20 0 EIADMP CC[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000531967860 1031888584 /nfs/dbraw/zinc/88/85/84/1031888584.db2.gz ZJNNTKHMSBGNEZ-YSVLISHTSA-N 2 1 328.422 4.476 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)cc1 ZINC000453417279 1031952650 /nfs/dbraw/zinc/95/26/50/1031952650.db2.gz KCOWSAHJEAKWAT-DOTOQJQBSA-N 2 1 327.472 4.037 20 0 EIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453393313 1031960299 /nfs/dbraw/zinc/96/02/99/1031960299.db2.gz FYFHRPJKTLUNNH-HXUWFJFHSA-N 2 1 325.500 4.318 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)no1 ZINC000459370359 1031966204 /nfs/dbraw/zinc/96/62/04/1031966204.db2.gz RKNWTVBTVZAOPZ-UHFFFAOYSA-N 2 1 335.451 4.001 20 0 EIADMP C[C@H](C[NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000453591454 1032037418 /nfs/dbraw/zinc/03/74/18/1032037418.db2.gz CCAAJQZVGFDLBI-CQSZACIVSA-N 2 1 328.422 4.273 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000512653431 1033619364 /nfs/dbraw/zinc/61/93/64/1033619364.db2.gz FHIFODHMDTVILA-KZNAEPCWSA-N 2 1 340.433 4.219 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CC3CCC(F)(F)CC3)C2)CC1 ZINC001307440786 1033780473 /nfs/dbraw/zinc/78/04/73/1033780473.db2.gz SUVIIVWKPJMILI-SFHVURJKSA-N 2 1 328.491 4.256 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000512774052 1033914650 /nfs/dbraw/zinc/91/46/50/1033914650.db2.gz VRCBYLXJGRINQJ-UHFFFAOYSA-N 2 1 338.495 4.136 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(F)c3cccnc23)CC1 ZINC000052210068 1034411500 /nfs/dbraw/zinc/41/15/00/1034411500.db2.gz PWPQSFAGKBYQNW-UHFFFAOYSA-N 2 1 343.490 4.318 20 0 EIADMP Cc1ccc(C[N@H+]2CCCC3(CC[NH+]([C@H]4C[C@H]5C[C@H]5C4)CC3)C2)cc1 ZINC001167941591 1034809060 /nfs/dbraw/zinc/80/90/60/1034809060.db2.gz QKTNVACZNILHEQ-ZBYYUNFXSA-N 2 1 338.539 4.472 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(F)c(F)c1 ZINC000469100191 1034898991 /nfs/dbraw/zinc/89/89/91/1034898991.db2.gz ZCIOFOBBMOZGDQ-IIBYNOLFSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(F)c(F)c1 ZINC000469100191 1034898994 /nfs/dbraw/zinc/89/89/94/1034898994.db2.gz ZCIOFOBBMOZGDQ-IIBYNOLFSA-N 2 1 344.449 4.008 20 0 EIADMP C[N@H+](C[C@@H]1C[C@@H]1c1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513483525 1034973937 /nfs/dbraw/zinc/97/39/37/1034973937.db2.gz DURJWSGWPOHJAZ-JTHBVZDNSA-N 2 1 334.507 4.387 20 0 EIADMP C[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513483525 1034973946 /nfs/dbraw/zinc/97/39/46/1034973946.db2.gz DURJWSGWPOHJAZ-JTHBVZDNSA-N 2 1 334.507 4.387 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cc(Cl)ccc1OCC1CC1 ZINC000430016583 1035010501 /nfs/dbraw/zinc/01/05/01/1035010501.db2.gz GDSUUVRNJWUQHZ-CQSZACIVSA-N 2 1 347.890 4.060 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501070252 1035368266 /nfs/dbraw/zinc/36/82/66/1035368266.db2.gz SDWTYXJEDBOMFJ-OAHLLOKOSA-N 2 1 345.437 4.269 20 0 EIADMP Cc1cc(C[NH2+]C2CC([NH+]3CCCCC3)C2)ccc1C(F)(F)F ZINC000414428549 1035418336 /nfs/dbraw/zinc/41/83/36/1035418336.db2.gz BMEJQZQCEHCTHC-UHFFFAOYSA-N 2 1 326.406 4.120 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420328280 1035532590 /nfs/dbraw/zinc/53/25/90/1035532590.db2.gz ZVTDIVMAVVLURT-JKSUJKDBSA-N 2 1 329.513 4.111 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc3sccc3c2)[C@@H](C)C1 ZINC000575222287 1035730525 /nfs/dbraw/zinc/73/05/25/1035730525.db2.gz ZMWVFJIJQRIMIX-LPHOPBHVSA-N 2 1 346.540 4.128 20 0 EIADMP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)CC3 ZINC000491043097 1035793317 /nfs/dbraw/zinc/79/33/17/1035793317.db2.gz YZIYFYSDOWEDAL-MSOLQXFVSA-N 2 1 339.527 4.044 20 0 EIADMP c1ccc(OCCC[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491057664 1035798401 /nfs/dbraw/zinc/79/84/01/1035798401.db2.gz FBNYDSHTQQGEBX-FQEVSTJZSA-N 2 1 330.516 4.044 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+](C)C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000195679012 1035881247 /nfs/dbraw/zinc/88/12/47/1035881247.db2.gz QRRGMRRGIBNJLP-SNVBAGLBSA-N 2 1 342.327 4.327 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090592 1035939025 /nfs/dbraw/zinc/93/90/25/1035939025.db2.gz GHUSSRTXJLVXLT-KBXCAEBGSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090592 1035939050 /nfs/dbraw/zinc/93/90/50/1035939050.db2.gz GHUSSRTXJLVXLT-KBXCAEBGSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090592 1035939072 /nfs/dbraw/zinc/93/90/72/1035939072.db2.gz GHUSSRTXJLVXLT-KBXCAEBGSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090592 1035939098 /nfs/dbraw/zinc/93/90/98/1035939098.db2.gz GHUSSRTXJLVXLT-KBXCAEBGSA-N 2 1 332.488 4.326 20 0 EIADMP FC1(F)CCC[C@@H](C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000502318914 1036075295 /nfs/dbraw/zinc/07/52/95/1036075295.db2.gz QILMQNJUDOHKPD-GOSISDBHSA-N 2 1 336.470 4.109 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)C1 ZINC000502415625 1036200527 /nfs/dbraw/zinc/20/05/27/1036200527.db2.gz MWJJJMOAJQQOHD-ZWKOTPCHSA-N 2 1 332.536 4.017 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)C1 ZINC000502415625 1036200534 /nfs/dbraw/zinc/20/05/34/1036200534.db2.gz MWJJJMOAJQQOHD-ZWKOTPCHSA-N 2 1 332.536 4.017 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000502420482 1036204155 /nfs/dbraw/zinc/20/41/55/1036204155.db2.gz YNLNPXISQLMMLZ-YJMBLLCNSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H](NCCC[N@@H+](C)Cc1ccccc1)c1cnn(C2CCCC2)c1 ZINC000502683581 1036502294 /nfs/dbraw/zinc/50/22/94/1036502294.db2.gz DVFBFNHRKBAOAJ-SFHVURJKSA-N 2 1 340.515 4.171 20 0 EIADMP C[C@H]([NH2+]CCCN(C)Cc1ccccc1)c1cnn(C2CCCC2)c1 ZINC000502683581 1036502311 /nfs/dbraw/zinc/50/23/11/1036502311.db2.gz DVFBFNHRKBAOAJ-SFHVURJKSA-N 2 1 340.515 4.171 20 0 EIADMP c1nc2ccc(C[NH2+]Cc3ccccc3C[NH+]3CCCCCC3)cc2[nH]1 ZINC000602908853 1036660740 /nfs/dbraw/zinc/66/07/40/1036660740.db2.gz CBWZQVRUDQTGNU-UHFFFAOYSA-N 2 1 348.494 4.229 20 0 EIADMP C[C@H]([NH2+]C/C=C\c1ccc(F)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486472922 1036722829 /nfs/dbraw/zinc/72/28/29/1036722829.db2.gz DPKARZYRVMHYLF-KWBXCNMKSA-N 2 1 338.470 4.339 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3ccc(F)cc3[nH]2)c1 ZINC000486699032 1036820700 /nfs/dbraw/zinc/82/07/00/1036820700.db2.gz WCOUPBKLLJCZBZ-UHFFFAOYSA-N 2 1 339.458 4.437 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CC12CCSCC2 ZINC000421869867 1036838840 /nfs/dbraw/zinc/83/88/40/1036838840.db2.gz DYFYOEIPJOPGHU-HOJAQTOUSA-N 2 1 344.568 4.020 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CC12CCSCC2 ZINC000421869868 1036840311 /nfs/dbraw/zinc/84/03/11/1036840311.db2.gz DYFYOEIPJOPGHU-MISYRCLQSA-N 2 1 344.568 4.020 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2c(F)cccc2Cl)C1 ZINC000589837211 1036880361 /nfs/dbraw/zinc/88/03/61/1036880361.db2.gz LPDHIDUHXQWPSJ-GASCZTMLSA-N 2 1 326.887 4.327 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C/C=C\c2ccncc2)C1 ZINC000486935521 1036907105 /nfs/dbraw/zinc/90/71/05/1036907105.db2.gz JKOJRLHJEKUGPQ-BQHGXPCASA-N 2 1 335.495 4.117 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311088388 1037082432 /nfs/dbraw/zinc/08/24/32/1037082432.db2.gz NJNYOPFCJYHFPH-DBXWQHBBSA-N 2 1 340.486 4.257 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C/C=C\c1ccncc1 ZINC000487320922 1037117338 /nfs/dbraw/zinc/11/73/38/1037117338.db2.gz ITXFSFVOWCUUAG-XQRVVYSFSA-N 2 1 347.462 4.110 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)nc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272265920 1037148334 /nfs/dbraw/zinc/14/83/34/1037148334.db2.gz AKVPTBQQKHUFBX-FRQCXROJSA-N 2 1 343.902 4.296 20 0 EIADMP CSc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000590819100 1037185268 /nfs/dbraw/zinc/18/52/68/1037185268.db2.gz KIFULEIIHJTBSA-IBGZPJMESA-N 2 1 332.557 4.497 20 0 EIADMP CSc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000590819100 1037185288 /nfs/dbraw/zinc/18/52/88/1037185288.db2.gz KIFULEIIHJTBSA-IBGZPJMESA-N 2 1 332.557 4.497 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CS1 ZINC000488443202 1037584067 /nfs/dbraw/zinc/58/40/67/1037584067.db2.gz GBHCYMLENCFRKE-FZCLSBEQSA-N 2 1 338.586 4.251 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CS1 ZINC000488443202 1037584085 /nfs/dbraw/zinc/58/40/85/1037584085.db2.gz GBHCYMLENCFRKE-FZCLSBEQSA-N 2 1 338.586 4.251 20 0 EIADMP C[C@@H]1C[C@@H]1C[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415365 1037584926 /nfs/dbraw/zinc/58/49/26/1037584926.db2.gz AMULRZHPYCSPRT-IIVZCXTMSA-N 2 1 340.433 4.334 20 0 EIADMP C[C@@H]1C[C@@H]1C[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415365 1037584931 /nfs/dbraw/zinc/58/49/31/1037584931.db2.gz AMULRZHPYCSPRT-IIVZCXTMSA-N 2 1 340.433 4.334 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)cc1F ZINC000488434020 1037591553 /nfs/dbraw/zinc/59/15/53/1037591553.db2.gz IITDCFVMKQOGRM-YJBOKZPZSA-N 2 1 347.503 4.330 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000573596136 1037596202 /nfs/dbraw/zinc/59/62/02/1037596202.db2.gz CXUZOHUXCCXLCQ-XBNGYDHASA-N 2 1 340.433 4.430 20 0 EIADMP COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422758371 1037818298 /nfs/dbraw/zinc/81/82/98/1037818298.db2.gz IXNYKFHPIGXIJY-ONYGOOLBSA-N 2 1 336.907 4.308 20 0 EIADMP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c2ccccc21 ZINC000422792885 1037839726 /nfs/dbraw/zinc/83/97/26/1037839726.db2.gz ZYSCPOHCGXBQJG-GOTSBHOMSA-N 3 1 349.522 4.297 20 0 EIADMP CCN(CC)[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)c1ccsc1 ZINC000422868786 1037855763 /nfs/dbraw/zinc/85/57/63/1037855763.db2.gz WAUGUVVCDYFZMO-VNTMZGSJSA-N 2 1 349.588 4.031 20 0 EIADMP C[C@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000422871098 1037859171 /nfs/dbraw/zinc/85/91/71/1037859171.db2.gz ZTNKZTZETRYJIZ-DZGCQCFKSA-N 2 1 341.480 4.034 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CN[C@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000422874198 1037859378 /nfs/dbraw/zinc/85/93/78/1037859378.db2.gz CGFMFZGQGORYSN-VSDWSMLSSA-N 2 1 349.522 4.153 20 0 EIADMP COc1ccc([C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])c2ccccc2Cl)cc1 ZINC000422920422 1037880780 /nfs/dbraw/zinc/88/07/80/1037880780.db2.gz LYSLNFKLKZVEED-KSMMKXTCSA-N 2 1 332.875 4.153 20 0 EIADMP CC[C@@H](C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000414706130 1037887980 /nfs/dbraw/zinc/88/79/80/1037887980.db2.gz AABSGHUCWCBEAR-UGKGYDQZSA-N 2 1 337.511 4.220 20 0 EIADMP Fc1ccc(C[C@H]([NH2+]C2CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000423189702 1038044573 /nfs/dbraw/zinc/04/45/73/1038044573.db2.gz RBGMTNHEJLDYSA-IBGZPJMESA-N 2 1 332.850 4.105 20 0 EIADMP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cc2ccccc2s1 ZINC000423191790 1038044672 /nfs/dbraw/zinc/04/46/72/1038044672.db2.gz TZTPFVYPBGCHJC-HNNXBMFYSA-N 2 1 325.481 4.127 20 0 EIADMP COc1ccc2cc([C@H](C)[NH2+]CCC[NH2+]Cc3cccnc3)ccc2c1 ZINC000423190696 1038047073 /nfs/dbraw/zinc/04/70/73/1038047073.db2.gz RLVTYCYOWNSRGY-KRWDZBQOSA-N 2 1 349.478 4.074 20 0 EIADMP CCC([NH3+])(CC)C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000423288173 1038091731 /nfs/dbraw/zinc/09/17/31/1038091731.db2.gz QVLYKHGIYALKDC-GOSISDBHSA-N 2 1 331.891 4.126 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CCCO2 ZINC000489582802 1038127525 /nfs/dbraw/zinc/12/75/25/1038127525.db2.gz IREUETYDYFMPAB-OAQYLSRUSA-N 2 1 342.527 4.488 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000423385007 1038194703 /nfs/dbraw/zinc/19/47/03/1038194703.db2.gz QTDRODSTLWSJGN-UMVBOHGHSA-N 2 1 334.410 4.232 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+]Cc1cccc(OCc2ccccc2F)c1 ZINC000504109700 1038215350 /nfs/dbraw/zinc/21/53/50/1038215350.db2.gz LAHQTVONCKAYDW-UHFFFAOYSA-N 2 1 344.474 4.225 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1cccc(OCc2ccccc2F)c1 ZINC000504109700 1038215361 /nfs/dbraw/zinc/21/53/61/1038215361.db2.gz LAHQTVONCKAYDW-UHFFFAOYSA-N 2 1 344.474 4.225 20 0 EIADMP C[C@@H]([NH3+])[C@H](C)[NH2+][C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423435289 1038236583 /nfs/dbraw/zinc/23/65/83/1038236583.db2.gz DNIZTMRGBXCOEW-VGMNWLOBSA-N 2 1 328.300 4.111 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1)c1ccc(F)cn1 ZINC000490123229 1038352174 /nfs/dbraw/zinc/35/21/74/1038352174.db2.gz AGLZZUVUAXUEJD-IBGZPJMESA-N 2 1 329.463 4.302 20 0 EIADMP CC[N@H+]1CC[C@H](CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167134 1038365753 /nfs/dbraw/zinc/36/57/53/1038365753.db2.gz FYARYIKMISZVGT-UZLBHIALSA-N 2 1 328.887 4.361 20 0 EIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167134 1038365772 /nfs/dbraw/zinc/36/57/72/1038365772.db2.gz FYARYIKMISZVGT-UZLBHIALSA-N 2 1 328.887 4.361 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167134 1038365787 /nfs/dbraw/zinc/36/57/87/1038365787.db2.gz FYARYIKMISZVGT-UZLBHIALSA-N 2 1 328.887 4.361 20 0 EIADMP c1coc([C@@H]2CC[NH+](CCCCC[N@H+]3CC[C@@H](c4ccco4)C3)C2)c1 ZINC000607152484 1038395694 /nfs/dbraw/zinc/39/56/94/1038395694.db2.gz YNOXRAYMXQLHBM-RTBURBONSA-N 2 1 342.483 4.322 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000594974525 1038484885 /nfs/dbraw/zinc/48/48/85/1038484885.db2.gz KYCKVHZPXJOSOG-MJGOQNOKSA-N 2 1 332.557 4.162 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000594974525 1038484898 /nfs/dbraw/zinc/48/48/98/1038484898.db2.gz KYCKVHZPXJOSOG-MJGOQNOKSA-N 2 1 332.557 4.162 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000594974524 1038485535 /nfs/dbraw/zinc/48/55/35/1038485535.db2.gz KYCKVHZPXJOSOG-IEBWSBKVSA-N 2 1 332.557 4.162 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000594974524 1038485537 /nfs/dbraw/zinc/48/55/37/1038485537.db2.gz KYCKVHZPXJOSOG-IEBWSBKVSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cccc(C[NH+](C)C)c1 ZINC000924968402 1038679644 /nfs/dbraw/zinc/67/96/44/1038679644.db2.gz BBRYVIKRBHZCBR-CQSZACIVSA-N 2 1 331.529 4.353 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc2ccnc(Cl)c2s1 ZINC000894288392 1038751884 /nfs/dbraw/zinc/75/18/84/1038751884.db2.gz UBCIFXSRRLTJJH-UHFFFAOYSA-N 2 1 334.876 4.025 20 0 EIADMP c1ccc(CC[C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000480763303 1038803421 /nfs/dbraw/zinc/80/34/21/1038803421.db2.gz MJCOBARYOHFAJA-REWPJTCUSA-N 2 1 334.507 4.434 20 0 EIADMP CC[NH+]1CCN(CCCC[NH2+][C@H](CC(C)C)c2ccccc2C)CC1 ZINC000480783082 1038805689 /nfs/dbraw/zinc/80/56/89/1038805689.db2.gz YNEGKIYWZAIORA-JOCHJYFZSA-N 2 1 345.575 4.090 20 0 EIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000480772781 1038809725 /nfs/dbraw/zinc/80/97/25/1038809725.db2.gz GOTWPMAUYRBWQB-ZBFHGGJFSA-N 2 1 338.948 4.285 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@H+](C)C[C@@H](C[NH3+])c1ccc(F)cc1 ZINC000424306880 1038814135 /nfs/dbraw/zinc/81/41/35/1038814135.db2.gz WESBYVAKFLBRDK-UKRRQHHQSA-N 2 1 343.471 4.171 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@@H+](C)C[C@@H](C[NH3+])c1ccc(F)cc1 ZINC000424306880 1038814136 /nfs/dbraw/zinc/81/41/36/1038814136.db2.gz WESBYVAKFLBRDK-UKRRQHHQSA-N 2 1 343.471 4.171 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424378989 1038839807 /nfs/dbraw/zinc/83/98/07/1038839807.db2.gz UUGOOVIVNZRSCW-IUIKQTSFSA-N 2 1 333.476 4.178 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000504926311 1038857589 /nfs/dbraw/zinc/85/75/89/1038857589.db2.gz HWNZODOSUZOXCJ-QXSJWSMHSA-N 2 1 340.433 4.414 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539201328 1038878786 /nfs/dbraw/zinc/87/87/86/1038878786.db2.gz WTWIIUSWZHCSHY-KSSFIOAISA-N 2 1 340.433 4.478 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCCC[N@@H+]2C)cc1OCC ZINC000539269211 1038901378 /nfs/dbraw/zinc/90/13/78/1038901378.db2.gz CAWSSLQGGLLHGU-FUHWJXTLSA-N 2 1 334.504 4.009 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCCC[N@H+]2C)cc1OCC ZINC000539269211 1038901407 /nfs/dbraw/zinc/90/14/07/1038901407.db2.gz CAWSSLQGGLLHGU-FUHWJXTLSA-N 2 1 334.504 4.009 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000462107913 1038912576 /nfs/dbraw/zinc/91/25/76/1038912576.db2.gz JBZRSKKPICQGMG-APHBMKBZSA-N 2 1 329.315 4.387 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000462107913 1038912588 /nfs/dbraw/zinc/91/25/88/1038912588.db2.gz JBZRSKKPICQGMG-APHBMKBZSA-N 2 1 329.315 4.387 20 0 EIADMP Cc1cnc(CC[N@@H+](C)CC(C)(C)C[NH+](C)Cc2ccccc2)s1 ZINC000537621357 1038968509 /nfs/dbraw/zinc/96/85/09/1038968509.db2.gz KQRDSGYADINCMB-UHFFFAOYSA-N 2 1 345.556 4.084 20 0 EIADMP Cc1cnc(CC[N@H+](C)CC(C)(C)C[NH+](C)Cc2ccccc2)s1 ZINC000537621357 1038968535 /nfs/dbraw/zinc/96/85/35/1038968535.db2.gz KQRDSGYADINCMB-UHFFFAOYSA-N 2 1 345.556 4.084 20 0 EIADMP Cc1cnc(CC[NH+](C)CC(C)(C)C[N@H+](C)Cc2ccccc2)s1 ZINC000537621357 1038968564 /nfs/dbraw/zinc/96/85/64/1038968564.db2.gz KQRDSGYADINCMB-UHFFFAOYSA-N 2 1 345.556 4.084 20 0 EIADMP Cc1cnc(CC[NH+](C)CC(C)(C)C[N@@H+](C)Cc2ccccc2)s1 ZINC000537621357 1038968580 /nfs/dbraw/zinc/96/85/80/1038968580.db2.gz KQRDSGYADINCMB-UHFFFAOYSA-N 2 1 345.556 4.084 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000481037758 1038988969 /nfs/dbraw/zinc/98/89/69/1038988969.db2.gz MXZOEKCCSCVWBB-BLLLJJGKSA-N 2 1 327.299 4.302 20 0 EIADMP c1ccc(CC(Cc2ccccc2)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000378931085 1039040272 /nfs/dbraw/zinc/04/02/72/1039040272.db2.gz YIYROVRNYOVJIR-JTHBVZDNSA-N 2 1 334.507 4.057 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC[N@@H+]1C ZINC000552043413 1039064549 /nfs/dbraw/zinc/06/45/49/1039064549.db2.gz LVAHWQDGHUGHOR-VMGRFDJRSA-N 2 1 342.405 4.109 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC[N@H+]1C ZINC000552043413 1039064567 /nfs/dbraw/zinc/06/45/67/1039064567.db2.gz LVAHWQDGHUGHOR-VMGRFDJRSA-N 2 1 342.405 4.109 20 0 EIADMP CC[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CCOCC1 ZINC000552045320 1039065870 /nfs/dbraw/zinc/06/58/70/1039065870.db2.gz CYNOXBPYIUZFFU-LZBANZJXSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1cccc(F)c1 ZINC000481184834 1039088103 /nfs/dbraw/zinc/08/81/03/1039088103.db2.gz GAMOIFNXJKCGGH-GCJKJVERSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1cccc(F)c1 ZINC000481184834 1039088122 /nfs/dbraw/zinc/08/81/22/1039088122.db2.gz GAMOIFNXJKCGGH-GCJKJVERSA-N 2 1 340.486 4.259 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@H]1C ZINC000552070779 1039095594 /nfs/dbraw/zinc/09/55/94/1039095594.db2.gz DJZFMJRANKPBFA-QAPCUYQASA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@H]1C ZINC000552070779 1039095614 /nfs/dbraw/zinc/09/56/14/1039095614.db2.gz DJZFMJRANKPBFA-QAPCUYQASA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@H]1C ZINC000552070779 1039095638 /nfs/dbraw/zinc/09/56/38/1039095638.db2.gz DJZFMJRANKPBFA-QAPCUYQASA-N 2 1 330.447 4.390 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3cccc(Cl)c3F)CCCC2)CC[N@H+]1C ZINC000477864122 1039143418 /nfs/dbraw/zinc/14/34/18/1039143418.db2.gz ZUZJOOCGZVMZSM-GJZGRUSLSA-N 2 1 338.898 4.363 20 0 EIADMP CCOCCC1(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCC1 ZINC000090457093 1039232213 /nfs/dbraw/zinc/23/22/13/1039232213.db2.gz GCQLCFUFOGKIAR-QGZVFWFLSA-N 2 1 341.499 4.428 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000481298673 1039232917 /nfs/dbraw/zinc/23/29/17/1039232917.db2.gz INBDZTSAJOQWME-UWJYYQICSA-N 2 1 344.449 4.180 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)[C@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000481322924 1039291410 /nfs/dbraw/zinc/29/14/10/1039291410.db2.gz NYEMHFXCEYJGSL-HZSPNIEDSA-N 2 1 345.314 4.081 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000691 1039294203 /nfs/dbraw/zinc/29/42/03/1039294203.db2.gz IQXGHXSNVQBBMJ-HUUCEWRRSA-N 2 1 328.422 4.430 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000691 1039294222 /nfs/dbraw/zinc/29/42/22/1039294222.db2.gz IQXGHXSNVQBBMJ-HUUCEWRRSA-N 2 1 328.422 4.430 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)CC[N@@H+]1C ZINC000513830998 1039309748 /nfs/dbraw/zinc/30/97/48/1039309748.db2.gz IGXRHLLXUZDFMM-ZHALLVOQSA-N 2 1 328.500 4.285 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)CC[N@H+]1C ZINC000513830998 1039309766 /nfs/dbraw/zinc/30/97/66/1039309766.db2.gz IGXRHLLXUZDFMM-ZHALLVOQSA-N 2 1 328.500 4.285 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)[C@@H]2COc3ccccc32)cc1 ZINC000090845040 1039310016 /nfs/dbraw/zinc/31/00/16/1039310016.db2.gz NZYHVNFHVORNQK-ZOCZFRKYSA-N 2 1 347.462 4.396 20 0 EIADMP C[C@@H]1C[C@@H](N(C)Cc2ccc(Cl)o2)CC[N@H+]1Cc1ccccc1 ZINC000552256658 1039319401 /nfs/dbraw/zinc/31/94/01/1039319401.db2.gz WJTLDRFBMCGRFR-WBVHZDCISA-N 2 1 332.875 4.418 20 0 EIADMP CC[N@@H+](C)Cc1cccc(CNCc2conc2Cc2ccccc2)c1 ZINC000555537800 1039354606 /nfs/dbraw/zinc/35/46/06/1039354606.db2.gz XPZZLROWZPEVTE-UHFFFAOYSA-N 2 1 349.478 4.007 20 0 EIADMP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2conc2Cc2ccccc2)c1 ZINC000555537800 1039354622 /nfs/dbraw/zinc/35/46/22/1039354622.db2.gz XPZZLROWZPEVTE-UHFFFAOYSA-N 2 1 349.478 4.007 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2conc2Cc2ccccc2)c1 ZINC000555537800 1039354631 /nfs/dbraw/zinc/35/46/31/1039354631.db2.gz XPZZLROWZPEVTE-UHFFFAOYSA-N 2 1 349.478 4.007 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](CCOC)c2ccccc2)CC1 ZINC000534543247 1039536786 /nfs/dbraw/zinc/53/67/86/1039536786.db2.gz NZLCBUBJJYPDOB-NRFANRHFSA-N 2 1 332.532 4.208 20 0 EIADMP CCOCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000514103473 1039609242 /nfs/dbraw/zinc/60/92/42/1039609242.db2.gz CIONWXYZOWWFHF-YPAWHYETSA-N 2 1 344.543 4.084 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(Cl)c(Cl)c3)C2)CC1 ZINC000555801183 1039640760 /nfs/dbraw/zinc/64/07/60/1039640760.db2.gz LNHNTRLMLQUUQK-OAHLLOKOSA-N 2 1 327.299 4.157 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(CC)s2)[C@@H](C)C1 ZINC000122343852 1039656235 /nfs/dbraw/zinc/65/62/35/1039656235.db2.gz VJBVKJMUFCTYPB-JZXOWHBKSA-N 2 1 338.561 4.098 20 0 EIADMP COc1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c2ccccc12 ZINC000537646993 1039801132 /nfs/dbraw/zinc/80/11/32/1039801132.db2.gz GJHORJCAEXESPP-GOSISDBHSA-N 2 1 338.495 4.156 20 0 EIADMP Cc1cccc2oc(CC[NH2+][C@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)nc21 ZINC000551038890 1039896101 /nfs/dbraw/zinc/89/61/01/1039896101.db2.gz HAAJWKBZIUBWCU-RBUKOAKNSA-N 2 1 349.478 4.104 20 0 EIADMP Cc1cccc2oc(CC[NH2+][C@H]3CC[N@H+](C)[C@@H](c4ccccc4)C3)nc21 ZINC000551038890 1039896107 /nfs/dbraw/zinc/89/61/07/1039896107.db2.gz HAAJWKBZIUBWCU-RBUKOAKNSA-N 2 1 349.478 4.104 20 0 EIADMP CN(C)c1ccccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000567851431 1039928128 /nfs/dbraw/zinc/92/81/28/1039928128.db2.gz HQAAAEPWXSJPKA-NRFANRHFSA-N 2 1 349.522 4.039 20 0 EIADMP COc1c(C)c[nH+]c(CN2CCC([N@H+](C)CCC(C)(C)C)CC2)c1C ZINC000535077553 1039947999 /nfs/dbraw/zinc/94/79/99/1039947999.db2.gz NGCDDPMXMYZDBY-UHFFFAOYSA-N 2 1 347.547 4.039 20 0 EIADMP COc1c(C)c[nH+]c(CN2CCC([N@@H+](C)CCC(C)(C)C)CC2)c1C ZINC000535077553 1039948017 /nfs/dbraw/zinc/94/80/17/1039948017.db2.gz NGCDDPMXMYZDBY-UHFFFAOYSA-N 2 1 347.547 4.039 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1c(F)cccc1F ZINC000505585206 1039967969 /nfs/dbraw/zinc/96/79/69/1039967969.db2.gz DNEZGWHGDLHKGS-UHFFFAOYSA-N 2 1 345.437 4.098 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000551093862 1039976203 /nfs/dbraw/zinc/97/62/03/1039976203.db2.gz USDSVXNNNIXPEE-IBGZPJMESA-N 2 1 336.470 4.266 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCNc2cccc(F)c2)C[C@H]1c1ccccc1 ZINC000551170357 1040016204 /nfs/dbraw/zinc/01/62/04/1040016204.db2.gz SVFBJGBZJQMLIK-RTWAWAEBSA-N 2 1 341.474 4.053 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCNc2cccc(F)c2)C[C@H]1c1ccccc1 ZINC000551170357 1040016229 /nfs/dbraw/zinc/01/62/29/1040016229.db2.gz SVFBJGBZJQMLIK-RTWAWAEBSA-N 2 1 341.474 4.053 20 0 EIADMP CNc1ccc(C[N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000712114654 1040026442 /nfs/dbraw/zinc/02/64/42/1040026442.db2.gz IPIIAJYNWFCCJP-UHFFFAOYSA-N 2 1 337.511 4.072 20 0 EIADMP CC(C)=CCC[C@H](C)CC[NH+]1CCN(CC[N@@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000482141708 1040049539 /nfs/dbraw/zinc/04/95/39/1040049539.db2.gz KXFSMXPDTQZBGV-FDFHNCONSA-N 2 1 349.607 4.249 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551206157 1040061967 /nfs/dbraw/zinc/06/19/67/1040061967.db2.gz WNAFQKHDCWJHBS-CQSZACIVSA-N 2 1 349.931 4.285 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551206157 1040061981 /nfs/dbraw/zinc/06/19/81/1040061981.db2.gz WNAFQKHDCWJHBS-CQSZACIVSA-N 2 1 349.931 4.285 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccccc2OC(F)(F)F)C1 ZINC000482341206 1040190054 /nfs/dbraw/zinc/19/00/54/1040190054.db2.gz CWSYSTDUTCLBEU-HUUCEWRRSA-N 2 1 344.421 4.356 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccccc2OC(F)(F)F)C1 ZINC000482341206 1040190076 /nfs/dbraw/zinc/19/00/76/1040190076.db2.gz CWSYSTDUTCLBEU-HUUCEWRRSA-N 2 1 344.421 4.356 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)C1 ZINC000482355200 1040196114 /nfs/dbraw/zinc/19/61/14/1040196114.db2.gz FKRXCVUQOCIMEU-LSDHHAIUSA-N 2 1 344.421 4.356 20 0 EIADMP Cc1cccc2c1CC[C@H]2[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482455385 1040265060 /nfs/dbraw/zinc/26/50/60/1040265060.db2.gz YMTMZFLTWBKIGT-NFBKMPQASA-N 2 1 334.507 4.137 20 0 EIADMP Cc1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482455386 1040265877 /nfs/dbraw/zinc/26/58/77/1040265877.db2.gz YMTMZFLTWBKIGT-NZQKXSOJSA-N 2 1 334.507 4.137 20 0 EIADMP C[C@H](C[N@H+]1CCC[C@H]2C[NH+](C)CC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890644 1040328696 /nfs/dbraw/zinc/32/86/96/1040328696.db2.gz KVYNOJCNKJXPKN-UWWQBHOKSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CCC[C@H]2C[N@H+](C)CC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890644 1040328714 /nfs/dbraw/zinc/32/87/14/1040328714.db2.gz KVYNOJCNKJXPKN-UWWQBHOKSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CCC[C@H]2C[N@@H+](C)CC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890644 1040328735 /nfs/dbraw/zinc/32/87/35/1040328735.db2.gz KVYNOJCNKJXPKN-UWWQBHOKSA-N 2 1 340.433 4.225 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000667493845 1040377515 /nfs/dbraw/zinc/37/75/15/1040377515.db2.gz FKIBXXQBILIGDE-UHFFFAOYSA-N 2 1 343.540 4.423 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000667493845 1040377530 /nfs/dbraw/zinc/37/75/30/1040377530.db2.gz FKIBXXQBILIGDE-UHFFFAOYSA-N 2 1 343.540 4.423 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(Br)c2C)C[C@@H]1C ZINC000535585295 1040387842 /nfs/dbraw/zinc/38/78/42/1040387842.db2.gz LMYGJAYGHLZJDU-XJKSGUPXSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(Br)c2C)C[C@@H]1C ZINC000535585295 1040387858 /nfs/dbraw/zinc/38/78/58/1040387858.db2.gz LMYGJAYGHLZJDU-XJKSGUPXSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(Br)c2C)C[C@@H]1C ZINC000535585295 1040387880 /nfs/dbraw/zinc/38/78/80/1040387880.db2.gz LMYGJAYGHLZJDU-XJKSGUPXSA-N 2 1 339.321 4.062 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2ccccc2OC(F)F)C1 ZINC000515020059 1040419881 /nfs/dbraw/zinc/41/98/81/1040419881.db2.gz MSXKPCDSPVCMGH-UVQBRAAOSA-N 2 1 338.442 4.013 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1nccc2ccccc21 ZINC000515019136 1040436003 /nfs/dbraw/zinc/43/60/03/1040436003.db2.gz HZSYULOATZWXPC-FGTMMUONSA-N 2 1 325.500 4.253 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1nccc2ccccc21 ZINC000515019136 1040436011 /nfs/dbraw/zinc/43/60/11/1040436011.db2.gz HZSYULOATZWXPC-FGTMMUONSA-N 2 1 325.500 4.253 20 0 EIADMP c1ccc(COc2ccccc2C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666999577 1040439356 /nfs/dbraw/zinc/43/93/56/1040439356.db2.gz ZPLDODNPTQOHRN-FQEVSTJZSA-N 2 1 336.479 4.030 20 0 EIADMP FC(F)Oc1ccc2ccccc2c1C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666999536 1040442281 /nfs/dbraw/zinc/44/22/81/1040442281.db2.gz TUBVFENPSPHNCM-HNNXBMFYSA-N 2 1 346.421 4.206 20 0 EIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000539508895 1040504659 /nfs/dbraw/zinc/50/46/59/1040504659.db2.gz BVDBEZRBYBVVLN-LSDHHAIUSA-N 2 1 325.456 4.487 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)CCCc1c[nH+]cn1C ZINC000568168911 1040635416 /nfs/dbraw/zinc/63/54/16/1040635416.db2.gz VZWQXWANJWABMB-CYBMUJFWSA-N 2 1 325.378 4.065 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CCCc1c[nH+]cn1C ZINC000568168911 1040635421 /nfs/dbraw/zinc/63/54/21/1040635421.db2.gz VZWQXWANJWABMB-CYBMUJFWSA-N 2 1 325.378 4.065 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3cc4ccncc4s3)C2)CC1 ZINC000667561327 1040702414 /nfs/dbraw/zinc/70/24/14/1040702414.db2.gz SLSZTDWNHLZAEE-QGZVFWFLSA-N 2 1 343.540 4.240 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3cc4ccncc4s3)C2)CC1 ZINC000667561327 1040702441 /nfs/dbraw/zinc/70/24/41/1040702441.db2.gz SLSZTDWNHLZAEE-QGZVFWFLSA-N 2 1 343.540 4.240 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(CC)cc2)[C@@H](C)C1 ZINC000479876917 1040738950 /nfs/dbraw/zinc/73/89/50/1040738950.db2.gz VJCIZYFQVPBEGG-WFXMLNOXSA-N 2 1 332.532 4.037 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cnc(-c3ccc(C)cc3)s2)[C@H](C)C1 ZINC000539835706 1040829622 /nfs/dbraw/zinc/82/96/22/1040829622.db2.gz PAMZFRRVIUKVTQ-VQIMIIECSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cnc(-c3ccc(C)cc3)s2)[C@H](C)C1 ZINC000539835706 1040829637 /nfs/dbraw/zinc/82/96/37/1040829637.db2.gz PAMZFRRVIUKVTQ-VQIMIIECSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cnc(-c3ccc(C)cc3)s2)[C@H](C)C1 ZINC000539835706 1040829640 /nfs/dbraw/zinc/82/96/40/1040829640.db2.gz PAMZFRRVIUKVTQ-VQIMIIECSA-N 2 1 343.540 4.281 20 0 EIADMP C[C@@H](c1ccsc1)[NH+]1CCN(c2cc[nH+]c3cc(F)ccc32)CC1 ZINC000462693312 1040844240 /nfs/dbraw/zinc/84/42/40/1040844240.db2.gz UVTJORDZQVHVQP-AWEZNQCLSA-N 2 1 341.455 4.319 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCCc3c(O)cccc32)CC1 ZINC000483432001 1040856143 /nfs/dbraw/zinc/85/61/43/1040856143.db2.gz FWASCXAQGRWKJI-TYCQWZJGSA-N 2 1 342.527 4.402 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3c(O)cccc32)CC1 ZINC000483431998 1040856403 /nfs/dbraw/zinc/85/64/03/1040856403.db2.gz FWASCXAQGRWKJI-HBGVWJBISA-N 2 1 342.527 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCOc3cccc4ccccc43)CC[C@H]21 ZINC000483485345 1040875620 /nfs/dbraw/zinc/87/56/20/1040875620.db2.gz RQPXRQZARCKAHI-TZIWHRDSSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCOc3cccc4ccccc43)CC[C@H]21 ZINC000483485345 1040875622 /nfs/dbraw/zinc/87/56/22/1040875622.db2.gz RQPXRQZARCKAHI-TZIWHRDSSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCOc3cccc4ccccc43)CC[C@H]21 ZINC000483485345 1040875625 /nfs/dbraw/zinc/87/56/25/1040875625.db2.gz RQPXRQZARCKAHI-TZIWHRDSSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCSc3ccccc3Cl)CC[C@H]21 ZINC000483504615 1040877114 /nfs/dbraw/zinc/87/71/14/1040877114.db2.gz RVVJURMMKKTPKA-DOTOQJQBSA-N 2 1 338.948 4.238 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)[N@@H+]2CCC[C@H](C)C2)C1 ZINC000467341015 1040902389 /nfs/dbraw/zinc/90/23/89/1040902389.db2.gz BJNMISQDZKNWBF-NBYUQASBSA-N 2 1 329.532 4.126 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)[N@H+]2CCC[C@H](C)C2)C1 ZINC000467341015 1040902412 /nfs/dbraw/zinc/90/24/12/1040902412.db2.gz BJNMISQDZKNWBF-NBYUQASBSA-N 2 1 329.532 4.126 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000537952087 1040920834 /nfs/dbraw/zinc/92/08/34/1040920834.db2.gz PJKBCEQAMVFONV-XMSQKQJNSA-N 2 1 338.495 4.004 20 0 EIADMP C[C@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000903160614 1040929586 /nfs/dbraw/zinc/92/95/86/1040929586.db2.gz RZMHVBILXVLOSN-PVCSLBTHSA-N 2 1 344.568 4.161 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000537964908 1040933512 /nfs/dbraw/zinc/93/35/12/1040933512.db2.gz KGLPODONKJGHIU-NEPJUHHUSA-N 2 1 326.271 4.485 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H](c3cccnc3)C3CC3)CC2)C1 ZINC000537947837 1040940116 /nfs/dbraw/zinc/94/01/16/1040940116.db2.gz LSGJGKZZOPDRDP-TYCQWZJGSA-N 2 1 327.516 4.165 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@H]3C)cc2)cc1 ZINC000537988485 1040964399 /nfs/dbraw/zinc/96/43/99/1040964399.db2.gz VGGQQABYWYUOLS-DRSNIGMVSA-N 2 1 338.495 4.181 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC000436241146 1040991796 /nfs/dbraw/zinc/99/17/96/1040991796.db2.gz QNCYICSGDBNDEB-JRFVFWCSSA-N 2 1 348.534 4.477 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)Cc1cccs1 ZINC000483760323 1041003875 /nfs/dbraw/zinc/00/38/75/1041003875.db2.gz WSHSLUSKWHWXFS-BBTUJRGHSA-N 2 1 342.552 4.427 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)Cc1cccs1 ZINC000483760323 1041003891 /nfs/dbraw/zinc/00/38/91/1041003891.db2.gz WSHSLUSKWHWXFS-BBTUJRGHSA-N 2 1 342.552 4.427 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000480147767 1041004683 /nfs/dbraw/zinc/00/46/83/1041004683.db2.gz KYTYJCBSJRAXIG-CQSZACIVSA-N 2 1 347.503 4.394 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cc3c(cccc3F)[nH]2)C1 ZINC000436277035 1041023724 /nfs/dbraw/zinc/02/37/24/1041023724.db2.gz VXSUHGGWGIORDW-IYBDPMFKSA-N 2 1 331.479 4.155 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000480178104 1041041460 /nfs/dbraw/zinc/04/14/60/1041041460.db2.gz IAYADEDUDVPNBD-AWEZNQCLSA-N 2 1 332.410 4.009 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000480178104 1041041473 /nfs/dbraw/zinc/04/14/73/1041041473.db2.gz IAYADEDUDVPNBD-AWEZNQCLSA-N 2 1 332.410 4.009 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)C1 ZINC000462889311 1041051205 /nfs/dbraw/zinc/05/12/05/1041051205.db2.gz SJINKFOZHFMYAK-SJORKVTESA-N 2 1 327.516 4.156 20 0 EIADMP c1cc(-c2n[nH]cc2C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cs1 ZINC000436290023 1041055111 /nfs/dbraw/zinc/05/51/11/1041055111.db2.gz YHVNYFTUJPJMQX-UHFFFAOYSA-N 2 1 344.528 4.025 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C ZINC000480189123 1041065132 /nfs/dbraw/zinc/06/51/32/1041065132.db2.gz BRDUOTFAJYKDQJ-MRXNPFEDSA-N 2 1 345.556 4.423 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000480189123 1041065148 /nfs/dbraw/zinc/06/51/48/1041065148.db2.gz BRDUOTFAJYKDQJ-MRXNPFEDSA-N 2 1 345.556 4.423 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C)cnn1-c1cccc(Cl)c1 ZINC000480190106 1041068160 /nfs/dbraw/zinc/06/81/60/1041068160.db2.gz DAYHCFBWMUDZBQ-OAHLLOKOSA-N 2 1 348.922 4.215 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCC[N@H+](C)C(C)C)cnn1-c1cccc(Cl)c1 ZINC000480190106 1041068166 /nfs/dbraw/zinc/06/81/66/1041068166.db2.gz DAYHCFBWMUDZBQ-OAHLLOKOSA-N 2 1 348.922 4.215 20 0 EIADMP 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 1041077242 /nfs/dbraw/zinc/07/72/42/1041077242.db2.gz NTILICQRBKONJP-VVMVDLBUSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(OCC(F)(F)F)cc1 ZINC000538163079 1041107312 /nfs/dbraw/zinc/10/73/12/1041107312.db2.gz PVHRFOXCJHKESP-HOCLYGCPSA-N 2 1 344.421 4.153 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccc(Oc3ccc(F)cc3)cc2)CC[N@H+]1C ZINC000540140581 1041162149 /nfs/dbraw/zinc/16/21/49/1041162149.db2.gz PCYQAEVBTZYWLR-QFBILLFUSA-N 2 1 342.458 4.233 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000540141004 1041162236 /nfs/dbraw/zinc/16/22/36/1041162236.db2.gz VIKRDUYHGRUDGB-SBHAEUEKSA-N 2 1 340.511 4.491 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1sccc1Br ZINC000540167470 1041208661 /nfs/dbraw/zinc/20/86/61/1041208661.db2.gz ZHHBAWZBPUKNSX-WDEREUQCSA-N 2 1 342.306 4.002 20 0 EIADMP C[C@H](CCCC(F)(F)F)[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000480333959 1041219824 /nfs/dbraw/zinc/21/98/24/1041219824.db2.gz MIVRAKADUOYMCP-OAHLLOKOSA-N 2 1 328.422 4.146 20 0 EIADMP C[C@H](CCCC(F)(F)F)[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000480333959 1041219840 /nfs/dbraw/zinc/21/98/40/1041219840.db2.gz MIVRAKADUOYMCP-OAHLLOKOSA-N 2 1 328.422 4.146 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1cccs1 ZINC000540162337 1041224186 /nfs/dbraw/zinc/22/41/86/1041224186.db2.gz BRNKLSPMHOHKAD-FXAWDEMLSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1cccs1 ZINC000540162337 1041224210 /nfs/dbraw/zinc/22/42/10/1041224210.db2.gz BRNKLSPMHOHKAD-FXAWDEMLSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1cc(Br)ccc1F ZINC000484464528 1041253623 /nfs/dbraw/zinc/25/36/23/1041253623.db2.gz DUJFLMUTKXAJPU-YUTCNCBUSA-N 2 1 343.284 4.112 20 0 EIADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc[nH+]c2ccccc21 ZINC000463063518 1041300133 /nfs/dbraw/zinc/30/01/33/1041300133.db2.gz HKFFKWKMAXEEHE-LJQANCHMSA-N 2 1 331.463 4.193 20 0 EIADMP Cc1ccccc1OCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463063899 1041300310 /nfs/dbraw/zinc/30/03/10/1041300310.db2.gz FTFGNRQFWPGFJU-FPOVZHCZSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1ccccc1OCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463063899 1041300322 /nfs/dbraw/zinc/30/03/22/1041300322.db2.gz FTFGNRQFWPGFJU-FPOVZHCZSA-N 2 1 338.495 4.017 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@H](Cc3ccccc3)C3CC3)CC2)cc1 ZINC000463120822 1041360078 /nfs/dbraw/zinc/36/00/78/1041360078.db2.gz ABEVCOAIOKBHRY-XMMPIXPASA-N 2 1 348.534 4.304 20 0 EIADMP CCCCn1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)c(C)n1 ZINC000540317772 1041364112 /nfs/dbraw/zinc/36/41/12/1041364112.db2.gz FMTUXAMLDOYUGC-LAUBAEHRSA-N 2 1 346.563 4.124 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463141466 1041374298 /nfs/dbraw/zinc/37/42/98/1041374298.db2.gz ZDONDTLABANVOK-TUNNFDKTSA-N 3 1 345.575 4.140 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463141466 1041374308 /nfs/dbraw/zinc/37/43/08/1041374308.db2.gz ZDONDTLABANVOK-TUNNFDKTSA-N 3 1 345.575 4.140 20 0 EIADMP C[C@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)c1ccccc1 ZINC000463149316 1041383338 /nfs/dbraw/zinc/38/33/38/1041383338.db2.gz YQRVMFIUIADSLK-GOSISDBHSA-N 2 1 340.486 4.226 20 0 EIADMP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463189775 1041405899 /nfs/dbraw/zinc/40/58/99/1041405899.db2.gz KYZRVALLUCBWLO-PDGJWGCVSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463189775 1041405905 /nfs/dbraw/zinc/40/59/05/1041405905.db2.gz KYZRVALLUCBWLO-PDGJWGCVSA-N 2 1 344.543 4.080 20 0 EIADMP CCS[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000463189497 1041406989 /nfs/dbraw/zinc/40/69/89/1041406989.db2.gz AKVUGFSKCALAPQ-RTWAWAEBSA-N 2 1 346.584 4.347 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2ccccc2n1 ZINC000480601914 1041411979 /nfs/dbraw/zinc/41/19/79/1041411979.db2.gz OMGXDUFGIPQFLD-KURKYZTESA-N 2 1 325.500 4.253 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(OC)c1 ZINC000480608405 1041419971 /nfs/dbraw/zinc/41/99/71/1041419971.db2.gz KUTNPWBQVZABKY-IRXDYDNUSA-N 2 1 334.504 4.009 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc(F)c(F)c(F)c1 ZINC000480606329 1041431216 /nfs/dbraw/zinc/43/12/16/1041431216.db2.gz DDHUWCMPJAZXFO-KBPBESRZSA-N 2 1 328.422 4.267 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000467554508 1041434026 /nfs/dbraw/zinc/43/40/26/1041434026.db2.gz OHSINPYAQIJJAL-PXNSSMCTSA-N 2 1 346.478 4.344 20 0 EIADMP Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000924668093 1041439583 /nfs/dbraw/zinc/43/95/83/1041439583.db2.gz OIPCMYGZFPIQCS-JKSUJKDBSA-N 2 1 341.499 4.374 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)CCC2 ZINC000480635084 1041448276 /nfs/dbraw/zinc/44/82/76/1041448276.db2.gz VNQCFUSMPGBVKH-JKSUJKDBSA-N 2 1 335.561 4.327 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]Cc3ccc(C4CC4)cc3)CC2)cc1 ZINC000463239930 1041448820 /nfs/dbraw/zinc/44/88/20/1041448820.db2.gz FCLKOYZTKRNSTL-UHFFFAOYSA-N 2 1 334.507 4.361 20 0 EIADMP C[N@@H+]1CC[C@H]2CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC000516221095 1041458025 /nfs/dbraw/zinc/45/80/25/1041458025.db2.gz OGIBKTARSPUBIY-ZEQRLZLVSA-N 2 1 348.534 4.114 20 0 EIADMP C[N@H+]1CC[C@H]2CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC000516221095 1041458029 /nfs/dbraw/zinc/45/80/29/1041458029.db2.gz OGIBKTARSPUBIY-ZEQRLZLVSA-N 2 1 348.534 4.114 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@H+](CC(Cc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC000516221095 1041458033 /nfs/dbraw/zinc/45/80/33/1041458033.db2.gz OGIBKTARSPUBIY-ZEQRLZLVSA-N 2 1 348.534 4.114 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@@H+](CC(Cc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC000516221095 1041458038 /nfs/dbraw/zinc/45/80/38/1041458038.db2.gz OGIBKTARSPUBIY-ZEQRLZLVSA-N 2 1 348.534 4.114 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cccc(C(C)C)c2)[C@@H](C)C1 ZINC000480674041 1041465528 /nfs/dbraw/zinc/46/55/28/1041465528.db2.gz WPLMDACGDOAROX-GHTZIAJQSA-N 2 1 332.532 4.037 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000516214729 1041466534 /nfs/dbraw/zinc/46/65/34/1041466534.db2.gz XIOJVDBSJZGDME-KBPBESRZSA-N 2 1 339.405 4.240 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)o1 ZINC000538718507 1041488344 /nfs/dbraw/zinc/48/83/44/1041488344.db2.gz WXAAEUYVXZCPEP-QGZVFWFLSA-N 2 1 342.458 4.312 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)o1 ZINC000538718507 1041488352 /nfs/dbraw/zinc/48/83/52/1041488352.db2.gz WXAAEUYVXZCPEP-QGZVFWFLSA-N 2 1 342.458 4.312 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463290707 1041488563 /nfs/dbraw/zinc/48/85/63/1041488563.db2.gz UCUIYQRKXLVBKS-FKVLARQCSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463290707 1041488566 /nfs/dbraw/zinc/48/85/66/1041488566.db2.gz UCUIYQRKXLVBKS-FKVLARQCSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463290712 1041489896 /nfs/dbraw/zinc/48/98/96/1041489896.db2.gz UCUIYQRKXLVBKS-YJMBLLCNSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463290712 1041489900 /nfs/dbraw/zinc/48/99/00/1041489900.db2.gz UCUIYQRKXLVBKS-YJMBLLCNSA-N 2 1 344.543 4.223 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@@H]1C ZINC000538719069 1041490060 /nfs/dbraw/zinc/49/00/60/1041490060.db2.gz JPKJEUARIVNSLD-KBXCAEBGSA-N 2 1 346.906 4.035 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@@H]1C ZINC000538719069 1041490067 /nfs/dbraw/zinc/49/00/67/1041490067.db2.gz JPKJEUARIVNSLD-KBXCAEBGSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@@H]1C ZINC000538719069 1041490072 /nfs/dbraw/zinc/49/00/72/1041490072.db2.gz JPKJEUARIVNSLD-KBXCAEBGSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@@H]1C ZINC000538719069 1041490078 /nfs/dbraw/zinc/49/00/78/1041490078.db2.gz JPKJEUARIVNSLD-KBXCAEBGSA-N 2 1 346.906 4.035 20 0 EIADMP CC1(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)Cc2ccccc2C1 ZINC000463290082 1041490141 /nfs/dbraw/zinc/49/01/41/1041490141.db2.gz ULVGFIVBXQOWKL-UHFFFAOYSA-N 2 1 348.534 4.088 20 0 EIADMP C[C@H]1C[NH+](CCCCC[N@H+]2CCC(F)(F)[C@@H](C)C2)CCC1(F)F ZINC000554946421 1041506698 /nfs/dbraw/zinc/50/66/98/1041506698.db2.gz SPUVNLAKEKBEGA-GJZGRUSLSA-N 2 1 338.433 4.111 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2OCc2ccccc2)C1 ZINC000538750187 1041523112 /nfs/dbraw/zinc/52/31/12/1041523112.db2.gz JDBCTXLQYNJRJF-FQEVSTJZSA-N 2 1 338.495 4.039 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2OCc2ccccc2)C1 ZINC000538750187 1041523125 /nfs/dbraw/zinc/52/31/25/1041523125.db2.gz JDBCTXLQYNJRJF-FQEVSTJZSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2OCc2ccccc2)C1 ZINC000538750187 1041523134 /nfs/dbraw/zinc/52/31/34/1041523134.db2.gz JDBCTXLQYNJRJF-FQEVSTJZSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2OCc2ccccc2)C1 ZINC000538750187 1041523139 /nfs/dbraw/zinc/52/31/39/1041523139.db2.gz JDBCTXLQYNJRJF-FQEVSTJZSA-N 2 1 338.495 4.039 20 0 EIADMP COc1ccc2cc(C[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000538749722 1041523954 /nfs/dbraw/zinc/52/39/54/1041523954.db2.gz CEHOXUUDVVJLNO-IBGZPJMESA-N 2 1 338.495 4.156 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000538750071 1041524845 /nfs/dbraw/zinc/52/48/45/1041524845.db2.gz YGKOHAHQQPBYNM-MRXNPFEDSA-N 2 1 330.447 4.168 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000538750071 1041524864 /nfs/dbraw/zinc/52/48/64/1041524864.db2.gz YGKOHAHQQPBYNM-MRXNPFEDSA-N 2 1 330.447 4.168 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000538750071 1041524878 /nfs/dbraw/zinc/52/48/78/1041524878.db2.gz YGKOHAHQQPBYNM-MRXNPFEDSA-N 2 1 330.447 4.168 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000538750071 1041524889 /nfs/dbraw/zinc/52/48/89/1041524889.db2.gz YGKOHAHQQPBYNM-MRXNPFEDSA-N 2 1 330.447 4.168 20 0 EIADMP COc1ccc2cc(C[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000538749723 1041525380 /nfs/dbraw/zinc/52/53/80/1041525380.db2.gz CEHOXUUDVVJLNO-LJQANCHMSA-N 2 1 338.495 4.156 20 0 EIADMP CCC[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000540605223 1041558788 /nfs/dbraw/zinc/55/87/88/1041558788.db2.gz FTTIYBUNGYFKOT-QGZVFWFLSA-N 2 1 326.406 4.398 20 0 EIADMP CC[N@H+]1CC[C@H](Nc2ccc(C[NH+]3CCCC[C@H]3C)cc2)[C@H](C)C1 ZINC000540699433 1041614173 /nfs/dbraw/zinc/61/41/73/1041614173.db2.gz FDEHMQRWLSYIBQ-OPYAIIAOSA-N 2 1 329.532 4.203 20 0 EIADMP CC[NH+]1CC[C@H](Nc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)[C@H](C)C1 ZINC000540699433 1041614176 /nfs/dbraw/zinc/61/41/76/1041614176.db2.gz FDEHMQRWLSYIBQ-OPYAIIAOSA-N 2 1 329.532 4.203 20 0 EIADMP CC[NH+]1CC[C@H](Nc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)[C@H](C)C1 ZINC000540699433 1041614180 /nfs/dbraw/zinc/61/41/80/1041614180.db2.gz FDEHMQRWLSYIBQ-OPYAIIAOSA-N 2 1 329.532 4.203 20 0 EIADMP C[C@H]([NH2+]CCc1ccc(F)cc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000516802129 1041763311 /nfs/dbraw/zinc/76/33/11/1041763311.db2.gz LSPNPISOOLLEDR-LPHOPBHVSA-N 2 1 344.449 4.008 20 0 EIADMP CSC1(C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000516822415 1041774286 /nfs/dbraw/zinc/77/42/86/1041774286.db2.gz RHMOIXYPNLBTRD-HKUYNNGSSA-N 2 1 332.557 4.162 20 0 EIADMP CC(C)(C)[C@H]1CCC[NH+]1CC1(C[N@@H+]2CCC[C@@H]2C(C)(C)C)COC1 ZINC000541071929 1041798137 /nfs/dbraw/zinc/79/81/37/1041798137.db2.gz RDLDVISRDQIQPI-QZTJIDSGSA-N 2 1 336.564 4.024 20 0 EIADMP Cn1ccnc1C[C@@H]1CCC[N@H+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000437791854 1041912381 /nfs/dbraw/zinc/91/23/81/1041912381.db2.gz HTYPVOCBVOQNKU-VCOUNFBDSA-N 2 1 337.511 4.185 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2ccco2)c2ccccc2)C1 ZINC000541549257 1042007231 /nfs/dbraw/zinc/00/72/31/1042007231.db2.gz PWOUUFIZYRXYQX-RXVVDRJESA-N 2 1 326.484 4.471 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)Cc2ccccc2F)CC1 ZINC000438091593 1042041315 /nfs/dbraw/zinc/04/13/15/1042041315.db2.gz ZNCJYKFFFQNQJU-SFHVURJKSA-N 2 1 340.486 4.319 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)C1 ZINC000438119944 1042061877 /nfs/dbraw/zinc/06/18/77/1042061877.db2.gz LAFTUKSKZIACIF-QGQQZZQASA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000438119944 1042061888 /nfs/dbraw/zinc/06/18/88/1042061888.db2.gz LAFTUKSKZIACIF-QGQQZZQASA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000438119944 1042061900 /nfs/dbraw/zinc/06/19/00/1042061900.db2.gz LAFTUKSKZIACIF-QGQQZZQASA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000438119944 1042061907 /nfs/dbraw/zinc/06/19/07/1042061907.db2.gz LAFTUKSKZIACIF-QGQQZZQASA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000438119944 1042061911 /nfs/dbraw/zinc/06/19/11/1042061911.db2.gz LAFTUKSKZIACIF-QGQQZZQASA-N 2 1 338.539 4.446 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000425955266 1042074746 /nfs/dbraw/zinc/07/47/46/1042074746.db2.gz RCDOQFNMVUDLCH-FQEVSTJZSA-N 2 1 343.902 4.093 20 0 EIADMP CC[NH+](CC)CCC[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000425958172 1042081817 /nfs/dbraw/zinc/08/18/17/1042081817.db2.gz LXUVYVQFLWVHCH-HXUWFJFHSA-N 2 1 345.918 4.340 20 0 EIADMP C[C@H]1[N@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)CCC12CCOCC2 ZINC000541779805 1042103051 /nfs/dbraw/zinc/10/30/51/1042103051.db2.gz KAECZXIUBFYZIJ-LJQANCHMSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@H]1[N@@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)CCC12CCOCC2 ZINC000541779805 1042103055 /nfs/dbraw/zinc/10/30/55/1042103055.db2.gz KAECZXIUBFYZIJ-LJQANCHMSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@H]1[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)CCC12CCOCC2 ZINC000541779805 1042103062 /nfs/dbraw/zinc/10/30/62/1042103062.db2.gz KAECZXIUBFYZIJ-LJQANCHMSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@H]1[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CCC12CCOCC2 ZINC000541779805 1042103069 /nfs/dbraw/zinc/10/30/69/1042103069.db2.gz KAECZXIUBFYZIJ-LJQANCHMSA-N 2 1 344.543 4.036 20 0 EIADMP Cc1cc(NC2CC[NH+](CC3CC3)CC2)c[nH+]c1N1CCCC[C@H]1C ZINC000541881588 1042156490 /nfs/dbraw/zinc/15/64/90/1042156490.db2.gz MHLUOVBQDDIACS-QGZVFWFLSA-N 2 1 342.531 4.055 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCCSc2ccccc2Cl)C1 ZINC000464774792 1042157098 /nfs/dbraw/zinc/15/70/98/1042157098.db2.gz IVXWGEAQVWFTLR-INIZCTEOSA-N 2 1 340.964 4.486 20 0 EIADMP C[C@H](C[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C[NH+]1CCCC1 ZINC000518272600 1042445081 /nfs/dbraw/zinc/44/50/81/1042445081.db2.gz LLCZXCSDMSPMSZ-GFCCVEGCSA-N 2 1 334.813 4.180 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+]C2(Cc3ccc(Cl)cc3)CCC2)s1 ZINC000491581288 1042471926 /nfs/dbraw/zinc/47/19/26/1042471926.db2.gz KYGKMUHURKKXQM-UHFFFAOYSA-N 2 1 349.931 4.113 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCOc2ccc(F)cc2)C1 ZINC000303603347 1042483624 /nfs/dbraw/zinc/48/36/24/1042483624.db2.gz NYEWPCQBRHPXPM-MOPGFXCFSA-N 2 1 348.506 4.181 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCOc2ccc(F)cc2)C1 ZINC000303603347 1042483628 /nfs/dbraw/zinc/48/36/28/1042483628.db2.gz NYEWPCQBRHPXPM-MOPGFXCFSA-N 2 1 348.506 4.181 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCOc2ccc(F)cc2)C1 ZINC000303603347 1042483633 /nfs/dbraw/zinc/48/36/33/1042483633.db2.gz NYEWPCQBRHPXPM-MOPGFXCFSA-N 2 1 348.506 4.181 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000426289005 1042514061 /nfs/dbraw/zinc/51/40/61/1042514061.db2.gz FJHMJMMQTCHPLV-BVYCBKJFSA-N 2 1 344.543 4.099 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccc(F)c(F)c2)cc1F ZINC000173350716 1042567055 /nfs/dbraw/zinc/56/70/55/1042567055.db2.gz HMTNEBBGYVSRLK-GFCCVEGCSA-N 2 1 345.368 4.449 20 0 EIADMP [NH3+]CCCc1cn(C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccccc12 ZINC001167964637 1042658314 /nfs/dbraw/zinc/65/83/14/1042658314.db2.gz VFKGOSRUGKVZHF-YOFSQIOKSA-N 2 1 337.511 4.111 20 0 EIADMP Cc1cc(C)c(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1C ZINC000518766175 1042675356 /nfs/dbraw/zinc/67/53/56/1042675356.db2.gz HEKCATGSCQJUAQ-UHFFFAOYSA-N 2 1 336.523 4.409 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000506688649 1042775662 /nfs/dbraw/zinc/77/56/62/1042775662.db2.gz JZPPUUFMYCJRJK-UHFFFAOYSA-N 2 1 332.488 4.470 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000506688649 1042775667 /nfs/dbraw/zinc/77/56/67/1042775667.db2.gz JZPPUUFMYCJRJK-UHFFFAOYSA-N 2 1 332.488 4.470 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)o1 ZINC000519021094 1042793952 /nfs/dbraw/zinc/79/39/52/1042793952.db2.gz BSUVGUZKDBKTDS-INIZCTEOSA-N 2 1 330.447 4.214 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH2+]C[C@@H]2CC[N@H+](C(C)C)C2)o1 ZINC000519021094 1042793959 /nfs/dbraw/zinc/79/39/59/1042793959.db2.gz BSUVGUZKDBKTDS-INIZCTEOSA-N 2 1 330.447 4.214 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1F ZINC000310093550 1042828257 /nfs/dbraw/zinc/82/82/57/1042828257.db2.gz SWFBCCOMKFVDSG-NVXWUHKLSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)ccc1F ZINC000310093550 1042828259 /nfs/dbraw/zinc/82/82/59/1042828259.db2.gz SWFBCCOMKFVDSG-NVXWUHKLSA-N 2 1 330.422 4.138 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000177295715 1042833395 /nfs/dbraw/zinc/83/33/95/1042833395.db2.gz UDIDRPJYIZCMRE-IERDGZPVSA-N 2 1 337.442 4.346 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccccc1)c1ccc(F)cc1 ZINC000177370600 1042835636 /nfs/dbraw/zinc/83/56/36/1042835636.db2.gz UGAZVXOKESAQLD-OAQYLSRUSA-N 2 1 337.442 4.490 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(Br)cc1 ZINC000157477393 1042844917 /nfs/dbraw/zinc/84/49/17/1042844917.db2.gz LXWMPXBOUSZSKG-JECHBYEQSA-N 2 1 331.257 4.245 20 0 EIADMP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310970374 1042849656 /nfs/dbraw/zinc/84/96/56/1042849656.db2.gz DDQQVYWGAWSCGW-UYAOXDASSA-N 2 1 338.495 4.176 20 0 EIADMP FC1(F)CCC[C@H](C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)C1 ZINC000311007384 1042850342 /nfs/dbraw/zinc/85/03/42/1042850342.db2.gz WOYAWOMPCPZDHJ-MTQWCTHYSA-N 2 1 348.481 4.312 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2cc[nH]c21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311064199 1042851457 /nfs/dbraw/zinc/85/14/57/1042851457.db2.gz JCQRFOBBWYZVPE-LAUBAEHRSA-N 2 1 333.479 4.168 20 0 EIADMP COc1ccccc1C[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001203438046 1042944871 /nfs/dbraw/zinc/94/48/71/1042944871.db2.gz PNCKMWZSVSNMBB-UHFFFAOYSA-N 2 1 338.495 4.039 20 0 EIADMP COC[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000493882619 1042971506 /nfs/dbraw/zinc/97/15/06/1042971506.db2.gz JOXROKYMEUDERV-APWZRJJASA-N 2 1 338.923 4.129 20 0 EIADMP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000493890001 1042972743 /nfs/dbraw/zinc/97/27/43/1042972743.db2.gz ZVJIVCOYSFAYKF-XMSQKQJNSA-N 2 1 338.495 4.017 20 0 EIADMP C[C@@H]1CC([NH2+]Cc2ccc(F)c(F)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168006991 1043011136 /nfs/dbraw/zinc/01/11/36/1043011136.db2.gz QDEAVUFQAJBQTG-HZPDHXFCSA-N 2 1 344.449 4.496 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1F ZINC000183191785 1043039164 /nfs/dbraw/zinc/03/91/64/1043039164.db2.gz YGYSTDJZWHMUBS-YQQAZPJKSA-N 2 1 334.479 4.138 20 0 EIADMP CCc1nc(C)c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000183196280 1043039619 /nfs/dbraw/zinc/03/96/19/1043039619.db2.gz PUNVBVCRHVONDB-IJEWVQPXSA-N 2 1 335.561 4.318 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(F)c1 ZINC000183192681 1043039659 /nfs/dbraw/zinc/03/96/59/1043039659.db2.gz AQHHZEJOJDKOLQ-HRCADAONSA-N 2 1 334.479 4.138 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(F)c1 ZINC000183192681 1043039663 /nfs/dbraw/zinc/03/96/63/1043039663.db2.gz AQHHZEJOJDKOLQ-HRCADAONSA-N 2 1 334.479 4.138 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183183857 1043040018 /nfs/dbraw/zinc/04/00/18/1043040018.db2.gz ADVYFYJMIYLWDU-FGTMMUONSA-N 2 1 330.516 4.307 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183183857 1043040026 /nfs/dbraw/zinc/04/00/26/1043040026.db2.gz ADVYFYJMIYLWDU-FGTMMUONSA-N 2 1 330.516 4.307 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cscc2Br)C1 ZINC000512147702 1043086738 /nfs/dbraw/zinc/08/67/38/1043086738.db2.gz UZVIILDFZOJLNQ-ZDUSSCGKSA-N 2 1 345.350 4.112 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000310336180 1043126288 /nfs/dbraw/zinc/12/62/88/1043126288.db2.gz BJYGGLMQZQMTDZ-HKUYNNGSSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@@H](c1ccncc1)[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000673857220 1043126509 /nfs/dbraw/zinc/12/65/09/1043126509.db2.gz LEVILVIRXOAPPI-SIKLNZKXSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccncc1)[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000673857220 1043126511 /nfs/dbraw/zinc/12/65/11/1043126511.db2.gz LEVILVIRXOAPPI-SIKLNZKXSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccncc1)[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000673857220 1043126512 /nfs/dbraw/zinc/12/65/12/1043126512.db2.gz LEVILVIRXOAPPI-SIKLNZKXSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccncc1)[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000673857220 1043126522 /nfs/dbraw/zinc/12/65/22/1043126522.db2.gz LEVILVIRXOAPPI-SIKLNZKXSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657965810 1043222614 /nfs/dbraw/zinc/22/26/14/1043222614.db2.gz BOBQZHSXLJZENT-JENIJYKNSA-N 2 1 349.478 4.389 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cnc2ccccc2c1 ZINC000727466077 1043227386 /nfs/dbraw/zinc/22/73/86/1043227386.db2.gz SSTRSSOXSPGDGG-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP FC(F)(F)c1ccc(CCC[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000674005749 1043271353 /nfs/dbraw/zinc/27/13/53/1043271353.db2.gz NJLABTQLIJHLML-QGZVFWFLSA-N 2 1 340.433 4.056 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccnn2-c2ccccc2)c1 ZINC000281344586 1043276543 /nfs/dbraw/zinc/27/65/43/1043276543.db2.gz UXWNVOMZYGNKGA-GOSISDBHSA-N 2 1 348.494 4.175 20 0 EIADMP COc1cccc(CC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000347873966 1043281519 /nfs/dbraw/zinc/28/15/19/1043281519.db2.gz GELUNLIBSNOSGF-MRXNPFEDSA-N 2 1 335.451 4.083 20 0 EIADMP CC[NH+]1CCC([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC000674006316 1043282980 /nfs/dbraw/zinc/28/29/80/1043282980.db2.gz QGOAHOUHBKFTMP-UHFFFAOYSA-N 2 1 328.422 4.054 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC000674006316 1043282994 /nfs/dbraw/zinc/28/29/94/1043282994.db2.gz QGOAHOUHBKFTMP-UHFFFAOYSA-N 2 1 328.422 4.054 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)C1 ZINC000665252181 1043284946 /nfs/dbraw/zinc/28/49/46/1043284946.db2.gz JFHHIFQACFFRQY-GXRSIYKFSA-N 2 1 349.522 4.152 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000166764918 1043311034 /nfs/dbraw/zinc/31/10/34/1043311034.db2.gz WPTKUWCJBCUTSK-DLBZAZTESA-N 2 1 342.508 4.140 20 0 EIADMP Clc1ccc(CCC[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c(Cl)c1 ZINC000166760936 1043312116 /nfs/dbraw/zinc/31/21/16/1043312116.db2.gz OKKRLZUSIDPCHE-JKSUJKDBSA-N 2 1 327.299 4.142 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C1CCSCC1 ZINC000187283876 1043337490 /nfs/dbraw/zinc/33/74/90/1043337490.db2.gz QYYNBDUVRHHSTB-ABSDTBQOSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C1CCSCC1 ZINC000187283876 1043337504 /nfs/dbraw/zinc/33/75/04/1043337504.db2.gz QYYNBDUVRHHSTB-ABSDTBQOSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1cccc2ccccc21 ZINC000674048912 1043351735 /nfs/dbraw/zinc/35/17/35/1043351735.db2.gz FUMCKJDZLJBPNB-YLJYHZDGSA-N 2 1 338.495 4.134 20 0 EIADMP CCC[NH+](CCC)CCN[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012232 1043428881 /nfs/dbraw/zinc/42/88/81/1043428881.db2.gz YKOURBMASGIMTP-VTYHHJSWSA-N 2 1 345.575 4.140 20 0 EIADMP CCCc1csc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)n1 ZINC000494379193 1043460125 /nfs/dbraw/zinc/46/01/25/1043460125.db2.gz VYSDFRJJAYMBTG-UHFFFAOYSA-N 2 1 343.540 4.371 20 0 EIADMP CC[C@H]1C[N@@H+](CCCCn2ccnc2C)CC[C@@H]1c1ccccc1 ZINC000442394522 1043669736 /nfs/dbraw/zinc/66/97/36/1043669736.db2.gz SHOSLCGPXOTZGE-FPOVZHCZSA-N 2 1 325.500 4.487 20 0 EIADMP CC[C@H]1C[N@H+](CCCCn2cc[nH+]c2C)CC[C@@H]1c1ccccc1 ZINC000442394522 1043669745 /nfs/dbraw/zinc/66/97/45/1043669745.db2.gz SHOSLCGPXOTZGE-FPOVZHCZSA-N 2 1 325.500 4.487 20 0 EIADMP CC[C@H]1C[N@@H+](CCCCn2cc[nH+]c2C)CC[C@@H]1c1ccccc1 ZINC000442394522 1043669755 /nfs/dbraw/zinc/66/97/55/1043669755.db2.gz SHOSLCGPXOTZGE-FPOVZHCZSA-N 2 1 325.500 4.487 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCCC[C@H]1[C@@H]1CCOC1)[N@@H+](C)Cc1ccccc1 ZINC000474035178 1043698338 /nfs/dbraw/zinc/69/83/38/1043698338.db2.gz OWLPQOXPLDYQJO-PSWRPDDJSA-N 2 1 344.543 4.082 20 0 EIADMP COCCC[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000442633208 1043774003 /nfs/dbraw/zinc/77/40/03/1043774003.db2.gz CDGXCWBEZAATNH-XLIONFOSSA-N 2 1 336.495 4.148 20 0 EIADMP C[C@@H](CC[NH2+][C@@H](C)c1ccc(Br)s1)[NH+]1CCCCC1 ZINC000542488566 1043803637 /nfs/dbraw/zinc/80/36/37/1043803637.db2.gz LMSIYBKRGBCOOU-STQMWFEESA-N 2 1 345.350 4.426 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cnn1C(C)(C)C ZINC000191178231 1043789812 /nfs/dbraw/zinc/78/98/12/1043789812.db2.gz QVAHCMPZCNMFOT-DLBZAZTESA-N 2 1 334.552 4.252 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cn1ccc(-c2ccccc2)n1 ZINC000731660836 1043810355 /nfs/dbraw/zinc/81/03/55/1043810355.db2.gz WBKUTRHJLUABJQ-UHFFFAOYSA-N 2 1 348.494 4.091 20 0 EIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cn1ccc(-c2ccccc2)n1 ZINC000731660836 1043810356 /nfs/dbraw/zinc/81/03/56/1043810356.db2.gz WBKUTRHJLUABJQ-UHFFFAOYSA-N 2 1 348.494 4.091 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001168466900 1043819777 /nfs/dbraw/zinc/81/97/77/1043819777.db2.gz HIRWSPRFTJUDRX-GOSISDBHSA-N 2 1 340.486 4.053 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH2+]C(C)(C)Cc1ccc(C(F)(F)F)cc1 ZINC000442761782 1043825958 /nfs/dbraw/zinc/82/59/58/1043825958.db2.gz CULNVAGOPGLQJR-INIZCTEOSA-N 2 1 328.422 4.100 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000442779548 1043831412 /nfs/dbraw/zinc/83/14/12/1043831412.db2.gz JEARKIFSLQDKBG-AETAKHFUSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000442779548 1043831415 /nfs/dbraw/zinc/83/14/15/1043831415.db2.gz JEARKIFSLQDKBG-AETAKHFUSA-N 2 1 340.433 4.414 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000674878090 1043907291 /nfs/dbraw/zinc/90/72/91/1043907291.db2.gz BIQAGPVUEGQPLJ-UXHICEINSA-N 2 1 347.522 4.169 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000674878090 1043907307 /nfs/dbraw/zinc/90/73/07/1043907307.db2.gz BIQAGPVUEGQPLJ-UXHICEINSA-N 2 1 347.522 4.169 20 0 EIADMP COc1ccc([C@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@@H]2CCC[NH2+]2)cc1 ZINC000665300688 1043929645 /nfs/dbraw/zinc/92/96/45/1043929645.db2.gz HRCMLPPHLWLDJI-HOTGVXAUSA-N 2 1 344.421 4.057 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)c1cc(Br)cs1)[NH+]1CCCCC1 ZINC000494749609 1044017172 /nfs/dbraw/zinc/01/71/72/1044017172.db2.gz RSWJBTNKWBTYHE-CHWSQXEVSA-N 2 1 345.350 4.426 20 0 EIADMP CS[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)C(C)(C)C ZINC000542499934 1044227787 /nfs/dbraw/zinc/22/77/87/1044227787.db2.gz RTNWSLRFRBTEIY-NZSAHSFTSA-N 2 1 334.573 4.264 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(C(F)(F)F)cc2C)CC1 ZINC000443416717 1044265907 /nfs/dbraw/zinc/26/59/07/1044265907.db2.gz OADAYWIJKSCESM-UHFFFAOYSA-N 2 1 328.422 4.320 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000358343725 1044276127 /nfs/dbraw/zinc/27/61/27/1044276127.db2.gz UBLGSBIDTSWKHU-MAUKXSAKSA-N 2 1 336.520 4.320 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000358343725 1044276137 /nfs/dbraw/zinc/27/61/37/1044276137.db2.gz UBLGSBIDTSWKHU-MAUKXSAKSA-N 2 1 336.520 4.320 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000466343341 1044294252 /nfs/dbraw/zinc/29/42/52/1044294252.db2.gz JRCYCOVUKHXFGD-ZHHKINOHSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)C1CCC(F)(F)CC1 ZINC000474060493 1044326408 /nfs/dbraw/zinc/32/64/08/1044326408.db2.gz AGKCHTPJXIUPKN-MRXNPFEDSA-N 2 1 336.470 4.238 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)C1CCC(F)(F)CC1 ZINC000474060493 1044326426 /nfs/dbraw/zinc/32/64/26/1044326426.db2.gz AGKCHTPJXIUPKN-MRXNPFEDSA-N 2 1 336.470 4.238 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H](C)C3)ccc21 ZINC000327016911 1044404484 /nfs/dbraw/zinc/40/44/84/1044404484.db2.gz HMJOJOWVVUOPHZ-FUHWJXTLSA-N 2 1 335.495 4.387 20 0 EIADMP Cc1cccc2c1OCC[C@H]2[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1 ZINC000474087304 1044434894 /nfs/dbraw/zinc/43/48/94/1044434894.db2.gz FJVONOHHJIQSFL-DQLDELGASA-N 2 1 342.527 4.451 20 0 EIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000675879886 1044551614 /nfs/dbraw/zinc/55/16/14/1044551614.db2.gz ACIQPRHNBNUJKQ-UNMCSNQZSA-N 2 1 344.543 4.315 20 0 EIADMP CC(C)Cc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000675882954 1044555161 /nfs/dbraw/zinc/55/51/61/1044555161.db2.gz VUICZTCSZLWQLP-PGRDOPGGSA-N 2 1 344.543 4.179 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000327092292 1044592457 /nfs/dbraw/zinc/59/24/57/1044592457.db2.gz YMBWLHLSSLZTQX-SFHVURJKSA-N 2 1 338.495 4.053 20 0 EIADMP C[C@@H]1CC([NH2+]C(C)(C)c2ccccn2)C[C@@H](C)N1Cc1ccccc1 ZINC001168025313 1044647399 /nfs/dbraw/zinc/64/73/99/1044647399.db2.gz JIYBNMRSBPWCMS-QZTJIDSGSA-N 2 1 337.511 4.348 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000543461462 1044652036 /nfs/dbraw/zinc/65/20/36/1044652036.db2.gz GYLWTVOGIWUTRG-MOPGFXCFSA-N 2 1 330.516 4.007 20 0 EIADMP CC(C)[C@@H](C[NH+]1CCC(Cc2[nH+]ccn2C)CC1)c1ccccc1 ZINC000474281848 1044834008 /nfs/dbraw/zinc/83/40/08/1044834008.db2.gz FMXSCWJOEFALDJ-HXUWFJFHSA-N 2 1 325.500 4.114 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2CCSCC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168031865 1044840959 /nfs/dbraw/zinc/84/09/59/1044840959.db2.gz CUFIIVQLSNCDLW-XEMDLRDOSA-N 2 1 332.557 4.161 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1CCC2(CCCCC2)O1 ZINC000429260345 1044858045 /nfs/dbraw/zinc/85/80/45/1044858045.db2.gz MCJZSKXTFPTTRJ-SFHVURJKSA-N 2 1 333.520 4.039 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1CCC2(CCCCC2)O1 ZINC000429260345 1044858047 /nfs/dbraw/zinc/85/80/47/1044858047.db2.gz MCJZSKXTFPTTRJ-SFHVURJKSA-N 2 1 333.520 4.039 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+]CCc3cnc4ccccc4c3)CC2)cc1 ZINC000922703568 1044893143 /nfs/dbraw/zinc/89/31/43/1044893143.db2.gz KCIVWLVLRNBPCF-UHFFFAOYSA-N 2 1 345.490 4.032 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000429005194 1044991816 /nfs/dbraw/zinc/99/18/16/1044991816.db2.gz RLYVDGAKMISMQS-QFIPXVFZSA-N 2 1 338.495 4.155 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH+]1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000429005194 1044991832 /nfs/dbraw/zinc/99/18/32/1044991832.db2.gz RLYVDGAKMISMQS-QFIPXVFZSA-N 2 1 338.495 4.155 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000429005194 1044991845 /nfs/dbraw/zinc/99/18/45/1044991845.db2.gz RLYVDGAKMISMQS-QFIPXVFZSA-N 2 1 338.495 4.155 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)ccc1SC(F)F ZINC000766165393 1045004715 /nfs/dbraw/zinc/00/47/15/1045004715.db2.gz HMMUKYUBGFFJEA-DYEKYZERSA-N 2 1 344.471 4.143 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1SC(F)F ZINC000766165393 1045004726 /nfs/dbraw/zinc/00/47/26/1045004726.db2.gz HMMUKYUBGFFJEA-DYEKYZERSA-N 2 1 344.471 4.143 20 0 EIADMP Cc1csc(CC[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)n1 ZINC000671740899 1045160427 /nfs/dbraw/zinc/16/04/27/1045160427.db2.gz VHPSVVMCXBTDMC-UHFFFAOYSA-N 2 1 343.540 4.027 20 0 EIADMP Clc1ccc(Cl)c(C[NH+]2CCC3(CC[NH2+]C3)CC2)c1Cl ZINC001235104283 1045240568 /nfs/dbraw/zinc/24/05/68/1045240568.db2.gz QFLZKSRJWIWEKZ-UHFFFAOYSA-N 2 1 333.690 4.222 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]Cc3cccc4cc[nH]c43)C2)c1 ZINC000236582321 1045361072 /nfs/dbraw/zinc/36/10/72/1045361072.db2.gz OQJDZUGGOUJYPC-INIZCTEOSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]Cc3cccc4cc[nH]c43)C2)c1 ZINC000236582321 1045361076 /nfs/dbraw/zinc/36/10/76/1045361076.db2.gz OQJDZUGGOUJYPC-INIZCTEOSA-N 2 1 339.508 4.231 20 0 EIADMP c1ccc(OCC2CC2)c(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000236631080 1045362022 /nfs/dbraw/zinc/36/20/22/1045362022.db2.gz RBBKGPOJALLVKQ-UHFFFAOYSA-N 2 1 342.527 4.362 20 0 EIADMP C/C(=C/c1ccccc1)C[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000236702665 1045363671 /nfs/dbraw/zinc/36/36/71/1045363671.db2.gz NCNAKZCMSKCHLL-VUHHOQONSA-N 2 1 334.507 4.244 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH2+]C[C@H]3CCC[N@@H+](C)C3)ccc21 ZINC000237006944 1045372948 /nfs/dbraw/zinc/37/29/48/1045372948.db2.gz FLTCUGOJJNBEKR-GOSISDBHSA-N 2 1 335.495 4.246 20 0 EIADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)o1 ZINC000237370002 1045383018 /nfs/dbraw/zinc/38/30/18/1045383018.db2.gz LMQRTQDPUWGUKD-LMNJBCLMSA-N 2 1 338.495 4.057 20 0 EIADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)o1 ZINC000237370002 1045383022 /nfs/dbraw/zinc/38/30/22/1045383022.db2.gz LMQRTQDPUWGUKD-LMNJBCLMSA-N 2 1 338.495 4.057 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000237572432 1045389945 /nfs/dbraw/zinc/38/99/45/1045389945.db2.gz MTHLKHJOKDSYHK-OAHLLOKOSA-N 2 1 325.481 4.346 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767875783 1045669661 /nfs/dbraw/zinc/66/96/61/1045669661.db2.gz MYRRHFAHDKQSQH-INIZCTEOSA-N 2 1 337.389 4.090 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767875783 1045669677 /nfs/dbraw/zinc/66/96/77/1045669677.db2.gz MYRRHFAHDKQSQH-INIZCTEOSA-N 2 1 337.389 4.090 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767875784 1045669952 /nfs/dbraw/zinc/66/99/52/1045669952.db2.gz MYRRHFAHDKQSQH-MRXNPFEDSA-N 2 1 337.389 4.090 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767875784 1045669964 /nfs/dbraw/zinc/66/99/64/1045669964.db2.gz MYRRHFAHDKQSQH-MRXNPFEDSA-N 2 1 337.389 4.090 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc2c(c1)CCCO2 ZINC000768101097 1045712989 /nfs/dbraw/zinc/71/29/89/1045712989.db2.gz HISCZRPDWNOOSY-PXNSSMCTSA-N 2 1 330.516 4.173 20 0 EIADMP C([NH2+][C@@H]1CCCC12CCOCC2)C1([NH+]2CCCCC2)CCCCC1 ZINC000326300895 1045784483 /nfs/dbraw/zinc/78/44/83/1045784483.db2.gz HYFDXVGNWYFDOQ-LJQANCHMSA-N 2 1 334.548 4.114 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000397993099 1045820536 /nfs/dbraw/zinc/82/05/36/1045820536.db2.gz RANXRNJAFJXBEF-NEWSRXKRSA-N 2 1 336.470 4.312 20 0 EIADMP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1OC ZINC000248407631 1045873132 /nfs/dbraw/zinc/87/31/32/1045873132.db2.gz UNTAPTLJWLZMII-ZWOKBUDYSA-N 2 1 330.516 4.389 20 0 EIADMP CSCCCCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000248882154 1045887049 /nfs/dbraw/zinc/88/70/49/1045887049.db2.gz LBHNXXXENYLRCJ-ACDBMABISA-N 2 1 332.557 4.305 20 0 EIADMP CC[C@H]1C[C@@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)CCO1 ZINC001170176611 1045912189 /nfs/dbraw/zinc/91/21/89/1045912189.db2.gz AAEJAJVUHWWWJQ-KWVZWOLDSA-N 2 1 342.527 4.072 20 0 EIADMP CC[C@@H]1C[C@H]([N@@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222647 1045949783 /nfs/dbraw/zinc/94/97/83/1045949783.db2.gz OMOUBGBLPIMZCG-MLMGXCOMSA-N 2 1 342.527 4.055 20 0 EIADMP CC[C@@H]1C[C@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@H+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222647 1045949791 /nfs/dbraw/zinc/94/97/91/1045949791.db2.gz OMOUBGBLPIMZCG-MLMGXCOMSA-N 2 1 342.527 4.055 20 0 EIADMP CC[C@@H]1C[C@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@@H+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222647 1045949803 /nfs/dbraw/zinc/94/98/03/1045949803.db2.gz OMOUBGBLPIMZCG-MLMGXCOMSA-N 2 1 342.527 4.055 20 0 EIADMP Cc1c(Cl)cccc1N1CCC[N@H+](CCC[NH+]2CCCCC2)CC1 ZINC001170245176 1045950630 /nfs/dbraw/zinc/95/06/30/1045950630.db2.gz VJCUSPOBKCCKLB-UHFFFAOYSA-N 2 1 349.950 4.037 20 0 EIADMP Cc1c(Cl)cccc1N1CCC[N@@H+](CCC[NH+]2CCCCC2)CC1 ZINC001170245176 1045950646 /nfs/dbraw/zinc/95/06/46/1045950646.db2.gz VJCUSPOBKCCKLB-UHFFFAOYSA-N 2 1 349.950 4.037 20 0 EIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@H](C)Cc2ccccc2Cl)CC1 ZINC001170275859 1045966184 /nfs/dbraw/zinc/96/61/84/1045966184.db2.gz ZICPWYDBGJCRCM-OAHLLOKOSA-N 2 1 343.902 4.213 20 0 EIADMP Cc1cccc(N([C@H](C)Cc2ccccc2Cl)C2CC[NH2+]CC2)[nH+]1 ZINC001170293449 1045977189 /nfs/dbraw/zinc/97/71/89/1045977189.db2.gz LBVHASKPSQPVOW-MRXNPFEDSA-N 2 1 343.902 4.233 20 0 EIADMP Cn1ccc2cc[nH+]c(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c21 ZINC001170331507 1046003125 /nfs/dbraw/zinc/00/31/25/1046003125.db2.gz WJHIXUIVKNDNFO-OWZKRDHZSA-N 2 1 346.478 4.181 20 0 EIADMP Cn1ccc2cc[nH+]c(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)c21 ZINC001170331507 1046003142 /nfs/dbraw/zinc/00/31/42/1046003142.db2.gz WJHIXUIVKNDNFO-OWZKRDHZSA-N 2 1 346.478 4.181 20 0 EIADMP [NH3+]C1(c2ccc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)cc2)CC1 ZINC001170333627 1046006402 /nfs/dbraw/zinc/00/64/02/1046006402.db2.gz PNRWECIUJLFULV-DKUWSORSSA-N 2 1 347.506 4.242 20 0 EIADMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000261658757 1046131168 /nfs/dbraw/zinc/13/11/68/1046131168.db2.gz BLLDDEIDVFBFJL-CRAIPNDOSA-N 2 1 344.449 4.156 20 0 EIADMP COc1ccccc1-c1ccc([C@H](C)[N@@H+](C)C[C@H]2CCC[NH2+]C2)cc1 ZINC000261745941 1046144164 /nfs/dbraw/zinc/14/41/64/1046144164.db2.gz BWMYVDZTRPWFBR-ROUUACIJSA-N 2 1 338.495 4.355 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cccc(Br)c1 ZINC000037786206 1046159020 /nfs/dbraw/zinc/15/90/20/1046159020.db2.gz JMJGWQWFAMPNKM-CYBMUJFWSA-N 2 1 339.321 4.363 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000508695467 1046326989 /nfs/dbraw/zinc/32/69/89/1046326989.db2.gz PWCCCAMCYOWFHY-JHNUBAFKSA-N 2 1 342.527 4.187 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000508695467 1046327004 /nfs/dbraw/zinc/32/70/04/1046327004.db2.gz PWCCCAMCYOWFHY-JHNUBAFKSA-N 2 1 342.527 4.187 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cn1 ZINC000268898974 1046332427 /nfs/dbraw/zinc/33/24/27/1046332427.db2.gz PVIWOGOKFHIMDE-BBTUJRGHSA-N 2 1 340.515 4.025 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cn1 ZINC000268898974 1046332443 /nfs/dbraw/zinc/33/24/43/1046332443.db2.gz PVIWOGOKFHIMDE-BBTUJRGHSA-N 2 1 340.515 4.025 20 0 EIADMP c1ccc(C(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c2ccccc2)cc1 ZINC000508708704 1046352312 /nfs/dbraw/zinc/35/23/12/1046352312.db2.gz DSXVBAMNPLDKQP-FQEVSTJZSA-N 2 1 334.507 4.236 20 0 EIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1cc(Cl)nc2ccccc12 ZINC000771306504 1046371390 /nfs/dbraw/zinc/37/13/90/1046371390.db2.gz APSQUMTYSMLXJV-MRXNPFEDSA-N 2 1 331.891 4.194 20 0 EIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1cc(Cl)nc2ccccc12 ZINC000771306504 1046371401 /nfs/dbraw/zinc/37/14/01/1046371401.db2.gz APSQUMTYSMLXJV-MRXNPFEDSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1cc(Cl)nc2ccccc12 ZINC000771306504 1046371415 /nfs/dbraw/zinc/37/14/15/1046371415.db2.gz APSQUMTYSMLXJV-MRXNPFEDSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1cc(Cl)nc2ccccc12 ZINC000771306504 1046371428 /nfs/dbraw/zinc/37/14/28/1046371428.db2.gz APSQUMTYSMLXJV-MRXNPFEDSA-N 2 1 331.891 4.194 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCCC[C@H]3C(C)C)CC2)oc1C ZINC000162745203 1046493576 /nfs/dbraw/zinc/49/35/76/1046493576.db2.gz YOBDTQKQDLFBNS-PMACEKPBSA-N 2 1 347.547 4.308 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)cc1 ZINC000126875724 1046576547 /nfs/dbraw/zinc/57/65/47/1046576547.db2.gz BGHQYWRUORUJCS-SJORKVTESA-N 2 1 344.524 4.320 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cc1 ZINC000126875724 1046576558 /nfs/dbraw/zinc/57/65/58/1046576558.db2.gz BGHQYWRUORUJCS-SJORKVTESA-N 2 1 344.524 4.320 20 0 EIADMP c1csc([C@H]([NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)C2CCCC2)c1 ZINC000772457391 1046644166 /nfs/dbraw/zinc/64/41/66/1046644166.db2.gz VMPOEVITXLCNDV-UYAOXDASSA-N 2 1 348.556 4.212 20 0 EIADMP CCN(Cc1ccccc1OC)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536708739 1046717617 /nfs/dbraw/zinc/71/76/17/1046717617.db2.gz QCKXTNJWAOWEHU-HXUWFJFHSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1ccccc1OC)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536708739 1046717669 /nfs/dbraw/zinc/71/76/69/1046717669.db2.gz QCKXTNJWAOWEHU-HXUWFJFHSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1ccccc1OC)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536708739 1046717685 /nfs/dbraw/zinc/71/76/85/1046717685.db2.gz QCKXTNJWAOWEHU-HXUWFJFHSA-N 2 1 338.495 4.039 20 0 EIADMP CN(Cc1ccccn1)[C@@H]1CCC[N@@H+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501870 1046728209 /nfs/dbraw/zinc/72/82/09/1046728209.db2.gz FGQYJHDKVOHITG-HSZRJFAPSA-N 2 1 349.522 4.446 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501870 1046728221 /nfs/dbraw/zinc/72/82/21/1046728221.db2.gz FGQYJHDKVOHITG-HSZRJFAPSA-N 2 1 349.522 4.446 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501870 1046728229 /nfs/dbraw/zinc/72/82/29/1046728229.db2.gz FGQYJHDKVOHITG-HSZRJFAPSA-N 2 1 349.522 4.446 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@H+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501870 1046728243 /nfs/dbraw/zinc/72/82/43/1046728243.db2.gz FGQYJHDKVOHITG-HSZRJFAPSA-N 2 1 349.522 4.446 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@@H+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501870 1046728257 /nfs/dbraw/zinc/72/82/57/1046728257.db2.gz FGQYJHDKVOHITG-HSZRJFAPSA-N 2 1 349.522 4.446 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000379632381 1046732406 /nfs/dbraw/zinc/73/24/06/1046732406.db2.gz NQKMOZAYOJRDOI-NZSAHSFTSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000379632381 1046732415 /nfs/dbraw/zinc/73/24/15/1046732415.db2.gz NQKMOZAYOJRDOI-NZSAHSFTSA-N 2 1 336.470 4.455 20 0 EIADMP CCOc1ccccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379654650 1046754713 /nfs/dbraw/zinc/75/47/13/1046754713.db2.gz JFZDKHAWMFWDKU-NQIIRXRSSA-N 2 1 338.495 4.228 20 0 EIADMP CCOc1ccccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379654650 1046754727 /nfs/dbraw/zinc/75/47/27/1046754727.db2.gz JFZDKHAWMFWDKU-NQIIRXRSSA-N 2 1 338.495 4.228 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)s1 ZINC000128238857 1046784938 /nfs/dbraw/zinc/78/49/38/1046784938.db2.gz QLZBURFLSAOTCA-OAHLLOKOSA-N 2 1 329.513 4.334 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)cc1 ZINC000536831026 1046824195 /nfs/dbraw/zinc/82/41/95/1046824195.db2.gz DQUGMCSTNDFSMJ-ZAAXVRCTSA-N 2 1 341.499 4.425 20 0 EIADMP CC(C)C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccs1 ZINC000536858764 1046827395 /nfs/dbraw/zinc/82/73/95/1046827395.db2.gz RROCLULKLLAEJZ-FGTMMUONSA-N 2 1 338.561 4.314 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cccc(Cl)c1Cl ZINC000536866228 1046831307 /nfs/dbraw/zinc/83/13/07/1046831307.db2.gz ZOOVLWCKDDHJDQ-RYUDHWBXSA-N 2 1 326.271 4.485 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC(C)(C)c2c(F)cccc2Cl)[C@@H](C)C1 ZINC000536875833 1046837789 /nfs/dbraw/zinc/83/77/89/1046837789.db2.gz JFKJRTMHLMEYDP-BBRMVZONSA-N 2 1 326.887 4.077 20 0 EIADMP CC[N@@H+](CCC1CCN(Cc2ncc(C3CC3)o2)CC1)CC(C)C ZINC000536887784 1046848415 /nfs/dbraw/zinc/84/84/15/1046848415.db2.gz BFEQZABHEIIOBO-UHFFFAOYSA-N 2 1 333.520 4.132 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2ncc(C3CC3)o2)CC1)CC(C)C ZINC000536887784 1046848416 /nfs/dbraw/zinc/84/84/16/1046848416.db2.gz BFEQZABHEIIOBO-UHFFFAOYSA-N 2 1 333.520 4.132 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ncc(C3CC3)o2)CC1)CC(C)C ZINC000536887784 1046848418 /nfs/dbraw/zinc/84/84/18/1046848418.db2.gz BFEQZABHEIIOBO-UHFFFAOYSA-N 2 1 333.520 4.132 20 0 EIADMP Cc1cc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)ccc1Oc1cccnc1 ZINC000459726991 1046865324 /nfs/dbraw/zinc/86/53/24/1046865324.db2.gz GWQAAWQSONFIQZ-GOSISDBHSA-N 2 1 339.483 4.004 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459796847 1046893268 /nfs/dbraw/zinc/89/32/68/1046893268.db2.gz WLKVQCLGSLPSTE-STTHAQSSSA-N 2 1 338.442 4.013 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)C12CCC2 ZINC000537293479 1047074563 /nfs/dbraw/zinc/07/45/63/1047074563.db2.gz UPJLKQBWSUXMIV-DZFGPLHGSA-N 2 1 342.527 4.149 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCc3nc(Cl)ccc32)C1 ZINC000806131614 1047123727 /nfs/dbraw/zinc/12/37/27/1047123727.db2.gz LFQHFACZTQITPY-HLLBOEOZSA-N 2 1 335.923 4.070 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCc3ccc(Cl)nc32)C1 ZINC000788538615 1047215433 /nfs/dbraw/zinc/21/54/33/1047215433.db2.gz HZVLETKVVVJAOJ-HLLBOEOZSA-N 2 1 335.923 4.070 20 0 EIADMP COc1ccc(CCC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556058598 1047422696 /nfs/dbraw/zinc/42/26/96/1047422696.db2.gz ABNDWSSEBUJJAJ-IRLDBZIGSA-N 2 1 338.495 4.053 20 0 EIADMP COc1ccc(CCC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556058598 1047422702 /nfs/dbraw/zinc/42/27/02/1047422702.db2.gz ABNDWSSEBUJJAJ-IRLDBZIGSA-N 2 1 338.495 4.053 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCOc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000556064370 1047429801 /nfs/dbraw/zinc/42/98/01/1047429801.db2.gz YGHRFHZNBKXKRS-QUCCMNQESA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCOc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000556064370 1047429811 /nfs/dbraw/zinc/42/98/11/1047429811.db2.gz YGHRFHZNBKXKRS-QUCCMNQESA-N 2 1 344.886 4.144 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556076014 1047433817 /nfs/dbraw/zinc/43/38/17/1047433817.db2.gz HUNBFIGTEPIXGK-SFTDATJTSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556076014 1047433821 /nfs/dbraw/zinc/43/38/21/1047433821.db2.gz HUNBFIGTEPIXGK-SFTDATJTSA-N 2 1 338.495 4.189 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000556103322 1047454783 /nfs/dbraw/zinc/45/47/83/1047454783.db2.gz MMPJNUJPYYWOOR-LEWJYISDSA-N 2 1 344.543 4.399 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000556103322 1047454790 /nfs/dbraw/zinc/45/47/90/1047454790.db2.gz MMPJNUJPYYWOOR-LEWJYISDSA-N 2 1 344.543 4.399 20 0 EIADMP CCS[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556104933 1047457033 /nfs/dbraw/zinc/45/70/33/1047457033.db2.gz MYKWVCTVYZPANO-LWYYNNOASA-N 2 1 332.557 4.476 20 0 EIADMP CCS[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556104933 1047457038 /nfs/dbraw/zinc/45/70/38/1047457038.db2.gz MYKWVCTVYZPANO-LWYYNNOASA-N 2 1 332.557 4.476 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)C[C@H](C)O1 ZINC000556155046 1047498902 /nfs/dbraw/zinc/49/89/02/1047498902.db2.gz QLBQZJBMKKFWHH-WIRSXHRWSA-N 2 1 330.516 4.107 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]C[C@@H]3CCc4ccccc43)C2)c1 ZINC000790050334 1047510000 /nfs/dbraw/zinc/51/00/00/1047510000.db2.gz ZJWDZGJUZPPMQQ-MJGOQNOKSA-N 2 1 340.536 4.280 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]C[C@@H]3CCc4ccccc43)C2)c1 ZINC000790050334 1047510012 /nfs/dbraw/zinc/51/00/12/1047510012.db2.gz ZJWDZGJUZPPMQQ-MJGOQNOKSA-N 2 1 340.536 4.280 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)C[C@@H]1c1ccccc1 ZINC000556178406 1047539271 /nfs/dbraw/zinc/53/92/71/1047539271.db2.gz GWLLOFHRLCQYFN-IFMALSPDSA-N 2 1 333.479 4.136 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)C[C@@H]1c1ccccc1 ZINC000556178406 1047539282 /nfs/dbraw/zinc/53/92/82/1047539282.db2.gz GWLLOFHRLCQYFN-IFMALSPDSA-N 2 1 333.479 4.136 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C1(C)C ZINC000556179632 1047541861 /nfs/dbraw/zinc/54/18/61/1047541861.db2.gz URIJMELPMOVCGE-LWYYNNOASA-N 2 1 330.516 4.004 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C1(C)C ZINC000556179632 1047541872 /nfs/dbraw/zinc/54/18/72/1047541872.db2.gz URIJMELPMOVCGE-LWYYNNOASA-N 2 1 330.516 4.004 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccncc1F ZINC000556235914 1047600628 /nfs/dbraw/zinc/60/06/28/1047600628.db2.gz IXFBLOYHXLPPMN-KRWDZBQOSA-N 2 1 341.474 4.448 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCc3c2cccc3O)CC1 ZINC000130623212 1047755381 /nfs/dbraw/zinc/75/53/81/1047755381.db2.gz SFNKYRYMTNQBSO-YSGRDPCXSA-N 2 1 328.500 4.012 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCCOC2CCCCC2)C[C@H]1c1ccccc1 ZINC000550606702 1047758575 /nfs/dbraw/zinc/75/85/75/1047758575.db2.gz JGPMDDKYJJKDPV-FPOVZHCZSA-N 2 1 330.516 4.151 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCOC2CCCCC2)C[C@H]1c1ccccc1 ZINC000550606702 1047758576 /nfs/dbraw/zinc/75/85/76/1047758576.db2.gz JGPMDDKYJJKDPV-FPOVZHCZSA-N 2 1 330.516 4.151 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCCOc2ccc(F)cc2)C[C@@H]1c1ccccc1 ZINC000550644327 1047800003 /nfs/dbraw/zinc/80/00/03/1047800003.db2.gz QXWFJWPGUVQKII-PZJWPPBQSA-N 2 1 342.458 4.020 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCOc2ccc(F)cc2)C[C@@H]1c1ccccc1 ZINC000550644327 1047800007 /nfs/dbraw/zinc/80/00/07/1047800007.db2.gz QXWFJWPGUVQKII-PZJWPPBQSA-N 2 1 342.458 4.020 20 0 EIADMP Cc1ccccc1C1(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000550642809 1047801586 /nfs/dbraw/zinc/80/15/86/1047801586.db2.gz UUDYDAFVFBNORL-IRLDBZIGSA-N 2 1 334.507 4.452 20 0 EIADMP Cc1ccccc1C1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000550642809 1047801588 /nfs/dbraw/zinc/80/15/88/1047801588.db2.gz UUDYDAFVFBNORL-IRLDBZIGSA-N 2 1 334.507 4.452 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001171064632 1047921538 /nfs/dbraw/zinc/92/15/38/1047921538.db2.gz SFSZBVLJPHMJNX-CJNGLKHVSA-N 2 1 341.326 4.172 20 0 EIADMP COC1CCC(CC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000514953581 1048088462 /nfs/dbraw/zinc/08/84/62/1048088462.db2.gz IFEYFHCNXCTYQE-YXIVMFJDSA-N 2 1 330.516 4.007 20 0 EIADMP COC1CCC(CC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000514953581 1048088478 /nfs/dbraw/zinc/08/84/78/1048088478.db2.gz IFEYFHCNXCTYQE-YXIVMFJDSA-N 2 1 330.516 4.007 20 0 EIADMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170759204 1048135492 /nfs/dbraw/zinc/13/54/92/1048135492.db2.gz AFOLIYWRKALMJP-WKCHPHFGSA-N 2 1 326.528 4.265 20 0 EIADMP Cc1ccc(C(F)(F)F)c(C[NH+]2CCN(c3cc[nH+]c(C)c3)CC2)c1 ZINC001143683311 1048152854 /nfs/dbraw/zinc/15/28/54/1048152854.db2.gz BMNACINHPVKALR-UHFFFAOYSA-N 2 1 349.400 4.039 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171112196 1048236478 /nfs/dbraw/zinc/23/64/78/1048236478.db2.gz TYGUIMSJPQVZNQ-UFYCRDLUSA-N 2 1 332.919 4.179 20 0 EIADMP Cn1c[nH+]c2cc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)ccc21 ZINC000499136762 1048334492 /nfs/dbraw/zinc/33/44/92/1048334492.db2.gz RRTZPVQCAQARKB-OWZKRDHZSA-N 2 1 346.478 4.181 20 0 EIADMP Cn1c[nH+]c2cc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)ccc21 ZINC000499136762 1048334506 /nfs/dbraw/zinc/33/45/06/1048334506.db2.gz RRTZPVQCAQARKB-OWZKRDHZSA-N 2 1 346.478 4.181 20 0 EIADMP FC1(F)C[C@@]12CCC[N@@H+](Cc1ccc(C[NH+]3CCCCC3)cc1)C2 ZINC000844443377 1048343507 /nfs/dbraw/zinc/34/35/07/1048343507.db2.gz KCCRDXJGAXUWJU-LJQANCHMSA-N 2 1 334.454 4.294 20 0 EIADMP FC1(F)C[C@]12CCC[N@@H+](Cc1cccc(C[NH+]3CCCCC3)c1)C2 ZINC000844443969 1048343811 /nfs/dbraw/zinc/34/38/11/1048343811.db2.gz NHGWWBBKMQMKFS-IBGZPJMESA-N 2 1 334.454 4.294 20 0 EIADMP FC1(F)C[C@]12CCC[N@@H+](Cc1ccc(C[NH+]3CCCCC3)cc1)C2 ZINC000844443368 1048344675 /nfs/dbraw/zinc/34/46/75/1048344675.db2.gz KCCRDXJGAXUWJU-IBGZPJMESA-N 2 1 334.454 4.294 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000499149851 1048357242 /nfs/dbraw/zinc/35/72/42/1048357242.db2.gz UXTHIQFBKQPVCX-MJGOQNOKSA-N 2 1 341.886 4.226 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000499149851 1048357255 /nfs/dbraw/zinc/35/72/55/1048357255.db2.gz UXTHIQFBKQPVCX-MJGOQNOKSA-N 2 1 341.886 4.226 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499166237 1048362157 /nfs/dbraw/zinc/36/21/57/1048362157.db2.gz DRHTZUUWQKVBLA-OWZKRDHZSA-N 2 1 340.536 4.384 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171130196 1048381590 /nfs/dbraw/zinc/38/15/90/1048381590.db2.gz QPLHITKPJGOVEJ-HXUWFJFHSA-N 2 1 334.935 4.250 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171139220 1048416734 /nfs/dbraw/zinc/41/67/34/1048416734.db2.gz JWYUFSRSEDCNHS-XJKSGUPXSA-N 2 1 341.326 4.172 20 0 EIADMP Clc1cc2c(cc1Cl)C[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CC2 ZINC001171142711 1048452249 /nfs/dbraw/zinc/45/22/49/1048452249.db2.gz CIFGSSSQKVNXBR-OAHLLOKOSA-N 2 1 339.310 4.067 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccccc2OCC2CC2)cc1 ZINC000809737647 1048508546 /nfs/dbraw/zinc/50/85/46/1048508546.db2.gz ILRAYPYZOHYQQF-UHFFFAOYSA-N 2 1 338.495 4.169 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc3cc(F)ccc3o2)cc1 ZINC000809739048 1048510269 /nfs/dbraw/zinc/51/02/69/1048510269.db2.gz VKFHVAXARBKEID-UHFFFAOYSA-N 2 1 326.415 4.266 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)C/C=C/c2ccc(F)cc2F)cc1 ZINC000809738706 1048510642 /nfs/dbraw/zinc/51/06/42/1048510642.db2.gz GBFYCXWNTZAZAV-SNAWJCMRSA-N 2 1 330.422 4.172 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)[C@@](C)(O)c2ccccc2)cc1 ZINC000846044069 1048804488 /nfs/dbraw/zinc/80/44/88/1048804488.db2.gz NTMNZXRLVRSWAG-GSHUGGBRSA-N 2 1 349.478 4.128 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC[C@]1(C)C[C@]1(F)Cl ZINC000846188817 1048838121 /nfs/dbraw/zinc/83/81/21/1048838121.db2.gz JTERVABTEPDIAM-QXCFHYIPSA-N 2 1 338.898 4.191 20 0 EIADMP CCC[N@@H+](Cc1cccc(Br)c1)[C@H]1CC[NH2+]C(C)(C)C1 ZINC001246846788 1049020976 /nfs/dbraw/zinc/02/09/76/1049020976.db2.gz QBOGFYHJWBYZPK-INIZCTEOSA-N 2 1 339.321 4.192 20 0 EIADMP Fc1ccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC001170662268 1049367020 /nfs/dbraw/zinc/36/70/20/1049367020.db2.gz YVZMUGIBFOOXOK-UHFFFAOYSA-N 2 1 338.470 4.314 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H](c2ccccc2)N(C)C)cc1 ZINC000348130215 1049436688 /nfs/dbraw/zinc/43/66/88/1049436688.db2.gz KFVCIDKKHZTKJJ-JTSKRJEESA-N 2 1 348.494 4.134 20 0 EIADMP Clc1ccccc1C[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccoc1 ZINC000820807866 1049554374 /nfs/dbraw/zinc/55/43/74/1049554374.db2.gz SLJHQHGLYBTXAI-QRWLVFNGSA-N 2 1 344.886 4.291 20 0 EIADMP Clc1ccccc1C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccoc1 ZINC000820807866 1049554405 /nfs/dbraw/zinc/55/44/05/1049554405.db2.gz SLJHQHGLYBTXAI-QRWLVFNGSA-N 2 1 344.886 4.291 20 0 EIADMP C[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1cccc(C[NH+](C)C)c1 ZINC000820808787 1049555495 /nfs/dbraw/zinc/55/54/95/1049555495.db2.gz NNGBBIXZONLDCS-CQSZACIVSA-N 2 1 341.480 4.316 20 0 EIADMP c1cc(C2CCCC2)ccc1C[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000812756422 1049566502 /nfs/dbraw/zinc/56/65/02/1049566502.db2.gz JQKZGRGXVZYMJE-JOCHJYFZSA-N 2 1 342.527 4.077 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389390 1049601077 /nfs/dbraw/zinc/60/10/77/1049601077.db2.gz STKBZOJBHIFBSU-GBESFXJTSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389390 1049601090 /nfs/dbraw/zinc/60/10/90/1049601090.db2.gz STKBZOJBHIFBSU-GBESFXJTSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389390 1049601098 /nfs/dbraw/zinc/60/10/98/1049601098.db2.gz STKBZOJBHIFBSU-GBESFXJTSA-N 2 1 348.481 4.161 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495138 1049720190 /nfs/dbraw/zinc/72/01/90/1049720190.db2.gz XTNDEBFJWRHBDH-FHWLQOOXSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495138 1049720198 /nfs/dbraw/zinc/72/01/98/1049720198.db2.gz XTNDEBFJWRHBDH-FHWLQOOXSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495138 1049720210 /nfs/dbraw/zinc/72/02/10/1049720210.db2.gz XTNDEBFJWRHBDH-FHWLQOOXSA-N 2 1 348.481 4.161 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171472722 1049727529 /nfs/dbraw/zinc/72/75/29/1049727529.db2.gz QHJWBIUZTVOHLM-BHIYHBOVSA-N 2 1 348.481 4.337 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH+]1CCC([N@@H+](C)Cc3ccccc3)CC1)C2 ZINC001171571132 1049757709 /nfs/dbraw/zinc/75/77/09/1049757709.db2.gz SFHWRLHZTUYAIL-HSZRJFAPSA-N 2 1 348.534 4.449 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001171567393 1049758330 /nfs/dbraw/zinc/75/83/30/1049758330.db2.gz PRBKHBYUEUAVKZ-OAQYLSRUSA-N 2 1 338.539 4.193 20 0 EIADMP C[NH+]1C(C)(C)CC([N@@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171631048 1049761977 /nfs/dbraw/zinc/76/19/77/1049761977.db2.gz VHJHKTMZUOJZLK-WGSAOQKQSA-N 3 1 349.607 4.400 20 0 EIADMP CN1C(C)(C)CC([N@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171631048 1049761986 /nfs/dbraw/zinc/76/19/86/1049761986.db2.gz VHJHKTMZUOJZLK-WGSAOQKQSA-N 2 1 349.607 4.400 20 0 EIADMP CN1C(C)(C)CC([N@@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171631048 1049761994 /nfs/dbraw/zinc/76/19/94/1049761994.db2.gz VHJHKTMZUOJZLK-WGSAOQKQSA-N 2 1 349.607 4.400 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]C2(c3ccccc3F)CCOCC2)CC1(C)C ZINC001171626784 1049769741 /nfs/dbraw/zinc/76/97/41/1049769741.db2.gz BHEPZFCGSHVLJR-UHFFFAOYSA-N 2 1 348.506 4.072 20 0 EIADMP CC(C)c1noc([C@H]2CCC[N@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)n1 ZINC001171639727 1049778366 /nfs/dbraw/zinc/77/83/66/1049778366.db2.gz QWVHYFXUQGELIU-HNNXBMFYSA-N 2 1 348.535 4.024 20 0 EIADMP Cc1ccccc1O[C@H]1CC[N@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)C1 ZINC001171637381 1049778994 /nfs/dbraw/zinc/77/89/94/1049778994.db2.gz LSWMYUVGMZRBJE-SFHVURJKSA-N 2 1 330.516 4.100 20 0 EIADMP Cc1cc2cc(C[NH3+])ccc2n1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727135 1049784711 /nfs/dbraw/zinc/78/47/11/1049784711.db2.gz QCDLNLPDTIOJRR-IIBYNOLFSA-N 2 1 333.479 4.244 20 0 EIADMP C[C@H]1C[C@H](n2cc(CCC[NH3+])c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC001171724899 1049785092 /nfs/dbraw/zinc/78/50/92/1049785092.db2.gz DWJZEQKCPYGLPQ-RXVVDRJESA-N 2 1 347.506 4.368 20 0 EIADMP C[C@@H]([NH3+])Cc1cn([C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171733307 1049786502 /nfs/dbraw/zinc/78/65/02/1049786502.db2.gz QEARQCZLYKTWFO-LVCYWYKZSA-N 2 1 347.506 4.367 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC[C@H]2CC2(Cl)Cl)cc1 ZINC000822822750 1049801279 /nfs/dbraw/zinc/80/12/79/1049801279.db2.gz UFOWTNLYMCHATC-DOMZBBRYSA-N 2 1 338.282 4.415 20 0 EIADMP Cc1cccc(Cl)c1C(=[NH2+])N[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171742645 1049801431 /nfs/dbraw/zinc/80/14/31/1049801431.db2.gz XNPQQRWGWSPZKS-NVXWUHKLSA-N 2 1 341.886 4.226 20 0 EIADMP Cc1cccc(Cl)c1C(=[NH2+])N[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171742645 1049801433 /nfs/dbraw/zinc/80/14/33/1049801433.db2.gz XNPQQRWGWSPZKS-NVXWUHKLSA-N 2 1 341.886 4.226 20 0 EIADMP C[C@H]1C[C@H](n2c(C[NH3+])cc3cccc(F)c32)C[N@H+]1Cc1ccccc1 ZINC001171741667 1049801637 /nfs/dbraw/zinc/80/16/37/1049801637.db2.gz QSJMHHDTQCOPDE-KXBFYZLASA-N 2 1 337.442 4.075 20 0 EIADMP CC1(C)C[C@H](n2c3ccccc3nc2C[NH3+])CC[N@H+]1Cc1ccccc1 ZINC001171966557 1049826549 /nfs/dbraw/zinc/82/65/49/1049826549.db2.gz VNDORPAFLQXIRT-GOSISDBHSA-N 2 1 348.494 4.111 20 0 EIADMP C[C@@H](NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccnc1 ZINC000813881833 1049830641 /nfs/dbraw/zinc/83/06/41/1049830641.db2.gz VTHZOJRCJNEBRA-AMZGXZFVSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccnc1 ZINC000813881833 1049830647 /nfs/dbraw/zinc/83/06/47/1049830647.db2.gz VTHZOJRCJNEBRA-AMZGXZFVSA-N 2 1 335.495 4.318 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2cncc(Cl)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171974218 1049835694 /nfs/dbraw/zinc/83/56/94/1049835694.db2.gz DWCHIYSJTBPXCQ-LJQANCHMSA-N 2 1 343.902 4.268 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2cncc(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC001171974218 1049835695 /nfs/dbraw/zinc/83/56/95/1049835695.db2.gz DWCHIYSJTBPXCQ-LJQANCHMSA-N 2 1 343.902 4.268 20 0 EIADMP CN(Cc1cccc(O)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977933 1049837264 /nfs/dbraw/zinc/83/72/64/1049837264.db2.gz VDCQOBDGOOEIFR-FQEVSTJZSA-N 2 1 338.495 4.267 20 0 EIADMP C[NH+](Cc1cccc(O)c1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977933 1049837275 /nfs/dbraw/zinc/83/72/75/1049837275.db2.gz VDCQOBDGOOEIFR-FQEVSTJZSA-N 2 1 338.495 4.267 20 0 EIADMP C[NH+](Cc1cccc(O)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977933 1049837278 /nfs/dbraw/zinc/83/72/78/1049837278.db2.gz VDCQOBDGOOEIFR-FQEVSTJZSA-N 2 1 338.495 4.267 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CC[C@H](c3ccncc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171983730 1049838223 /nfs/dbraw/zinc/83/82/23/1049838223.db2.gz GNPYKHHGKJIARF-VXKWHMMOSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CC[C@H](c3ccncc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983730 1049838225 /nfs/dbraw/zinc/83/82/25/1049838225.db2.gz GNPYKHHGKJIARF-VXKWHMMOSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CC[C@H](c3ccncc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983730 1049838226 /nfs/dbraw/zinc/83/82/26/1049838226.db2.gz GNPYKHHGKJIARF-VXKWHMMOSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CC2CCSCC2)CC[N@H+]1Cc1ccccc1 ZINC001171981219 1049838328 /nfs/dbraw/zinc/83/83/28/1049838328.db2.gz ZSNBOCLLDLQNOK-IBGZPJMESA-N 2 1 332.557 4.162 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2CCCc3ccncc32)CC[N@H+]1Cc1ccccc1 ZINC001171978819 1049839134 /nfs/dbraw/zinc/83/91/34/1049839134.db2.gz LXYKHVYJZMYIQL-UNMCSNQZSA-N 2 1 349.522 4.492 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccc(N)cc1 ZINC001171984847 1049839984 /nfs/dbraw/zinc/83/99/84/1049839984.db2.gz YCKPOFSKWIREJF-UWJYYQICSA-N 2 1 337.511 4.363 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@@H]2CCc4ncccc42)C3)cc1 ZINC001172077023 1049843954 /nfs/dbraw/zinc/84/39/54/1049843954.db2.gz OGECTQHXZGKJCB-VLVHOKLOSA-N 2 1 347.506 4.244 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@H]2CCc4cccnc42)C3)cc1 ZINC001172073571 1049845444 /nfs/dbraw/zinc/84/54/44/1049845444.db2.gz RZEDLHUXKUKJCE-KJJMTIBFSA-N 2 1 347.506 4.244 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@H]2CCc4cccnc42)C3)cc1 ZINC001172073571 1049845447 /nfs/dbraw/zinc/84/54/47/1049845447.db2.gz RZEDLHUXKUKJCE-KJJMTIBFSA-N 2 1 347.506 4.244 20 0 EIADMP COC1(C)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172080418 1049846509 /nfs/dbraw/zinc/84/65/09/1049846509.db2.gz VRSPCTSQFLTMJW-WKCHPHFGSA-N 2 1 342.527 4.073 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CC[C@H](OCc3ccccc3)CC1)C2 ZINC001172099619 1049849540 /nfs/dbraw/zinc/84/95/40/1049849540.db2.gz LRLYPNARXJVHFH-HRMJIJJXSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CC[C@H](OCc3ccccc3)CC1)C2 ZINC001172099619 1049849542 /nfs/dbraw/zinc/84/95/42/1049849542.db2.gz LRLYPNARXJVHFH-HRMJIJJXSA-N 2 1 342.527 4.119 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]CC[C@@H]2CCCCO2)C3)cc1 ZINC001172062536 1049850052 /nfs/dbraw/zinc/85/00/52/1049850052.db2.gz OZDJKRIVBBWXFB-LRSLUSHPSA-N 2 1 342.527 4.121 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCO1 ZINC001172063202 1049850230 /nfs/dbraw/zinc/85/02/30/1049850230.db2.gz ABXKNBSNWPNGOL-BURNTYAHSA-N 2 1 342.527 4.119 20 0 EIADMP Cc1ccc(CN[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)nc1 ZINC001172061906 1049850290 /nfs/dbraw/zinc/85/02/90/1049850290.db2.gz JQEWVUBPLRKFMO-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)nc1 ZINC001172061906 1049850293 /nfs/dbraw/zinc/85/02/93/1049850293.db2.gz JQEWVUBPLRKFMO-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)nc1 ZINC001172061906 1049850294 /nfs/dbraw/zinc/85/02/94/1049850294.db2.gz JQEWVUBPLRKFMO-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP COC1CCC([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172070030 1049853177 /nfs/dbraw/zinc/85/31/77/1049853177.db2.gz IXJKXAMNDOMHJC-YFZZKHBCSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](n1c3ccccc3nc1[C@@H]1CCCC[NH2+]1)C2 ZINC001172127735 1049853393 /nfs/dbraw/zinc/85/33/93/1049853393.db2.gz LFFHMQPUOPSZTD-ZMMAXQRCSA-N 2 1 338.499 4.039 20 0 EIADMP C[C@@]1(F)CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070160 1049853605 /nfs/dbraw/zinc/85/36/05/1049853605.db2.gz XJQQPBWAQDWCRD-IVAOSVALSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@@]1(F)CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070160 1049853606 /nfs/dbraw/zinc/85/36/06/1049853606.db2.gz XJQQPBWAQDWCRD-IVAOSVALSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@@]1(F)CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070160 1049853609 /nfs/dbraw/zinc/85/36/09/1049853609.db2.gz XJQQPBWAQDWCRD-IVAOSVALSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@@]1(F)CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070160 1049853614 /nfs/dbraw/zinc/85/36/14/1049853614.db2.gz XJQQPBWAQDWCRD-IVAOSVALSA-N 2 1 330.491 4.396 20 0 EIADMP c1csc(CC[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172069545 1049853855 /nfs/dbraw/zinc/85/38/55/1049853855.db2.gz UYNVJCYPUOYOKZ-ACDBMABISA-N 2 1 340.536 4.466 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1ccc(Cl)cc1Cl)C2 ZINC001172102440 1049855902 /nfs/dbraw/zinc/85/59/02/1049855902.db2.gz NCGATRVRSVEUJH-PHZGNYQRSA-N 2 1 327.299 4.141 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccc1)Cc1ccccn1)C2 ZINC001172120824 1049859126 /nfs/dbraw/zinc/85/91/26/1049859126.db2.gz NGSSBJUJXLETQF-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccc1)Cc1ccccn1)C2 ZINC001172120824 1049859129 /nfs/dbraw/zinc/85/91/29/1049859129.db2.gz NGSSBJUJXLETQF-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+](Cc1ccccc1)Cc1ccccn1)C2 ZINC001172120824 1049859133 /nfs/dbraw/zinc/85/91/33/1049859133.db2.gz NGSSBJUJXLETQF-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+](Cc1ccccc1)Cc1ccccn1)C2 ZINC001172120824 1049859142 /nfs/dbraw/zinc/85/91/42/1049859142.db2.gz NGSSBJUJXLETQF-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)[C@H]1CSc2ccccc2C1 ZINC001172208080 1049864774 /nfs/dbraw/zinc/86/47/74/1049864774.db2.gz NBHDFDYZGBVUKH-HXUWFJFHSA-N 2 1 344.568 4.432 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)C12CCC2 ZINC000245878531 1049867591 /nfs/dbraw/zinc/86/75/91/1049867591.db2.gz KKYMESATDVQLSL-GDAAHCPNSA-N 2 1 348.556 4.068 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)C12CCC2 ZINC000245878531 1049867593 /nfs/dbraw/zinc/86/75/93/1049867593.db2.gz KKYMESATDVQLSL-GDAAHCPNSA-N 2 1 348.556 4.068 20 0 EIADMP c1ccc2c(c1)C[C@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)CS2 ZINC001172199852 1049869357 /nfs/dbraw/zinc/86/93/57/1049869357.db2.gz HQHXXYJMTOJJKP-IBGZPJMESA-N 2 1 342.552 4.044 20 0 EIADMP c1ccc2c(c1)C[C@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)CS2 ZINC001172199852 1049869359 /nfs/dbraw/zinc/86/93/59/1049869359.db2.gz HQHXXYJMTOJJKP-IBGZPJMESA-N 2 1 342.552 4.044 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172317325 1049876444 /nfs/dbraw/zinc/87/64/44/1049876444.db2.gz BLJRQWGABSLJAU-LTLOCAGFSA-N 2 1 344.543 4.365 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[N@@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC001172327956 1049886255 /nfs/dbraw/zinc/88/62/55/1049886255.db2.gz AENGEPFONOVMPI-RBUKOAKNSA-N 2 1 332.532 4.177 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001172340462 1049888542 /nfs/dbraw/zinc/88/85/42/1049888542.db2.gz KBARCGNPTXHPAJ-RBUKOAKNSA-N 2 1 332.532 4.177 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001172339796 1049889414 /nfs/dbraw/zinc/88/94/14/1049889414.db2.gz QQODUWZMEHHNIH-RTBURBONSA-N 2 1 348.531 4.161 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001172470653 1049908686 /nfs/dbraw/zinc/90/86/86/1049908686.db2.gz GINSFAYUYXYRML-IBGZPJMESA-N 2 1 332.532 4.082 20 0 EIADMP CC(C)OCC[C@@H](C)[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001172446146 1049915122 /nfs/dbraw/zinc/91/51/22/1049915122.db2.gz ISHMXWZCLOJJIJ-QUCCMNQESA-N 2 1 348.531 4.160 20 0 EIADMP COc1cccc2cc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)oc21 ZINC000068840364 1049921284 /nfs/dbraw/zinc/92/12/84/1049921284.db2.gz DQBRXTMDSQNATI-UHFFFAOYSA-N 2 1 342.483 4.186 20 0 EIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172560748 1049933334 /nfs/dbraw/zinc/93/33/34/1049933334.db2.gz SGIFAWVWPPFVDP-UXHICEINSA-N 2 1 335.495 4.265 20 0 EIADMP Cc1ccc[nH+]c1N([C@@H]1CC[C@@H](c2ccccc2)C1)C1CC[NH2+]CC1 ZINC001172564485 1049934547 /nfs/dbraw/zinc/93/45/47/1049934547.db2.gz HEQLUMFJDBCEKQ-TZIWHRDSSA-N 2 1 335.495 4.285 20 0 EIADMP Cc1nccn1CCCC[N@@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000246257020 1049939071 /nfs/dbraw/zinc/93/90/71/1049939071.db2.gz KHBSFDVAOVQCHZ-APWZRJJASA-N 2 1 329.513 4.150 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000246257020 1049939076 /nfs/dbraw/zinc/93/90/76/1049939076.db2.gz KHBSFDVAOVQCHZ-APWZRJJASA-N 2 1 329.513 4.150 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000246257020 1049939082 /nfs/dbraw/zinc/93/90/82/1049939082.db2.gz KHBSFDVAOVQCHZ-APWZRJJASA-N 2 1 329.513 4.150 20 0 EIADMP CC[NH+]1CCC([N@H+](C)[C@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172574761 1049941862 /nfs/dbraw/zinc/94/18/62/1049941862.db2.gz SOMCVNXQKCZVIT-CYBMUJFWSA-N 2 1 344.877 4.355 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)[C@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172574761 1049941867 /nfs/dbraw/zinc/94/18/67/1049941867.db2.gz SOMCVNXQKCZVIT-CYBMUJFWSA-N 2 1 344.877 4.355 20 0 EIADMP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC001172575647 1049941883 /nfs/dbraw/zinc/94/18/83/1049941883.db2.gz JOBGNSNWNYYBAT-KBPBESRZSA-N 2 1 344.877 4.261 20 0 EIADMP CC1(C)CC([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)CC(C)(C)O1 ZINC001172653304 1049957330 /nfs/dbraw/zinc/95/73/30/1049957330.db2.gz HUUJPHGTYLJANZ-WGSAOQKQSA-N 2 1 344.543 4.495 20 0 EIADMP Cc1cc(N(C2CC[NH2+]CC2)C2CCC3(CCCC3)CC2)nc(C)[nH+]1 ZINC001172730287 1049969302 /nfs/dbraw/zinc/96/93/02/1049969302.db2.gz CEIKDMPRYDVSMH-UHFFFAOYSA-N 2 1 342.531 4.155 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1cccnc1 ZINC000246643172 1049993386 /nfs/dbraw/zinc/99/33/86/1049993386.db2.gz XLAUUHRRRAYEAO-CEXWTWQISA-N 2 1 337.511 4.410 20 0 EIADMP Cc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000246871845 1050004397 /nfs/dbraw/zinc/00/43/97/1050004397.db2.gz DMNJQWANWBTTDJ-RBUKOAKNSA-N 2 1 338.495 4.067 20 0 EIADMP Cc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000246871845 1050004404 /nfs/dbraw/zinc/00/44/04/1050004404.db2.gz DMNJQWANWBTTDJ-RBUKOAKNSA-N 2 1 338.495 4.067 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1OC ZINC000246937448 1050006742 /nfs/dbraw/zinc/00/67/42/1050006742.db2.gz HLHWWMUNXVPJBI-BQFCYCMXSA-N 2 1 334.504 4.007 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000246937448 1050006744 /nfs/dbraw/zinc/00/67/44/1050006744.db2.gz HLHWWMUNXVPJBI-BQFCYCMXSA-N 2 1 334.504 4.007 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000247105358 1050013800 /nfs/dbraw/zinc/01/38/00/1050013800.db2.gz SQZFCIIOPIMXMQ-GRDNDAEWSA-N 2 1 329.513 4.252 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000247105358 1050013817 /nfs/dbraw/zinc/01/38/17/1050013817.db2.gz SQZFCIIOPIMXMQ-GRDNDAEWSA-N 2 1 329.513 4.252 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000247105358 1050013822 /nfs/dbraw/zinc/01/38/22/1050013822.db2.gz SQZFCIIOPIMXMQ-GRDNDAEWSA-N 2 1 329.513 4.252 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc3ccccc3o2)[C@H](C)C1 ZINC000248060402 1050042111 /nfs/dbraw/zinc/04/21/11/1050042111.db2.gz YIBAYZKGPSKXPD-LMMKCTJWSA-N 2 1 344.499 4.220 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cc3ccccc3o2)[C@H](C)C1 ZINC000248060402 1050042120 /nfs/dbraw/zinc/04/21/20/1050042120.db2.gz YIBAYZKGPSKXPD-LMMKCTJWSA-N 2 1 344.499 4.220 20 0 EIADMP C[C@H](N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)c(F)c(F)c1 ZINC000248401592 1050054430 /nfs/dbraw/zinc/05/44/30/1050054430.db2.gz LYKCUHYJZVJLPS-IHRRRGAJSA-N 2 1 340.433 4.408 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)c(F)c(F)c1 ZINC000248401592 1050054434 /nfs/dbraw/zinc/05/44/34/1050054434.db2.gz LYKCUHYJZVJLPS-IHRRRGAJSA-N 2 1 340.433 4.408 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)c(F)c(F)c1 ZINC000248401592 1050054444 /nfs/dbraw/zinc/05/44/44/1050054444.db2.gz LYKCUHYJZVJLPS-IHRRRGAJSA-N 2 1 340.433 4.408 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccccc1N(C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248408758 1050055599 /nfs/dbraw/zinc/05/55/99/1050055599.db2.gz VVPWURMSYYSBGE-SQNIBIBYSA-N 2 1 329.532 4.056 20 0 EIADMP Cc1cccc(NC[C@H]2CC[N@H+](C[C@H]3CCC4(CCCCC4)O3)C2)[nH+]1 ZINC000248825141 1050080231 /nfs/dbraw/zinc/08/02/31/1050080231.db2.gz KFZDXKRMGIGMTG-RTBURBONSA-N 2 1 343.515 4.006 20 0 EIADMP Cc1cccc(NC[C@H]2CC[N@@H+](C[C@H]3CCC4(CCCCC4)O3)C2)[nH+]1 ZINC000248825141 1050080238 /nfs/dbraw/zinc/08/02/38/1050080238.db2.gz KFZDXKRMGIGMTG-RTBURBONSA-N 2 1 343.515 4.006 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3occc32)[C@H]1c1cccs1 ZINC000248879327 1050081952 /nfs/dbraw/zinc/08/19/52/1050081952.db2.gz KHYZQUPVYKTBOW-ALKREAHSSA-N 2 1 330.497 4.391 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3occc32)[C@H]1c1cccs1 ZINC000248879327 1050081960 /nfs/dbraw/zinc/08/19/60/1050081960.db2.gz KHYZQUPVYKTBOW-ALKREAHSSA-N 2 1 330.497 4.391 20 0 EIADMP COC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCCC1 ZINC000248876176 1050082342 /nfs/dbraw/zinc/08/23/42/1050082342.db2.gz JNVFOCBAGAZFCR-WKCHPHFGSA-N 2 1 342.527 4.121 20 0 EIADMP C[N@@H+](C1CC1)C1CC[NH+](C2CCC(Cc3ccccc3)CC2)CC1 ZINC001172825564 1050165675 /nfs/dbraw/zinc/16/56/75/1050165675.db2.gz XYQWQBLIZKSRLP-UHFFFAOYSA-N 2 1 326.528 4.347 20 0 EIADMP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC001177256390 1050174647 /nfs/dbraw/zinc/17/46/47/1050174647.db2.gz DYPAKMVNKXKTPW-VLCRHTCISA-N 2 1 344.543 4.356 20 0 EIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccc(F)cc2Cl)[C@@H](C)C1 ZINC001172864996 1050175747 /nfs/dbraw/zinc/17/57/47/1050175747.db2.gz JFLZOMWEYHLLBZ-PMUMKWKESA-N 2 1 326.887 4.119 20 0 EIADMP COc1cc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc2ccccc21 ZINC001177298400 1050179641 /nfs/dbraw/zinc/17/96/41/1050179641.db2.gz BDYKUTIKMTYHOY-SFHVURJKSA-N 2 1 340.511 4.450 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@@H]2C(C)=CCC[C@H]2C)cc1F ZINC001177454606 1050213374 /nfs/dbraw/zinc/21/33/74/1050213374.db2.gz SXMBSFBPBNISKT-CRAIPNDOSA-N 2 1 327.447 4.402 20 0 EIADMP CO[C@H]1CCC[C@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001172922262 1050235174 /nfs/dbraw/zinc/23/51/74/1050235174.db2.gz GMXLSBDRIXULET-KWVZWOLDSA-N 2 1 342.527 4.072 20 0 EIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC001177528794 1050240150 /nfs/dbraw/zinc/24/01/50/1050240150.db2.gz HPZIAIXAZYXDMI-UHFFFAOYSA-N 2 1 344.499 4.116 20 0 EIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Br)cc2Cl)CC1 ZINC001206305370 1050247226 /nfs/dbraw/zinc/24/72/26/1050247226.db2.gz YASOSMHBNOJAIA-HNNXBMFYSA-N 2 1 345.712 4.053 20 0 EIADMP Brc1ccc([C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CC2)cc1 ZINC000091268613 1050248459 /nfs/dbraw/zinc/24/84/59/1050248459.db2.gz VINQERBLSLOOTL-SFHVURJKSA-N 2 1 349.316 4.117 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@H](c3ccccc3)C(C)C)CC2)nc(C)[nH+]1 ZINC000091368024 1050255113 /nfs/dbraw/zinc/25/51/13/1050255113.db2.gz QJQLDDGMJZALTJ-NRFANRHFSA-N 2 1 338.499 4.049 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccccc2Cl)[C@@H](C)C1 ZINC000252646028 1050283478 /nfs/dbraw/zinc/28/34/78/1050283478.db2.gz DFZLZGZUGJBJQP-FCEWJHQRSA-N 2 1 338.923 4.128 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccccc2Cl)[C@@H](C)C1 ZINC000252646028 1050283490 /nfs/dbraw/zinc/28/34/90/1050283490.db2.gz DFZLZGZUGJBJQP-FCEWJHQRSA-N 2 1 338.923 4.128 20 0 EIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC001177741691 1050291914 /nfs/dbraw/zinc/29/19/14/1050291914.db2.gz BUGDTWNNTRZNJW-HMXCVIKNSA-N 2 1 329.532 4.352 20 0 EIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC001177741691 1050291928 /nfs/dbraw/zinc/29/19/28/1050291928.db2.gz BUGDTWNNTRZNJW-HMXCVIKNSA-N 2 1 329.532 4.352 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCOC2CCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001177875318 1050309188 /nfs/dbraw/zinc/30/91/88/1050309188.db2.gz JBRIEZCOVIHZLR-TZIWHRDSSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCOC2CCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001177875318 1050309205 /nfs/dbraw/zinc/30/92/05/1050309205.db2.gz JBRIEZCOVIHZLR-TZIWHRDSSA-N 2 1 344.543 4.369 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+]2C[C@H]3[C@@H](C2)CCC[C@@H]3OCC2CC2)CC1 ZINC001173111105 1050309421 /nfs/dbraw/zinc/30/94/21/1050309421.db2.gz RWAPSHAYTFIOMK-XGQIVCTBSA-N 2 1 348.575 4.167 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H](c3nc(C(C)C)no3)C2)CC1 ZINC001173113031 1050310465 /nfs/dbraw/zinc/31/04/65/1050310465.db2.gz GZTWXZPDJDGMIH-AOCRQIFASA-N 2 1 348.535 4.025 20 0 EIADMP Cc1cc(Br)cc(C[NH2+]CCC[NH+](C(C)C)C(C)C)c1 ZINC001177949081 1050345884 /nfs/dbraw/zinc/34/58/84/1050345884.db2.gz OZJCEVYKBXZNST-UHFFFAOYSA-N 2 1 341.337 4.356 20 0 EIADMP CC(C)[N@H+]1CC[C@@H]([NH2+]C2CCC(Oc3ccccc3)CC2)[C@@H](C)C1 ZINC001173202546 1050346154 /nfs/dbraw/zinc/34/61/54/1050346154.db2.gz UJNSJROBNXYYKF-QUWFBVPJSA-N 2 1 330.516 4.085 20 0 EIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001173210541 1050370202 /nfs/dbraw/zinc/37/02/02/1050370202.db2.gz MWZFGTFYRQVIFF-QIJUGHKUSA-N 2 1 334.507 4.091 20 0 EIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH+]1C[C@H]2C[N@@H+](C)C[C@H]2C1 ZINC001173210541 1050370217 /nfs/dbraw/zinc/37/02/17/1050370217.db2.gz MWZFGTFYRQVIFF-QIJUGHKUSA-N 2 1 334.507 4.091 20 0 EIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH+]1C[C@H]2C[N@H+](C)C[C@H]2C1 ZINC001173210541 1050370236 /nfs/dbraw/zinc/37/02/36/1050370236.db2.gz MWZFGTFYRQVIFF-QIJUGHKUSA-N 2 1 334.507 4.091 20 0 EIADMP CCc1ccc([C@@H](CNc2cc(C)[nH+]c(C)n2)[NH+](CC)CC)cc1 ZINC001186594283 1050372776 /nfs/dbraw/zinc/37/27/76/1050372776.db2.gz QUIOKZAUZJQVJW-LJQANCHMSA-N 2 1 326.488 4.151 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2ccc(F)cc2F)C[N@H+]1Cc1ccccc1 ZINC001178207950 1050403614 /nfs/dbraw/zinc/40/36/14/1050403614.db2.gz JKLCUJDGELSWEZ-AEFFLSMTSA-N 2 1 344.449 4.355 20 0 EIADMP CC[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CCC[C@@H](N(C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276631 1050406513 /nfs/dbraw/zinc/40/65/13/1050406513.db2.gz CLORNAMJBCZDRP-OCFWJZSCSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CCC[C@@H]([NH+](C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276631 1050406523 /nfs/dbraw/zinc/40/65/23/1050406523.db2.gz CLORNAMJBCZDRP-OCFWJZSCSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CCC[C@@H]([NH+](C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276631 1050406533 /nfs/dbraw/zinc/40/65/33/1050406533.db2.gz CLORNAMJBCZDRP-OCFWJZSCSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([NH+]2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276631 1050406543 /nfs/dbraw/zinc/40/65/43/1050406543.db2.gz CLORNAMJBCZDRP-OCFWJZSCSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([NH+]2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276631 1050406550 /nfs/dbraw/zinc/40/65/50/1050406550.db2.gz CLORNAMJBCZDRP-OCFWJZSCSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([NH+]2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)C1 ZINC001173278996 1050408126 /nfs/dbraw/zinc/40/81/26/1050408126.db2.gz NVMAZKALAOKVRT-QUCCMNQESA-N 2 1 341.543 4.337 20 0 EIADMP C[C@H](CC[NH2+]Cc1ccc(SC(F)F)cc1)[NH+]1CCCCC1 ZINC001178463579 1050477524 /nfs/dbraw/zinc/47/75/24/1050477524.db2.gz RIAPZGDKHBDYGI-CQSZACIVSA-N 2 1 328.472 4.355 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@H]2CCCN(C)[C@@H]2C1 ZINC001173551663 1050487599 /nfs/dbraw/zinc/48/75/99/1050487599.db2.gz UQGOASXYAXMGKB-DDUZABMNSA-N 2 1 341.326 4.341 20 0 EIADMP COCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCCCC1 ZINC001178868247 1050574068 /nfs/dbraw/zinc/57/40/68/1050574068.db2.gz QBSWRXNTCXRYEI-TZIWHRDSSA-N 2 1 344.543 4.226 20 0 EIADMP COCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCCCC1 ZINC001178868247 1050574088 /nfs/dbraw/zinc/57/40/88/1050574088.db2.gz QBSWRXNTCXRYEI-TZIWHRDSSA-N 2 1 344.543 4.226 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3nc(Cl)ccc3s2)C[C@H]1C ZINC001204236521 1050615430 /nfs/dbraw/zinc/61/54/30/1050615430.db2.gz HVJZJFPMJRXJAF-CHWSQXEVSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc3nc(Cl)ccc3s2)C[C@H]1C ZINC001204236521 1050615448 /nfs/dbraw/zinc/61/54/48/1050615448.db2.gz HVJZJFPMJRXJAF-CHWSQXEVSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc3nc(Cl)ccc3s2)C[C@H]1C ZINC001204236521 1050615465 /nfs/dbraw/zinc/61/54/65/1050615465.db2.gz HVJZJFPMJRXJAF-CHWSQXEVSA-N 2 1 337.920 4.254 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC001179160383 1050643873 /nfs/dbraw/zinc/64/38/73/1050643873.db2.gz VYZGYRYLPGVYCZ-SFHVURJKSA-N 2 1 338.495 4.184 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC001179160383 1050643890 /nfs/dbraw/zinc/64/38/90/1050643890.db2.gz VYZGYRYLPGVYCZ-SFHVURJKSA-N 2 1 338.495 4.184 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000093644486 1050647819 /nfs/dbraw/zinc/64/78/19/1050647819.db2.gz PHRNZPDSLIKRCC-PXNSSMCTSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000093644486 1050647823 /nfs/dbraw/zinc/64/78/23/1050647823.db2.gz PHRNZPDSLIKRCC-PXNSSMCTSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000093644486 1050647826 /nfs/dbraw/zinc/64/78/26/1050647826.db2.gz PHRNZPDSLIKRCC-PXNSSMCTSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000093644486 1050647834 /nfs/dbraw/zinc/64/78/34/1050647834.db2.gz PHRNZPDSLIKRCC-PXNSSMCTSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000093644484 1050647940 /nfs/dbraw/zinc/64/79/40/1050647940.db2.gz PHRNZPDSLIKRCC-FXAWDEMLSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000093644484 1050647948 /nfs/dbraw/zinc/64/79/48/1050647948.db2.gz PHRNZPDSLIKRCC-FXAWDEMLSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000093644484 1050647957 /nfs/dbraw/zinc/64/79/57/1050647957.db2.gz PHRNZPDSLIKRCC-FXAWDEMLSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000093644484 1050647964 /nfs/dbraw/zinc/64/79/64/1050647964.db2.gz PHRNZPDSLIKRCC-FXAWDEMLSA-N 2 1 338.495 4.277 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC34CCCCC4)CC2)cc1 ZINC001179259762 1050662860 /nfs/dbraw/zinc/66/28/60/1050662860.db2.gz XWWAYMNCBAAQTK-HXUWFJFHSA-N 2 1 330.491 4.145 20 0 EIADMP Cc1cc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)cc(C)n1 ZINC001179771694 1050767381 /nfs/dbraw/zinc/76/73/81/1050767381.db2.gz LAWFQMQHBCCFBL-XPWALMASSA-N 2 1 349.522 4.089 20 0 EIADMP Cc1ccc2[nH]cc(CC[NH2+]C3CC[NH+](Cc4ccccc4)CC3)c2c1 ZINC001179780873 1050770791 /nfs/dbraw/zinc/77/07/91/1050770791.db2.gz YATCDOZECOIVGR-UHFFFAOYSA-N 2 1 347.506 4.273 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@H]2CCc3ccccc32)C1 ZINC001180030506 1050860550 /nfs/dbraw/zinc/86/05/50/1050860550.db2.gz NRWHHXKGZPBBNS-SVFBPWRDSA-N 2 1 326.528 4.303 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@H]2CCc3ccccc32)C1 ZINC001180030506 1050860557 /nfs/dbraw/zinc/86/05/57/1050860557.db2.gz NRWHHXKGZPBBNS-SVFBPWRDSA-N 2 1 326.528 4.303 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@H]2CCc3ccccc32)C1 ZINC001180030506 1050860562 /nfs/dbraw/zinc/86/05/62/1050860562.db2.gz NRWHHXKGZPBBNS-SVFBPWRDSA-N 2 1 326.528 4.303 20 0 EIADMP C[C@H](C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267122 1050942263 /nfs/dbraw/zinc/94/22/63/1050942263.db2.gz OSNQAAMBLHLISM-UYAOXDASSA-N 2 1 340.486 4.383 20 0 EIADMP C[C@H](C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267122 1050942268 /nfs/dbraw/zinc/94/22/68/1050942268.db2.gz OSNQAAMBLHLISM-UYAOXDASSA-N 2 1 340.486 4.383 20 0 EIADMP C[C@H](C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267122 1050942271 /nfs/dbraw/zinc/94/22/71/1050942271.db2.gz OSNQAAMBLHLISM-UYAOXDASSA-N 2 1 340.486 4.383 20 0 EIADMP Cc1csc(CCC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)n1 ZINC000157289879 1051151056 /nfs/dbraw/zinc/15/10/56/1051151056.db2.gz YUAPDHMHSVPBBI-OAHLLOKOSA-N 2 1 340.496 4.229 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775378986 1051170727 /nfs/dbraw/zinc/17/07/27/1051170727.db2.gz OTMRNVPXJFQJPN-DYVFJYSZSA-N 2 1 340.483 4.310 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cnccc2C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000414224366 1051179662 /nfs/dbraw/zinc/17/96/62/1051179662.db2.gz HQAQWGWHPLIZSP-PZJWPPBQSA-N 2 1 337.511 4.304 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cnccc2C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000414224366 1051179664 /nfs/dbraw/zinc/17/96/64/1051179664.db2.gz HQAQWGWHPLIZSP-PZJWPPBQSA-N 2 1 337.511 4.304 20 0 EIADMP CC[NH+](CC)c1ccc(Nc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC001174816360 1051183938 /nfs/dbraw/zinc/18/39/38/1051183938.db2.gz ZYZMCRCWAROAOP-UHFFFAOYSA-N 2 1 338.499 4.028 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCCSC(C)(C)C)C2)CC1 ZINC001190652297 1051245167 /nfs/dbraw/zinc/24/51/67/1051245167.db2.gz YZIBBRWVEKEZMH-GOSISDBHSA-N 2 1 326.594 4.352 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SCC(F)(F)F)cc2)C1 ZINC000163221692 1051252967 /nfs/dbraw/zinc/25/29/67/1051252967.db2.gz QVDKKCRJVVTASO-KBPBESRZSA-N 2 1 346.462 4.333 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000153989737 1051254741 /nfs/dbraw/zinc/25/47/41/1051254741.db2.gz XJQHXCPXLJSKJB-APIJFGDWSA-N 2 1 328.422 4.270 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000153989737 1051254751 /nfs/dbraw/zinc/25/47/51/1051254751.db2.gz XJQHXCPXLJSKJB-APIJFGDWSA-N 2 1 328.422 4.270 20 0 EIADMP COc1ccc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)c(Cl)c1 ZINC000620755217 1051273702 /nfs/dbraw/zinc/27/37/02/1051273702.db2.gz CQPUIFQBIRFRGI-UHFFFAOYSA-N 2 1 346.902 4.479 20 0 EIADMP CO[C@@H](C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccc(F)cc1 ZINC001190826210 1051286409 /nfs/dbraw/zinc/28/64/09/1051286409.db2.gz GEWHQWKAVGQNOG-RXVVDRJESA-N 2 1 348.506 4.101 20 0 EIADMP CO[C@@H](C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccc(F)cc1 ZINC001190826210 1051286419 /nfs/dbraw/zinc/28/64/19/1051286419.db2.gz GEWHQWKAVGQNOG-RXVVDRJESA-N 2 1 348.506 4.101 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000154841590 1051342687 /nfs/dbraw/zinc/34/26/87/1051342687.db2.gz URXFISCUADPVFD-NRFANRHFSA-N 2 1 326.459 4.443 20 0 EIADMP CS[C@@H]1CC[N@@H+](C[C@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001182063341 1051389218 /nfs/dbraw/zinc/38/92/18/1051389218.db2.gz TXTZABLRTDWYBG-TZIWHRDSSA-N 2 1 346.584 4.362 20 0 EIADMP CS[C@@H]1CC[NH+](C[C@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC001182063341 1051389229 /nfs/dbraw/zinc/38/92/29/1051389229.db2.gz TXTZABLRTDWYBG-TZIWHRDSSA-N 2 1 346.584 4.362 20 0 EIADMP CS[C@@H]1CC[NH+](C[C@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001182063341 1051389242 /nfs/dbraw/zinc/38/92/42/1051389242.db2.gz TXTZABLRTDWYBG-TZIWHRDSSA-N 2 1 346.584 4.362 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cncs1 ZINC000268809613 1051394432 /nfs/dbraw/zinc/39/44/32/1051394432.db2.gz KDUIFGQGKPJALF-JKSUJKDBSA-N 2 1 329.513 4.368 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1cncs1 ZINC000268809613 1051394444 /nfs/dbraw/zinc/39/44/44/1051394444.db2.gz KDUIFGQGKPJALF-JKSUJKDBSA-N 2 1 329.513 4.368 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](CCSc2cccc(Cl)c2)C1 ZINC001191255369 1051396649 /nfs/dbraw/zinc/39/66/49/1051396649.db2.gz DRGDFFHZPKHFQK-HNNXBMFYSA-N 2 1 326.937 4.096 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCSc2cccc(Cl)c2)C1 ZINC001191255369 1051396664 /nfs/dbraw/zinc/39/66/64/1051396664.db2.gz DRGDFFHZPKHFQK-HNNXBMFYSA-N 2 1 326.937 4.096 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@@H]1C ZINC001191417133 1051452640 /nfs/dbraw/zinc/45/26/40/1051452640.db2.gz NMPYNGKWAVSPED-KSSFIOAISA-N 2 1 331.891 4.193 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@@H]1C ZINC001191417133 1051452645 /nfs/dbraw/zinc/45/26/45/1051452645.db2.gz NMPYNGKWAVSPED-KSSFIOAISA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@@H]1C ZINC001191417133 1051452654 /nfs/dbraw/zinc/45/26/54/1051452654.db2.gz NMPYNGKWAVSPED-KSSFIOAISA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@@H]1C ZINC001191417133 1051452658 /nfs/dbraw/zinc/45/26/58/1051452658.db2.gz NMPYNGKWAVSPED-KSSFIOAISA-N 2 1 331.891 4.193 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@H]2CCCC(C)(C)O2)CC1 ZINC001191549316 1051485273 /nfs/dbraw/zinc/48/52/73/1051485273.db2.gz AVAYVDYVVYEWAD-UYAOXDASSA-N 2 1 336.564 4.311 20 0 EIADMP CSc1ccccc1C[N@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001175352141 1051545133 /nfs/dbraw/zinc/54/51/33/1051545133.db2.gz OJXBCBWIKMYDJA-IBGZPJMESA-N 2 1 332.557 4.495 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000157002877 1051586564 /nfs/dbraw/zinc/58/65/64/1051586564.db2.gz RGKIAVNNJYRZDK-HOTGVXAUSA-N 2 1 329.488 4.356 20 0 EIADMP CCOc1c(Cl)cc(C[N@H+]2CCC[C@](F)(C[NH3+])CC2)cc1Cl ZINC001205581404 1051641761 /nfs/dbraw/zinc/64/17/61/1051641761.db2.gz TTZJGVQSVACNGS-MRXNPFEDSA-N 2 1 349.277 4.045 20 0 EIADMP CC[NH+](CC)CCC[N@@H+](Cc1ccc2c(c1)OCO2)C1(C)CCCC1 ZINC001192149135 1051642025 /nfs/dbraw/zinc/64/20/25/1051642025.db2.gz LKFDPFLEPCOFEZ-UHFFFAOYSA-N 2 1 346.515 4.282 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000158120250 1051715124 /nfs/dbraw/zinc/71/51/24/1051715124.db2.gz VBBIDKDMYNBDSN-NVXWUHKLSA-N 2 1 341.524 4.119 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000158120250 1051715133 /nfs/dbraw/zinc/71/51/33/1051715133.db2.gz VBBIDKDMYNBDSN-NVXWUHKLSA-N 2 1 341.524 4.119 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000158162050 1051721321 /nfs/dbraw/zinc/72/13/21/1051721321.db2.gz HJHWZLDLJJYTKR-HRAATJIYSA-N 2 1 326.484 4.231 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC001182959836 1051749802 /nfs/dbraw/zinc/74/98/02/1051749802.db2.gz MPYVZNGBQLKLHG-VWPQPMDRSA-N 2 1 326.528 4.493 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC001182959836 1051749812 /nfs/dbraw/zinc/74/98/12/1051749812.db2.gz MPYVZNGBQLKLHG-VWPQPMDRSA-N 2 1 326.528 4.493 20 0 EIADMP CC[C@@]1(CCc2ccccc2)CCC[N@@H+]1CCCc1c[nH+]cn1C ZINC001175757599 1051770137 /nfs/dbraw/zinc/77/01/37/1051770137.db2.gz DOFDWXQILPOVLJ-NRFANRHFSA-N 2 1 325.500 4.230 20 0 EIADMP CC[C@@]1(CCc2ccccc2)CCC[N@H+]1CCCc1c[nH+]cn1C ZINC001175757599 1051770146 /nfs/dbraw/zinc/77/01/46/1051770146.db2.gz DOFDWXQILPOVLJ-NRFANRHFSA-N 2 1 325.500 4.230 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cncc(Cl)c2)CC1 ZINC000621254274 1051786061 /nfs/dbraw/zinc/78/60/61/1051786061.db2.gz OLMIKHMHUTXCKZ-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCCCCn2cccn2)CC1 ZINC000158973624 1051800761 /nfs/dbraw/zinc/80/07/61/1051800761.db2.gz XWGGIASGZRPANT-FQEVSTJZSA-N 2 1 346.563 4.030 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCCCCn2cccn2)CC1 ZINC000158973482 1051801280 /nfs/dbraw/zinc/80/12/80/1051801280.db2.gz XWGGIASGZRPANT-HXUWFJFHSA-N 2 1 346.563 4.030 20 0 EIADMP CC[NH+](CC)CCC[NH2+]C1(c2cccc(C(F)(F)F)c2)CCC1 ZINC001192707811 1051802682 /nfs/dbraw/zinc/80/26/82/1051802682.db2.gz BWRXCFUEQJPOMF-UHFFFAOYSA-N 2 1 328.422 4.406 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC001183281072 1051812348 /nfs/dbraw/zinc/81/23/48/1051812348.db2.gz LQUNGGYLYYEMQN-JTAQYXEDSA-N 2 1 336.523 4.284 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1)[C@@H]1COc2ccccc2C1 ZINC001183379233 1051840172 /nfs/dbraw/zinc/84/01/72/1051840172.db2.gz KTEVZNQFSDNHGY-CUWPLCDZSA-N 2 1 342.527 4.013 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1)[C@@H]1COc2ccccc2C1 ZINC001183379233 1051840177 /nfs/dbraw/zinc/84/01/77/1051840177.db2.gz KTEVZNQFSDNHGY-CUWPLCDZSA-N 2 1 342.527 4.013 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000164970229 1052046719 /nfs/dbraw/zinc/04/67/19/1052046719.db2.gz XTWIDUMWLIBJAB-YRNRMSPPSA-N 2 1 344.524 4.490 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000164970229 1052046732 /nfs/dbraw/zinc/04/67/32/1052046732.db2.gz XTWIDUMWLIBJAB-YRNRMSPPSA-N 2 1 344.524 4.490 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC(C)(C)OC2(C)C)[C@H]1c1cccs1 ZINC000165004404 1052046839 /nfs/dbraw/zinc/04/68/39/1052046839.db2.gz ORQUBEGJEJNYEE-PVAVHDDUSA-N 2 1 336.545 4.067 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CC(C)(C)OC2(C)C)[C@H]1c1cccs1 ZINC000165004404 1052046846 /nfs/dbraw/zinc/04/68/46/1052046846.db2.gz ORQUBEGJEJNYEE-PVAVHDDUSA-N 2 1 336.545 4.067 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2cc(C)cc(Br)c2)CC1 ZINC000774846755 1052208125 /nfs/dbraw/zinc/20/81/25/1052208125.db2.gz SSKJYRSXRGAIED-UHFFFAOYSA-N 2 1 339.321 4.064 20 0 EIADMP Clc1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c2ncccc12 ZINC000173880169 1052554616 /nfs/dbraw/zinc/55/46/16/1052554616.db2.gz PHSUOUUDEJIJOZ-INIZCTEOSA-N 2 1 343.902 4.196 20 0 EIADMP Clc1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c2ncccc12 ZINC000173880169 1052554621 /nfs/dbraw/zinc/55/46/21/1052554621.db2.gz PHSUOUUDEJIJOZ-INIZCTEOSA-N 2 1 343.902 4.196 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccccc1F ZINC000174450470 1052568123 /nfs/dbraw/zinc/56/81/23/1052568123.db2.gz MKPITSZOOSNLLD-UHFFFAOYSA-N 2 1 338.426 4.341 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000174514889 1052569379 /nfs/dbraw/zinc/56/93/79/1052569379.db2.gz NXPRJIXUDMOWLL-FUHWJXTLSA-N 2 1 326.484 4.199 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000174514889 1052569386 /nfs/dbraw/zinc/56/93/86/1052569386.db2.gz NXPRJIXUDMOWLL-FUHWJXTLSA-N 2 1 326.484 4.199 20 0 EIADMP CCOc1cccc2cc([C@H](C)N[C@H]3CC[N@@H+](C)C(C)(C)C3)oc21 ZINC000623342621 1052626187 /nfs/dbraw/zinc/62/61/87/1052626187.db2.gz GQXUTNKLQDJWIX-HOCLYGCPSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)oc21 ZINC000623342621 1052626194 /nfs/dbraw/zinc/62/61/94/1052626194.db2.gz GQXUTNKLQDJWIX-HOCLYGCPSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@H]3CC[N@@H+](C)C(C)(C)C3)oc21 ZINC000623342621 1052626198 /nfs/dbraw/zinc/62/61/98/1052626198.db2.gz GQXUTNKLQDJWIX-HOCLYGCPSA-N 2 1 330.472 4.355 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CN[C@@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357193 1052634309 /nfs/dbraw/zinc/63/43/09/1052634309.db2.gz BZJDZANHKHMQGR-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(CN[C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623357193 1052634315 /nfs/dbraw/zinc/63/43/15/1052634315.db2.gz BZJDZANHKHMQGR-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(CN[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623357193 1052634319 /nfs/dbraw/zinc/63/43/19/1052634319.db2.gz BZJDZANHKHMQGR-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357193 1052634324 /nfs/dbraw/zinc/63/43/24/1052634324.db2.gz BZJDZANHKHMQGR-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357193 1052634326 /nfs/dbraw/zinc/63/43/26/1052634326.db2.gz BZJDZANHKHMQGR-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623357193 1052634330 /nfs/dbraw/zinc/63/43/30/1052634330.db2.gz BZJDZANHKHMQGR-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623357193 1052634334 /nfs/dbraw/zinc/63/43/34/1052634334.db2.gz BZJDZANHKHMQGR-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1OC(F)F ZINC000623355780 1052634803 /nfs/dbraw/zinc/63/48/03/1052634803.db2.gz VMTZTEDGFVVVFN-HIFRSBDPSA-N 2 1 326.431 4.202 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1OC(F)F ZINC000623355780 1052634806 /nfs/dbraw/zinc/63/48/06/1052634806.db2.gz VMTZTEDGFVVVFN-HIFRSBDPSA-N 2 1 326.431 4.202 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)ccc1OCCC(C)C ZINC000177901115 1052693589 /nfs/dbraw/zinc/69/35/89/1052693589.db2.gz NSRHRRAVZVMZRL-ZIFCJYIRSA-N 2 1 348.531 4.253 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1OCCC(C)C ZINC000177901115 1052693594 /nfs/dbraw/zinc/69/35/94/1052693594.db2.gz NSRHRRAVZVMZRL-ZIFCJYIRSA-N 2 1 348.531 4.253 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000623656916 1052698672 /nfs/dbraw/zinc/69/86/72/1052698672.db2.gz FMWKFQBMRXWOLV-UVQBRAAOSA-N 2 1 338.442 4.013 20 0 EIADMP Fc1ccc(S[C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000623866516 1052825128 /nfs/dbraw/zinc/82/51/28/1052825128.db2.gz YQOTVWTZTDGIBY-QGZVKYPTSA-N 2 1 348.531 4.445 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3scnc32)c1 ZINC000623877286 1052828499 /nfs/dbraw/zinc/82/84/99/1052828499.db2.gz XVTMKIPQHBEHFW-KRWDZBQOSA-N 2 1 329.513 4.151 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(CN[C@H]2CCCc3scnc32)c1 ZINC000623877286 1052828496 /nfs/dbraw/zinc/82/84/96/1052828496.db2.gz XVTMKIPQHBEHFW-KRWDZBQOSA-N 2 1 329.513 4.151 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3scnc32)c1 ZINC000623877286 1052828502 /nfs/dbraw/zinc/82/85/02/1052828502.db2.gz XVTMKIPQHBEHFW-KRWDZBQOSA-N 2 1 329.513 4.151 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC[N@H+]1C ZINC000623898298 1052832640 /nfs/dbraw/zinc/83/26/40/1052832640.db2.gz FAOWKUYTOFTHMU-IAISJRAMSA-N 2 1 331.891 4.271 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]C[C@H]3CCCC[N@H+](C)C3)oc21 ZINC000624122399 1052868796 /nfs/dbraw/zinc/86/87/96/1052868796.db2.gz QJUCJAJSSBETOF-HZPDHXFCSA-N 2 1 330.472 4.214 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]C[C@H]3CCCC[N@@H+](C)C3)oc21 ZINC000624122399 1052868797 /nfs/dbraw/zinc/86/87/97/1052868797.db2.gz QJUCJAJSSBETOF-HZPDHXFCSA-N 2 1 330.472 4.214 20 0 EIADMP COc1ccccc1[C@@H](CC(C)C)[NH2+]CCCCn1cc[nH+]c1C ZINC000181698979 1052893668 /nfs/dbraw/zinc/89/36/68/1052893668.db2.gz NQMJMRKGJLSFPB-LJQANCHMSA-N 2 1 329.488 4.357 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1OC(F)F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185667296 1053019536 /nfs/dbraw/zinc/01/95/36/1053019536.db2.gz TXDPUTOSPAVHRN-GDBMZVCRSA-N 2 1 338.442 4.031 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1OC(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185667296 1053019540 /nfs/dbraw/zinc/01/95/40/1053019540.db2.gz TXDPUTOSPAVHRN-GDBMZVCRSA-N 2 1 338.442 4.031 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000381151226 1053055579 /nfs/dbraw/zinc/05/55/79/1053055579.db2.gz ANTBRZLMBZOJLU-HKUYNNGSSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000381151226 1053055583 /nfs/dbraw/zinc/05/55/83/1053055583.db2.gz ANTBRZLMBZOJLU-HKUYNNGSSA-N 2 1 341.474 4.174 20 0 EIADMP COc1ccc(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000381343446 1053070383 /nfs/dbraw/zinc/07/03/83/1053070383.db2.gz LATOABLAJNQDGQ-NRFANRHFSA-N 2 1 338.495 4.087 20 0 EIADMP C[C@@H]([NH2+]Cc1sccc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381895137 1053109107 /nfs/dbraw/zinc/10/91/07/1053109107.db2.gz UEJAWGRKOWHVIO-GDBMZVCRSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@@H]([NH2+]Cc1sccc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381895137 1053109119 /nfs/dbraw/zinc/10/91/19/1053109119.db2.gz UEJAWGRKOWHVIO-GDBMZVCRSA-N 2 1 334.916 4.402 20 0 EIADMP Cc1c([C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cnn1-c1ccccc1 ZINC000764636673 1053241285 /nfs/dbraw/zinc/24/12/85/1053241285.db2.gz TTWKHTFOXWJMKN-OAHLLOKOSA-N 2 1 340.515 4.141 20 0 EIADMP CC(C)O[C@H]1CCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001195809574 1053495528 /nfs/dbraw/zinc/49/55/28/1053495528.db2.gz OCABUJYUOPJIID-NRFANRHFSA-N 2 1 330.516 4.062 20 0 EIADMP CSCC1CCC([NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000385424949 1053522246 /nfs/dbraw/zinc/52/22/46/1053522246.db2.gz LCMVAGVBCYGMHR-PPXMBRMGSA-N 2 1 346.584 4.408 20 0 EIADMP FC(F)(F)c1ccccc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000385614823 1053535630 /nfs/dbraw/zinc/53/56/30/1053535630.db2.gz OOKWEDXLBCRIRO-KRWDZBQOSA-N 2 1 348.412 4.317 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccnc(Cl)c1 ZINC000765451610 1053555042 /nfs/dbraw/zinc/55/50/42/1053555042.db2.gz ALNWACYVLHLWDN-HNNXBMFYSA-N 2 1 335.923 4.430 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc(C)cnc2Cl)cc1 ZINC000921514431 1053568178 /nfs/dbraw/zinc/56/81/78/1053568178.db2.gz YXYMUUGSMHECPJ-UHFFFAOYSA-N 2 1 331.891 4.175 20 0 EIADMP CCCC[N@@H+](Cc1cccc(OC)n1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545939 1053696678 /nfs/dbraw/zinc/69/66/78/1053696678.db2.gz VBCSVCHIUBYGNY-UHFFFAOYSA-N 2 1 333.520 4.002 20 0 EIADMP CC1(C)C[N@@H+](CCCCF)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001196545103 1053697465 /nfs/dbraw/zinc/69/74/65/1053697465.db2.gz KUSFFNITZGBRTG-HXUWFJFHSA-N 2 1 332.507 4.359 20 0 EIADMP CCOc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000386416522 1053713902 /nfs/dbraw/zinc/71/39/02/1053713902.db2.gz YTOLFOWGZUAATJ-RXVVDRJESA-N 2 1 338.495 4.086 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CC[C@@H]2CCCS2)C3)cc1 ZINC000866482263 1053745567 /nfs/dbraw/zinc/74/55/67/1053745567.db2.gz ZJEXLENRIZOXDD-YRPNKDGESA-N 2 1 330.541 4.057 20 0 EIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2C[C@H]2CCCCC2(F)F)CC1 ZINC001196934744 1053804196 /nfs/dbraw/zinc/80/41/96/1053804196.db2.gz CGTGAMPUFTWTLY-MSOLQXFVSA-N 2 1 328.491 4.398 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]CCCOC3CCCCC3)CC2)cc1 ZINC000121720908 1053841510 /nfs/dbraw/zinc/84/15/10/1053841510.db2.gz RKVSGOHXHKMMTL-UHFFFAOYSA-N 2 1 344.543 4.023 20 0 EIADMP C[C@]1(C2CCCCC2)CC[N@H+]1Cc1ccc(CN2CCOCC2)cc1 ZINC001197239247 1053859330 /nfs/dbraw/zinc/85/93/30/1053859330.db2.gz MZYBMVQPGADPEY-JOCHJYFZSA-N 2 1 342.527 4.064 20 0 EIADMP C[C@]1(C2CCCCC2)CC[N@@H+]1Cc1ccc(C[NH+]2CCOCC2)cc1 ZINC001197239247 1053859335 /nfs/dbraw/zinc/85/93/35/1053859335.db2.gz MZYBMVQPGADPEY-JOCHJYFZSA-N 2 1 342.527 4.064 20 0 EIADMP C[C@]1(C2CCCCC2)CC[N@H+]1Cc1ccc(C[NH+]2CCOCC2)cc1 ZINC001197239247 1053859337 /nfs/dbraw/zinc/85/93/37/1053859337.db2.gz MZYBMVQPGADPEY-JOCHJYFZSA-N 2 1 342.527 4.064 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2F)c2ccccc2)CC[N@@H+]1C ZINC000429522088 1053959736 /nfs/dbraw/zinc/95/97/36/1053959736.db2.gz SHSLCSGVHHYLPI-OZOXKJRCSA-N 2 1 326.459 4.182 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2F)c2ccccc2)CC[N@H+]1C ZINC000429522088 1053959748 /nfs/dbraw/zinc/95/97/48/1053959748.db2.gz SHSLCSGVHHYLPI-OZOXKJRCSA-N 2 1 326.459 4.182 20 0 EIADMP Clc1ccsc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000338542466 1053988498 /nfs/dbraw/zinc/98/84/98/1053988498.db2.gz PCDMOPCTFOLYDJ-UHFFFAOYSA-N 2 1 335.904 4.314 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000872022897 1054338386 /nfs/dbraw/zinc/33/83/86/1054338386.db2.gz MUKXMIWSGNLERX-FQEVSTJZSA-N 2 1 330.516 4.108 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccc(O)c2F)c1 ZINC000872028804 1054346541 /nfs/dbraw/zinc/34/65/41/1054346541.db2.gz RSTIEKDLIUNRJM-OAHLLOKOSA-N 2 1 330.447 4.222 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccc(O)c2F)c1 ZINC000872028804 1054346554 /nfs/dbraw/zinc/34/65/54/1054346554.db2.gz RSTIEKDLIUNRJM-OAHLLOKOSA-N 2 1 330.447 4.222 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]Cc3ccccc3C3CC3)CC2)cc1 ZINC001199126976 1054348932 /nfs/dbraw/zinc/34/89/32/1054348932.db2.gz JREBBSDTWDOUNH-UHFFFAOYSA-N 2 1 334.507 4.361 20 0 EIADMP CC(C)[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC001199127295 1054348997 /nfs/dbraw/zinc/34/89/97/1054348997.db2.gz WYNNRUSBORCOQN-IRLDBZIGSA-N 2 1 328.544 4.498 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)CC1(C)C ZINC001199309424 1054387156 /nfs/dbraw/zinc/38/71/56/1054387156.db2.gz IJLOAXQYGIJPOP-HXUWFJFHSA-N 2 1 338.495 4.228 20 0 EIADMP COc1cccc2c1CCC[C@H]([NH2+]C[C@@]1([NH+](C)C)CCC[C@H](C)C1)C2 ZINC001199638604 1054437688 /nfs/dbraw/zinc/43/76/88/1054437688.db2.gz FCYCDUPTSRFTDT-LQBOVUBWSA-N 2 1 344.543 4.043 20 0 EIADMP CCN(c1ccccc1)c1ccc(C[NH2+]CCn2cc[nH+]c2C)cc1 ZINC001199876004 1054488970 /nfs/dbraw/zinc/48/89/70/1054488970.db2.gz XCRWYEWXORRXCM-UHFFFAOYSA-N 2 1 334.467 4.139 20 0 EIADMP CCOc1ccc(C2=CC[N@H+](CC[C@@H]3CCCC[NH+]3C)CC2)cc1 ZINC000509503685 1054702082 /nfs/dbraw/zinc/70/20/82/1054702082.db2.gz OZRXMFQQBMXUAD-FQEVSTJZSA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccc(C2=CC[N@@H+](CC[C@@H]3CCCC[NH+]3C)CC2)cc1 ZINC000509503685 1054702095 /nfs/dbraw/zinc/70/20/95/1054702095.db2.gz OZRXMFQQBMXUAD-FQEVSTJZSA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccc(C2=CC[NH+](CC[C@@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000509503685 1054702106 /nfs/dbraw/zinc/70/21/06/1054702106.db2.gz OZRXMFQQBMXUAD-FQEVSTJZSA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccc(C2=CC[NH+](CC[C@@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000509503685 1054702119 /nfs/dbraw/zinc/70/21/19/1054702119.db2.gz OZRXMFQQBMXUAD-FQEVSTJZSA-N 2 1 328.500 4.049 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](CCCOc2ccc3ccccc3c2)CC1 ZINC000429546258 1054724254 /nfs/dbraw/zinc/72/42/54/1054724254.db2.gz BRLIKWSJCHJCAW-FQEVSTJZSA-N 2 1 326.484 4.025 20 0 EIADMP CC(C)=CCC[C@H](C)C[N@H+]1CC[C@@]2(C[NH+](C)C[C@@H]2COCC2CC2)C1 ZINC001201486161 1054814536 /nfs/dbraw/zinc/81/45/36/1054814536.db2.gz GJEJKEQVHSZANB-KSEOMHKRSA-N 2 1 348.575 4.049 20 0 EIADMP CC(C)=CCC[C@H](C)C[NH+]1CC[C@]2(C1)C[N@H+](C)C[C@@H]2COCC1CC1 ZINC001201486161 1054814538 /nfs/dbraw/zinc/81/45/38/1054814538.db2.gz GJEJKEQVHSZANB-KSEOMHKRSA-N 2 1 348.575 4.049 20 0 EIADMP CC(C)=CCC[C@H](C)C[NH+]1CC[C@]2(C1)C[N@@H+](C)C[C@@H]2COCC1CC1 ZINC001201486161 1054814542 /nfs/dbraw/zinc/81/45/42/1054814542.db2.gz GJEJKEQVHSZANB-KSEOMHKRSA-N 2 1 348.575 4.049 20 0 EIADMP CC(C)=CCC[C@H](C)C[N@@H+]1CCn2c(C[NH+](C)C(C)C)cnc2[C@@H]1C ZINC001201488102 1054816506 /nfs/dbraw/zinc/81/65/06/1054816506.db2.gz VPFUOXLCCUMVRD-OALUTQOASA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@H](C)C[N@H+]1CCn2c(C[NH+](C)C(C)C)cnc2[C@@H]1C ZINC001201488102 1054816509 /nfs/dbraw/zinc/81/65/09/1054816509.db2.gz VPFUOXLCCUMVRD-OALUTQOASA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@H](C)C[NH+]1CCn2c(C[N@H+](C)C(C)C)cnc2[C@@H]1C ZINC001201488102 1054816510 /nfs/dbraw/zinc/81/65/10/1054816510.db2.gz VPFUOXLCCUMVRD-OALUTQOASA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@H](C)C[NH+]1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@@H]1C ZINC001201488102 1054816519 /nfs/dbraw/zinc/81/65/19/1054816519.db2.gz VPFUOXLCCUMVRD-OALUTQOASA-N 2 1 346.563 4.482 20 0 EIADMP C[N@@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](CCc1ccccc1)CC2 ZINC001201597970 1054846695 /nfs/dbraw/zinc/84/66/95/1054846695.db2.gz DYDFFMCZBXGQGB-UHFFFAOYSA-N 2 1 349.522 4.001 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCOc2ccccc2C)CC1 ZINC000065223097 1054909975 /nfs/dbraw/zinc/90/99/75/1054909975.db2.gz JEFYLZGTXQAPHE-UHFFFAOYSA-N 2 1 332.532 4.208 20 0 EIADMP CC(C)=CCC[C@@H](C)CC[N@@H+]1CCn2c(C[NH+](C)C(C)C)cnc2C1 ZINC001201974677 1054952778 /nfs/dbraw/zinc/95/27/78/1054952778.db2.gz ZBSSRKARUUHFSH-LJQANCHMSA-N 2 1 346.563 4.312 20 0 EIADMP CC(C)=CCC[C@@H](C)CC[N@H+]1CCn2c(C[NH+](C)C(C)C)cnc2C1 ZINC001201974677 1054952793 /nfs/dbraw/zinc/95/27/93/1054952793.db2.gz ZBSSRKARUUHFSH-LJQANCHMSA-N 2 1 346.563 4.312 20 0 EIADMP CC(C)=CCC[C@@H](C)CC[NH+]1CCn2c(C[N@H+](C)C(C)C)cnc2C1 ZINC001201974677 1054952807 /nfs/dbraw/zinc/95/28/07/1054952807.db2.gz ZBSSRKARUUHFSH-LJQANCHMSA-N 2 1 346.563 4.312 20 0 EIADMP CC(C)=CCC[C@@H](C)CC[NH+]1CCn2c(C[N@@H+](C)C(C)C)cnc2C1 ZINC001201974677 1054952820 /nfs/dbraw/zinc/95/28/20/1054952820.db2.gz ZBSSRKARUUHFSH-LJQANCHMSA-N 2 1 346.563 4.312 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+]Cc1cccc(OCc2ccccc2Cl)c1 ZINC000065981522 1054983929 /nfs/dbraw/zinc/98/39/29/1054983929.db2.gz JSRKUIMPVJZZNI-MRXNPFEDSA-N 2 1 346.902 4.349 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3c(ccnc3Cl)o2)c1 ZINC000877020402 1055003391 /nfs/dbraw/zinc/00/33/91/1055003391.db2.gz SBISCKZYDHTFJE-UHFFFAOYSA-N 2 1 343.858 4.223 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000877546912 1055075807 /nfs/dbraw/zinc/07/58/07/1055075807.db2.gz NPUPSUNBSGIMEB-IFNDBITQSA-N 2 1 330.541 4.056 20 0 EIADMP COCC(C)(C)CC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877803742 1055121552 /nfs/dbraw/zinc/12/15/52/1055121552.db2.gz JDMAKYZATZYEAT-UYAOXDASSA-N 2 1 330.516 4.007 20 0 EIADMP COCC(C)(C)CC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877803742 1055121561 /nfs/dbraw/zinc/12/15/61/1055121561.db2.gz JDMAKYZATZYEAT-UYAOXDASSA-N 2 1 330.516 4.007 20 0 EIADMP FC(F)(F)CCC[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001202444048 1055176763 /nfs/dbraw/zinc/17/67/63/1055176763.db2.gz COAPXRUNKSPPMH-MSOLQXFVSA-N 2 1 340.433 4.173 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001202444048 1055176769 /nfs/dbraw/zinc/17/67/69/1055176769.db2.gz COAPXRUNKSPPMH-MSOLQXFVSA-N 2 1 340.433 4.173 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001202444048 1055176777 /nfs/dbraw/zinc/17/67/77/1055176777.db2.gz COAPXRUNKSPPMH-MSOLQXFVSA-N 2 1 340.433 4.173 20 0 EIADMP CC(C)[NH2+]C1CC[NH+](CCCOc2ccc(C(C)(C)C)cc2)CC1 ZINC000111054308 1055214271 /nfs/dbraw/zinc/21/42/71/1055214271.db2.gz DHKQOEXOKSARAR-UHFFFAOYSA-N 2 1 332.532 4.215 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC000166407486 1055548067 /nfs/dbraw/zinc/54/80/67/1055548067.db2.gz QYNKIXXWONPCBS-LSDHHAIUSA-N 2 1 341.326 4.487 20 0 EIADMP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000282300148 1055791664 /nfs/dbraw/zinc/79/16/64/1055791664.db2.gz MGAHYHHSXLHRKX-IZIZEDOESA-N 2 1 336.470 4.311 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474473037 1055884030 /nfs/dbraw/zinc/88/40/30/1055884030.db2.gz PLWYKDMHWRBJGI-VRLRAXNCSA-N 2 1 331.426 4.174 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1 ZINC000515315597 1056675780 /nfs/dbraw/zinc/67/57/80/1056675780.db2.gz HWVDPVVKKRVIOB-RBUKOAKNSA-N 2 1 344.886 4.274 20 0 EIADMP Brc1cccc(C2([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000180429465 1058600365 /nfs/dbraw/zinc/60/03/65/1058600365.db2.gz GLCNSMUQVVOPGN-DLBZAZTESA-N 2 1 349.316 4.045 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3cnccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379619231 1060134523 /nfs/dbraw/zinc/13/45/23/1060134523.db2.gz BFNASELXOMSVQN-WZONZLPQSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3cnccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379619231 1060134545 /nfs/dbraw/zinc/13/45/45/1060134545.db2.gz BFNASELXOMSVQN-WZONZLPQSA-N 2 1 345.490 4.378 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000386483109 1060266225 /nfs/dbraw/zinc/26/62/25/1060266225.db2.gz WLRQDPIDGSNHHW-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccnc(Cl)c1 ZINC000766466668 1060370154 /nfs/dbraw/zinc/37/01/54/1060370154.db2.gz ZNPOAJVJVYBDSK-TXPKVOOTSA-N 2 1 343.902 4.296 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccnc(Cl)c1 ZINC000766466668 1060370177 /nfs/dbraw/zinc/37/01/77/1060370177.db2.gz ZNPOAJVJVYBDSK-TXPKVOOTSA-N 2 1 343.902 4.296 20 0 EIADMP CC(C)C[C@@H](Cc1ccccc1)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001169062318 1060619321 /nfs/dbraw/zinc/61/93/21/1060619321.db2.gz SMSSXYMLCSGZJE-FQEVSTJZSA-N 3 1 347.591 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+](CCc1ccccc1)Cc1ccccc1)C2 ZINC001169148095 1060665270 /nfs/dbraw/zinc/66/52/70/1060665270.db2.gz YPZWHUWNCUQCLC-NUNAXRQHSA-N 2 1 334.507 4.357 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+](CCc1ccccc1)Cc1ccccc1)C2 ZINC001169148095 1060665280 /nfs/dbraw/zinc/66/52/80/1060665280.db2.gz YPZWHUWNCUQCLC-NUNAXRQHSA-N 2 1 334.507 4.357 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+](CCc1ccccc1)Cc1ccccc1)C2 ZINC001169148095 1060665287 /nfs/dbraw/zinc/66/52/87/1060665287.db2.gz YPZWHUWNCUQCLC-NUNAXRQHSA-N 2 1 334.507 4.357 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147032 1060665661 /nfs/dbraw/zinc/66/56/61/1060665661.db2.gz RMUHRKPLVPREKM-CAOSSQGBSA-N 2 1 339.310 4.408 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CC[C@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147032 1060665668 /nfs/dbraw/zinc/66/56/68/1060665668.db2.gz RMUHRKPLVPREKM-CAOSSQGBSA-N 2 1 339.310 4.408 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CC[C@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147032 1060665672 /nfs/dbraw/zinc/66/56/72/1060665672.db2.gz RMUHRKPLVPREKM-CAOSSQGBSA-N 2 1 339.310 4.408 20 0 EIADMP 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 1060666404 /nfs/dbraw/zinc/66/64/04/1060666404.db2.gz VSUPYEFXNMBVGX-BGTYHANMSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CC[C@@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147648 1060666410 /nfs/dbraw/zinc/66/64/10/1060666410.db2.gz VSUPYEFXNMBVGX-BGTYHANMSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CC[C@@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147648 1060666416 /nfs/dbraw/zinc/66/64/16/1060666416.db2.gz VSUPYEFXNMBVGX-BGTYHANMSA-N 2 1 338.417 4.120 20 0 EIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169154969 1060670324 /nfs/dbraw/zinc/67/03/24/1060670324.db2.gz VGTCDVTZZDTYDA-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP CC[NH+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169154969 1060670333 /nfs/dbraw/zinc/67/03/33/1060670333.db2.gz VGTCDVTZZDTYDA-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP CC[NH+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169154969 1060670340 /nfs/dbraw/zinc/67/03/40/1060670340.db2.gz VGTCDVTZZDTYDA-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2sccc2Oc2ccccc2)CCC[C@H]1C[NH3+] ZINC001206003734 1060687793 /nfs/dbraw/zinc/68/77/93/1060687793.db2.gz LYSYUHUFUGITRA-CVEARBPZSA-N 2 1 330.497 4.347 20 0 EIADMP CC[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC001169261444 1060708911 /nfs/dbraw/zinc/70/89/11/1060708911.db2.gz FWHMNHYLYFPTOP-QGZVFWFLSA-N 2 1 326.406 4.327 20 0 EIADMP CC[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC001169261444 1060708917 /nfs/dbraw/zinc/70/89/17/1060708917.db2.gz FWHMNHYLYFPTOP-QGZVFWFLSA-N 2 1 326.406 4.327 20 0 EIADMP C[N@H+]1CCC[C@@H](CCNc2[nH+]ccc3c2ccn3Cc2ccccc2)C1 ZINC001156390076 1061008250 /nfs/dbraw/zinc/00/82/50/1061008250.db2.gz UUDOHFSMSWAMHB-IBGZPJMESA-N 2 1 348.494 4.228 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(Br)s2)CC1 ZINC000038002098 202384319 /nfs/dbraw/zinc/38/43/19/202384319.db2.gz XVANHCZULPZVLG-LLVKDONJSA-N 2 1 331.323 4.036 20 0 EIADMP C[NH+]1CCC([NH2+][C@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1 ZINC000532200191 1032086583 /nfs/dbraw/zinc/08/65/83/1032086583.db2.gz ZMUULQDDNPBAEC-HXUWFJFHSA-N 2 1 328.887 4.308 20 0 EIADMP CCc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)o1 ZINC000532367450 1032173866 /nfs/dbraw/zinc/17/38/66/1032173866.db2.gz OZWXYHPJBFBUDG-QGZVFWFLSA-N 2 1 326.484 4.364 20 0 EIADMP CCc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)o1 ZINC000532367450 1032173872 /nfs/dbraw/zinc/17/38/72/1032173872.db2.gz OZWXYHPJBFBUDG-QGZVFWFLSA-N 2 1 326.484 4.364 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1OC ZINC000173364523 1032359351 /nfs/dbraw/zinc/35/93/51/1032359351.db2.gz OKFLHRNAXBSNIS-MRXNPFEDSA-N 2 1 346.515 4.009 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000173386117 1032360875 /nfs/dbraw/zinc/36/08/75/1032360875.db2.gz WQFJNABANNHMRJ-STQMWFEESA-N 2 1 325.378 4.197 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)C1CC(F)(F)C1 ZINC000529543538 1032434156 /nfs/dbraw/zinc/43/41/56/1032434156.db2.gz BBVXMKVYPLHOOT-ZENOOKHLSA-N 2 1 328.472 4.154 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)C1CC(F)(F)C1 ZINC000529543538 1032434167 /nfs/dbraw/zinc/43/41/67/1032434167.db2.gz BBVXMKVYPLHOOT-ZENOOKHLSA-N 2 1 328.472 4.154 20 0 EIADMP C[C@@H](c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427244 1032487126 /nfs/dbraw/zinc/48/71/26/1032487126.db2.gz FFOPRUKBJWKTEV-DOTOQJQBSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427244 1032487132 /nfs/dbraw/zinc/48/71/32/1032487132.db2.gz FFOPRUKBJWKTEV-DOTOQJQBSA-N 2 1 340.433 4.270 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000178706650 1032543733 /nfs/dbraw/zinc/54/37/33/1032543733.db2.gz ZBLQDNLEHAOINM-CABCVRRESA-N 2 1 340.496 4.302 20 0 EIADMP c1cc2c(o1)CCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000180107286 1032566484 /nfs/dbraw/zinc/56/64/84/1032566484.db2.gz PIOQHRLTOHCOBX-QYYYHEGRSA-N 2 1 336.479 4.442 20 0 EIADMP c1cc2c(o1)CCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180107286 1032566489 /nfs/dbraw/zinc/56/64/89/1032566489.db2.gz PIOQHRLTOHCOBX-QYYYHEGRSA-N 2 1 336.479 4.442 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000760174784 1032572123 /nfs/dbraw/zinc/57/21/23/1032572123.db2.gz ZCJCNBODKRODBJ-SJLPKXTDSA-N 2 1 343.902 4.298 20 0 EIADMP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1 ZINC000533354619 1032690600 /nfs/dbraw/zinc/69/06/00/1032690600.db2.gz IIMUUOJAXYCSMY-SFHVURJKSA-N 2 1 341.474 4.271 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1 ZINC000533354619 1032690612 /nfs/dbraw/zinc/69/06/12/1032690612.db2.gz IIMUUOJAXYCSMY-SFHVURJKSA-N 2 1 341.474 4.271 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1 ZINC000533354619 1032690620 /nfs/dbraw/zinc/69/06/20/1032690620.db2.gz IIMUUOJAXYCSMY-SFHVURJKSA-N 2 1 341.474 4.271 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1 ZINC000533354619 1032690631 /nfs/dbraw/zinc/69/06/31/1032690631.db2.gz IIMUUOJAXYCSMY-SFHVURJKSA-N 2 1 341.474 4.271 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000432796644 1032818586 /nfs/dbraw/zinc/81/85/86/1032818586.db2.gz BCWQPGKTSHRLIP-MRXNPFEDSA-N 2 1 332.488 4.470 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000432796644 1032818590 /nfs/dbraw/zinc/81/85/90/1032818590.db2.gz BCWQPGKTSHRLIP-MRXNPFEDSA-N 2 1 332.488 4.470 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccccc2OCc2ccccc2)CC1 ZINC000432799005 1032821064 /nfs/dbraw/zinc/82/10/64/1032821064.db2.gz VCIVJOWBMMXLPY-NRFANRHFSA-N 2 1 338.495 4.182 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccccc2OCc2ccccc2)CC1 ZINC000432799005 1032821069 /nfs/dbraw/zinc/82/10/69/1032821069.db2.gz VCIVJOWBMMXLPY-NRFANRHFSA-N 2 1 338.495 4.182 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC000683227151 1019542955 /nfs/dbraw/zinc/54/29/55/1019542955.db2.gz CCPLVWMVXCFVGI-QGZVFWFLSA-N 2 1 328.422 4.054 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(CSC(F)F)o2)C1 ZINC000120621082 1019898133 /nfs/dbraw/zinc/89/81/33/1019898133.db2.gz FSBIYEHQFUWLFA-CQSZACIVSA-N 2 1 346.487 4.337 20 0 EIADMP Clc1cccc(OCCC[NH+]2CCC([NH+]3CCCCC3)CC2)c1 ZINC000065223069 1019969510 /nfs/dbraw/zinc/96/95/10/1019969510.db2.gz ZTUTXSVNIHRNEV-UHFFFAOYSA-N 2 1 336.907 4.059 20 0 EIADMP CS[C@H]1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000180141865 1020064894 /nfs/dbraw/zinc/06/48/94/1020064894.db2.gz RFUHKMZCLCDMOQ-WNTWWTRPSA-N 2 1 344.568 4.446 20 0 EIADMP FC(F)(F)c1ccc2c(N[C@H]3CC[N@@H+]4CCC[C@H]4C3)cc[nH+]c2c1 ZINC000443677833 1020207769 /nfs/dbraw/zinc/20/77/69/1020207769.db2.gz ZPYZJBSAZVFLGR-KBPBESRZSA-N 2 1 335.373 4.292 20 0 EIADMP FC(F)(F)c1ccc2c(N[C@H]3CC[N@H+]4CCC[C@H]4C3)cc[nH+]c2c1 ZINC000443677833 1020207780 /nfs/dbraw/zinc/20/77/80/1020207780.db2.gz ZPYZJBSAZVFLGR-KBPBESRZSA-N 2 1 335.373 4.292 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000398153888 1020506013 /nfs/dbraw/zinc/50/60/13/1020506013.db2.gz QCFBOHSOHMNLFQ-DVVHHAQGSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000398153888 1020506026 /nfs/dbraw/zinc/50/60/26/1020506026.db2.gz QCFBOHSOHMNLFQ-DVVHHAQGSA-N 2 1 334.507 4.433 20 0 EIADMP Cn1c[nH+]cc1CCC[NH+]1CCC(c2cccc3ccccc32)CC1 ZINC001167248323 1020666426 /nfs/dbraw/zinc/66/64/26/1020666426.db2.gz NHVFSHAWAZXUQH-UHFFFAOYSA-N 2 1 333.479 4.386 20 0 EIADMP CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547830237 1020775206 /nfs/dbraw/zinc/77/52/06/1020775206.db2.gz KLSCIUISJUWKSL-BHYGNILZSA-N 2 1 328.422 4.218 20 0 EIADMP CC(C)(C)[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(F)cc1 ZINC000655703334 1020907782 /nfs/dbraw/zinc/90/77/82/1020907782.db2.gz OJQHVDXPWNBQAW-UXHICEINSA-N 2 1 348.506 4.146 20 0 EIADMP Cc1cccc([C@H]([NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)C(C)(C)C)c1 ZINC000655720818 1020916870 /nfs/dbraw/zinc/91/68/70/1020916870.db2.gz HAXYTUFZWXDZPS-SFTDATJTSA-N 2 1 344.543 4.315 20 0 EIADMP Cc1ncc(C[NH+]2CCC3(CCC[N@H+](C4CCCC4)C3)CC2)s1 ZINC001279420027 1020928236 /nfs/dbraw/zinc/92/82/36/1020928236.db2.gz YYLVSECGXIMOIE-UHFFFAOYSA-N 2 1 333.545 4.072 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCSC(C)(C)C)CC1 ZINC001167305970 1020997282 /nfs/dbraw/zinc/99/72/82/1020997282.db2.gz AOZHFBHKCAEFKO-UHFFFAOYSA-N 2 1 334.573 4.362 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc3cccnc32)c1 ZINC000340438432 1021027317 /nfs/dbraw/zinc/02/73/17/1021027317.db2.gz ZRVFSJYHXFHUHX-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccncc1F ZINC000340469448 1021072539 /nfs/dbraw/zinc/07/25/39/1021072539.db2.gz JRMTVAAEYVEIHA-SJORKVTESA-N 2 1 341.474 4.303 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccncc1F ZINC000340469448 1021072543 /nfs/dbraw/zinc/07/25/43/1021072543.db2.gz JRMTVAAEYVEIHA-SJORKVTESA-N 2 1 341.474 4.303 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccncc1F ZINC000340475463 1021096181 /nfs/dbraw/zinc/09/61/81/1021096181.db2.gz RQXNUJXCUNCVMM-IAGOWNOFSA-N 2 1 341.474 4.446 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1ccncc1F ZINC000340475463 1021096187 /nfs/dbraw/zinc/09/61/87/1021096187.db2.gz RQXNUJXCUNCVMM-IAGOWNOFSA-N 2 1 341.474 4.446 20 0 EIADMP Cc1ccncc1[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000683691511 1021100274 /nfs/dbraw/zinc/10/02/74/1021100274.db2.gz YNVFDSFOHIZERQ-WLRLJWMZSA-N 2 1 335.495 4.236 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000272354298 1021643033 /nfs/dbraw/zinc/64/30/33/1021643033.db2.gz RCBQXHMQMONGAC-DOXZYTNZSA-N 2 1 343.540 4.321 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccc4cnccc4c3)C2)CC1 ZINC000683827440 1021724803 /nfs/dbraw/zinc/72/48/03/1021724803.db2.gz GXRXCWFSMNLYIQ-FQEVSTJZSA-N 2 1 337.511 4.179 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccc4cnccc4c3)C2)CC1 ZINC000683827440 1021724829 /nfs/dbraw/zinc/72/48/29/1021724829.db2.gz GXRXCWFSMNLYIQ-FQEVSTJZSA-N 2 1 337.511 4.179 20 0 EIADMP c1cc2cc(C[N@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)ccc2cn1 ZINC000683830260 1021746719 /nfs/dbraw/zinc/74/67/19/1021746719.db2.gz SJWAKBJZWPXEBW-HXUWFJFHSA-N 2 1 337.511 4.323 20 0 EIADMP c1cc2cc(C[N@@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)ccc2cn1 ZINC000683830260 1021746736 /nfs/dbraw/zinc/74/67/36/1021746736.db2.gz SJWAKBJZWPXEBW-HXUWFJFHSA-N 2 1 337.511 4.323 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1csc(-c2ccccc2)n1 ZINC000414085167 1021824052 /nfs/dbraw/zinc/82/40/52/1021824052.db2.gz YCHDIZMNQGUJPL-GJZGRUSLSA-N 2 1 340.496 4.302 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1csc(-c2ccccc2)n1 ZINC000414086349 1021826650 /nfs/dbraw/zinc/82/66/50/1021826650.db2.gz ZKEJPMKDYRIZBE-CQSZACIVSA-N 2 1 326.469 4.056 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)c(C)c1 ZINC000414109576 1021869174 /nfs/dbraw/zinc/86/91/74/1021869174.db2.gz HLKZNTAKDJVFGR-KRWDZBQOSA-N 2 1 339.483 4.027 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c(C)c1 ZINC000414110191 1021870889 /nfs/dbraw/zinc/87/08/89/1021870889.db2.gz HXTJJNBDZOXUAT-KRWDZBQOSA-N 2 1 339.483 4.027 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000564429263 1022007501 /nfs/dbraw/zinc/00/75/01/1022007501.db2.gz PNXWTFOCIKYGHC-FPOVZHCZSA-N 2 1 337.511 4.343 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000564429263 1022007514 /nfs/dbraw/zinc/00/75/14/1022007514.db2.gz PNXWTFOCIKYGHC-FPOVZHCZSA-N 2 1 337.511 4.343 20 0 EIADMP COc1ccc2cc([C@@H](C)[NH2+]CC[C@H]3CCC[N@@H+](C)C3)ccc2c1 ZINC000414171311 1022023482 /nfs/dbraw/zinc/02/34/82/1022023482.db2.gz DFFQWXZJZKMYHY-IAGOWNOFSA-N 2 1 326.484 4.231 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)c2ccccc12 ZINC000414173963 1022031547 /nfs/dbraw/zinc/03/15/47/1022031547.db2.gz HEMSHFWOHXDMIF-SJORKVTESA-N 2 1 326.484 4.231 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2OC)CC1 ZINC000613491916 1022165102 /nfs/dbraw/zinc/16/51/02/1022165102.db2.gz DQQZTCYNOPDMDA-UHFFFAOYSA-N 2 1 338.923 4.293 20 0 EIADMP COc1ccsc1[C@H](C)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000471593615 1022202076 /nfs/dbraw/zinc/20/20/76/1022202076.db2.gz MJBLPSVVUAWZAB-RYRKJORJSA-N 2 1 344.524 4.318 20 0 EIADMP COc1ccsc1[C@H](C)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000471593615 1022202083 /nfs/dbraw/zinc/20/20/83/1022202083.db2.gz MJBLPSVVUAWZAB-RYRKJORJSA-N 2 1 344.524 4.318 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H](C)CC(F)(F)F)cc1 ZINC000414256345 1022326461 /nfs/dbraw/zinc/32/64/61/1022326461.db2.gz COEIHSVXDMFOIP-OLZOCXBDSA-N 2 1 325.378 4.420 20 0 EIADMP c1ccc2c(c1)ccc1c2OCCC[C@H]1[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000378192780 1022505163 /nfs/dbraw/zinc/50/51/63/1022505163.db2.gz PHWUFYPVUIJGTR-OAQYLSRUSA-N 2 1 336.479 4.270 20 0 EIADMP CC(C)Oc1ccc(CC[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000892630873 1022700412 /nfs/dbraw/zinc/70/04/12/1022700412.db2.gz KGYXLYSEOYINIC-VOBGVNJCSA-N 2 1 330.516 4.010 20 0 EIADMP c1nc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)sc1-c1ccccc1 ZINC000647542747 1022779143 /nfs/dbraw/zinc/77/91/43/1022779143.db2.gz BJFDCXQURDSEQC-ROUUACIJSA-N 2 1 341.524 4.022 20 0 EIADMP C[C@H]([NH2+]CCc1c(F)cccc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000402101122 1022800990 /nfs/dbraw/zinc/80/09/90/1022800990.db2.gz VGCRZWLMUXDAJU-WMZOPIPTSA-N 2 1 344.449 4.008 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000581131477 1022847459 /nfs/dbraw/zinc/84/74/59/1022847459.db2.gz RKORXKPMNUBNIJ-SLFFLAALSA-N 2 1 344.568 4.447 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000581131477 1022847460 /nfs/dbraw/zinc/84/74/60/1022847460.db2.gz RKORXKPMNUBNIJ-SLFFLAALSA-N 2 1 344.568 4.447 20 0 EIADMP CC[C@@H](C)c1ccc([C@@H](C)[NH2+]CCCCN2CC[NH+](CC)CC2)cc1 ZINC000623861782 1022877519 /nfs/dbraw/zinc/87/75/19/1022877519.db2.gz CHJIOPAQVVMQSB-WOJBJXKFSA-N 2 1 345.575 4.268 20 0 EIADMP CCCC[C@H](C)[C@H](C)[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000367998648 1022968400 /nfs/dbraw/zinc/96/84/00/1022968400.db2.gz QZMVWBLHTVPJFB-HOTGVXAUSA-N 2 1 335.536 4.308 20 0 EIADMP C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687838 1023189588 /nfs/dbraw/zinc/18/95/88/1023189588.db2.gz PXEIDOKANLTINQ-BEFAXECRSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687838 1023189592 /nfs/dbraw/zinc/18/95/92/1023189592.db2.gz PXEIDOKANLTINQ-BEFAXECRSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687838 1023189597 /nfs/dbraw/zinc/18/95/97/1023189597.db2.gz PXEIDOKANLTINQ-BEFAXECRSA-N 2 1 328.431 4.002 20 0 EIADMP Cc1nc(C)c(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000310276138 1023233026 /nfs/dbraw/zinc/23/30/26/1023233026.db2.gz OLYHGDDVJKXFMU-IBGZPJMESA-N 2 1 343.540 4.152 20 0 EIADMP Cc1nc(C)c(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000310276140 1023233495 /nfs/dbraw/zinc/23/34/95/1023233495.db2.gz OLYHGDDVJKXFMU-LJQANCHMSA-N 2 1 343.540 4.152 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(Cl)cn2)CC1 ZINC000581447644 1023238317 /nfs/dbraw/zinc/23/83/17/1023238317.db2.gz RPHFXHXYTVZLLV-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(Cl)cn2)CC1 ZINC000581447644 1023238334 /nfs/dbraw/zinc/23/83/34/1023238334.db2.gz RPHFXHXYTVZLLV-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP [NH3+]CCC[C@H]([NH2+][C@@H](CCc1ccccc1)C(F)F)c1ccccc1 ZINC000415052412 1023409723 /nfs/dbraw/zinc/40/97/23/1023409723.db2.gz LDNRUHHXNRPNNK-OALUTQOASA-N 2 1 332.438 4.323 20 0 EIADMP Brc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000415075696 1023423177 /nfs/dbraw/zinc/42/31/77/1023423177.db2.gz BYFPQVJZYXVDJI-MSOLQXFVSA-N 2 1 345.284 4.032 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1F ZINC000415078603 1023429329 /nfs/dbraw/zinc/42/93/29/1023429329.db2.gz IZJNASHAPFCDBA-FXAWDEMLSA-N 2 1 326.459 4.186 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+]CCOc3ccc4ccccc4c3)CC[NH2+]2)cc1 ZINC000415086973 1023437588 /nfs/dbraw/zinc/43/75/88/1023437588.db2.gz SJQINOZRQMWVLN-FYYLOGMGSA-N 2 1 346.474 4.302 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]CCOc3ccc4ccccc4c3)CC[NH2+]2)cc1 ZINC000415086974 1023437701 /nfs/dbraw/zinc/43/77/01/1023437701.db2.gz SJQINOZRQMWVLN-GGAORHGYSA-N 2 1 346.474 4.302 20 0 EIADMP Cc1sc([C@@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)nc1-c1ccc(Cl)cc1 ZINC000415088852 1023439226 /nfs/dbraw/zinc/43/92/26/1023439226.db2.gz VSTVZXKMXCAMNQ-TZMCWYRMSA-N 2 1 349.931 4.422 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@@H]1c1ccccc1 ZINC000581621800 1023441384 /nfs/dbraw/zinc/44/13/84/1023441384.db2.gz HGAOZWZIEBGCFV-PZJWPPBQSA-N 2 1 338.495 4.269 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@@H]1c1ccccc1 ZINC000581621800 1023441389 /nfs/dbraw/zinc/44/13/89/1023441389.db2.gz HGAOZWZIEBGCFV-PZJWPPBQSA-N 2 1 338.495 4.269 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Br)c(C)c2)C[C@H]1C ZINC000500088701 1023494866 /nfs/dbraw/zinc/49/48/66/1023494866.db2.gz FQDAPNMFPWXYDZ-ZBFHGGJFSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Br)c(C)c2)C[C@H]1C ZINC000500088701 1023494872 /nfs/dbraw/zinc/49/48/72/1023494872.db2.gz FQDAPNMFPWXYDZ-ZBFHGGJFSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Br)c(C)c2)C[C@H]1C ZINC000500088701 1023494876 /nfs/dbraw/zinc/49/48/76/1023494876.db2.gz FQDAPNMFPWXYDZ-ZBFHGGJFSA-N 2 1 339.321 4.062 20 0 EIADMP C[C@H](C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118177 1023515556 /nfs/dbraw/zinc/51/55/56/1023515556.db2.gz SNSVTIFQPIFYKD-HFTRVMKXSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118177 1023515562 /nfs/dbraw/zinc/51/55/62/1023515562.db2.gz SNSVTIFQPIFYKD-HFTRVMKXSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118177 1023515568 /nfs/dbraw/zinc/51/55/68/1023515568.db2.gz SNSVTIFQPIFYKD-HFTRVMKXSA-N 2 1 340.433 4.225 20 0 EIADMP CCCC[N@@H+](CCCN1CC[NH+](C(C)C)CC1)[C@@H](C)c1ccccc1 ZINC000500126503 1023519887 /nfs/dbraw/zinc/51/98/87/1023519887.db2.gz ARRAKNZKPFDWMK-NRFANRHFSA-N 2 1 345.575 4.266 20 0 EIADMP c1sc(-c2ccccc2)nc1C[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656786257 1023527964 /nfs/dbraw/zinc/52/79/64/1023527964.db2.gz QYYUKPQVPIYOAI-SFHVURJKSA-N 2 1 341.524 4.022 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC000398017874 1023642840 /nfs/dbraw/zinc/64/28/40/1023642840.db2.gz IIXQUYISKOXQAP-MBSDFSHPSA-N 2 1 334.507 4.176 20 0 EIADMP Cc1ccc([C@@H](C2CC2)[N@H+](C)C2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000377650846 1023652958 /nfs/dbraw/zinc/65/29/58/1023652958.db2.gz NZLVYDRVOSWXDI-QFIPXVFZSA-N 2 1 342.527 4.021 20 0 EIADMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2cnc(-c3ccc(C(C)C)cc3)s2)C1 ZINC000430650539 1023653766 /nfs/dbraw/zinc/65/37/66/1023653766.db2.gz KCYRCFVOWYPZPE-INIZCTEOSA-N 2 1 343.540 4.365 20 0 EIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cnc(-c3ccc(C(C)C)cc3)s2)C1 ZINC000430650539 1023653772 /nfs/dbraw/zinc/65/37/72/1023653772.db2.gz KCYRCFVOWYPZPE-INIZCTEOSA-N 2 1 343.540 4.365 20 0 EIADMP Clc1ccc(CNC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)o1 ZINC000390554774 1023671359 /nfs/dbraw/zinc/67/13/59/1023671359.db2.gz LBBOPCHPVSTCGI-ALOPSCKCSA-N 2 1 330.859 4.218 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[N@@H+]2CCC3(CCOCC3)[C@@H]2C)cc1 ZINC000377710951 1023705448 /nfs/dbraw/zinc/70/54/48/1023705448.db2.gz YKLQOAWRXMNGSP-SJORKVTESA-N 2 1 339.483 4.133 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[N@H+]2CCC3(CCOCC3)[C@@H]2C)cc1 ZINC000377710951 1023705451 /nfs/dbraw/zinc/70/54/51/1023705451.db2.gz YKLQOAWRXMNGSP-SJORKVTESA-N 2 1 339.483 4.133 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398165569 1023716357 /nfs/dbraw/zinc/71/63/57/1023716357.db2.gz GSYBSAHFRJSWIH-HMFYCAOWSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398165569 1023716371 /nfs/dbraw/zinc/71/63/71/1023716371.db2.gz GSYBSAHFRJSWIH-HMFYCAOWSA-N 2 1 340.486 4.257 20 0 EIADMP CN1CCC([NH+]2CCC(CC[N@@H+](C)[C@H]3C=CCCCCC3)CC2)CC1 ZINC000559107719 1023734128 /nfs/dbraw/zinc/73/41/28/1023734128.db2.gz SKOQEVTVQAAMII-NRFANRHFSA-N 3 1 347.591 4.003 20 0 EIADMP C[N@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)[C@H]1C=CCCCCC1 ZINC000559107719 1023734137 /nfs/dbraw/zinc/73/41/37/1023734137.db2.gz SKOQEVTVQAAMII-NRFANRHFSA-N 3 1 347.591 4.003 20 0 EIADMP C[N@@H+](CCC1CC[NH+](C2CC[NH+](C)CC2)CC1)[C@H]1C=CCCCCC1 ZINC000559107719 1023734146 /nfs/dbraw/zinc/73/41/46/1023734146.db2.gz SKOQEVTVQAAMII-NRFANRHFSA-N 3 1 347.591 4.003 20 0 EIADMP CC[C@H](CC(F)F)C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000660436512 1023793909 /nfs/dbraw/zinc/79/39/09/1023793909.db2.gz RMFJWRZRZCFJMI-CQSZACIVSA-N 2 1 325.447 4.080 20 0 EIADMP Cc1cccc(COc2ccc([C@H](C)[NH2+]CCc3c[nH+]cn3C)cc2)c1 ZINC000471772169 1023823163 /nfs/dbraw/zinc/82/31/63/1023823163.db2.gz OXDISABRBYBNDP-SFHVURJKSA-N 2 1 349.478 4.201 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Br)c1 ZINC000130225279 1023932729 /nfs/dbraw/zinc/93/27/29/1023932729.db2.gz YTXFOVKGNLZJLO-ZACQAIPSSA-N 2 1 337.305 4.117 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2cc3cnccc3o2)CC[N@@H+]1Cc1ccccc1 ZINC000651637988 1024063436 /nfs/dbraw/zinc/06/34/36/1024063436.db2.gz HEEBYAABMNNZDA-FXAWDEMLSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2cc3cnccc3o2)CC[N@H+]1Cc1ccccc1 ZINC000651637988 1024063452 /nfs/dbraw/zinc/06/34/52/1024063452.db2.gz HEEBYAABMNNZDA-FXAWDEMLSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2cc3cnccc3o2)CC[NH+]1Cc1ccccc1 ZINC000651637988 1024063471 /nfs/dbraw/zinc/06/34/71/1024063471.db2.gz HEEBYAABMNNZDA-FXAWDEMLSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cc3cnccc3o2)CC[NH+]1Cc1ccccc1 ZINC000651637988 1024063483 /nfs/dbraw/zinc/06/34/83/1024063483.db2.gz HEEBYAABMNNZDA-FXAWDEMLSA-N 2 1 349.478 4.313 20 0 EIADMP CCC[N@@H+]1Cc2cccc(NC(=O)CC[NH+](C)C3CCCCC3)c2C1 ZINC000548389426 1024105584 /nfs/dbraw/zinc/10/55/84/1024105584.db2.gz LXJORHJWKFUVMT-UHFFFAOYSA-N 2 1 343.515 4.005 20 0 EIADMP CCC[N@H+]1Cc2cccc(NC(=O)CC[NH+](C)C3CCCCC3)c2C1 ZINC000548389426 1024105599 /nfs/dbraw/zinc/10/55/99/1024105599.db2.gz LXJORHJWKFUVMT-UHFFFAOYSA-N 2 1 343.515 4.005 20 0 EIADMP CCC[NH+]1Cc2cccc(NC(=O)CC[N@H+](C)C3CCCCC3)c2C1 ZINC000548389426 1024105618 /nfs/dbraw/zinc/10/56/18/1024105618.db2.gz LXJORHJWKFUVMT-UHFFFAOYSA-N 2 1 343.515 4.005 20 0 EIADMP CCC[NH+]1Cc2cccc(NC(=O)CC[N@@H+](C)C3CCCCC3)c2C1 ZINC000548389426 1024105637 /nfs/dbraw/zinc/10/56/37/1024105637.db2.gz LXJORHJWKFUVMT-UHFFFAOYSA-N 2 1 343.515 4.005 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@@H]([NH3+])[C@@H](C)C3)s2)cc1 ZINC000430950046 1024268913 /nfs/dbraw/zinc/26/89/13/1024268913.db2.gz PPHIMICNLXDAGA-KBXCAEBGSA-N 2 1 329.513 4.103 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@@H]([NH3+])[C@@H](C)C3)s2)cc1 ZINC000430950046 1024268941 /nfs/dbraw/zinc/26/89/41/1024268941.db2.gz PPHIMICNLXDAGA-KBXCAEBGSA-N 2 1 329.513 4.103 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)ccc1Cl ZINC000510711445 1024280880 /nfs/dbraw/zinc/28/08/80/1024280880.db2.gz COXMMVPJNFMTPI-INIZCTEOSA-N 2 1 336.907 4.047 20 0 EIADMP Cc1cccc(NC[C@H]2CC[N@H+](Cc3cc4c(ccc(C)c4C)[nH]3)C2)[nH+]1 ZINC000473141261 1024421902 /nfs/dbraw/zinc/42/19/02/1024421902.db2.gz NKOABUPWQCKZFO-GOSISDBHSA-N 2 1 348.494 4.422 20 0 EIADMP Cc1cccc(NC[C@H]2CC[N@@H+](Cc3cc4c(ccc(C)c4C)[nH]3)C2)[nH+]1 ZINC000473141261 1024421953 /nfs/dbraw/zinc/42/19/53/1024421953.db2.gz NKOABUPWQCKZFO-GOSISDBHSA-N 2 1 348.494 4.422 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CC2(CCC2)Oc2ccccc21 ZINC000164662649 1024778730 /nfs/dbraw/zinc/77/87/30/1024778730.db2.gz PUXAXZWFBUXOMJ-SFHVURJKSA-N 2 1 325.456 4.008 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000164707442 1024819743 /nfs/dbraw/zinc/81/97/43/1024819743.db2.gz WEPQCHOHKCMFLH-CYBMUJFWSA-N 2 1 341.377 4.221 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cc[nH+]c3c(O)cccc23)C1 ZINC000684575021 1024828280 /nfs/dbraw/zinc/82/82/80/1024828280.db2.gz IZRMWAWKYAIKLM-IRXDYDNUSA-N 2 1 339.483 4.031 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000548483353 1024829795 /nfs/dbraw/zinc/82/97/95/1024829795.db2.gz NPJZKVMHVJGIBO-ILZDJORESA-N 2 1 342.552 4.488 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCSCC1 ZINC000510944329 1024859556 /nfs/dbraw/zinc/85/95/56/1024859556.db2.gz JDFXHTQPWZAQRX-YLJYHZDGSA-N 2 1 346.584 4.408 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCSCC1 ZINC000510944329 1024859559 /nfs/dbraw/zinc/85/95/59/1024859559.db2.gz JDFXHTQPWZAQRX-YLJYHZDGSA-N 2 1 346.584 4.408 20 0 EIADMP CC(C)c1ccc(OC2CC[NH+](CC[C@H]3CCC[N@H+]3C)CC2)cc1 ZINC000535765563 1024923229 /nfs/dbraw/zinc/92/32/29/1024923229.db2.gz VYYNVVSOFLIVNZ-LJQANCHMSA-N 2 1 330.516 4.138 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295866 1025049565 /nfs/dbraw/zinc/04/95/65/1025049565.db2.gz IIEDUBYJKJMPJO-PBHICJAKSA-N 2 1 338.442 4.061 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]Cc3cccc4[nH]ccc43)C2)c1 ZINC000236582273 1025245580 /nfs/dbraw/zinc/24/55/80/1025245580.db2.gz CZYKEGIOFLKMJU-INIZCTEOSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]Cc3cccc4[nH]ccc43)C2)c1 ZINC000236582273 1025245589 /nfs/dbraw/zinc/24/55/89/1025245589.db2.gz CZYKEGIOFLKMJU-INIZCTEOSA-N 2 1 339.508 4.231 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1CNc1[nH+]ccc2c(N)cccc21 ZINC000663391700 1025276632 /nfs/dbraw/zinc/27/66/32/1025276632.db2.gz KQQBDWLVLZVEGH-UHFFFAOYSA-N 2 1 334.467 4.269 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1CNc1[nH+]ccc2c(N)cccc21 ZINC000663391700 1025276641 /nfs/dbraw/zinc/27/66/41/1025276641.db2.gz KQQBDWLVLZVEGH-UHFFFAOYSA-N 2 1 334.467 4.269 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000563119638 1025385625 /nfs/dbraw/zinc/38/56/25/1025385625.db2.gz AOQKKYPDRKELTH-ROUUACIJSA-N 2 1 334.454 4.351 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000563119638 1025385639 /nfs/dbraw/zinc/38/56/39/1025385639.db2.gz AOQKKYPDRKELTH-ROUUACIJSA-N 2 1 334.454 4.351 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(C)(C)CC(F)(F)F ZINC000663477440 1025435953 /nfs/dbraw/zinc/43/59/53/1025435953.db2.gz FDWWVHJJBAQBPN-RDJZCZTQSA-N 2 1 342.449 4.465 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(C)(C)CC(F)(F)F ZINC000663477440 1025435968 /nfs/dbraw/zinc/43/59/68/1025435968.db2.gz FDWWVHJJBAQBPN-RDJZCZTQSA-N 2 1 342.449 4.465 20 0 EIADMP Cc1cccc(C)c1OC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167965884 1025545898 /nfs/dbraw/zinc/54/58/98/1025545898.db2.gz PFJXIDPOGINIQG-XSLAUPDRSA-N 2 1 342.527 4.066 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H](Oc2cccc(OC)c2)C1 ZINC001167824729 1025586907 /nfs/dbraw/zinc/58/69/07/1025586907.db2.gz FZDOOYYTJGQFCV-WIYYLYMNSA-N 2 1 348.531 4.049 20 0 EIADMP CCOc1ccccc1[C@@H](CC(C)C)[NH2+]CCCn1cc[nH+]c1C ZINC000342249981 1025614858 /nfs/dbraw/zinc/61/48/58/1025614858.db2.gz XRBJYRIJUUMGDE-LJQANCHMSA-N 2 1 329.488 4.357 20 0 EIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CCc3[nH+]ccn3C2)c2ccccc2)cc1 ZINC000278923997 1025620375 /nfs/dbraw/zinc/62/03/75/1025620375.db2.gz IEVAPRNHCBEXHZ-XMSQKQJNSA-N 2 1 331.463 4.133 20 0 EIADMP Cc1cccc(N2CCC([NH2+]Cc3cc4c(ccc(C)c4C)[nH]3)CC2)[nH+]1 ZINC000472080524 1025695769 /nfs/dbraw/zinc/69/57/69/1025695769.db2.gz PXMRQEXXOCXRSP-UHFFFAOYSA-N 2 1 348.494 4.247 20 0 EIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCc3[nH+]ccn3C1)CCCS2 ZINC000278933299 1025721901 /nfs/dbraw/zinc/72/19/01/1025721901.db2.gz JKFFDRZDYKGTDT-CJNGLKHVSA-N 2 1 347.915 4.316 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)oc21 ZINC000643547883 1025750434 /nfs/dbraw/zinc/75/04/34/1025750434.db2.gz KGTZSWXJQMKMJK-GDBMZVCRSA-N 2 1 328.456 4.157 20 0 EIADMP CC[C@H](c1ccccc1)[NH+]1CCN(C[C@@H]2CCCC[N@H+]2C(C)C)CC1 ZINC001167508353 1025753256 /nfs/dbraw/zinc/75/32/56/1025753256.db2.gz GQPYXPHHLCLNTL-FCHUYYIVSA-N 2 1 343.559 4.018 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C/C=C/c2ccc(F)c(F)c2)c1 ZINC000512036363 1025816911 /nfs/dbraw/zinc/81/69/11/1025816911.db2.gz HQAXKJMEXSTOSF-VMPITWQZSA-N 2 1 330.422 4.220 20 0 EIADMP CC[C@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)C(C)(C)c1ccccc1 ZINC000512067324 1025876260 /nfs/dbraw/zinc/87/62/60/1025876260.db2.gz KWUDCGMSWLICKM-KRWDZBQOSA-N 2 1 331.529 4.051 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1cc2ccccc2s1 ZINC000432425678 1025919720 /nfs/dbraw/zinc/91/97/20/1025919720.db2.gz WLPDSZJATQFXPX-HZPDHXFCSA-N 2 1 332.513 4.053 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1cc2ccccc2s1 ZINC000432425678 1025919749 /nfs/dbraw/zinc/91/97/49/1025919749.db2.gz WLPDSZJATQFXPX-HZPDHXFCSA-N 2 1 332.513 4.053 20 0 EIADMP C[N@@H+](CCc1cccs1)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001167540254 1025995359 /nfs/dbraw/zinc/99/53/59/1025995359.db2.gz XJRQSQHLUUBWCD-UHFFFAOYSA-N 2 1 328.525 4.409 20 0 EIADMP c1ccc(-c2cccnc2)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167971284 1026055693 /nfs/dbraw/zinc/05/56/93/1026055693.db2.gz WBDPCQJAKQNISU-FRIKZZABSA-N 2 1 347.506 4.244 20 0 EIADMP COc1ccc(C[N@H+](CCCc2c[nH+]cn2C)Cc2ccccc2)cc1 ZINC000582070792 1026075044 /nfs/dbraw/zinc/07/50/44/1026075044.db2.gz XYHRNFKOLIUNLF-UHFFFAOYSA-N 2 1 349.478 4.064 20 0 EIADMP COc1ccc(C[N@@H+](CCCc2c[nH+]cn2C)Cc2ccccc2)cc1 ZINC000582070792 1026075062 /nfs/dbraw/zinc/07/50/62/1026075062.db2.gz XYHRNFKOLIUNLF-UHFFFAOYSA-N 2 1 349.478 4.064 20 0 EIADMP FC(F)(F)C1CCC(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001167971524 1026076127 /nfs/dbraw/zinc/07/61/27/1026076127.db2.gz XFZMVLOUTWEKSS-DWVVOELRSA-N 2 1 344.465 4.350 20 0 EIADMP C[N@@H+](Cc1ccc(-n2ccnc2)cc1)C1CCC(C(F)(F)F)CC1 ZINC000344169127 1026090624 /nfs/dbraw/zinc/09/06/24/1026090624.db2.gz OBUIRGXPQHFENU-UHFFFAOYSA-N 2 1 337.389 4.425 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3cccc4[nH]ccc43)C2)CC1 ZINC000512165858 1026193674 /nfs/dbraw/zinc/19/36/74/1026193674.db2.gz IBJLHYRGKYPQCJ-SFHVURJKSA-N 2 1 325.500 4.112 20 0 EIADMP Fc1ccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)cc1 ZINC001167975212 1026225055 /nfs/dbraw/zinc/22/50/55/1026225055.db2.gz MJKJKGPUFAKCPK-SEJPIABJSA-N 2 1 342.502 4.143 20 0 EIADMP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000049553333 1026298698 /nfs/dbraw/zinc/29/86/98/1026298698.db2.gz AKTJXCCZSDTAAT-RYUDHWBXSA-N 2 1 339.277 4.186 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCSc2cc(C)c(C)cc21 ZINC000187160699 1026342146 /nfs/dbraw/zinc/34/21/46/1026342146.db2.gz BTLAWAKNEWQIJU-SCLBCKFNSA-N 2 1 329.513 4.271 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccccc2F)CC1 ZINC000514097742 1026384001 /nfs/dbraw/zinc/38/40/01/1026384001.db2.gz ANHZAWMHYRJYFN-UHFFFAOYSA-N 2 1 326.459 4.359 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000550239232 1026392664 /nfs/dbraw/zinc/39/26/64/1026392664.db2.gz TUPAZDOIFKPBPH-RHSMWYFYSA-N 2 1 326.406 4.184 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000550239232 1026392668 /nfs/dbraw/zinc/39/26/68/1026392668.db2.gz TUPAZDOIFKPBPH-RHSMWYFYSA-N 2 1 326.406 4.184 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000550239232 1026392680 /nfs/dbraw/zinc/39/26/80/1026392680.db2.gz TUPAZDOIFKPBPH-RHSMWYFYSA-N 2 1 326.406 4.184 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000550239232 1026392695 /nfs/dbraw/zinc/39/26/95/1026392695.db2.gz TUPAZDOIFKPBPH-RHSMWYFYSA-N 2 1 326.406 4.184 20 0 EIADMP Fc1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1C(F)(F)F ZINC000506863221 1026480932 /nfs/dbraw/zinc/48/09/32/1026480932.db2.gz WABQOVFNHRICLG-UHFFFAOYSA-N 2 1 344.396 4.152 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)C1CCOCC1 ZINC000638742506 1026508456 /nfs/dbraw/zinc/50/84/56/1026508456.db2.gz ZYCPFNKTRMLZFF-BAGYTPMASA-N 2 1 342.527 4.149 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)C1CCOCC1 ZINC000638742506 1026508471 /nfs/dbraw/zinc/50/84/71/1026508471.db2.gz ZYCPFNKTRMLZFF-BAGYTPMASA-N 2 1 342.527 4.149 20 0 EIADMP Fc1ccc(F)c(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c1 ZINC000432656006 1026684073 /nfs/dbraw/zinc/68/40/73/1026684073.db2.gz LLBJUMPUWKXZHR-GOSISDBHSA-N 2 1 348.462 4.171 20 0 EIADMP Fc1ccc(F)c(C[N@@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c1 ZINC000432656006 1026684078 /nfs/dbraw/zinc/68/40/78/1026684078.db2.gz LLBJUMPUWKXZHR-GOSISDBHSA-N 2 1 348.462 4.171 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148315 1026751374 /nfs/dbraw/zinc/75/13/74/1026751374.db2.gz XOKFCLNKPINFAN-AEFFLSMTSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148315 1026751386 /nfs/dbraw/zinc/75/13/86/1026751386.db2.gz XOKFCLNKPINFAN-AEFFLSMTSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148315 1026751394 /nfs/dbraw/zinc/75/13/94/1026751394.db2.gz XOKFCLNKPINFAN-AEFFLSMTSA-N 2 1 340.433 4.369 20 0 EIADMP [NH3+][C@@H]1C[C@@H](NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000261629375 1026757218 /nfs/dbraw/zinc/75/72/18/1026757218.db2.gz VTYNMQHREBQRHS-WWPVKYPJSA-N 2 1 349.522 4.023 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)cc1 ZINC000152819289 1026853174 /nfs/dbraw/zinc/85/31/74/1026853174.db2.gz LWEHMNCYMCCGOW-GOSISDBHSA-N 2 1 337.511 4.002 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCCc4cccnc43)cc2)C1 ZINC000684954077 1026888791 /nfs/dbraw/zinc/88/87/91/1026888791.db2.gz PJDFCSLTKCFGES-PGRDOPGGSA-N 2 1 349.522 4.481 20 0 EIADMP CC[NH+](CC)CCO[C@H]1CC[N@H+]([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC001167603778 1026993370 /nfs/dbraw/zinc/99/33/70/1026993370.db2.gz ZQDGHSMBHIROQW-PMACEKPBSA-N 2 1 332.532 4.106 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C(C)(C)c1cccc(C(F)(F)F)c1 ZINC000342859970 1027326216 /nfs/dbraw/zinc/32/62/16/1027326216.db2.gz MRVQNKLUWUOWHZ-UHFFFAOYSA-N 2 1 325.378 4.125 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000342858321 1027326406 /nfs/dbraw/zinc/32/64/06/1027326406.db2.gz DBHCNPUGOHLUJQ-CYBMUJFWSA-N 2 1 325.378 4.293 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000342858321 1027326427 /nfs/dbraw/zinc/32/64/27/1027326427.db2.gz DBHCNPUGOHLUJQ-CYBMUJFWSA-N 2 1 325.378 4.293 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CSc3ccccc32)C[C@H]1c1ccccc1 ZINC000453217809 1027341054 /nfs/dbraw/zinc/34/10/54/1027341054.db2.gz JPMCNZVXWICEMB-BJLQDIEVSA-N 2 1 338.520 4.301 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CSc3ccccc32)C[C@H]1c1ccccc1 ZINC000453217809 1027341076 /nfs/dbraw/zinc/34/10/76/1027341076.db2.gz JPMCNZVXWICEMB-BJLQDIEVSA-N 2 1 338.520 4.301 20 0 EIADMP CC(C)c1ccccc1NC(=O)[C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000116396411 1027349772 /nfs/dbraw/zinc/34/97/72/1027349772.db2.gz HNFXJUTZHDBPAI-LPHOPBHVSA-N 2 1 347.547 4.093 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1OC ZINC000119718156 1027372955 /nfs/dbraw/zinc/37/29/55/1027372955.db2.gz ISUXTVYVLFODMU-MRXNPFEDSA-N 2 1 346.515 4.152 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2ccc3c(n2)CCC3)cc1 ZINC000582830972 1027455150 /nfs/dbraw/zinc/45/51/50/1027455150.db2.gz APKKUZPSHJWDOY-SFHVURJKSA-N 2 1 349.522 4.235 20 0 EIADMP Cc1cc(C)cc(OCCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441400061 1027523695 /nfs/dbraw/zinc/52/36/95/1027523695.db2.gz ZAPWJDIBLAJDMK-KNQAVFIVSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441400061 1027523705 /nfs/dbraw/zinc/52/37/05/1027523705.db2.gz ZAPWJDIBLAJDMK-KNQAVFIVSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441400061 1027523719 /nfs/dbraw/zinc/52/37/19/1027523719.db2.gz ZAPWJDIBLAJDMK-KNQAVFIVSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000441400061 1027523732 /nfs/dbraw/zinc/52/37/32/1027523732.db2.gz ZAPWJDIBLAJDMK-KNQAVFIVSA-N 2 1 342.527 4.021 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000152457998 1027609741 /nfs/dbraw/zinc/60/97/41/1027609741.db2.gz BUMVDAZIDIQCHM-NEPJUHHUSA-N 2 1 344.833 4.076 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000152457998 1027609756 /nfs/dbraw/zinc/60/97/56/1027609756.db2.gz BUMVDAZIDIQCHM-NEPJUHHUSA-N 2 1 344.833 4.076 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1OC ZINC000152465876 1027659496 /nfs/dbraw/zinc/65/94/96/1027659496.db2.gz LGEWIZXJLJYNJQ-IRXDYDNUSA-N 2 1 346.515 4.009 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@@H](C)[C@@H](C)C3CCCCC3)CC2)nc(C)[nH+]1 ZINC000474879753 1027710695 /nfs/dbraw/zinc/71/06/95/1027710695.db2.gz ODQWTICHOQYCLA-SJORKVTESA-N 2 1 344.547 4.257 20 0 EIADMP COc1ccc([C@@H](C)[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995134 1027741073 /nfs/dbraw/zinc/74/10/73/1027741073.db2.gz XJSCPQUYZLSESJ-AZCLRUCKSA-N 2 1 328.500 4.093 20 0 EIADMP COc1ccc([C@@H](C)[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167995134 1027741087 /nfs/dbraw/zinc/74/10/87/1027741087.db2.gz XJSCPQUYZLSESJ-AZCLRUCKSA-N 2 1 328.500 4.093 20 0 EIADMP COc1ccc([C@@H](C)[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167995134 1027741109 /nfs/dbraw/zinc/74/11/09/1027741109.db2.gz XJSCPQUYZLSESJ-AZCLRUCKSA-N 2 1 328.500 4.093 20 0 EIADMP Fc1ccc([C@H]2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)C2)cc1 ZINC001167994512 1027752182 /nfs/dbraw/zinc/75/21/82/1027752182.db2.gz HAOQCUJGGIISIX-YBVXAUJNSA-N 2 1 328.475 4.020 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)C1CCSCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000474942044 1027808546 /nfs/dbraw/zinc/80/85/46/1027808546.db2.gz KKSJKFHPEWBXPL-SQGPQFPESA-N 2 1 332.557 4.018 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccsc4)cc3)CC[C@H]21 ZINC001167648122 1027842334 /nfs/dbraw/zinc/84/23/34/1027842334.db2.gz RIYKVYBVUJUIQP-UYAOXDASSA-N 2 1 326.509 4.331 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(-c4ccsc4)cc3)CC[C@H]21 ZINC001167648122 1027842338 /nfs/dbraw/zinc/84/23/38/1027842338.db2.gz RIYKVYBVUJUIQP-UYAOXDASSA-N 2 1 326.509 4.331 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4ccsc4)cc3)CC[C@H]21 ZINC001167648122 1027842349 /nfs/dbraw/zinc/84/23/49/1027842349.db2.gz RIYKVYBVUJUIQP-UYAOXDASSA-N 2 1 326.509 4.331 20 0 EIADMP CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cs1 ZINC000162277860 1027847564 /nfs/dbraw/zinc/84/75/64/1027847564.db2.gz BTLFIKJAQQSQFF-HUUCEWRRSA-N 2 1 347.528 4.058 20 0 EIADMP CCc1nc([C@@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cs1 ZINC000162321605 1027857116 /nfs/dbraw/zinc/85/71/16/1027857116.db2.gz DOTLMCVMHDGIHE-HUUCEWRRSA-N 2 1 347.528 4.058 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CC[N@H+](C(C)C)C1 ZINC000548786339 1027930522 /nfs/dbraw/zinc/93/05/22/1027930522.db2.gz KJQZTKGRJGTALY-IZNAZMGOSA-N 2 1 340.433 4.429 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CC[N@H+](C(C)C)C1 ZINC000548786335 1027932134 /nfs/dbraw/zinc/93/21/34/1027932134.db2.gz KJQZTKGRJGTALY-AAGJOFLKSA-N 2 1 340.433 4.429 20 0 EIADMP COc1cccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1F ZINC000192688616 1028052071 /nfs/dbraw/zinc/05/20/71/1028052071.db2.gz GLQOQHJBVSAVJY-DNVCBOLYSA-N 2 1 348.487 4.069 20 0 EIADMP COc1cccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1F ZINC000192688616 1028052089 /nfs/dbraw/zinc/05/20/89/1028052089.db2.gz GLQOQHJBVSAVJY-DNVCBOLYSA-N 2 1 348.487 4.069 20 0 EIADMP Fc1cccc(Oc2ccc(CN[C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000443962588 1028122941 /nfs/dbraw/zinc/12/29/41/1028122941.db2.gz GNDYALXWRHLSGA-RTBURBONSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000443962588 1028122945 /nfs/dbraw/zinc/12/29/45/1028122945.db2.gz GNDYALXWRHLSGA-RTBURBONSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000443962588 1028122962 /nfs/dbraw/zinc/12/29/62/1028122962.db2.gz GNDYALXWRHLSGA-RTBURBONSA-N 2 1 340.442 4.334 20 0 EIADMP Cc1cccc([C@@H](O)C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1 ZINC001167660091 1028269382 /nfs/dbraw/zinc/26/93/82/1028269382.db2.gz ZFKIRFZPWGYURR-UGKGYDQZSA-N 2 1 344.543 4.005 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1cccs1)C(C)C ZINC000346169350 1028306112 /nfs/dbraw/zinc/30/61/12/1028306112.db2.gz JDBHDZCGGPZXER-UHFFFAOYSA-N 2 1 326.469 4.048 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000280995068 1028315382 /nfs/dbraw/zinc/31/53/82/1028315382.db2.gz XETVQZPTLZQUOZ-NZQKXSOJSA-N 2 1 349.522 4.077 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000280995075 1028316550 /nfs/dbraw/zinc/31/65/50/1028316550.db2.gz XETVQZPTLZQUOZ-REWPJTCUSA-N 2 1 349.522 4.077 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC[N@H+]1C ZINC000443983774 1028690784 /nfs/dbraw/zinc/69/07/84/1028690784.db2.gz FXZFFQDJODLJKW-CRAIPNDOSA-N 2 1 328.431 4.190 20 0 EIADMP C[C@H]([NH2+]CCSCc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000192637958 1028859939 /nfs/dbraw/zinc/85/99/39/1028859939.db2.gz MMFSLYUYMOXJKV-HKUYNNGSSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1Cl ZINC000163231362 1028886555 /nfs/dbraw/zinc/88/65/55/1028886555.db2.gz RXKWAFHKRUIGPK-BQFCYCMXSA-N 2 1 343.902 4.439 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2sc(-c3ccccc3)nc2C)C1 ZINC000163286592 1028953539 /nfs/dbraw/zinc/95/35/39/1028953539.db2.gz KPILKJDLKVOZQB-GOEBONIOSA-N 2 1 329.513 4.111 20 0 EIADMP CSc1ccc2c(c1)[C@@H]([NH2+]C1CC([NH+]3CCCCC3)C1)CCC2 ZINC000583630738 1028973312 /nfs/dbraw/zinc/97/33/12/1028973312.db2.gz QRPJHXYFSUPBNA-UHYCVJNDSA-N 2 1 330.541 4.392 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@H](c3ccccn3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168051811 1029064801 /nfs/dbraw/zinc/06/48/01/1029064801.db2.gz ISBVQZHYSFCBEA-SBHAEUEKSA-N 2 1 349.522 4.313 20 0 EIADMP C[NH2+]Cc1ccccc1C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000650755751 1029193674 /nfs/dbraw/zinc/19/36/74/1029193674.db2.gz LWLZCRLNQQBYHU-UHFFFAOYSA-N 3 1 345.575 4.175 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)cc1 ZINC000278532059 1029437689 /nfs/dbraw/zinc/43/76/89/1029437689.db2.gz UHSAKHNDUQIBTQ-MRXNPFEDSA-N 2 1 346.478 4.305 20 0 EIADMP C[C@@H](CCc1ccccc1F)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475279232 1029487464 /nfs/dbraw/zinc/48/74/64/1029487464.db2.gz XQWNNSPMYHPYEI-AZUAARDMSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000475281261 1029497016 /nfs/dbraw/zinc/49/70/16/1029497016.db2.gz PWKAYWQMCYOSJW-AEFFLSMTSA-N 2 1 336.470 4.312 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H]2CCCSc3ccc(OC)cc32)CC1 ZINC000446751795 1029560345 /nfs/dbraw/zinc/56/03/45/1029560345.db2.gz MALBWPWMHKJELW-SFHVURJKSA-N 2 1 334.529 4.086 20 0 EIADMP C[N@H+](Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CC2CCC2)CC1 ZINC000536202817 1029564686 /nfs/dbraw/zinc/56/46/86/1029564686.db2.gz GBDPIOJPTYWIEY-UHFFFAOYSA-N 2 1 340.433 4.402 20 0 EIADMP C[N@@H+](Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CC2CCC2)CC1 ZINC000536202817 1029564695 /nfs/dbraw/zinc/56/46/95/1029564695.db2.gz GBDPIOJPTYWIEY-UHFFFAOYSA-N 2 1 340.433 4.402 20 0 EIADMP C[N@@H+]1CCCC12CCN(c1cc[nH+]c3cc(C(F)(F)F)ccc31)CC2 ZINC000445601381 1029570500 /nfs/dbraw/zinc/57/05/00/1029570500.db2.gz REASKMLKNHBFSR-UHFFFAOYSA-N 2 1 349.400 4.318 20 0 EIADMP C[N@H+]1CCCC12CCN(c1cc[nH+]c3cc(C(F)(F)F)ccc31)CC2 ZINC000445601381 1029570505 /nfs/dbraw/zinc/57/05/05/1029570505.db2.gz REASKMLKNHBFSR-UHFFFAOYSA-N 2 1 349.400 4.318 20 0 EIADMP C[C@@H]([NH+](C)Cc1cncc(C[N@H+](C)[C@H](C)C2(C)CC2)c1)C1(C)CC1 ZINC000584094449 1029612732 /nfs/dbraw/zinc/61/27/32/1029612732.db2.gz PTPUIXZKJKSSLE-IAGOWNOFSA-N 2 1 329.532 4.322 20 0 EIADMP CC(C)[N@H+](C1CCOCC1)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168063620 1029613746 /nfs/dbraw/zinc/61/37/46/1029613746.db2.gz DARLQSCIEDFXRE-OALUTQOASA-N 2 1 344.543 4.317 20 0 EIADMP CC(C)[N@@H+](C1CCOCC1)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168063620 1029613751 /nfs/dbraw/zinc/61/37/51/1029613751.db2.gz DARLQSCIEDFXRE-OALUTQOASA-N 2 1 344.543 4.317 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@H](C(F)F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168064290 1029627674 /nfs/dbraw/zinc/62/76/74/1029627674.db2.gz PSUSMUZAAHPBMS-UKBAYJJMSA-N 2 1 336.470 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](C(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168064290 1029627678 /nfs/dbraw/zinc/62/76/78/1029627678.db2.gz PSUSMUZAAHPBMS-UKBAYJJMSA-N 2 1 336.470 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](C(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168064290 1029627687 /nfs/dbraw/zinc/62/76/87/1029627687.db2.gz PSUSMUZAAHPBMS-UKBAYJJMSA-N 2 1 336.470 4.405 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccn1 ZINC000158990877 1029635215 /nfs/dbraw/zinc/63/52/15/1029635215.db2.gz VAUBDZYTUBWTSU-RTWAWAEBSA-N 2 1 337.511 4.077 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccn1 ZINC000158990877 1029635219 /nfs/dbraw/zinc/63/52/19/1029635219.db2.gz VAUBDZYTUBWTSU-RTWAWAEBSA-N 2 1 337.511 4.077 20 0 EIADMP FC(F)(F)C1CCC([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000192927823 1029648377 /nfs/dbraw/zinc/64/83/77/1029648377.db2.gz NHHDXNSBWWBEIS-WWDZGPRUSA-N 2 1 340.433 4.219 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCn2ccc3cc(Cl)ccc32)CC1 ZINC000584200847 1029671851 /nfs/dbraw/zinc/67/18/51/1029671851.db2.gz QYIKECADCRIRKM-UHFFFAOYSA-N 2 1 333.907 4.099 20 0 EIADMP COc1ccc([C@H](C)C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)cc1 ZINC000447075904 1029688160 /nfs/dbraw/zinc/68/81/60/1029688160.db2.gz HJEGSFPFWYNBQL-QGZVFWFLSA-N 2 1 340.467 4.046 20 0 EIADMP COc1ccccc1[C@H](CNc1cc[nH+]c2ccsc21)[NH+](C)C ZINC000301351190 1029713193 /nfs/dbraw/zinc/71/31/93/1029713193.db2.gz JZQMDFJGDSCHSO-INIZCTEOSA-N 2 1 327.453 4.020 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(C(F)F)nc1 ZINC000657838544 1029721123 /nfs/dbraw/zinc/72/11/23/1029721123.db2.gz VOJBHEFZJPIAHQ-GJZGRUSLSA-N 2 1 325.447 4.324 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(C(F)F)nc1 ZINC000657838542 1029721905 /nfs/dbraw/zinc/72/19/05/1029721905.db2.gz VOJBHEFZJPIAHQ-CABCVRRESA-N 2 1 325.447 4.324 20 0 EIADMP Cc1ccc(N2CCC(Nc3cc(C)[nH+]c4ccccc34)CC2)[nH+]c1 ZINC000301410761 1029728392 /nfs/dbraw/zinc/72/83/92/1029728392.db2.gz XXAXLHNWTCEZAI-UHFFFAOYSA-N 2 1 332.451 4.328 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc2ccncc2s1 ZINC000657837988 1029733315 /nfs/dbraw/zinc/73/33/15/1029733315.db2.gz LTXXPTONJRQIOW-CVEARBPZSA-N 2 1 331.529 4.459 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1cccc(C2CC2)c1 ZINC000708502473 1029742989 /nfs/dbraw/zinc/74/29/89/1029742989.db2.gz HNSCXKKPRRKWIP-WZONZLPQSA-N 2 1 334.507 4.422 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNCc1ccccc1Cl ZINC000708519858 1029743045 /nfs/dbraw/zinc/74/30/45/1029743045.db2.gz KCVXAEZIGVYGHM-VQIMIIECSA-N 2 1 328.887 4.198 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccccc1Cl ZINC000708519858 1029743048 /nfs/dbraw/zinc/74/30/48/1029743048.db2.gz KCVXAEZIGVYGHM-VQIMIIECSA-N 2 1 328.887 4.198 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccccc1Cl ZINC000708519858 1029743055 /nfs/dbraw/zinc/74/30/55/1029743055.db2.gz KCVXAEZIGVYGHM-VQIMIIECSA-N 2 1 328.887 4.198 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000657841282 1029754713 /nfs/dbraw/zinc/75/47/13/1029754713.db2.gz OPFNPJMHCNKEAE-OCCSQVGLSA-N 2 1 348.840 4.221 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000657840126 1029756415 /nfs/dbraw/zinc/75/64/15/1029756415.db2.gz MGTNJZLLVVUNOZ-SQNIBIBYSA-N 2 1 340.433 4.243 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3cc(F)ccc32)c1 ZINC000182062686 1029934473 /nfs/dbraw/zinc/93/44/73/1029934473.db2.gz DUCRFHJDLILIEK-HXUWFJFHSA-N 2 1 342.458 4.281 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@H+](C[C@H]3CCCCC3(F)F)C1)CCCC2 ZINC000450788101 1029983820 /nfs/dbraw/zinc/98/38/20/1029983820.db2.gz TUOLCUOOIRFOKH-HZPDHXFCSA-N 2 1 337.458 4.143 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@@H+](C[C@H]3CCCCC3(F)F)C1)CCCC2 ZINC000450788101 1029983843 /nfs/dbraw/zinc/98/38/43/1029983843.db2.gz TUOLCUOOIRFOKH-HZPDHXFCSA-N 2 1 337.458 4.143 20 0 EIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccc(Cl)c2cccnc12 ZINC000525783782 1030014525 /nfs/dbraw/zinc/01/45/25/1030014525.db2.gz OSPBEGWBHKDXRO-INIZCTEOSA-N 2 1 331.891 4.194 20 0 EIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccc(Cl)c2cccnc12 ZINC000525783782 1030014548 /nfs/dbraw/zinc/01/45/48/1030014548.db2.gz OSPBEGWBHKDXRO-INIZCTEOSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1ccc(Cl)c2cccnc12 ZINC000525783782 1030014579 /nfs/dbraw/zinc/01/45/79/1030014579.db2.gz OSPBEGWBHKDXRO-INIZCTEOSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1ccc(Cl)c2cccnc12 ZINC000525783782 1030014590 /nfs/dbraw/zinc/01/45/90/1030014590.db2.gz OSPBEGWBHKDXRO-INIZCTEOSA-N 2 1 331.891 4.194 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390682497 1030034887 /nfs/dbraw/zinc/03/48/87/1030034887.db2.gz WINOUGHSAKZNHW-WIYYLYMNSA-N 2 1 340.511 4.491 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390682497 1030034906 /nfs/dbraw/zinc/03/49/06/1030034906.db2.gz WINOUGHSAKZNHW-WIYYLYMNSA-N 2 1 340.511 4.491 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2nc(C(C)(C)C)cs2)CC1 ZINC000447369243 1030038922 /nfs/dbraw/zinc/03/89/22/1030038922.db2.gz VYHIUSVYTDAUPT-UHFFFAOYSA-N 2 1 337.577 4.385 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2nc(C(C)(C)C)cs2)CC1 ZINC000447369243 1030038943 /nfs/dbraw/zinc/03/89/43/1030038943.db2.gz VYHIUSVYTDAUPT-UHFFFAOYSA-N 2 1 337.577 4.385 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000525860286 1030082800 /nfs/dbraw/zinc/08/28/00/1030082800.db2.gz REHZEMRASDYTNT-UVUJQTEASA-N 2 1 344.543 4.049 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447522309 1030117848 /nfs/dbraw/zinc/11/78/48/1030117848.db2.gz QDISWBXQPROLSE-WLRLJWMZSA-N 2 1 338.495 4.386 20 0 EIADMP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000657875696 1030144373 /nfs/dbraw/zinc/14/43/73/1030144373.db2.gz HSGZOLSWTBAQGI-JSGCOSHPSA-N 2 1 348.840 4.221 20 0 EIADMP FC1(F)CC[C@H](C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC000450981579 1030156514 /nfs/dbraw/zinc/15/65/14/1030156514.db2.gz IYLQQWYUBYFUKN-RBUKOAKNSA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC[C@H](C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC000450981579 1030156529 /nfs/dbraw/zinc/15/65/29/1030156529.db2.gz IYLQQWYUBYFUKN-RBUKOAKNSA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC[C@H](C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC000450981579 1030156548 /nfs/dbraw/zinc/15/65/48/1030156548.db2.gz IYLQQWYUBYFUKN-RBUKOAKNSA-N 2 1 334.454 4.020 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]Cc2ccc4c(c2)COC4)C3)cc1 ZINC000447587131 1030188228 /nfs/dbraw/zinc/18/82/28/1030188228.db2.gz OWKTWBABVZFFNF-NUNAXRQHSA-N 2 1 348.490 4.002 20 0 EIADMP C[C@@H]([NH2+]C1(C[NH2+]C2CC(CF)(CF)C2)CCCC1)c1ccccc1 ZINC000657888957 1030295122 /nfs/dbraw/zinc/29/51/22/1030295122.db2.gz OHZZAQQCMLRHID-MRXNPFEDSA-N 2 1 336.470 4.327 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]C2CC(c3cc(F)cc(F)c3)C2)C1 ZINC000685421385 1030299100 /nfs/dbraw/zinc/29/91/00/1030299100.db2.gz CSCKROIEMRIMPL-FVWXCPNNSA-N 2 1 336.470 4.313 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000530354823 1030335181 /nfs/dbraw/zinc/33/51/81/1030335181.db2.gz KCFBFGPCQMJKMU-LJQANCHMSA-N 2 1 343.833 4.134 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470100 1030353711 /nfs/dbraw/zinc/35/37/11/1030353711.db2.gz WFKFTOJMZXJMBP-AVRDEDQJSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470100 1030353724 /nfs/dbraw/zinc/35/37/24/1030353724.db2.gz WFKFTOJMZXJMBP-AVRDEDQJSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470100 1030353744 /nfs/dbraw/zinc/35/37/44/1030353744.db2.gz WFKFTOJMZXJMBP-AVRDEDQJSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470100 1030353761 /nfs/dbraw/zinc/35/37/61/1030353761.db2.gz WFKFTOJMZXJMBP-AVRDEDQJSA-N 2 1 337.511 4.227 20 0 EIADMP CC[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Oc2ccccc2)cc1 ZINC000530407317 1030378996 /nfs/dbraw/zinc/37/89/96/1030378996.db2.gz PRWXJBSSSMHNFG-OAQYLSRUSA-N 2 1 335.451 4.496 20 0 EIADMP Cc1ccc(C[C@@H]([NH2+]CCc2c[nH+]cn2C)c2ccc(C)cc2)cc1 ZINC000530513311 1030502784 /nfs/dbraw/zinc/50/27/84/1030502784.db2.gz FUXBJSWQEFVWJW-JOCHJYFZSA-N 2 1 333.479 4.153 20 0 EIADMP CSc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000685621682 1030575026 /nfs/dbraw/zinc/57/50/26/1030575026.db2.gz UHOMEKIUUAFIRS-INIZCTEOSA-N 2 1 332.538 4.082 20 0 EIADMP COCC1(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCCCC1 ZINC000685665275 1030663410 /nfs/dbraw/zinc/66/34/10/1030663410.db2.gz QERVGKLNGHBMDL-TZIWHRDSSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNCc3ccncc3Cl)cc2)C1 ZINC000527639460 1030790216 /nfs/dbraw/zinc/79/02/16/1030790216.db2.gz DQKBMNNYNQAWEP-MRXNPFEDSA-N 2 1 343.902 4.257 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccncc3Cl)cc2)C1 ZINC000527639460 1030790228 /nfs/dbraw/zinc/79/02/28/1030790228.db2.gz DQKBMNNYNQAWEP-MRXNPFEDSA-N 2 1 343.902 4.257 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccncc3Cl)cc2)C1 ZINC000527639460 1030790239 /nfs/dbraw/zinc/79/02/39/1030790239.db2.gz DQKBMNNYNQAWEP-MRXNPFEDSA-N 2 1 343.902 4.257 20 0 EIADMP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccncc2Cl)CC1 ZINC000527638928 1030794214 /nfs/dbraw/zinc/79/42/14/1030794214.db2.gz PJKUJKNBQGAUCC-UHFFFAOYSA-N 2 1 343.902 4.257 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)cc1 ZINC000658235991 1030894009 /nfs/dbraw/zinc/89/40/09/1030894009.db2.gz GYZFYURWVOIVQQ-QKKBWIMNSA-N 2 1 333.435 4.224 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCc3ccc(O)cc32)CC1 ZINC000658242561 1030899844 /nfs/dbraw/zinc/89/98/44/1030899844.db2.gz ZXVSECYLLURXMR-LPTQZCDUSA-N 2 1 328.500 4.012 20 0 EIADMP C[C@@H]([NH2+]C1CCC2(CC2(F)F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000658265792 1030919571 /nfs/dbraw/zinc/91/95/71/1030919571.db2.gz PXOAUMDXURDDIG-OVZGMEQFSA-N 2 1 348.481 4.455 20 0 EIADMP Cc1ccc[nH+]c1N([C@@H](C)Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001168191870 1030971223 /nfs/dbraw/zinc/97/12/23/1030971223.db2.gz KPYHIJZJEAWBDG-INIZCTEOSA-N 2 1 343.902 4.233 20 0 EIADMP c1ccc(C[N@@H+]2C[C@H](C[NH2+][C@H]3CCCSCC3)C3(CCC3)C2)cc1 ZINC000658318854 1030977802 /nfs/dbraw/zinc/97/78/02/1030977802.db2.gz SYJIGFXSIYEVLD-PMACEKPBSA-N 2 1 344.568 4.164 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319280 1030981673 /nfs/dbraw/zinc/98/16/73/1030981673.db2.gz YWDQQYRVJZEESP-YADHBBJMSA-N 2 1 349.522 4.425 20 0 EIADMP COc1cccc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1C ZINC000658353657 1031025092 /nfs/dbraw/zinc/02/50/92/1031025092.db2.gz OXLGCIXRWOGMMJ-MRXNPFEDSA-N 2 1 335.451 4.349 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCOc1ccc(Cl)cc1Cl ZINC000532464688 1031125195 /nfs/dbraw/zinc/12/51/95/1031125195.db2.gz ZIBFIHXMECYVNM-WWGRRREGSA-N 2 1 345.314 4.081 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccccc1OCc1ccccc1 ZINC000532507298 1031227478 /nfs/dbraw/zinc/22/74/78/1031227478.db2.gz RGQQYFDMWJSTCR-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP COc1cc2ccccc2cc1C[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000449032488 1031366107 /nfs/dbraw/zinc/36/61/07/1031366107.db2.gz ZJQUXMMLEYYBDZ-UHFFFAOYSA-N 2 1 349.478 4.037 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000449084225 1031412269 /nfs/dbraw/zinc/41/22/69/1031412269.db2.gz XABGBPIYMUBUKX-GHTZIAJQSA-N 2 1 342.527 4.252 20 0 EIADMP Clc1ccc(C[C@H]2CCC[C@@H]2[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000449071474 1031422072 /nfs/dbraw/zinc/42/20/72/1031422072.db2.gz NYIYDNSDLNVTOK-UZLBHIALSA-N 2 1 332.919 4.268 20 0 EIADMP Clc1ccc(C2=CC[C@@H]([NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000449074347 1031425884 /nfs/dbraw/zinc/42/58/84/1031425884.db2.gz KPBATSWRXUUFFB-HNAYVOBHSA-N 2 1 330.903 4.350 20 0 EIADMP C[N@@H+](Cc1cc2ccccc2o1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000532623372 1031427897 /nfs/dbraw/zinc/42/78/97/1031427897.db2.gz WUYICVITDPWGKT-LJQANCHMSA-N 2 1 334.463 4.387 20 0 EIADMP C[N@H+](Cc1cc2ccccc2o1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000532623372 1031427908 /nfs/dbraw/zinc/42/79/08/1031427908.db2.gz WUYICVITDPWGKT-LJQANCHMSA-N 2 1 334.463 4.387 20 0 EIADMP C[NH+](Cc1cc2ccccc2o1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000532623372 1031427919 /nfs/dbraw/zinc/42/79/19/1031427919.db2.gz WUYICVITDPWGKT-LJQANCHMSA-N 2 1 334.463 4.387 20 0 EIADMP C[NH+](Cc1cc2ccccc2o1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000532623372 1031427930 /nfs/dbraw/zinc/42/79/30/1031427930.db2.gz WUYICVITDPWGKT-LJQANCHMSA-N 2 1 334.463 4.387 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCSc3ccccc32)c1 ZINC000123917814 1031491744 /nfs/dbraw/zinc/49/17/44/1031491744.db2.gz PADVWXUBIVDBNR-IBGZPJMESA-N 2 1 326.509 4.465 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](Cc1cccc(F)c1)c1cccc(F)c1 ZINC000531708084 1031494601 /nfs/dbraw/zinc/49/46/01/1031494601.db2.gz NOZJRPOKVVWCHX-FQEVSTJZSA-N 2 1 341.405 4.043 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)c1cccc(C(F)(F)F)c1 ZINC000531710574 1031496076 /nfs/dbraw/zinc/49/60/76/1031496076.db2.gz ZCYGXQBPVUCTLM-KEYYUXOJSA-N 2 1 342.449 4.301 20 0 EIADMP Cc1ccc(N2CCC([NH2+]C[C@@H](C)c3cc(F)cc(F)c3)CC2)[nH+]c1 ZINC000449165902 1031508081 /nfs/dbraw/zinc/50/80/81/1031508081.db2.gz YALHTNLGJDAIQG-OAHLLOKOSA-N 2 1 345.437 4.030 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(Oc2ccccc2)cn1 ZINC000453066189 1031530066 /nfs/dbraw/zinc/53/00/66/1031530066.db2.gz VGSNPKQZKNOBOC-MRXNPFEDSA-N 2 1 336.439 4.120 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cn2)C1 ZINC000453075807 1031563491 /nfs/dbraw/zinc/56/34/91/1031563491.db2.gz AYHIMWPANPYGRL-ZWKOTPCHSA-N 2 1 339.483 4.256 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cn2)C1 ZINC000453075807 1031563506 /nfs/dbraw/zinc/56/35/06/1031563506.db2.gz AYHIMWPANPYGRL-ZWKOTPCHSA-N 2 1 339.483 4.256 20 0 EIADMP C[C@@H]([NH2+]C[C@@H](C)c1cc(F)cc(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000449232833 1031565374 /nfs/dbraw/zinc/56/53/74/1031565374.db2.gz JGOXTYFLVQFORB-BZUAXINKSA-N 2 1 336.470 4.311 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cs1 ZINC000453090358 1031581975 /nfs/dbraw/zinc/58/19/75/1031581975.db2.gz RAQNVFUJSNQCCL-QGZVFWFLSA-N 2 1 328.525 4.414 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccncc1 ZINC000453116538 1031606179 /nfs/dbraw/zinc/60/61/79/1031606179.db2.gz HRQXXIQHTXNLLN-JENIJYKNSA-N 2 1 329.513 4.267 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)c1ccncc1 ZINC000453116538 1031606188 /nfs/dbraw/zinc/60/61/88/1031606188.db2.gz HRQXXIQHTXNLLN-JENIJYKNSA-N 2 1 329.513 4.267 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccccc2OC(F)F)c1 ZINC000065976599 1031639383 /nfs/dbraw/zinc/63/93/83/1031639383.db2.gz LMHJXNJCCDJSHS-UHFFFAOYSA-N 2 1 348.437 4.418 20 0 EIADMP CCOc1cccc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)c1 ZINC000065976487 1031639520 /nfs/dbraw/zinc/63/95/20/1031639520.db2.gz FKEYXYVHDCPILZ-UHFFFAOYSA-N 2 1 326.484 4.215 20 0 EIADMP C=CCOc1ccc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc1 ZINC000065982065 1031656490 /nfs/dbraw/zinc/65/64/90/1031656490.db2.gz OZDAIVZLNCLBKM-UHFFFAOYSA-N 2 1 342.527 4.386 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CCCc3ccccn3)[C@H]3CCC[C@@H]32)cc1 ZINC000453163302 1031663598 /nfs/dbraw/zinc/66/35/98/1031663598.db2.gz PXXDVVCJCTYYCO-VJBWXMMDSA-N 2 1 349.522 4.047 20 0 EIADMP Cc1nccn1CCCC[N@H+](CC(C)C)[C@@H]1CCCc2cccnc21 ZINC000126885418 1031665030 /nfs/dbraw/zinc/66/50/30/1031665030.db2.gz UGXUTARUDQSHHL-HXUWFJFHSA-N 2 1 340.515 4.402 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](CC(C)C)[C@@H]1CCCc2cccnc21 ZINC000126885418 1031665044 /nfs/dbraw/zinc/66/50/44/1031665044.db2.gz UGXUTARUDQSHHL-HXUWFJFHSA-N 2 1 340.515 4.402 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](CC(C)C)[C@@H]1CCCc2cccnc21 ZINC000126885418 1031665060 /nfs/dbraw/zinc/66/50/60/1031665060.db2.gz UGXUTARUDQSHHL-HXUWFJFHSA-N 2 1 340.515 4.402 20 0 EIADMP COCCC(C)(C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453198904 1031710283 /nfs/dbraw/zinc/71/02/83/1031710283.db2.gz PESYJQNADREOQK-NJDAHSKKSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CC(C)(C)Cc4occc43)CC2)[nH+]1 ZINC000128127174 1031727263 /nfs/dbraw/zinc/72/72/63/1031727263.db2.gz HELZESWQVKNTGS-GOSISDBHSA-N 2 1 339.483 4.255 20 0 EIADMP CC(C)[NH+]1CCC([NH2+]C2(c3ccc(OC(F)(F)F)cc3)CC2)CC1 ZINC000453233489 1031754211 /nfs/dbraw/zinc/75/42/11/1031754211.db2.gz HOPOAUAVVSFSMN-UHFFFAOYSA-N 2 1 342.405 4.037 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000449559855 1031847607 /nfs/dbraw/zinc/84/76/07/1031847607.db2.gz CXMRKXCMXSQNML-TZUVLKIQSA-N 2 1 340.433 4.241 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cnc(C3CC3)o2)CC1 ZINC000453358528 1031887011 /nfs/dbraw/zinc/88/70/11/1031887011.db2.gz OFUQSCJFYURJRB-UHFFFAOYSA-N 2 1 339.483 4.085 20 0 EIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1CCC(F)(F)CC1 ZINC000459360528 1031913137 /nfs/dbraw/zinc/91/31/37/1031913137.db2.gz OPVWCXOHGLPXGV-IBGZPJMESA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC1CCC(F)(F)CC1 ZINC000459360528 1031913149 /nfs/dbraw/zinc/91/31/49/1031913149.db2.gz OPVWCXOHGLPXGV-IBGZPJMESA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC1CCC(F)(F)CC1 ZINC000459360528 1031913159 /nfs/dbraw/zinc/91/31/59/1031913159.db2.gz OPVWCXOHGLPXGV-IBGZPJMESA-N 2 1 336.470 4.266 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000531980847 1031926779 /nfs/dbraw/zinc/92/67/79/1031926779.db2.gz WOLAVFKONUKRRB-VNHYZAJKSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000531980847 1031926796 /nfs/dbraw/zinc/92/67/96/1031926796.db2.gz WOLAVFKONUKRRB-VNHYZAJKSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000531980847 1031926805 /nfs/dbraw/zinc/92/68/05/1031926805.db2.gz WOLAVFKONUKRRB-VNHYZAJKSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000531980847 1031926818 /nfs/dbraw/zinc/92/68/18/1031926818.db2.gz WOLAVFKONUKRRB-VNHYZAJKSA-N 2 1 347.503 4.391 20 0 EIADMP COc1ccc([C@H]([NH2+]CCCC[N@@H+](C)C2CC2)c2ccccc2)cc1 ZINC000453399778 1031934827 /nfs/dbraw/zinc/93/48/27/1031934827.db2.gz LIZGDZMFEWGWAD-JOCHJYFZSA-N 2 1 338.495 4.249 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Oc2ccccc2)cn1 ZINC000453411612 1031946674 /nfs/dbraw/zinc/94/66/74/1031946674.db2.gz VQWQMUJQONIHLU-QGZVFWFLSA-N 2 1 339.483 4.399 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)cc1 ZINC000453417283 1031952908 /nfs/dbraw/zinc/95/29/08/1031952908.db2.gz KCOWSAHJEAKWAT-RDJZCZTQSA-N 2 1 327.472 4.037 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1nc(-c2ccccc2)cs1 ZINC000453390049 1031954400 /nfs/dbraw/zinc/95/44/00/1031954400.db2.gz CUHUMLCOOUALAF-HNNXBMFYSA-N 2 1 329.513 4.335 20 0 EIADMP CC(C)[N@H+]1CCc2nc(CNc3ccc4c[nH+]ccc4c3)sc2C1 ZINC000453624164 1032036278 /nfs/dbraw/zinc/03/62/78/1032036278.db2.gz XNCHGFWWWAUHMW-UHFFFAOYSA-N 2 1 338.480 4.070 20 0 EIADMP C[C@@H](C[NH2+]CCCC[N@@H+](C)C1CC1)c1cccc(Br)c1 ZINC000453601701 1032038850 /nfs/dbraw/zinc/03/88/50/1032038850.db2.gz VHCRROJRXCBRID-AWEZNQCLSA-N 2 1 339.321 4.017 20 0 EIADMP CSCCCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000512633695 1033572968 /nfs/dbraw/zinc/57/29/68/1033572968.db2.gz AWGPDSDOTGQSFS-HSALFYBXSA-N 2 1 332.557 4.020 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)CCCCc2cccc(C(F)(F)F)c2)CCN1C ZINC000429846700 1033767949 /nfs/dbraw/zinc/76/79/49/1033767949.db2.gz DLVVMNASUPBZMS-MAUKXSAKSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCCc2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000429846700 1033767968 /nfs/dbraw/zinc/76/79/68/1033767968.db2.gz DLVVMNASUPBZMS-MAUKXSAKSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCCc2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000429846700 1033767984 /nfs/dbraw/zinc/76/79/84/1033767984.db2.gz DLVVMNASUPBZMS-MAUKXSAKSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)CCCCc2cccc(C(F)(F)F)c2)CC[NH+]1C ZINC000429846700 1033768003 /nfs/dbraw/zinc/76/80/03/1033768003.db2.gz DLVVMNASUPBZMS-MAUKXSAKSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)CCCCc2cccc(C(F)(F)F)c2)CC[NH+]1C ZINC000429846700 1033768023 /nfs/dbraw/zinc/76/80/23/1033768023.db2.gz DLVVMNASUPBZMS-MAUKXSAKSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000513053793 1034373654 /nfs/dbraw/zinc/37/36/54/1034373654.db2.gz YIPUERXUFQKWHR-XLIONFOSSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2Cl)o1)C[NH+]1CCCC1 ZINC000513077591 1034499221 /nfs/dbraw/zinc/49/92/21/1034499221.db2.gz WNUGEZSJJXBQKC-HNNXBMFYSA-N 2 1 332.875 4.422 20 0 EIADMP CC(C)Oc1ccc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1Cl ZINC000513127434 1034604382 /nfs/dbraw/zinc/60/43/82/1034604382.db2.gz ICJMAMNUPUGLQH-SJPCQFCGSA-N 2 1 336.907 4.184 20 0 EIADMP CC(C)Oc1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1Cl ZINC000513127434 1034604408 /nfs/dbraw/zinc/60/44/08/1034604408.db2.gz ICJMAMNUPUGLQH-SJPCQFCGSA-N 2 1 336.907 4.184 20 0 EIADMP CC(C)Oc1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1Cl ZINC000513127434 1034604418 /nfs/dbraw/zinc/60/44/18/1034604418.db2.gz ICJMAMNUPUGLQH-SJPCQFCGSA-N 2 1 336.907 4.184 20 0 EIADMP CC(C)Oc1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1Cl ZINC000513127434 1034604435 /nfs/dbraw/zinc/60/44/35/1034604435.db2.gz ICJMAMNUPUGLQH-SJPCQFCGSA-N 2 1 336.907 4.184 20 0 EIADMP C[N@@H+](CCc1cccc(Cl)c1Cl)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513143228 1034654565 /nfs/dbraw/zinc/65/45/65/1034654565.db2.gz BLFILVFBEBQXRQ-YIONKMFJSA-N 2 1 327.299 4.093 20 0 EIADMP C[NH+](CCc1cccc(Cl)c1Cl)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000513143228 1034654582 /nfs/dbraw/zinc/65/45/82/1034654582.db2.gz BLFILVFBEBQXRQ-YIONKMFJSA-N 2 1 327.299 4.093 20 0 EIADMP C[NH+](CCc1cccc(Cl)c1Cl)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000513143228 1034654596 /nfs/dbraw/zinc/65/45/96/1034654596.db2.gz BLFILVFBEBQXRQ-YIONKMFJSA-N 2 1 327.299 4.093 20 0 EIADMP C[N@@H+](CCSC1CCCCC1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000500979142 1034809939 /nfs/dbraw/zinc/80/99/39/1034809939.db2.gz AZOCUMTXDHMJKR-UHFFFAOYSA-N 2 1 347.572 4.296 20 0 EIADMP COc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000513513013 1035008619 /nfs/dbraw/zinc/00/86/19/1035008619.db2.gz QZNFYGCYPMSIMR-WIYYLYMNSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000414170134 1035056543 /nfs/dbraw/zinc/05/65/43/1035056543.db2.gz BRWLMMLYWXWXTK-HUUCEWRRSA-N 2 1 342.499 4.426 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@H](c3cccnc3)C3CCC3)CC2)cc1 ZINC000280187784 1035193750 /nfs/dbraw/zinc/19/37/50/1035193750.db2.gz CVZAJJIRJCTYNE-QHCPKHFHSA-N 2 1 349.522 4.220 20 0 EIADMP Cc1nccn1CCC[N@H+](C)C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000501031007 1035348333 /nfs/dbraw/zinc/34/83/33/1035348333.db2.gz IKQKBLZOPAAIMI-CQSZACIVSA-N 2 1 339.405 4.336 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000501031007 1035348338 /nfs/dbraw/zinc/34/83/38/1035348338.db2.gz IKQKBLZOPAAIMI-CQSZACIVSA-N 2 1 339.405 4.336 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000501031007 1035348340 /nfs/dbraw/zinc/34/83/40/1035348340.db2.gz IKQKBLZOPAAIMI-CQSZACIVSA-N 2 1 339.405 4.336 20 0 EIADMP C[C@@H](c1ccc(F)cc1F)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501025551 1035353582 /nfs/dbraw/zinc/35/35/82/1035353582.db2.gz ZCJNWSGJTFBVJI-HNNXBMFYSA-N 2 1 345.437 4.269 20 0 EIADMP C[C@@H](c1ccc(F)cc1)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501043964 1035354995 /nfs/dbraw/zinc/35/49/95/1035354995.db2.gz FHXBUQYGVIIHDK-INIZCTEOSA-N 2 1 327.447 4.130 20 0 EIADMP C[C@H](c1c(F)cccc1F)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501060329 1035364351 /nfs/dbraw/zinc/36/43/51/1035364351.db2.gz AGADWKCKRJDQMG-OAHLLOKOSA-N 2 1 345.437 4.269 20 0 EIADMP C[N@@H+](CC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCc2ccc(F)cc21 ZINC000501072137 1035371803 /nfs/dbraw/zinc/37/18/03/1035371803.db2.gz ZEHMPFFFSFJTNN-OAQYLSRUSA-N 2 1 339.458 4.056 20 0 EIADMP C[N@@H+](CC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCCc2ccccc21 ZINC000501077846 1035373734 /nfs/dbraw/zinc/37/37/34/1035373734.db2.gz PELMWVMJUJJIEK-JOCHJYFZSA-N 2 1 335.495 4.307 20 0 EIADMP C[C@H](C[NH+]1CCC([NH+]2CCCC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501130442 1035379968 /nfs/dbraw/zinc/37/99/68/1035379968.db2.gz OABSFAWEKDSSBI-OAHLLOKOSA-N 2 1 340.433 4.369 20 0 EIADMP FC(F)(F)c1cc(Cl)ccc1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204735348 1035405766 /nfs/dbraw/zinc/40/57/66/1035405766.db2.gz PWMFACMSPJEXQD-UHFFFAOYSA-N 2 1 346.824 4.324 20 0 EIADMP CCc1cc(OC)ccc1C[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000501380964 1035436481 /nfs/dbraw/zinc/43/64/81/1035436481.db2.gz HVJRDAQXNZKJCT-UHFFFAOYSA-N 2 1 340.511 4.388 20 0 EIADMP C[NH+](C)[C@H](C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1)C1CCCCC1 ZINC000501427561 1035444102 /nfs/dbraw/zinc/44/41/02/1035444102.db2.gz WOTRMPPSCZGNBT-HMXCVIKNSA-N 2 1 329.532 4.208 20 0 EIADMP CCSC1(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000595090291 1035600599 /nfs/dbraw/zinc/60/05/99/1035600599.db2.gz AMJUQNAHRLQQBK-UHFFFAOYSA-N 2 1 332.557 4.305 20 0 EIADMP C[N@@H+](Cc1ccccc1C[NH2+]Cc1ccc(O)cc1)C1CCCCC1 ZINC000237154138 1036032488 /nfs/dbraw/zinc/03/24/88/1036032488.db2.gz YNXNJSFSBKSBKC-UHFFFAOYSA-N 2 1 338.495 4.447 20 0 EIADMP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)C1 ZINC000571700906 1036131567 /nfs/dbraw/zinc/13/15/67/1036131567.db2.gz BOEPSEZGMPATGM-OWCLPIDISA-N 2 1 345.487 4.186 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502683278 1036499658 /nfs/dbraw/zinc/49/96/58/1036499658.db2.gz IPBDNSKAWDHTIS-KURKYZTESA-N 2 1 332.536 4.017 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cnn(C2CCCC2)c1 ZINC000502727537 1036584749 /nfs/dbraw/zinc/58/47/49/1036584749.db2.gz NRVMEIMBNUTJDW-ZWKOTPCHSA-N 2 1 332.536 4.303 20 0 EIADMP C[C@H]1C[N@H+](C2CC[NH+](CC3CC3)CC2)CCc2ccc(Cl)cc21 ZINC001168388739 1036738308 /nfs/dbraw/zinc/73/83/08/1036738308.db2.gz HZAAKDNBJYXLJB-HNNXBMFYSA-N 2 1 332.919 4.176 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2[nH]nc3ccccc32)cc1 ZINC000589640203 1036855551 /nfs/dbraw/zinc/85/55/51/1036855551.db2.gz FXIFMWHWMVAOQQ-QGZVFWFLSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2cnc(-c3ccccc3)s2)C1 ZINC000589641437 1036857868 /nfs/dbraw/zinc/85/78/68/1036857868.db2.gz KTSGHUKOUBKDIA-CALCHBBNSA-N 2 1 343.540 4.268 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2cnc(-c3ccccc3)s2)C1 ZINC000589641437 1036857875 /nfs/dbraw/zinc/85/78/75/1036857875.db2.gz KTSGHUKOUBKDIA-CALCHBBNSA-N 2 1 343.540 4.268 20 0 EIADMP CC[N@@H+](CCO[C@H]1CCCC[C@@H]1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999652 1036917012 /nfs/dbraw/zinc/91/70/12/1036917012.db2.gz QIMFCIVCMWQDNE-RXVVDRJESA-N 2 1 332.532 4.165 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]C/C=C/c2ccncc2)C1 ZINC000486980345 1036932198 /nfs/dbraw/zinc/93/21/98/1036932198.db2.gz MLNZGQKTTZRNBH-VGIQHARFSA-N 2 1 349.522 4.363 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271842563 1037031829 /nfs/dbraw/zinc/03/18/29/1037031829.db2.gz HEFGNJANJCOYEI-HNNXBMFYSA-N 2 1 341.524 4.339 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000271866946 1037042128 /nfs/dbraw/zinc/04/21/28/1037042128.db2.gz LPYDMWJUKRMALD-CYBMUJFWSA-N 2 1 344.446 4.254 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CCO1 ZINC000272009906 1037079789 /nfs/dbraw/zinc/07/97/89/1037079789.db2.gz LSVVMQGFIRVGFL-ZHHKINOHSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CCO1 ZINC000272009906 1037079811 /nfs/dbraw/zinc/07/98/11/1037079811.db2.gz LSVVMQGFIRVGFL-ZHHKINOHSA-N 2 1 344.543 4.080 20 0 EIADMP Clc1ccc(C2([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)cc1Cl ZINC000272025616 1037082826 /nfs/dbraw/zinc/08/28/26/1037082826.db2.gz YRSFKTINSHIBJO-KGLIPLIRSA-N 2 1 325.283 4.199 20 0 EIADMP Clc1ccc(C2([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CC2)cc1Cl ZINC000272025616 1037082848 /nfs/dbraw/zinc/08/28/48/1037082848.db2.gz YRSFKTINSHIBJO-KGLIPLIRSA-N 2 1 325.283 4.199 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000272048003 1037087964 /nfs/dbraw/zinc/08/79/64/1037087964.db2.gz RIUBIRWGCDJFGR-ZHHKINOHSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000272048003 1037087983 /nfs/dbraw/zinc/08/79/83/1037087983.db2.gz RIUBIRWGCDJFGR-ZHHKINOHSA-N 2 1 344.543 4.223 20 0 EIADMP Cc1oc(-c2cccs2)nc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000590786155 1037165719 /nfs/dbraw/zinc/16/57/19/1037165719.db2.gz DGJFAIJETARCGB-UHFFFAOYSA-N 2 1 347.528 4.264 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2sccc2Br)CC1 ZINC000590786883 1037166742 /nfs/dbraw/zinc/16/67/42/1037166742.db2.gz IHAXLQKSWJARGA-UHFFFAOYSA-N 2 1 345.350 4.063 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000590818890 1037185365 /nfs/dbraw/zinc/18/53/65/1037185365.db2.gz GBFJMPFIBVRRFA-UHFFFAOYSA-N 2 1 339.321 4.001 20 0 EIADMP Oc1ccc(C2CCC([NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)CC2)cc1 ZINC000668820339 1037349814 /nfs/dbraw/zinc/34/98/14/1037349814.db2.gz UGHIPQHHVRVQEF-LWEYNCJUSA-N 2 1 342.527 4.130 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)CS1 ZINC000488420095 1037575410 /nfs/dbraw/zinc/57/54/10/1037575410.db2.gz IAGOROWBFALXAD-JZXOWHBKSA-N 2 1 338.586 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CS1 ZINC000488420095 1037575427 /nfs/dbraw/zinc/57/54/27/1037575427.db2.gz IAGOROWBFALXAD-JZXOWHBKSA-N 2 1 338.586 4.080 20 0 EIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CS1 ZINC000488426535 1037579364 /nfs/dbraw/zinc/57/93/64/1037579364.db2.gz TWBCWTFSKHWRCH-PMACEKPBSA-N 2 1 346.584 4.203 20 0 EIADMP C[C@@H]1C[C@@H]1C[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415367 1037582698 /nfs/dbraw/zinc/58/26/98/1037582698.db2.gz AMULRZHPYCSPRT-NOVWEMISSA-N 2 1 340.433 4.334 20 0 EIADMP C[C@@H]1C[C@@H]1C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415367 1037582718 /nfs/dbraw/zinc/58/27/18/1037582718.db2.gz AMULRZHPYCSPRT-NOVWEMISSA-N 2 1 340.433 4.334 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)CS1 ZINC000488437680 1037594693 /nfs/dbraw/zinc/59/46/93/1037594693.db2.gz WJUOJGJWOCYGFG-DBVUQKKJSA-N 2 1 332.557 4.332 20 0 EIADMP Cn1c[nH+]cc1CCC[NH2+]C(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000573695919 1037672891 /nfs/dbraw/zinc/67/28/91/1037672891.db2.gz PVCOAKFEQHAMRJ-UHFFFAOYSA-N 2 1 326.271 4.184 20 0 EIADMP CC[C@H](C(=O)Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)[NH+](CC)CC ZINC000605425139 1037777452 /nfs/dbraw/zinc/77/74/52/1037777452.db2.gz WFQOCXCEMFBPLS-YLJYHZDGSA-N 2 1 345.531 4.120 20 0 EIADMP CC[C@@H]1C[C@H](C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000503572726 1037824393 /nfs/dbraw/zinc/82/43/93/1037824393.db2.gz HHKMJPMHYLVUCB-BDKRGJGYSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CN[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422885701 1037854446 /nfs/dbraw/zinc/85/44/46/1037854446.db2.gz UZHWUEWLEJXHDK-MQNAVGNWSA-N 2 1 349.522 4.295 20 0 EIADMP Clc1ccc2sc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)nc2c1 ZINC000422899188 1037861238 /nfs/dbraw/zinc/86/12/38/1037861238.db2.gz GYDIHCLLWJCUBQ-RRFJBIMHSA-N 2 1 349.931 4.350 20 0 EIADMP COc1ccc([C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])c2ccccc2Cl)cc1 ZINC000422920423 1037880109 /nfs/dbraw/zinc/88/01/09/1037880109.db2.gz LYSLNFKLKZVEED-LPMFXHHGSA-N 2 1 332.875 4.153 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C1CC(c2cc(F)cc(F)c2)C1 ZINC000574199215 1037949595 /nfs/dbraw/zinc/94/95/95/1037949595.db2.gz ROVNTTFYHIBVOQ-XRTORIHISA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]([NH2+]CC1CCC(F)(F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000503906429 1038007916 /nfs/dbraw/zinc/00/79/16/1038007916.db2.gz ZKOOACSSMHPGAJ-APWZRJJASA-N 2 1 336.470 4.312 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000503951587 1038042111 /nfs/dbraw/zinc/04/21/11/1038042111.db2.gz FXNFZTUSRCLBFV-GCJKJVERSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000503951587 1038042135 /nfs/dbraw/zinc/04/21/35/1038042135.db2.gz FXNFZTUSRCLBFV-GCJKJVERSA-N 2 1 347.506 4.211 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCC[NH2+]Cc2cccnc2)c2ccccc12 ZINC000423191852 1038047953 /nfs/dbraw/zinc/04/79/53/1038047953.db2.gz UIJWTSOODIZFGY-QGZVFWFLSA-N 2 1 349.478 4.074 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)NC[C@@H]([NH3+])c1ccccc1 ZINC000423246119 1038075477 /nfs/dbraw/zinc/07/54/77/1038075477.db2.gz PHILJKRCFDWWEB-KBXCAEBGSA-N 2 1 337.492 4.469 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCCOc2c(C)cc(C(C)(C)C)cc21 ZINC000489500036 1038077174 /nfs/dbraw/zinc/07/71/74/1038077174.db2.gz NHFVYLNJVDRKAB-LJQANCHMSA-N 2 1 341.499 4.301 20 0 EIADMP [NH3+]C[C@@H]([NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C1CC1 ZINC000423284206 1038092152 /nfs/dbraw/zinc/09/21/52/1038092152.db2.gz WQEHQIBQDKDWQT-GDBMZVCRSA-N 2 1 347.915 4.168 20 0 EIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@H](C[NH3+])C1CC1 ZINC000423268039 1038097349 /nfs/dbraw/zinc/09/73/49/1038097349.db2.gz DHFDXIINPPMPHN-ZUZCIYMTSA-N 2 1 335.904 4.160 20 0 EIADMP C[N@H+](Cc1ccc(-c2nc3ccccc3s2)o1)[C@H]1CCC[NH2+]CC1 ZINC000414731201 1038108611 /nfs/dbraw/zinc/10/86/11/1038108611.db2.gz FMHBUJYNCNVSGJ-AWEZNQCLSA-N 2 1 341.480 4.130 20 0 EIADMP C[N@@H+](Cc1ccc(-c2nc3ccccc3s2)o1)[C@H]1CCC[NH2+]CC1 ZINC000414731201 1038108640 /nfs/dbraw/zinc/10/86/40/1038108640.db2.gz FMHBUJYNCNVSGJ-AWEZNQCLSA-N 2 1 341.480 4.130 20 0 EIADMP C[N@H+](Cc1ccc(-c2nc3ccccc3s2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000414731205 1038111905 /nfs/dbraw/zinc/11/19/05/1038111905.db2.gz FMHBUJYNCNVSGJ-CQSZACIVSA-N 2 1 341.480 4.130 20 0 EIADMP C[N@@H+](Cc1ccc(-c2nc3ccccc3s2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000414731205 1038111940 /nfs/dbraw/zinc/11/19/40/1038111940.db2.gz FMHBUJYNCNVSGJ-CQSZACIVSA-N 2 1 341.480 4.130 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1 ZINC000423344708 1038133238 /nfs/dbraw/zinc/13/32/38/1038133238.db2.gz FMNZFCLQCZPLAZ-IVZQSRNASA-N 2 1 346.478 4.491 20 0 EIADMP FC(F)Oc1ccc([C@@H]([NH2+]CC[C@H]2CCC[NH2+]2)c2ccccc2)cc1 ZINC000423364554 1038174631 /nfs/dbraw/zinc/17/46/31/1038174631.db2.gz OSJCWGXBBHXUEB-MJGOQNOKSA-N 2 1 346.421 4.109 20 0 EIADMP CCCCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480769816 1038796019 /nfs/dbraw/zinc/79/60/19/1038796019.db2.gz MQSLKWJNMVCVTM-MSOLQXFVSA-N 2 1 330.516 4.391 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+]C3CCC(F)(F)CC3)CC2)cc1 ZINC000539052161 1038800826 /nfs/dbraw/zinc/80/08/26/1038800826.db2.gz HDPFEBFPXVHPKS-UHFFFAOYSA-N 2 1 340.433 4.000 20 0 EIADMP COc1cccc2c1CC[C@H]2[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000480778576 1038804324 /nfs/dbraw/zinc/80/43/24/1038804324.db2.gz IRLZZGHBUBCCAV-OAQYLSRUSA-N 2 1 338.495 4.313 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccccc2OC(F)F)C1 ZINC000539045504 1038811099 /nfs/dbraw/zinc/81/10/99/1038811099.db2.gz BCKMFSDKLOMZMP-CVEARBPZSA-N 2 1 340.458 4.307 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccccc2OC(F)F)C1 ZINC000539045504 1038811102 /nfs/dbraw/zinc/81/11/02/1038811102.db2.gz BCKMFSDKLOMZMP-CVEARBPZSA-N 2 1 340.458 4.307 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccccc2OC(F)F)C1 ZINC000539045519 1038811175 /nfs/dbraw/zinc/81/11/75/1038811175.db2.gz BCKMFSDKLOMZMP-JKSUJKDBSA-N 2 1 340.458 4.307 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccccc2OC(F)F)C1 ZINC000539045519 1038811176 /nfs/dbraw/zinc/81/11/76/1038811176.db2.gz BCKMFSDKLOMZMP-JKSUJKDBSA-N 2 1 340.458 4.307 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2nc(C)sc2C)CC1)CC(C)C ZINC000539099390 1038838671 /nfs/dbraw/zinc/83/86/71/1038838671.db2.gz CTLJCYXHYVDWRU-UHFFFAOYSA-N 2 1 337.577 4.340 20 0 EIADMP CSC1(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)CCC1 ZINC000555098858 1038868500 /nfs/dbraw/zinc/86/85/00/1038868500.db2.gz CXMKJDDDNQJMIT-UHFFFAOYSA-N 2 1 332.557 4.116 20 0 EIADMP C[N@@H+]1CCCC12CC[NH+](CCCSc1ccccc1Cl)CC2 ZINC000539200129 1038877247 /nfs/dbraw/zinc/87/72/47/1038877247.db2.gz UKHZHVFDKBGXIY-UHFFFAOYSA-N 2 1 338.948 4.382 20 0 EIADMP C[N@H+]1CCCC12CC[NH+](CCCSc1ccccc1Cl)CC2 ZINC000539200129 1038877249 /nfs/dbraw/zinc/87/72/49/1038877249.db2.gz UKHZHVFDKBGXIY-UHFFFAOYSA-N 2 1 338.948 4.382 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCC[N@H+]2C)cc1OC ZINC000539252280 1038895885 /nfs/dbraw/zinc/89/58/85/1038895885.db2.gz ILKJDAFIPRPSJX-SJLPKXTDSA-N 2 1 334.504 4.009 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000537616141 1038898209 /nfs/dbraw/zinc/89/82/09/1038898209.db2.gz YFTQYIZAJRGKSX-LRDDRELGSA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000537616141 1038898213 /nfs/dbraw/zinc/89/82/13/1038898213.db2.gz YFTQYIZAJRGKSX-LRDDRELGSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000537616141 1038898217 /nfs/dbraw/zinc/89/82/17/1038898217.db2.gz YFTQYIZAJRGKSX-LRDDRELGSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000537616141 1038898218 /nfs/dbraw/zinc/89/82/18/1038898218.db2.gz YFTQYIZAJRGKSX-LRDDRELGSA-N 2 1 332.385 4.007 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](CCc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000462104073 1038907733 /nfs/dbraw/zinc/90/77/33/1038907733.db2.gz JONLIIFIIAHOBE-UEVCKROQSA-N 2 1 336.523 4.303 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](CCc2ccccc2)Cc2ccccc2)CC[N@H+]1C ZINC000462104073 1038907754 /nfs/dbraw/zinc/90/77/54/1038907754.db2.gz JONLIIFIIAHOBE-UEVCKROQSA-N 2 1 336.523 4.303 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(OCc3ccccc3)c2)C1 ZINC000481294927 1039228939 /nfs/dbraw/zinc/22/89/39/1039228939.db2.gz MZQGGPMAXWLLAT-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000481298470 1039238745 /nfs/dbraw/zinc/23/87/45/1039238745.db2.gz INBDZTSAJOQWME-DYESRHJHSA-N 2 1 344.449 4.180 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000552277140 1039350647 /nfs/dbraw/zinc/35/06/47/1039350647.db2.gz PJUCXQMDZIZKDG-IRFCIJBXSA-N 2 1 337.511 4.341 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(N[C@@H]2CC[NH+](C)[C@H]3CCC[C@H]32)cc1 ZINC000552276355 1039354866 /nfs/dbraw/zinc/35/48/66/1039354866.db2.gz UNCGNKJUYDYSCW-YCZSINBZSA-N 2 1 341.543 4.346 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(N[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)cc1 ZINC000552276355 1039354886 /nfs/dbraw/zinc/35/48/86/1039354886.db2.gz UNCGNKJUYDYSCW-YCZSINBZSA-N 2 1 341.543 4.346 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(N[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)cc1 ZINC000552276355 1039354899 /nfs/dbraw/zinc/35/48/99/1039354899.db2.gz UNCGNKJUYDYSCW-YCZSINBZSA-N 2 1 341.543 4.346 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000481436705 1039410508 /nfs/dbraw/zinc/41/05/08/1039410508.db2.gz OEQMQWBVLKOCFH-ZDUSSCGKSA-N 2 1 342.405 4.253 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@H+]1C ZINC000122161076 1039605389 /nfs/dbraw/zinc/60/53/89/1039605389.db2.gz QHKXXMRBHYNJQP-WMLDXEAASA-N 2 1 340.433 4.199 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000514097965 1039635259 /nfs/dbraw/zinc/63/52/59/1039635259.db2.gz CHLSOGABQDBQPF-RJGXRXQPSA-N 2 1 349.522 4.170 20 0 EIADMP CC(C)SCC[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000514117981 1039647956 /nfs/dbraw/zinc/64/79/56/1039647956.db2.gz DCLYWMMCMKJAQR-UHFFFAOYSA-N 2 1 332.557 4.116 20 0 EIADMP c1ccc(-c2cccc(C[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)c2)nc1 ZINC000093563983 1039714498 /nfs/dbraw/zinc/71/44/98/1039714498.db2.gz UXCZANJYSIIMHH-OAQYLSRUSA-N 2 1 335.495 4.199 20 0 EIADMP c1ccc(-c2cccc(C[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)c2)nc1 ZINC000093563982 1039717398 /nfs/dbraw/zinc/71/73/98/1039717398.db2.gz UXCZANJYSIIMHH-NRFANRHFSA-N 2 1 335.495 4.199 20 0 EIADMP Cc1ccc(CCC[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000434680235 1039798894 /nfs/dbraw/zinc/79/88/94/1039798894.db2.gz UARYEQFAUNAUQW-UHFFFAOYSA-N 2 1 337.511 4.340 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000505465512 1039803205 /nfs/dbraw/zinc/80/32/05/1039803205.db2.gz VRNJWMOSSZGMJE-YUXAGFNASA-N 2 1 334.507 4.217 20 0 EIADMP Clc1ccccc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434670483 1039804088 /nfs/dbraw/zinc/80/40/88/1039804088.db2.gz QAAQKCFNDZAWBN-UHFFFAOYSA-N 2 1 329.875 4.252 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537647596 1039805918 /nfs/dbraw/zinc/80/59/18/1039805918.db2.gz UGDBPQQKVSLKMY-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537647596 1039805927 /nfs/dbraw/zinc/80/59/27/1039805927.db2.gz UGDBPQQKVSLKMY-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP c1[nH+]c(C2CC[NH+](CCCCc3ccccc3)CC2)n2c1CCCC2 ZINC000434686465 1039811058 /nfs/dbraw/zinc/81/10/58/1039811058.db2.gz TXNRSMKQYAPIBD-UHFFFAOYSA-N 2 1 337.511 4.422 20 0 EIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537649743 1039823454 /nfs/dbraw/zinc/82/34/54/1039823454.db2.gz ZJAOJFVFEIAFPU-QGZVFWFLSA-N 2 1 342.458 4.249 20 0 EIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537649743 1039823456 /nfs/dbraw/zinc/82/34/56/1039823456.db2.gz ZJAOJFVFEIAFPU-QGZVFWFLSA-N 2 1 342.458 4.249 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537649743 1039823459 /nfs/dbraw/zinc/82/34/59/1039823459.db2.gz ZJAOJFVFEIAFPU-QGZVFWFLSA-N 2 1 342.458 4.249 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537649743 1039823460 /nfs/dbraw/zinc/82/34/60/1039823460.db2.gz ZJAOJFVFEIAFPU-QGZVFWFLSA-N 2 1 342.458 4.249 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000550977039 1039849922 /nfs/dbraw/zinc/84/99/22/1039849922.db2.gz BIDZTNNCIUHALN-VQTJNVASSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000550977039 1039849925 /nfs/dbraw/zinc/84/99/25/1039849925.db2.gz BIDZTNNCIUHALN-VQTJNVASSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000550977038 1039850481 /nfs/dbraw/zinc/85/04/81/1039850481.db2.gz BIDZTNNCIUHALN-UXHICEINSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000550977038 1039850482 /nfs/dbraw/zinc/85/04/82/1039850482.db2.gz BIDZTNNCIUHALN-UXHICEINSA-N 2 1 328.887 4.308 20 0 EIADMP CN1CC[C@H]([NH2+]Cc2ccccc2OC(F)F)C[C@H]1c1ccccc1 ZINC000550990267 1039854759 /nfs/dbraw/zinc/85/47/59/1039854759.db2.gz FZBNQKFQXNIYJC-ROUUACIJSA-N 2 1 346.421 4.213 20 0 EIADMP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C)s2)cc1 ZINC000469251409 1039870302 /nfs/dbraw/zinc/87/03/02/1039870302.db2.gz IILCMHQJORWJQU-UONOGXRCSA-N 2 1 347.528 4.118 20 0 EIADMP Cc1cccc(C)c1OCC[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000551013213 1039876580 /nfs/dbraw/zinc/87/65/80/1039876580.db2.gz GVXIAUWJKFJCRC-RTWAWAEBSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1cccc(C)c1OCC[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000551013213 1039876583 /nfs/dbraw/zinc/87/65/83/1039876583.db2.gz GVXIAUWJKFJCRC-RTWAWAEBSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1cc(C)cc(OCC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551014361 1039877056 /nfs/dbraw/zinc/87/70/56/1039877056.db2.gz SIQYIRQHVBCDSP-UNMCSNQZSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1cc(C)cc(OCC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551014361 1039877058 /nfs/dbraw/zinc/87/70/58/1039877058.db2.gz SIQYIRQHVBCDSP-UNMCSNQZSA-N 2 1 338.495 4.107 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(Cl)cc1 ZINC000481923495 1039898807 /nfs/dbraw/zinc/89/88/07/1039898807.db2.gz OQOFGLIBMMFBKR-QRWLVFNGSA-N 2 1 328.887 4.437 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cnc(C3CCCC3)s2)CC1 ZINC000535082839 1039919024 /nfs/dbraw/zinc/91/90/24/1039919024.db2.gz DFDQUQLDUGJFON-UHFFFAOYSA-N 2 1 335.561 4.353 20 0 EIADMP CCCOc1cc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)ccc1OC ZINC000535082086 1039920047 /nfs/dbraw/zinc/92/00/47/1039920047.db2.gz NXCUDMNZPNAFNB-UHFFFAOYSA-N 2 1 348.531 4.036 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CC2(C)Cc3ccccc3C2)C[C@H]1c1ccccc1 ZINC000551087037 1039968321 /nfs/dbraw/zinc/96/83/21/1039968321.db2.gz KSXRVEDOMGWYFD-VXKWHMMOSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC2(C)Cc3ccccc3C2)C[C@H]1c1ccccc1 ZINC000551087037 1039968350 /nfs/dbraw/zinc/96/83/50/1039968350.db2.gz KSXRVEDOMGWYFD-VXKWHMMOSA-N 2 1 334.507 4.217 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000623503877 1039980307 /nfs/dbraw/zinc/98/03/07/1039980307.db2.gz RFACSZBYBDEXGN-CZUORRHYSA-N 2 1 328.422 4.271 20 0 EIADMP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551147671 1040007323 /nfs/dbraw/zinc/00/73/23/1040007323.db2.gz HNIDGWRGKPLORZ-IRLDBZIGSA-N 2 1 337.511 4.304 20 0 EIADMP CCO[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccccc1 ZINC000551174998 1040017686 /nfs/dbraw/zinc/01/76/86/1040017686.db2.gz DXBBAXBMINPPBH-YPAWHYETSA-N 2 1 338.495 4.189 20 0 EIADMP CCO[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccccc1 ZINC000551174998 1040017698 /nfs/dbraw/zinc/01/76/98/1040017698.db2.gz DXBBAXBMINPPBH-YPAWHYETSA-N 2 1 338.495 4.189 20 0 EIADMP CSc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551174778 1040019772 /nfs/dbraw/zinc/01/97/72/1040019772.db2.gz DAIKOORIQDXPQY-PZJWPPBQSA-N 2 1 340.536 4.376 20 0 EIADMP CSc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551174778 1040019794 /nfs/dbraw/zinc/01/97/94/1040019794.db2.gz DAIKOORIQDXPQY-PZJWPPBQSA-N 2 1 340.536 4.376 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)C[C@@H]1c1ccccc1 ZINC000551176646 1040023379 /nfs/dbraw/zinc/02/33/79/1040023379.db2.gz YRWVBNJCMUQONC-ZVVDCOBXSA-N 2 1 338.470 4.497 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)C[C@@H]1c1ccccc1 ZINC000551176646 1040023403 /nfs/dbraw/zinc/02/34/03/1040023403.db2.gz YRWVBNJCMUQONC-ZVVDCOBXSA-N 2 1 338.470 4.497 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cccc(F)c1 ZINC000482133278 1040029247 /nfs/dbraw/zinc/02/92/47/1040029247.db2.gz IXPFWZXKRSIRKW-JKSUJKDBSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(F)c1 ZINC000482133278 1040029268 /nfs/dbraw/zinc/02/92/68/1040029268.db2.gz IXPFWZXKRSIRKW-JKSUJKDBSA-N 2 1 332.488 4.450 20 0 EIADMP Clc1ccc(-c2ncc(C[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)s2)cc1 ZINC000551225984 1040083415 /nfs/dbraw/zinc/08/34/15/1040083415.db2.gz YLYMHFIJBJTBRQ-CYBMUJFWSA-N 2 1 347.915 4.037 20 0 EIADMP Clc1ccc(-c2ncc(C[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)s2)cc1 ZINC000551225984 1040083434 /nfs/dbraw/zinc/08/34/34/1040083434.db2.gz YLYMHFIJBJTBRQ-CYBMUJFWSA-N 2 1 347.915 4.037 20 0 EIADMP CC(C)=CCC[C@H](C)CC[NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000482233450 1040088629 /nfs/dbraw/zinc/08/86/29/1040088629.db2.gz XWRJUMZRPCGWPF-KRWDZBQOSA-N 2 1 344.547 4.424 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCc2cccc(F)c2)CC1 ZINC000551268060 1040130012 /nfs/dbraw/zinc/13/00/12/1040130012.db2.gz YIGZFKCEPPXEQK-UHFFFAOYSA-N 2 1 340.486 4.401 20 0 EIADMP C[NH+](C)CCC1CC[NH+](Cc2cc(Cl)ccc2OC(F)F)CC1 ZINC000551383056 1040248341 /nfs/dbraw/zinc/24/83/41/1040248341.db2.gz DQSHNZMSGXAQAX-UHFFFAOYSA-N 2 1 346.849 4.105 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)ccc1F ZINC000482455943 1040254845 /nfs/dbraw/zinc/25/48/45/1040254845.db2.gz YUWCFVCFFNYDJI-AEFFLSMTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)ccc1F ZINC000482455943 1040254861 /nfs/dbraw/zinc/25/48/61/1040254861.db2.gz YUWCFVCFFNYDJI-AEFFLSMTSA-N 2 1 344.449 4.180 20 0 EIADMP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]C(C)(C)CC[NH+]1CCCCCC1 ZINC000482491644 1040296057 /nfs/dbraw/zinc/29/60/57/1040296057.db2.gz RJBILBGVMZOJHH-UHFFFAOYSA-N 2 1 348.579 4.389 20 0 EIADMP c1ccc(C[C@@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C2CC2)cc1 ZINC000479462196 1040370097 /nfs/dbraw/zinc/37/00/97/1040370097.db2.gz FPIKYDSQQWXYQU-FYYLOGMGSA-N 2 1 334.507 4.119 20 0 EIADMP Fc1ccc(F)c2c1CC[C@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479464049 1040373908 /nfs/dbraw/zinc/37/39/08/1040373908.db2.gz KRPRPUOIOWVXOY-OXJNMPFZSA-N 2 1 342.433 4.064 20 0 EIADMP Fc1ccc(F)c2c1CC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000479464049 1040373931 /nfs/dbraw/zinc/37/39/31/1040373931.db2.gz KRPRPUOIOWVXOY-OXJNMPFZSA-N 2 1 342.433 4.064 20 0 EIADMP CC[C@@H](C[N@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000435447649 1040395293 /nfs/dbraw/zinc/39/52/93/1040395293.db2.gz HVSMZVGYXGXIGI-ROUUACIJSA-N 2 1 343.540 4.057 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995458 1040403852 /nfs/dbraw/zinc/40/38/52/1040403852.db2.gz OICDCXWTCCGUBI-FQEVSTJZSA-N 2 1 336.479 4.127 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995459 1040404779 /nfs/dbraw/zinc/40/47/79/1040404779.db2.gz OICDCXWTCCGUBI-HXUWFJFHSA-N 2 1 336.479 4.127 20 0 EIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(C(F)(F)F)c1 ZINC000479511481 1040429264 /nfs/dbraw/zinc/42/92/64/1040429264.db2.gz OOYHUDGHOXMBQO-NVPAJSRCSA-N 2 1 326.406 4.373 20 0 EIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(Br)c1 ZINC000479514899 1040431964 /nfs/dbraw/zinc/43/19/64/1040431964.db2.gz XKYCNXFSNVMOSE-NVPAJSRCSA-N 2 1 337.305 4.117 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@@]4(CC[NH2+]C4)C3)s2)cc1 ZINC000462407878 1040574780 /nfs/dbraw/zinc/57/47/80/1040574780.db2.gz FOTSWNCUCXALAB-HXUWFJFHSA-N 2 1 341.524 4.119 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@@]4(CC[NH2+]C4)C3)s2)cc1 ZINC000462407878 1040574801 /nfs/dbraw/zinc/57/48/01/1040574801.db2.gz FOTSWNCUCXALAB-HXUWFJFHSA-N 2 1 341.524 4.119 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)C1 ZINC000435742447 1040595951 /nfs/dbraw/zinc/59/59/51/1040595951.db2.gz NMMVJGFXELBHPM-HLLBOEOZSA-N 2 1 332.454 4.494 20 0 EIADMP CCc1[nH+]ccn1[C@H]1CCCN(c2c(C)c[nH+]c3c(C)cccc32)C1 ZINC000462485094 1040648413 /nfs/dbraw/zinc/64/84/13/1040648413.db2.gz BUSFOUKHWZIBIZ-KRWDZBQOSA-N 2 1 334.467 4.452 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccc(OC)c1 ZINC000479850627 1040730520 /nfs/dbraw/zinc/73/05/20/1040730520.db2.gz KXRFDYSRGVYBTF-JOCHJYFZSA-N 2 1 338.495 4.401 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000483179008 1040746735 /nfs/dbraw/zinc/74/67/35/1040746735.db2.gz AXSOMXGPNVMJSA-MDNKFWRPSA-N 2 1 332.557 4.161 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000483179008 1040746754 /nfs/dbraw/zinc/74/67/54/1040746754.db2.gz AXSOMXGPNVMJSA-MDNKFWRPSA-N 2 1 332.557 4.161 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CC(C)(C)c4ccccc43)CC2)[nH+]1 ZINC000483191731 1040766878 /nfs/dbraw/zinc/76/68/78/1040766878.db2.gz GCYJSEDPGPRZGK-FQEVSTJZSA-N 2 1 335.495 4.371 20 0 EIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(C)(c2cccc(Cl)c2)CC1 ZINC000483248719 1040781677 /nfs/dbraw/zinc/78/16/77/1040781677.db2.gz RJDFTEPZGZDIML-UHFFFAOYSA-N 2 1 331.891 4.289 20 0 EIADMP CC(C)C1CCC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC000462673020 1040819338 /nfs/dbraw/zinc/81/93/38/1040819338.db2.gz HFOHYHSKYPNAFM-UHFFFAOYSA-N 2 1 328.544 4.498 20 0 EIADMP CC[N@@H+](Cc1sccc1OC)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000539862911 1040848334 /nfs/dbraw/zinc/84/83/34/1040848334.db2.gz QFUAQMYIXRHCNN-GOSISDBHSA-N 2 1 344.524 4.101 20 0 EIADMP CC[N@H+](Cc1sccc1OC)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000539862911 1040848341 /nfs/dbraw/zinc/84/83/41/1040848341.db2.gz QFUAQMYIXRHCNN-GOSISDBHSA-N 2 1 344.524 4.101 20 0 EIADMP CC[NH+](Cc1sccc1OC)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539862911 1040848342 /nfs/dbraw/zinc/84/83/42/1040848342.db2.gz QFUAQMYIXRHCNN-GOSISDBHSA-N 2 1 344.524 4.101 20 0 EIADMP CC[NH+](Cc1sccc1OC)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539862911 1040848345 /nfs/dbraw/zinc/84/83/45/1040848345.db2.gz QFUAQMYIXRHCNN-GOSISDBHSA-N 2 1 344.524 4.101 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000539852481 1040848473 /nfs/dbraw/zinc/84/84/73/1040848473.db2.gz ROAXZRBFKQDKJM-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000539852481 1040848481 /nfs/dbraw/zinc/84/84/81/1040848481.db2.gz ROAXZRBFKQDKJM-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000669846974 1040851582 /nfs/dbraw/zinc/85/15/82/1040851582.db2.gz UIKYOLMWUFUGSM-PCCBWWKXSA-N 2 1 332.507 4.407 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCOc3ccc4ccccc4c3)CC[C@@H]21 ZINC000483479436 1040873520 /nfs/dbraw/zinc/87/35/20/1040873520.db2.gz DWSGJCBCXCTQIF-IRLDBZIGSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCOc3ccc4ccccc4c3)CC[C@@H]21 ZINC000483479436 1040873521 /nfs/dbraw/zinc/87/35/21/1040873521.db2.gz DWSGJCBCXCTQIF-IRLDBZIGSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCOc3ccc4ccccc4c3)CC[C@@H]21 ZINC000483479436 1040873527 /nfs/dbraw/zinc/87/35/27/1040873527.db2.gz DWSGJCBCXCTQIF-IRLDBZIGSA-N 2 1 338.495 4.025 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](c2ccccc2F)C2CCOCC2)C1 ZINC000903090962 1040897995 /nfs/dbraw/zinc/89/79/95/1040897995.db2.gz KAKOUIHRIQXDMR-UWJYYQICSA-N 2 1 348.506 4.003 20 0 EIADMP CC[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000537940132 1040906731 /nfs/dbraw/zinc/90/67/31/1040906731.db2.gz VNUXUOXSFYICHU-CBQOVEMMSA-N 2 1 344.543 4.082 20 0 EIADMP COc1ccc(F)cc1C[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000462775295 1040911023 /nfs/dbraw/zinc/91/10/23/1040911023.db2.gz FWXMOULHPCDHBK-AUUYWEPGSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(F)cc1C[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000462775295 1040911046 /nfs/dbraw/zinc/91/10/46/1040911046.db2.gz FWXMOULHPCDHBK-AUUYWEPGSA-N 2 1 348.487 4.069 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC000537976242 1040945857 /nfs/dbraw/zinc/94/58/57/1040945857.db2.gz PRNPXOXWDJRLOH-GCJKJVERSA-N 2 1 333.479 4.401 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]C[C@@H](C)Cn3cc[nH+]c3C)c(C)c2c1 ZINC000537967507 1040968013 /nfs/dbraw/zinc/96/80/13/1040968013.db2.gz MAUSEWCWGVPPIP-HIFRSBDPSA-N 2 1 341.455 4.242 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+][C@@H]4CCCSCC4)C[C@@H]3C2)cc1 ZINC000898519247 1040971891 /nfs/dbraw/zinc/97/18/91/1040971891.db2.gz OBFQDPVLDUINKF-BQJUDKOJSA-N 2 1 344.568 4.162 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000436229415 1040976566 /nfs/dbraw/zinc/97/65/66/1040976566.db2.gz DOLPSIQYVRGGBL-LLVKDONJSA-N 2 1 345.796 4.290 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)c2cccc(Br)c21 ZINC000483734455 1040985597 /nfs/dbraw/zinc/98/55/97/1040985597.db2.gz XDQFQMGZLSZLQF-FOCJUVANSA-N 2 1 337.305 4.070 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)c2cccc(Br)c21 ZINC000483734455 1040985622 /nfs/dbraw/zinc/98/56/22/1040985622.db2.gz XDQFQMGZLSZLQF-FOCJUVANSA-N 2 1 337.305 4.070 20 0 EIADMP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000483743789 1040993691 /nfs/dbraw/zinc/99/36/91/1040993691.db2.gz IGWXXKDABRIHOF-RMRHIDDWSA-N 2 1 345.314 4.222 20 0 EIADMP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000483743789 1040993717 /nfs/dbraw/zinc/99/37/17/1040993717.db2.gz IGWXXKDABRIHOF-RMRHIDDWSA-N 2 1 345.314 4.222 20 0 EIADMP Fc1cccc2[nH]c(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)cc21 ZINC000436276374 1041049550 /nfs/dbraw/zinc/04/95/50/1041049550.db2.gz SSPZTHLNVSWCGC-UHFFFAOYSA-N 2 1 337.442 4.061 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1cccnc1 ZINC000538116499 1041049634 /nfs/dbraw/zinc/04/96/34/1041049634.db2.gz LBVMBCFTTNZXOD-QIJUGHKUSA-N 2 1 337.511 4.421 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1cccnc1 ZINC000538116499 1041049648 /nfs/dbraw/zinc/04/96/48/1041049648.db2.gz LBVMBCFTTNZXOD-QIJUGHKUSA-N 2 1 337.511 4.421 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCC[N@@H+](C)C(C)C)cnn1-c1cccc(Cl)c1 ZINC000480190105 1041067567 /nfs/dbraw/zinc/06/75/67/1041067567.db2.gz DAYHCFBWMUDZBQ-HNNXBMFYSA-N 2 1 348.922 4.215 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCC[N@H+](C)C(C)C)cnn1-c1cccc(Cl)c1 ZINC000480190105 1041067580 /nfs/dbraw/zinc/06/75/80/1041067580.db2.gz DAYHCFBWMUDZBQ-HNNXBMFYSA-N 2 1 348.922 4.215 20 0 EIADMP c1ccc(CC[C@H](Cc2ccccc2)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000480256407 1041122654 /nfs/dbraw/zinc/12/26/54/1041122654.db2.gz CRRZLHCVVINAFC-HSZRJFAPSA-N 2 1 348.534 4.447 20 0 EIADMP CC[C@H]([NH2+]CC(CC)(CC)[NH2+][C@H](C)c1ccccc1)[C@H]1CCOC1 ZINC000484142478 1041133442 /nfs/dbraw/zinc/13/34/42/1041133442.db2.gz SESCZWGQHPUZDX-HOJAQTOUSA-N 2 1 332.532 4.301 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)CCC2 ZINC000540148316 1041161951 /nfs/dbraw/zinc/16/19/51/1041161951.db2.gz YVPQNKRDNLQWPH-UWJYYQICSA-N 2 1 330.516 4.030 20 0 EIADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000480300840 1041195906 /nfs/dbraw/zinc/19/59/06/1041195906.db2.gz LKEALWGXUNJSTI-CQSZACIVSA-N 2 1 334.410 4.046 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000480300840 1041195927 /nfs/dbraw/zinc/19/59/27/1041195927.db2.gz LKEALWGXUNJSTI-CQSZACIVSA-N 2 1 334.410 4.046 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000667667651 1041252901 /nfs/dbraw/zinc/25/29/01/1041252901.db2.gz SEFBPYKHSRADQA-RDTXWAMCSA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000667667651 1041252911 /nfs/dbraw/zinc/25/29/11/1041252911.db2.gz SEFBPYKHSRADQA-RDTXWAMCSA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000667667651 1041252921 /nfs/dbraw/zinc/25/29/21/1041252921.db2.gz SEFBPYKHSRADQA-RDTXWAMCSA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000667667651 1041252931 /nfs/dbraw/zinc/25/29/31/1041252931.db2.gz SEFBPYKHSRADQA-RDTXWAMCSA-N 2 1 329.513 4.033 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000484506257 1041286978 /nfs/dbraw/zinc/28/69/78/1041286978.db2.gz QWQIYKVHYFRSQP-RXVVDRJESA-N 2 1 338.495 4.004 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000484506257 1041286998 /nfs/dbraw/zinc/28/69/98/1041286998.db2.gz QWQIYKVHYFRSQP-RXVVDRJESA-N 2 1 338.495 4.004 20 0 EIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc2ccccc2c1OC(F)F ZINC000538406080 1041301829 /nfs/dbraw/zinc/30/18/29/1041301829.db2.gz ORJNPBHTLSXSSE-AWEZNQCLSA-N 2 1 346.421 4.354 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]C[C@H](C)C[NH+]3CCCC3)oc21 ZINC000538397489 1041315534 /nfs/dbraw/zinc/31/55/34/1041315534.db2.gz IYMHEOIPXCZIRK-JKSUJKDBSA-N 2 1 330.472 4.214 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)C1(c2ccccc2)CCCC1 ZINC000554734340 1041365733 /nfs/dbraw/zinc/36/57/33/1041365733.db2.gz JRLPSQQKFVYBIN-MSOLQXFVSA-N 2 1 325.500 4.318 20 0 EIADMP CC[C@H]1CCC[N@@H+](C(C)(C)C[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000463146206 1041367022 /nfs/dbraw/zinc/36/70/22/1041367022.db2.gz NAUMZOGZIWNDIP-IBGZPJMESA-N 2 1 343.559 4.146 20 0 EIADMP CC[C@H]1CCC[N@H+](C(C)(C)C[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000463146206 1041367030 /nfs/dbraw/zinc/36/70/30/1041367030.db2.gz NAUMZOGZIWNDIP-IBGZPJMESA-N 2 1 343.559 4.146 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCC[C@@H]1Oc1ccccc1C ZINC000484635004 1041370412 /nfs/dbraw/zinc/37/04/12/1041370412.db2.gz HZMYEPHQCJGKFY-CTNGQTDRSA-N 2 1 341.499 4.260 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C[C@@H]3CCc4ccccc43)CC2)cc1 ZINC000463166563 1041399065 /nfs/dbraw/zinc/39/90/65/1041399065.db2.gz SKVXXPQSSPFCGB-NRFANRHFSA-N 2 1 334.507 4.013 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C[C@H]3CCc4ccccc43)CC2)cc1 ZINC000463166564 1041399131 /nfs/dbraw/zinc/39/91/31/1041399131.db2.gz SKVXXPQSSPFCGB-OAQYLSRUSA-N 2 1 334.507 4.013 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463190112 1041406563 /nfs/dbraw/zinc/40/65/63/1041406563.db2.gz IADGPQJUGRINTR-RLLPEYFOSA-N 2 1 334.507 4.260 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2Cc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000463190112 1041406567 /nfs/dbraw/zinc/40/65/67/1041406567.db2.gz IADGPQJUGRINTR-RLLPEYFOSA-N 2 1 334.507 4.260 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)[C@@H](C)c1ccccc1 ZINC000463194923 1041410660 /nfs/dbraw/zinc/41/06/60/1041410660.db2.gz XBPCBQVNYBGVGH-WOJBJXKFSA-N 2 1 336.523 4.475 20 0 EIADMP CCS[C@@H]1CCCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463187572 1041416856 /nfs/dbraw/zinc/41/68/56/1041416856.db2.gz BPNXQKLDODRYRW-LEWJYISDSA-N 2 1 346.584 4.347 20 0 EIADMP Cc1cccc(C)c1CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463205184 1041418556 /nfs/dbraw/zinc/41/85/56/1041418556.db2.gz LOWXFCCWYXUEPH-UHFFFAOYSA-N 2 1 336.523 4.143 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(OC)c1 ZINC000480608404 1041420492 /nfs/dbraw/zinc/42/04/92/1041420492.db2.gz KUTNPWBQVZABKY-IAGOWNOFSA-N 2 1 334.504 4.009 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)COC2 ZINC000480612954 1041423308 /nfs/dbraw/zinc/42/33/08/1041423308.db2.gz RPJSHZXXKGXWNW-KSZLIROESA-N 2 1 330.516 4.126 20 0 EIADMP COc1ccc(OC)c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000480617991 1041426949 /nfs/dbraw/zinc/42/69/49/1041426949.db2.gz VRBMIILHSPLWRZ-IAGOWNOFSA-N 2 1 334.504 4.009 20 0 EIADMP Clc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000414889620 1041434171 /nfs/dbraw/zinc/43/41/71/1041434171.db2.gz YWPSAXDATSBGET-PMACEKPBSA-N 2 1 343.902 4.141 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463251314 1041463307 /nfs/dbraw/zinc/46/33/07/1041463307.db2.gz DKBMSXZHQLWYFJ-JSFXGIFRSA-N 2 1 344.543 4.224 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463251314 1041463310 /nfs/dbraw/zinc/46/33/10/1041463310.db2.gz DKBMSXZHQLWYFJ-JSFXGIFRSA-N 2 1 344.543 4.224 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cccc(C(C)C)c2)[C@H](C)C1 ZINC000480674049 1041464803 /nfs/dbraw/zinc/46/48/03/1041464803.db2.gz WPLMDACGDOAROX-WIYYLYMNSA-N 2 1 332.532 4.037 20 0 EIADMP Cc1ccsc1CC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463271149 1041477465 /nfs/dbraw/zinc/47/74/65/1041477465.db2.gz IUORJYWIGGAUIV-UHFFFAOYSA-N 2 1 346.515 4.035 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1F ZINC000195133268 1041484313 /nfs/dbraw/zinc/48/43/13/1041484313.db2.gz YIIMKTDJUNETCW-WBVHZDCISA-N 2 1 330.422 4.138 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1F ZINC000195133268 1041484319 /nfs/dbraw/zinc/48/43/19/1041484319.db2.gz YIIMKTDJUNETCW-WBVHZDCISA-N 2 1 330.422 4.138 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@@H]3CCSc4ccccc43)C2)cc1 ZINC000195134379 1041486248 /nfs/dbraw/zinc/48/62/48/1041486248.db2.gz UIUPMCIFKFYCKM-AZUAARDMSA-N 2 1 338.520 4.335 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Br)cc2C)C[C@@H]1C ZINC000538718057 1041488087 /nfs/dbraw/zinc/48/80/87/1041488087.db2.gz RUEVPYXSJWBQJQ-WMLDXEAASA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Br)cc2C)C[C@@H]1C ZINC000538718057 1041488090 /nfs/dbraw/zinc/48/80/90/1041488090.db2.gz RUEVPYXSJWBQJQ-WMLDXEAASA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Br)cc2C)C[C@@H]1C ZINC000538718057 1041488101 /nfs/dbraw/zinc/48/81/01/1041488101.db2.gz RUEVPYXSJWBQJQ-WMLDXEAASA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c(OC)ccc3ccccc32)C[C@H]1C ZINC000538717251 1041488443 /nfs/dbraw/zinc/48/84/43/1041488443.db2.gz NWMOKQDDPBYJLK-AEFFLSMTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c(OC)ccc3ccccc32)C[C@H]1C ZINC000538717251 1041488448 /nfs/dbraw/zinc/48/84/48/1041488448.db2.gz NWMOKQDDPBYJLK-AEFFLSMTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c(OC)ccc3ccccc32)C[C@H]1C ZINC000538717251 1041488453 /nfs/dbraw/zinc/48/84/53/1041488453.db2.gz NWMOKQDDPBYJLK-AEFFLSMTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c(OC)ccc3ccccc32)C[C@H]1C ZINC000538717251 1041488458 /nfs/dbraw/zinc/48/84/58/1041488458.db2.gz NWMOKQDDPBYJLK-AEFFLSMTSA-N 2 1 326.484 4.153 20 0 EIADMP C[N@@H+](C[C@H]1C[C@@H]1c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538731489 1041501018 /nfs/dbraw/zinc/50/10/18/1041501018.db2.gz PGEYQDXHYOLBLN-MDNUFGMLSA-N 2 1 334.507 4.244 20 0 EIADMP C[NH+](C[C@H]1C[C@@H]1c1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000538731489 1041501028 /nfs/dbraw/zinc/50/10/28/1041501028.db2.gz PGEYQDXHYOLBLN-MDNUFGMLSA-N 2 1 334.507 4.244 20 0 EIADMP C[NH+](C[C@H]1C[C@@H]1c1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000538731489 1041501043 /nfs/dbraw/zinc/50/10/43/1041501043.db2.gz PGEYQDXHYOLBLN-MDNUFGMLSA-N 2 1 334.507 4.244 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cccc(OCc3ccccc3)c2)C1 ZINC000538750094 1041522748 /nfs/dbraw/zinc/52/27/48/1041522748.db2.gz AOFDWJWXBHRCPJ-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cccc(OCc3ccccc3)c2)C1 ZINC000538750094 1041522757 /nfs/dbraw/zinc/52/27/57/1041522757.db2.gz AOFDWJWXBHRCPJ-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2cccc(OCc3ccccc3)c2)C1 ZINC000538750094 1041522773 /nfs/dbraw/zinc/52/27/73/1041522773.db2.gz AOFDWJWXBHRCPJ-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cccc(OCc3ccccc3)c2)C1 ZINC000538750094 1041522784 /nfs/dbraw/zinc/52/27/84/1041522784.db2.gz AOFDWJWXBHRCPJ-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP c1csc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000538798680 1041539664 /nfs/dbraw/zinc/53/96/64/1041539664.db2.gz STYLXVGJAHAIQX-UYAOXDASSA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000538798680 1041539669 /nfs/dbraw/zinc/53/96/69/1041539669.db2.gz STYLXVGJAHAIQX-UYAOXDASSA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)c1 ZINC000538798680 1041539676 /nfs/dbraw/zinc/53/96/76/1041539676.db2.gz STYLXVGJAHAIQX-UYAOXDASSA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000538798680 1041539683 /nfs/dbraw/zinc/53/96/83/1041539683.db2.gz STYLXVGJAHAIQX-UYAOXDASSA-N 2 1 326.509 4.235 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccccc4F)o3)CC[C@H]21 ZINC000538799165 1041539744 /nfs/dbraw/zinc/53/97/44/1041539744.db2.gz RRENVKHCEKAYTI-DNVCBOLYSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(-c4ccccc4F)o3)CC[C@H]21 ZINC000538799165 1041539747 /nfs/dbraw/zinc/53/97/47/1041539747.db2.gz RRENVKHCEKAYTI-DNVCBOLYSA-N 2 1 328.431 4.002 20 0 EIADMP c1sc2ccccc2c1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000538799445 1041540251 /nfs/dbraw/zinc/54/02/51/1041540251.db2.gz GDYBWSBGAIJXDZ-DNVCBOLYSA-N 2 1 326.509 4.350 20 0 EIADMP c1sc2ccccc2c1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000538799445 1041540255 /nfs/dbraw/zinc/54/02/55/1041540255.db2.gz GDYBWSBGAIJXDZ-DNVCBOLYSA-N 2 1 326.509 4.350 20 0 EIADMP CC[N@H+]1CC[C@H](Nc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)[C@H](C)C1 ZINC000540699432 1041613709 /nfs/dbraw/zinc/61/37/09/1041613709.db2.gz FDEHMQRWLSYIBQ-LQWHRVPQSA-N 2 1 329.532 4.203 20 0 EIADMP CC[NH+]1CC[C@H](Nc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)[C@H](C)C1 ZINC000540699432 1041613711 /nfs/dbraw/zinc/61/37/11/1041613711.db2.gz FDEHMQRWLSYIBQ-LQWHRVPQSA-N 2 1 329.532 4.203 20 0 EIADMP CC[NH+]1CC[C@H](Nc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)[C@H](C)C1 ZINC000540699432 1041613715 /nfs/dbraw/zinc/61/37/15/1041613715.db2.gz FDEHMQRWLSYIBQ-LQWHRVPQSA-N 2 1 329.532 4.203 20 0 EIADMP CC[N@H+]1CC[C@H](Nc2ccc(C[NH+]3CCCC[C@H]3C)cc2)[C@@H](C)C1 ZINC000540699434 1041613975 /nfs/dbraw/zinc/61/39/75/1041613975.db2.gz FDEHMQRWLSYIBQ-UEXGIBASSA-N 2 1 329.532 4.203 20 0 EIADMP CC[NH+]1CC[C@H](Nc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)[C@@H](C)C1 ZINC000540699434 1041613981 /nfs/dbraw/zinc/61/39/81/1041613981.db2.gz FDEHMQRWLSYIBQ-UEXGIBASSA-N 2 1 329.532 4.203 20 0 EIADMP CC[NH+]1CC[C@H](Nc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)[C@@H](C)C1 ZINC000540699434 1041613984 /nfs/dbraw/zinc/61/39/84/1041613984.db2.gz FDEHMQRWLSYIBQ-UEXGIBASSA-N 2 1 329.532 4.203 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1ccccn1 ZINC000516650160 1041690153 /nfs/dbraw/zinc/69/01/53/1041690153.db2.gz HATHNHHLMKKNOG-HXUWFJFHSA-N 2 1 349.522 4.146 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1ccccn1 ZINC000516650160 1041690158 /nfs/dbraw/zinc/69/01/58/1041690158.db2.gz HATHNHHLMKKNOG-HXUWFJFHSA-N 2 1 349.522 4.146 20 0 EIADMP CC[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402486990 1041818882 /nfs/dbraw/zinc/81/88/82/1041818882.db2.gz ASRVHNKRKAKRDR-BQFCYCMXSA-N 2 1 342.449 4.465 20 0 EIADMP CC(C)(Cc1ccc(F)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167962214 1041865068 /nfs/dbraw/zinc/86/50/68/1041865068.db2.gz VLMMKRRMNBWSII-IHWFROFDSA-N 2 1 330.491 4.142 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]Cc3ccc4[nH]ccc4c3)C2)c1 ZINC000517172206 1041890020 /nfs/dbraw/zinc/89/00/20/1041890020.db2.gz FOFYHLBUHGKCMH-KRWDZBQOSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]Cc3ccc4[nH]ccc4c3)C2)c1 ZINC000517172206 1041890022 /nfs/dbraw/zinc/89/00/22/1041890022.db2.gz FOFYHLBUHGKCMH-KRWDZBQOSA-N 2 1 339.508 4.231 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCCOCc3ccccc3)C2)CC1 ZINC000541591194 1042025413 /nfs/dbraw/zinc/02/54/13/1042025413.db2.gz RTBXGWILTLFDDW-JOCHJYFZSA-N 2 1 344.543 4.037 20 0 EIADMP c1ccc(OCCCCC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000438121443 1042062476 /nfs/dbraw/zinc/06/24/76/1042062476.db2.gz PKEDYNLRPXFFJI-KNQAVFIVSA-N 2 1 342.527 4.184 20 0 EIADMP CC[NH+](CC)CCC[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000425958171 1042081552 /nfs/dbraw/zinc/08/15/52/1042081552.db2.gz LXUVYVQFLWVHCH-FQEVSTJZSA-N 2 1 345.918 4.340 20 0 EIADMP CCCC[C@H](CC)C[N@H+]1CCC[C@@]2(CCC[NH+](C[C@H](C)CO)C2)C1 ZINC001280201521 1042112931 /nfs/dbraw/zinc/11/29/31/1042112931.db2.gz SMDWAPFRCSZCJC-PCCBWWKXSA-N 2 1 338.580 4.009 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCC[C@@]2(CCC[N@H+](C[C@H](C)CO)C2)C1 ZINC001280201521 1042112939 /nfs/dbraw/zinc/11/29/39/1042112939.db2.gz SMDWAPFRCSZCJC-PCCBWWKXSA-N 2 1 338.580 4.009 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCC[C@@]2(CCC[N@@H+](C[C@H](C)CO)C2)C1 ZINC001280201521 1042112949 /nfs/dbraw/zinc/11/29/49/1042112949.db2.gz SMDWAPFRCSZCJC-PCCBWWKXSA-N 2 1 338.580 4.009 20 0 EIADMP Cc1nc(C(C)C)ccc1CN1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000550000704 1042123626 /nfs/dbraw/zinc/12/36/26/1042123626.db2.gz WVFMBIWWTKWCIM-SZPZYZBQSA-N 2 1 349.522 4.077 20 0 EIADMP CSC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)c1ccc(C(F)(F)F)cc1 ZINC000541915237 1042170631 /nfs/dbraw/zinc/17/06/31/1042170631.db2.gz DIUVTUGVEWLHTR-MRXNPFEDSA-N 2 1 348.478 4.429 20 0 EIADMP CSC[C@@H]([NH2+]CCC[N@@H+](C)C(C)C)c1ccc(C(F)(F)F)cc1 ZINC000541915237 1042170632 /nfs/dbraw/zinc/17/06/32/1042170632.db2.gz DIUVTUGVEWLHTR-MRXNPFEDSA-N 2 1 348.478 4.429 20 0 EIADMP C[N@@H+](CCSc1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464833798 1042180053 /nfs/dbraw/zinc/18/00/53/1042180053.db2.gz GCIMVBJBGAPILU-FQEVSTJZSA-N 2 1 340.536 4.233 20 0 EIADMP C[NH+](CCSc1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464833798 1042180056 /nfs/dbraw/zinc/18/00/56/1042180056.db2.gz GCIMVBJBGAPILU-FQEVSTJZSA-N 2 1 340.536 4.233 20 0 EIADMP C[NH+](CCSc1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464833798 1042180057 /nfs/dbraw/zinc/18/00/57/1042180057.db2.gz GCIMVBJBGAPILU-FQEVSTJZSA-N 2 1 340.536 4.233 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464828945 1042185951 /nfs/dbraw/zinc/18/59/51/1042185951.db2.gz FDFZHJOKSBMKAG-AEFFLSMTSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464828945 1042185957 /nfs/dbraw/zinc/18/59/57/1042185957.db2.gz FDFZHJOKSBMKAG-AEFFLSMTSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464828945 1042185961 /nfs/dbraw/zinc/18/59/61/1042185961.db2.gz FDFZHJOKSBMKAG-AEFFLSMTSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464828945 1042185965 /nfs/dbraw/zinc/18/59/65/1042185965.db2.gz FDFZHJOKSBMKAG-AEFFLSMTSA-N 2 1 344.449 4.480 20 0 EIADMP C[N@@H+](CCC[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1)Cc1ccccc1 ZINC000303093373 1042296567 /nfs/dbraw/zinc/29/65/67/1042296567.db2.gz BUXAZRPSNGJMET-IRXDYDNUSA-N 2 1 328.422 4.219 20 0 EIADMP CCCOc1ccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)cc1OCC ZINC000506353711 1042343759 /nfs/dbraw/zinc/34/37/59/1042343759.db2.gz SMZQFKAJSRDVET-UHFFFAOYSA-N 2 1 348.531 4.179 20 0 EIADMP CCCOc1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc1OCC ZINC000506353711 1042343767 /nfs/dbraw/zinc/34/37/67/1042343767.db2.gz SMZQFKAJSRDVET-UHFFFAOYSA-N 2 1 348.531 4.179 20 0 EIADMP COc1ccc(Oc2ccc(C[NH2+][C@H]3CC[N@@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000542322937 1042388364 /nfs/dbraw/zinc/38/83/64/1042388364.db2.gz NGRSGYTZFYGJTN-WMZOPIPTSA-N 2 1 340.467 4.060 20 0 EIADMP FC1(F)CCCC[C@@H](C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000491596369 1042478898 /nfs/dbraw/zinc/47/88/98/1042478898.db2.gz JSJDWHPFSVBDDW-GOSISDBHSA-N 2 1 336.470 4.456 20 0 EIADMP CSc1ccc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)s1 ZINC000518451595 1042526840 /nfs/dbraw/zinc/52/68/40/1042526840.db2.gz YDGFAGLZINFRMF-QGZVFWFLSA-N 2 1 346.565 4.424 20 0 EIADMP CSc1ccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)s1 ZINC000518451595 1042526848 /nfs/dbraw/zinc/52/68/48/1042526848.db2.gz YDGFAGLZINFRMF-QGZVFWFLSA-N 2 1 346.565 4.424 20 0 EIADMP CSc1ccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000518451595 1042526853 /nfs/dbraw/zinc/52/68/53/1042526853.db2.gz YDGFAGLZINFRMF-QGZVFWFLSA-N 2 1 346.565 4.424 20 0 EIADMP CSc1ccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000518451595 1042526861 /nfs/dbraw/zinc/52/68/61/1042526861.db2.gz YDGFAGLZINFRMF-QGZVFWFLSA-N 2 1 346.565 4.424 20 0 EIADMP Fc1cccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000518769285 1042683615 /nfs/dbraw/zinc/68/36/15/1042683615.db2.gz KSYPLTKDLPFIPT-OAQYLSRUSA-N 2 1 338.470 4.155 20 0 EIADMP Fc1cccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000518769285 1042683624 /nfs/dbraw/zinc/68/36/24/1042683624.db2.gz KSYPLTKDLPFIPT-OAQYLSRUSA-N 2 1 338.470 4.155 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(Cl)s1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309912989 1042824170 /nfs/dbraw/zinc/82/41/70/1042824170.db2.gz MWGOGHDMVJUKMZ-GOEBONIOSA-N 2 1 334.916 4.402 20 0 EIADMP CCc1ncc(CNC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000310422757 1042836553 /nfs/dbraw/zinc/83/65/53/1042836553.db2.gz QXTJIKRHAYEAQQ-GOSISDBHSA-N 2 1 343.540 4.097 20 0 EIADMP CCc1ncc(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000310422757 1042836556 /nfs/dbraw/zinc/83/65/56/1042836556.db2.gz QXTJIKRHAYEAQQ-GOSISDBHSA-N 2 1 343.540 4.097 20 0 EIADMP CCc1ncc(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000310422757 1042836557 /nfs/dbraw/zinc/83/65/57/1042836557.db2.gz QXTJIKRHAYEAQQ-GOSISDBHSA-N 2 1 343.540 4.097 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]C2CC(OC(C)(C)C)C2)CC1 ZINC000493173024 1042837877 /nfs/dbraw/zinc/83/78/77/1042837877.db2.gz BQTDFUDABBOIFJ-DZIBYMRMSA-N 2 1 330.516 4.148 20 0 EIADMP Cc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC000310522227 1042839582 /nfs/dbraw/zinc/83/95/82/1042839582.db2.gz NVJWGIYVOVMALP-FXAWDEMLSA-N 2 1 326.459 4.134 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000311016328 1042851098 /nfs/dbraw/zinc/85/10/98/1042851098.db2.gz NADWJIPWPYTHFU-HMFYCAOWSA-N 2 1 338.495 4.084 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc2ccccc2n1 ZINC000178099075 1042859014 /nfs/dbraw/zinc/85/90/14/1042859014.db2.gz DXRAEQFAPDHHRN-MSOLQXFVSA-N 2 1 325.500 4.398 20 0 EIADMP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000178253946 1042862068 /nfs/dbraw/zinc/86/20/68/1042862068.db2.gz YEJKRADPEUWOAZ-CQSZACIVSA-N 2 1 338.442 4.121 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2ccccc2n1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311621656 1042863447 /nfs/dbraw/zinc/86/34/47/1042863447.db2.gz HIEGOLHNOFKRLJ-RXVVDRJESA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2ccccc2n1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311621656 1042863448 /nfs/dbraw/zinc/86/34/48/1042863448.db2.gz HIEGOLHNOFKRLJ-RXVVDRJESA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H](C[NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C[NH+](C)C ZINC000391884771 1043069981 /nfs/dbraw/zinc/06/99/81/1043069981.db2.gz PDRKXRJDEXFXNU-SNVBAGLBSA-N 2 1 342.327 4.012 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCCCc2cc(Br)ccc21 ZINC000338775538 1043145817 /nfs/dbraw/zinc/14/58/17/1043145817.db2.gz PWPBJCXGRKDMRL-KRWDZBQOSA-N 2 1 348.288 4.011 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](Cc3ccccc3)C(C)C)CC2)[nH+]1 ZINC000427706532 1043170460 /nfs/dbraw/zinc/17/04/60/1043170460.db2.gz UQVHUONWHKKXKG-OAQYLSRUSA-N 2 1 337.511 4.216 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cc(O)cc(F)c1 ZINC000185468182 1043185981 /nfs/dbraw/zinc/18/59/81/1043185981.db2.gz IIJFCXZSCUSGIP-MRXNPFEDSA-N 2 1 342.458 4.196 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cc(O)cc(F)c1 ZINC000185468182 1043185992 /nfs/dbraw/zinc/18/59/92/1043185992.db2.gz IIJFCXZSCUSGIP-MRXNPFEDSA-N 2 1 342.458 4.196 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCc3nc(C)ncc32)cc1 ZINC000766046660 1043245793 /nfs/dbraw/zinc/24/57/93/1043245793.db2.gz ZKYGAVPZZAUIKX-XOBRGWDASA-N 2 1 347.466 4.007 20 0 EIADMP CCSc1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)ccn1 ZINC000427887056 1043251498 /nfs/dbraw/zinc/25/14/98/1043251498.db2.gz RWZQORHETUEZMO-APWZRJJASA-N 2 1 347.572 4.326 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)CCC3CC3)CC2)cs1 ZINC000186333174 1043271246 /nfs/dbraw/zinc/27/12/46/1043271246.db2.gz ADGDQWIPWHJURI-HNNXBMFYSA-N 2 1 335.561 4.086 20 0 EIADMP COc1cccc(CC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000347873956 1043281095 /nfs/dbraw/zinc/28/10/95/1043281095.db2.gz GELUNLIBSNOSGF-INIZCTEOSA-N 2 1 335.451 4.083 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000508135284 1043288109 /nfs/dbraw/zinc/28/81/09/1043288109.db2.gz DICRAPBCINJDPH-LJQANCHMSA-N 2 1 338.495 4.184 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2cccnc2c1 ZINC000674067646 1043386187 /nfs/dbraw/zinc/38/61/87/1043386187.db2.gz MRFXEFYUGRPDEB-PGRDOPGGSA-N 2 1 345.490 4.235 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2C)c1 ZINC000191267099 1043803880 /nfs/dbraw/zinc/80/38/80/1043803880.db2.gz CTGASTRYSRYJTN-INIZCTEOSA-N 2 1 328.504 4.075 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000442705873 1043812963 /nfs/dbraw/zinc/81/29/63/1043812963.db2.gz CEWCTJQGZHYVAP-UWWQBHOKSA-N 2 1 340.433 4.273 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)CC1 ZINC000731677086 1043815244 /nfs/dbraw/zinc/81/52/44/1043815244.db2.gz HFEITCSEUJRKPG-UHFFFAOYSA-N 2 1 330.516 4.143 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000191548954 1043825751 /nfs/dbraw/zinc/82/57/51/1043825751.db2.gz MDHZUEBSKVIIJX-BBRMVZONSA-N 2 1 328.422 4.055 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CCC(C(F)F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000442783429 1043834773 /nfs/dbraw/zinc/83/47/73/1043834773.db2.gz NCNOBHKSVNXMAD-GWFLUQINSA-N 2 1 336.470 4.453 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CCC(C(F)F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000442783429 1043834776 /nfs/dbraw/zinc/83/47/76/1043834776.db2.gz NCNOBHKSVNXMAD-GWFLUQINSA-N 2 1 336.470 4.453 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442829246 1043859329 /nfs/dbraw/zinc/85/93/29/1043859329.db2.gz UJKWAAVFNUKVRJ-SJLPKXTDSA-N 2 1 338.417 4.193 20 0 EIADMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000442918224 1043890151 /nfs/dbraw/zinc/89/01/51/1043890151.db2.gz CEHOTZQZWDEMIZ-CQSZACIVSA-N 2 1 341.480 4.117 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000674909365 1043932885 /nfs/dbraw/zinc/93/28/85/1043932885.db2.gz LCFSMUQNRCPNDS-LEWJYISDSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000674909365 1043932901 /nfs/dbraw/zinc/93/29/01/1043932901.db2.gz LCFSMUQNRCPNDS-LEWJYISDSA-N 2 1 336.479 4.079 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2cc(Cl)cs2)cc1F ZINC000193044079 1043994199 /nfs/dbraw/zinc/99/41/99/1043994199.db2.gz QWPYCPQXCJFGGQ-UHFFFAOYSA-N 2 1 335.835 4.325 20 0 EIADMP CC(C)C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195132353 1044025446 /nfs/dbraw/zinc/02/54/46/1044025446.db2.gz ADCNEPBONVTYFK-IRLDBZIGSA-N 2 1 337.511 4.281 20 0 EIADMP COC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCCC1 ZINC000193304082 1044037538 /nfs/dbraw/zinc/03/75/38/1044037538.db2.gz JNVFOCBAGAZFCR-SEJPIABJSA-N 2 1 342.527 4.121 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCSc2c(Cl)cccc21 ZINC000358082485 1044156640 /nfs/dbraw/zinc/15/66/40/1044156640.db2.gz NSQHXZQEDKYIQS-LRDDRELGSA-N 2 1 335.904 4.308 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(Br)cs2)C1 ZINC000194027906 1044243578 /nfs/dbraw/zinc/24/35/78/1044243578.db2.gz FBVDPBPAPAFXNI-QWHCGFSZSA-N 2 1 345.350 4.282 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccc(F)cc1 ZINC000174450089 1044273461 /nfs/dbraw/zinc/27/34/61/1044273461.db2.gz RPIYPSPQSNERRV-UHFFFAOYSA-N 2 1 338.426 4.341 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccsc1 ZINC000174450451 1044274425 /nfs/dbraw/zinc/27/44/25/1044274425.db2.gz CCCHVZOVYABMTN-UHFFFAOYSA-N 2 1 326.465 4.263 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CCC([NH+]4CCCCC4)CC3)c2c1 ZINC000443426911 1044281458 /nfs/dbraw/zinc/28/14/58/1044281458.db2.gz FCCGSCGXNRVQEF-UHFFFAOYSA-N 2 1 329.875 4.343 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)C1CCC(F)(F)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000474079413 1044357928 /nfs/dbraw/zinc/35/79/28/1044357928.db2.gz IXISZHDEECMEMO-UXLLHSPISA-N 2 1 328.491 4.443 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)cc1 ZINC000348035235 1044369732 /nfs/dbraw/zinc/36/97/32/1044369732.db2.gz DDJCSKIUEKJMJN-UZLBHIALSA-N 2 1 329.488 4.019 20 0 EIADMP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000542515437 1044394012 /nfs/dbraw/zinc/39/40/12/1044394012.db2.gz YGUPKMUGHAVJQG-IRXDYDNUSA-N 2 1 345.531 4.024 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)C1 ZINC000675728291 1044460023 /nfs/dbraw/zinc/46/00/23/1044460023.db2.gz FVLGTTIIQYEYGU-OXJNMPFZSA-N 2 1 325.500 4.255 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)o1 ZINC000675787065 1044498189 /nfs/dbraw/zinc/49/81/89/1044498189.db2.gz SVTXWRNOXOGXNX-HKUYNNGSSA-N 2 1 326.484 4.405 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)o1 ZINC000675787065 1044498205 /nfs/dbraw/zinc/49/82/05/1044498205.db2.gz SVTXWRNOXOGXNX-HKUYNNGSSA-N 2 1 326.484 4.405 20 0 EIADMP CCOc1ccc([C@H](CC)N[C@@H]2CC[N@H+](CC3CC3)C2)cc1OCC ZINC000675833489 1044520982 /nfs/dbraw/zinc/52/09/82/1044520982.db2.gz KRUMSXBYLNEQSN-MOPGFXCFSA-N 2 1 346.515 4.009 20 0 EIADMP CCOc1ccc([C@H](CC)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc1OCC ZINC000675833489 1044520991 /nfs/dbraw/zinc/52/09/91/1044520991.db2.gz KRUMSXBYLNEQSN-MOPGFXCFSA-N 2 1 346.515 4.009 20 0 EIADMP Cc1cccc(C(=[NH2+])N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168022690 1044532379 /nfs/dbraw/zinc/53/23/79/1044532379.db2.gz AWSYDFILNBJKKO-RMFSNUHRSA-N 2 1 335.495 4.352 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(Cl)cc1 ZINC000675882630 1044551810 /nfs/dbraw/zinc/55/18/10/1044551810.db2.gz SZLQYLMENUDYBA-RBUKOAKNSA-N 2 1 336.907 4.024 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(Cl)s1 ZINC000675880106 1044553255 /nfs/dbraw/zinc/55/32/55/1044553255.db2.gz BFKIJGVEYVYTMH-GJZGRUSLSA-N 2 1 342.936 4.086 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000443640882 1044584912 /nfs/dbraw/zinc/58/49/12/1044584912.db2.gz KEOJQPQJBDWDEW-MRXNPFEDSA-N 2 1 340.433 4.178 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000443640882 1044584930 /nfs/dbraw/zinc/58/49/30/1044584930.db2.gz KEOJQPQJBDWDEW-MRXNPFEDSA-N 2 1 340.433 4.178 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000443640882 1044584948 /nfs/dbraw/zinc/58/49/48/1044584948.db2.gz KEOJQPQJBDWDEW-MRXNPFEDSA-N 2 1 340.433 4.178 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(C(F)(F)F)s2)C1 ZINC000428874630 1044802906 /nfs/dbraw/zinc/80/29/06/1044802906.db2.gz ADXXFIMPOVGKBN-CYBMUJFWSA-N 2 1 334.451 4.369 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000673600442 1044854948 /nfs/dbraw/zinc/85/49/48/1044854948.db2.gz XCQRJQGARZZKLI-SCZPIIQISA-N 2 1 326.406 4.040 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000673600220 1044861676 /nfs/dbraw/zinc/86/16/76/1044861676.db2.gz WPAXHEQWJOTUKX-LNLBINEFSA-N 2 1 338.417 4.325 20 0 EIADMP Clc1cccc2c1C[C@@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001168735393 1044979932 /nfs/dbraw/zinc/97/99/32/1044979932.db2.gz SDIDRTWYDFKIIE-MSOLQXFVSA-N 2 1 332.919 4.148 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCCNc3ccccc32)C1 ZINC000347919702 1045097915 /nfs/dbraw/zinc/09/79/15/1045097915.db2.gz KIPXHLLYKJFQPS-LVCYWYKZSA-N 2 1 329.532 4.281 20 0 EIADMP CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H](C[C@@H]([NH3+])C3CCCC3)C2)co1 ZINC000923421337 1045098696 /nfs/dbraw/zinc/09/86/96/1045098696.db2.gz NBZDUSZAQPDADL-MAUKXSAKSA-N 2 1 333.520 4.092 20 0 EIADMP CC(C)(C)c1nc(C[N@H+]2CCC[C@@H](C[C@@H]([NH3+])C3CCCC3)C2)co1 ZINC000923421337 1045098711 /nfs/dbraw/zinc/09/87/11/1045098711.db2.gz NBZDUSZAQPDADL-MAUKXSAKSA-N 2 1 333.520 4.092 20 0 EIADMP CC[N@H+]1CC[C@H](N[C@@H]2CCOc3c(Cl)c(Cl)ccc32)[C@H](C)C1 ZINC000766259411 1045251193 /nfs/dbraw/zinc/25/11/93/1045251193.db2.gz YLSAAUYOGXAUSR-BYCMXARLSA-N 2 1 343.298 4.137 20 0 EIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000236931130 1045371187 /nfs/dbraw/zinc/37/11/87/1045371187.db2.gz HLJKYZBMIXIPBV-INIZCTEOSA-N 2 1 330.447 4.216 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000236931130 1045371192 /nfs/dbraw/zinc/37/11/92/1045371192.db2.gz HLJKYZBMIXIPBV-INIZCTEOSA-N 2 1 330.447 4.216 20 0 EIADMP Cc1ccc(COc2ccc(C[NH2+]C[C@H]3CCC[N@H+](C)C3)cc2)cc1 ZINC000237185112 1045377224 /nfs/dbraw/zinc/37/72/24/1045377224.db2.gz ZUXVTLSWGBONAT-OAQYLSRUSA-N 2 1 338.495 4.005 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCc1cccs1 ZINC000763079955 1045499424 /nfs/dbraw/zinc/49/94/24/1045499424.db2.gz CTXUXOWMXAWYIR-YRWFTTLQSA-N 2 1 328.525 4.037 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2ccc(C3CC3)cc2)cc1F ZINC000459386170 1045665231 /nfs/dbraw/zinc/66/52/31/1045665231.db2.gz ATFIEGDURURDJL-UHFFFAOYSA-N 2 1 335.426 4.487 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874479 1045668841 /nfs/dbraw/zinc/66/88/41/1045668841.db2.gz FUWBUTWZHJRUHT-AEFFLSMTSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874479 1045668888 /nfs/dbraw/zinc/66/88/88/1045668888.db2.gz FUWBUTWZHJRUHT-AEFFLSMTSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874479 1045668871 /nfs/dbraw/zinc/66/88/71/1045668871.db2.gz FUWBUTWZHJRUHT-AEFFLSMTSA-N 2 1 340.433 4.369 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc2c(c1)CCCO2 ZINC000768101493 1045713798 /nfs/dbraw/zinc/71/37/98/1045713798.db2.gz HISCZRPDWNOOSY-YLJYHZDGSA-N 2 1 330.516 4.173 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCC1CCOCC1 ZINC000398044839 1045826392 /nfs/dbraw/zinc/82/63/92/1045826392.db2.gz VARXDJUVWPCKQY-SIKLNZKXSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCC1CCOCC1 ZINC000398044839 1045826397 /nfs/dbraw/zinc/82/63/97/1045826397.db2.gz VARXDJUVWPCKQY-SIKLNZKXSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1cccc(F)c1 ZINC000398050262 1045826467 /nfs/dbraw/zinc/82/64/67/1045826467.db2.gz XICDCJDPPBXVGM-WWMYMODYSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1cccc(F)c1 ZINC000398050262 1045826469 /nfs/dbraw/zinc/82/64/69/1045826469.db2.gz XICDCJDPPBXVGM-WWMYMODYSA-N 2 1 326.459 4.387 20 0 EIADMP Cc1nc2c(s1)[C@H]([NH2+][C@H](C)[C@H]1CCC[N@H+](C3CCC3)C1)CCC2 ZINC000248392816 1045867716 /nfs/dbraw/zinc/86/77/16/1045867716.db2.gz DHDHOQQKKDMISZ-UKPHBRMFSA-N 2 1 333.545 4.072 20 0 EIADMP C[C@H](CCC1CC1)Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000769419450 1045957044 /nfs/dbraw/zinc/95/70/44/1045957044.db2.gz USRCMSBOYAELRP-QGZVFWFLSA-N 2 1 329.532 4.455 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@H](C)c3cccc(C)c3C)CC2)nc(C)[nH+]1 ZINC000162236836 1046158212 /nfs/dbraw/zinc/15/82/12/1046158212.db2.gz TXPJLANFUUJBAF-QGZVFWFLSA-N 2 1 338.499 4.030 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)C(c1ccccc1)c1ccccc1 ZINC000124379428 1046234778 /nfs/dbraw/zinc/23/47/78/1046234778.db2.gz MFHDJIAQENILBZ-OALUTQOASA-N 2 1 334.507 4.281 20 0 EIADMP C[C@@H](Nc1cccc(C[NH+](C)C)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508688659 1046321883 /nfs/dbraw/zinc/32/18/83/1046321883.db2.gz DLAGTOFQMIXOFR-NQIIRXRSSA-N 2 1 337.511 4.071 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000508695468 1046326413 /nfs/dbraw/zinc/32/64/13/1046326413.db2.gz PWCCCAMCYOWFHY-MHZRJXOASA-N 2 1 342.527 4.187 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000508695468 1046326430 /nfs/dbraw/zinc/32/64/30/1046326430.db2.gz PWCCCAMCYOWFHY-MHZRJXOASA-N 2 1 342.527 4.187 20 0 EIADMP CCc1noc(C)c1CN(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000268119979 1046326826 /nfs/dbraw/zinc/32/68/26/1046326826.db2.gz FRIAGKUGWVWTMP-LPHOPBHVSA-N 2 1 341.499 4.030 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cn1 ZINC000268898976 1046330706 /nfs/dbraw/zinc/33/07/06/1046330706.db2.gz PVIWOGOKFHIMDE-LVCYWYKZSA-N 2 1 340.515 4.025 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cn1 ZINC000268898976 1046330726 /nfs/dbraw/zinc/33/07/26/1046330726.db2.gz PVIWOGOKFHIMDE-LVCYWYKZSA-N 2 1 340.515 4.025 20 0 EIADMP C[C@@H]([NH2+]CCc1cc(F)ccc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710420 1046363621 /nfs/dbraw/zinc/36/36/21/1046363621.db2.gz MXRSPFQFWTUGES-VQIMIIECSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@@H](NC1(c2ccccc2F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508717800 1046375022 /nfs/dbraw/zinc/37/50/22/1046375022.db2.gz IBOBXUSGNOHDRE-MJGOQNOKSA-N 2 1 338.470 4.315 20 0 EIADMP C[C@@H]([NH2+]C1(c2ccccc2F)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508717800 1046375031 /nfs/dbraw/zinc/37/50/31/1046375031.db2.gz IBOBXUSGNOHDRE-MJGOQNOKSA-N 2 1 338.470 4.315 20 0 EIADMP C[C@@H]([NH2+]C1(c2ccccc2F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508717800 1046375045 /nfs/dbraw/zinc/37/50/45/1046375045.db2.gz IBOBXUSGNOHDRE-MJGOQNOKSA-N 2 1 338.470 4.315 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCc2sccc2[C@H]1c1cccs1 ZINC000127275257 1046641584 /nfs/dbraw/zinc/64/15/84/1046641584.db2.gz YSFGRMNFMIKUAY-SFHVURJKSA-N 2 1 343.521 4.352 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCc2sccc2[C@H]1c1cccs1 ZINC000127275257 1046641605 /nfs/dbraw/zinc/64/16/05/1046641605.db2.gz YSFGRMNFMIKUAY-SFHVURJKSA-N 2 1 343.521 4.352 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c3ccccc23)[C@@H](C)C1 ZINC000536682576 1046645863 /nfs/dbraw/zinc/64/58/63/1046645863.db2.gz YTJIHQCDTSXIMP-OXJNMPFZSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OC)c3ccccc23)[C@@H](C)C1 ZINC000536682576 1046645870 /nfs/dbraw/zinc/64/58/70/1046645870.db2.gz YTJIHQCDTSXIMP-OXJNMPFZSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(OC)c3ccccc23)[C@@H](C)C1 ZINC000536682576 1046645879 /nfs/dbraw/zinc/64/58/79/1046645879.db2.gz YTJIHQCDTSXIMP-OXJNMPFZSA-N 2 1 326.484 4.011 20 0 EIADMP CN(CC[C@@H]1CCCC[N@H+]1C)Cc1cnc(-c2ccccc2)s1 ZINC000536677825 1046663635 /nfs/dbraw/zinc/66/36/35/1046663635.db2.gz MDEYLBSEHWWCDG-KRWDZBQOSA-N 2 1 329.513 4.116 20 0 EIADMP c1ccc2c(c1)c1ccccc1n2CC[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000459470235 1046716655 /nfs/dbraw/zinc/71/66/55/1046716655.db2.gz AULJWPWZGWKWJK-UHFFFAOYSA-N 2 1 333.479 4.011 20 0 EIADMP CC[C@H](NCC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000379636729 1046724358 /nfs/dbraw/zinc/72/43/58/1046724358.db2.gz XTBZBTZYCLBUJQ-APWZRJJASA-N 2 1 329.463 4.172 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379641556 1046745331 /nfs/dbraw/zinc/74/53/31/1046745331.db2.gz YKEBXQKZHBLVLA-LVCYWYKZSA-N 2 1 338.495 4.399 20 0 EIADMP CCOc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379656073 1046760241 /nfs/dbraw/zinc/76/02/41/1046760241.db2.gz NXSNMKJTWLSNSY-RXVVDRJESA-N 2 1 338.495 4.228 20 0 EIADMP CCOc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379656073 1046760256 /nfs/dbraw/zinc/76/02/56/1046760256.db2.gz NXSNMKJTWLSNSY-RXVVDRJESA-N 2 1 338.495 4.228 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000536845204 1046817498 /nfs/dbraw/zinc/81/74/98/1046817498.db2.gz KRPJOJPOCREQLT-FPOVZHCZSA-N 2 1 344.543 4.084 20 0 EIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000536860662 1046828710 /nfs/dbraw/zinc/82/87/10/1046828710.db2.gz ZWJDLMMTJZEWTK-SOLBZPMBSA-N 2 1 344.499 4.281 20 0 EIADMP C[C@H](C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000459725126 1046865866 /nfs/dbraw/zinc/86/58/66/1046865866.db2.gz BATFYJPYBJRHIE-CABCVRRESA-N 2 1 328.422 4.130 20 0 EIADMP CC(C)CCC[C@H](C)[NH2+][C@H]1CC[C@H](N2CC[NH+](CC3CC3)CC2)CC1 ZINC001170063873 1046865983 /nfs/dbraw/zinc/86/59/83/1046865983.db2.gz ILTIBLXJFOHICE-BVSLBCMMSA-N 2 1 349.607 4.130 20 0 EIADMP C[NH+]1CCC(C[N@@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)CC1 ZINC000788484616 1047201772 /nfs/dbraw/zinc/20/17/72/1047201772.db2.gz BSFUBRJUAJQWQT-UHFFFAOYSA-N 2 1 335.495 4.055 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CCN(Cc2cc(Cl)nc3ccccc23)C1 ZINC000154707965 1047410186 /nfs/dbraw/zinc/41/01/86/1047410186.db2.gz NJZNJUGBZOFXOO-HNNXBMFYSA-N 2 1 331.891 4.052 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)CCS1 ZINC000897788147 1047482650 /nfs/dbraw/zinc/48/26/50/1047482650.db2.gz CCRSPCXHWVEFCA-YRPNKDGESA-N 2 1 344.568 4.303 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000129953087 1047531206 /nfs/dbraw/zinc/53/12/06/1047531206.db2.gz OKJIQAZSFVZWEA-UHFFFAOYSA-N 2 1 346.478 4.308 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000129953087 1047531225 /nfs/dbraw/zinc/53/12/25/1047531225.db2.gz OKJIQAZSFVZWEA-UHFFFAOYSA-N 2 1 346.478 4.308 20 0 EIADMP CCCNc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556178520 1047539019 /nfs/dbraw/zinc/53/90/19/1047539019.db2.gz JGCOKBKUFLCMCK-FGZHOGPDSA-N 2 1 337.511 4.434 20 0 EIADMP CCCNc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556178520 1047539029 /nfs/dbraw/zinc/53/90/29/1047539029.db2.gz JGCOKBKUFLCMCK-FGZHOGPDSA-N 2 1 337.511 4.434 20 0 EIADMP COC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCC(C)CC1 ZINC000556178735 1047539837 /nfs/dbraw/zinc/53/98/37/1047539837.db2.gz MYQNURRZZDHKRU-ODKCFSPTSA-N 2 1 330.516 4.007 20 0 EIADMP COC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCC(C)CC1 ZINC000556178735 1047539846 /nfs/dbraw/zinc/53/98/46/1047539846.db2.gz MYQNURRZZDHKRU-ODKCFSPTSA-N 2 1 330.516 4.007 20 0 EIADMP FC(F)(F)Sc1ccccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000898281722 1047607952 /nfs/dbraw/zinc/60/79/52/1047607952.db2.gz PCSYIWSHVAUGNL-KGLIPLIRSA-N 2 1 330.419 4.015 20 0 EIADMP FC(F)(F)Sc1ccccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000898281722 1047607988 /nfs/dbraw/zinc/60/79/88/1047607988.db2.gz PCSYIWSHVAUGNL-KGLIPLIRSA-N 2 1 330.419 4.015 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccncc2)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000898321900 1047615717 /nfs/dbraw/zinc/61/57/17/1047615717.db2.gz DVUOAAQTSMSZTB-YHYVQYDKSA-N 2 1 335.495 4.175 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccncc2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000898321900 1047615734 /nfs/dbraw/zinc/61/57/34/1047615734.db2.gz DVUOAAQTSMSZTB-YHYVQYDKSA-N 2 1 335.495 4.175 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000105480440 1047635281 /nfs/dbraw/zinc/63/52/81/1047635281.db2.gz QKXOIJYFANKAIF-KDOFPFPSSA-N 2 1 346.421 4.187 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000105480440 1047635290 /nfs/dbraw/zinc/63/52/90/1047635290.db2.gz QKXOIJYFANKAIF-KDOFPFPSSA-N 2 1 346.421 4.187 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@@H]1C1CCOCC1 ZINC000537511245 1047657464 /nfs/dbraw/zinc/65/74/64/1047657464.db2.gz UOLHJYJGWLCPDN-OAQYLSRUSA-N 2 1 344.543 4.036 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@@H+]1CCC[C@@H]1C1CCOCC1 ZINC000537511245 1047657468 /nfs/dbraw/zinc/65/74/68/1047657468.db2.gz UOLHJYJGWLCPDN-OAQYLSRUSA-N 2 1 344.543 4.036 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000537511245 1047657476 /nfs/dbraw/zinc/65/74/76/1047657476.db2.gz UOLHJYJGWLCPDN-OAQYLSRUSA-N 2 1 344.543 4.036 20 0 EIADMP Cc1ccc([C@@H](O)C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)cc1 ZINC000763432491 1047747103 /nfs/dbraw/zinc/74/71/03/1047747103.db2.gz MBSRKARZGUVNEJ-UGKGYDQZSA-N 2 1 344.543 4.005 20 0 EIADMP COc1ccccc1C[N@@H+]([C@@H]1C[C@@H]2[C@H](C1)C2(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170738476 1047965527 /nfs/dbraw/zinc/96/55/27/1047965527.db2.gz MSDAQQRAEUUGSV-DHUDUYKCSA-N 2 1 342.527 4.202 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+]([C@H]1C[C@@H]3[C@H](C1)C3(C)C)CC2 ZINC001170752069 1048064533 /nfs/dbraw/zinc/06/45/33/1048064533.db2.gz IMINEGUHDLPFIH-GSEOLPGOSA-N 2 1 342.527 4.391 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000556857534 1048075271 /nfs/dbraw/zinc/07/52/71/1048075271.db2.gz CKSDQMAWLNNSAC-NSHGMRRFSA-N 2 1 346.563 4.379 20 0 EIADMP Cc1ccnc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)c1 ZINC000556871319 1048089597 /nfs/dbraw/zinc/08/95/97/1048089597.db2.gz SKXKMESSOVJTLB-LJQANCHMSA-N 2 1 337.511 4.473 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CC[C@H](O)c2ccccc2)CC1)CC(C)C ZINC000808742525 1048099724 /nfs/dbraw/zinc/09/97/24/1048099724.db2.gz BAUGVRMZBPIGFL-QFIPXVFZSA-N 2 1 346.559 4.190 20 0 EIADMP Cc1cncc(C[NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000556884243 1048102777 /nfs/dbraw/zinc/10/27/77/1048102777.db2.gz HNESLWXSUKDJBL-YTFSRNRJSA-N 2 1 349.522 4.170 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000499149846 1048356939 /nfs/dbraw/zinc/35/69/39/1048356939.db2.gz UXTHIQFBKQPVCX-HKUYNNGSSA-N 2 1 341.886 4.226 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000499149846 1048356956 /nfs/dbraw/zinc/35/69/56/1048356956.db2.gz UXTHIQFBKQPVCX-HKUYNNGSSA-N 2 1 341.886 4.226 20 0 EIADMP Oc1cccc2c1CC[C@@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499153573 1048361143 /nfs/dbraw/zinc/36/11/43/1048361143.db2.gz RVFXRCBDDJZJFB-WEMPKCCASA-N 2 1 348.490 4.165 20 0 EIADMP Cc1c(O)cccc1C[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001144116909 1048429254 /nfs/dbraw/zinc/42/92/54/1048429254.db2.gz FHJWRJLATBXARK-UHFFFAOYSA-N 2 1 338.495 4.045 20 0 EIADMP Cc1cc(F)ccc1[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000815559192 1048508572 /nfs/dbraw/zinc/50/85/72/1048508572.db2.gz ZXEPMIFVUBLPQV-GOSISDBHSA-N 2 1 340.486 4.492 20 0 EIADMP Clc1ccc(CNC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000810178462 1048668224 /nfs/dbraw/zinc/66/82/24/1048668224.db2.gz UDBWPLGFQUOWDK-LJQANCHMSA-N 2 1 343.902 4.127 20 0 EIADMP Clc1ccc(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000810178462 1048668231 /nfs/dbraw/zinc/66/82/31/1048668231.db2.gz UDBWPLGFQUOWDK-LJQANCHMSA-N 2 1 343.902 4.127 20 0 EIADMP Clc1ccc(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000810178462 1048668238 /nfs/dbraw/zinc/66/82/38/1048668238.db2.gz UDBWPLGFQUOWDK-LJQANCHMSA-N 2 1 343.902 4.127 20 0 EIADMP c1cc(C2CC2)cc(NCc2ccc(OCC[NH+]3CCCC3)cc2)[nH+]1 ZINC000810175623 1048668867 /nfs/dbraw/zinc/66/88/67/1048668867.db2.gz PKNBBLOWHLQUMP-UHFFFAOYSA-N 2 1 337.467 4.046 20 0 EIADMP c1cc2cccc(C[NH+]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]4C3)c2[nH]1 ZINC001144718330 1048818942 /nfs/dbraw/zinc/81/89/42/1048818942.db2.gz HQZRWDQUAYKAET-UNMCSNQZSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2cccc(C[N@H+]3CC[C@H]4C[NH+](Cc5ccccc5)C[C@@H]4C3)c2[nH]1 ZINC001144718330 1048818944 /nfs/dbraw/zinc/81/89/44/1048818944.db2.gz HQZRWDQUAYKAET-UNMCSNQZSA-N 2 1 345.490 4.122 20 0 EIADMP Cc1nc(-c2cc3c(s2)CC[N@@H+](CCCCCC[NH3+])C3)cs1 ZINC000846222281 1048844640 /nfs/dbraw/zinc/84/46/40/1048844640.db2.gz CPHICHKVUKODSU-UHFFFAOYSA-N 2 1 335.542 4.057 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911487 1049187512 /nfs/dbraw/zinc/18/75/12/1049187512.db2.gz XVGNEPOUFJKNKL-SZMVWBNQSA-N 2 1 332.919 4.322 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C(C)C ZINC000348095193 1049412518 /nfs/dbraw/zinc/41/25/18/1049412518.db2.gz JREUFDBLXRZNML-OXJNMPFZSA-N 2 1 329.488 4.283 20 0 EIADMP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1 ZINC000820836051 1049565840 /nfs/dbraw/zinc/56/58/40/1049565840.db2.gz IZFYUQIMOOCFGF-PGRDOPGGSA-N 2 1 337.511 4.132 20 0 EIADMP CC[N@@H+](CCC[NH+]1CCCCC1)CCc1ccc(C(F)(F)F)cc1 ZINC001171400515 1049621410 /nfs/dbraw/zinc/62/14/10/1049621410.db2.gz XVBLMPZADJYJJI-UHFFFAOYSA-N 2 1 342.449 4.446 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)c1cccc(O)c1 ZINC000716693172 1049701890 /nfs/dbraw/zinc/70/18/90/1049701890.db2.gz OGBURNTVXIMOMX-LGYWMIHWSA-N 2 1 336.479 4.096 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@@H+](C)C[C@@H]1CC[NH+](Cc3ccccc3)C1)C2 ZINC001171573521 1049760059 /nfs/dbraw/zinc/76/00/59/1049760059.db2.gz IYVKHQYLIGSPFI-GMAHTHKFSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH+](C)C[C@@H]1CC[N@H+](Cc3ccccc3)C1)C2 ZINC001171573521 1049760061 /nfs/dbraw/zinc/76/00/61/1049760061.db2.gz IYVKHQYLIGSPFI-GMAHTHKFSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH+](C)C[C@@H]1CC[N@@H+](Cc3ccccc3)C1)C2 ZINC001171573521 1049760065 /nfs/dbraw/zinc/76/00/65/1049760065.db2.gz IYVKHQYLIGSPFI-GMAHTHKFSA-N 2 1 348.534 4.306 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@H](CCO)c2cccc(Cl)c2)CC1(C)C ZINC001171623133 1049768117 /nfs/dbraw/zinc/76/81/17/1049768117.db2.gz LJEJHJZAHQKBLL-QGZVFWFLSA-N 2 1 338.923 4.005 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2ccccc2OC(F)F)CC1(C)C ZINC001171623085 1049768555 /nfs/dbraw/zinc/76/85/55/1049768555.db2.gz JYJKHXJUAGPDKJ-UHFFFAOYSA-N 2 1 326.431 4.029 20 0 EIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@@H](C)CCc2ccc(C)cc2)CC1 ZINC001171672949 1049775358 /nfs/dbraw/zinc/77/53/58/1049775358.db2.gz UWRPQAYPTGHTSG-SFHVURJKSA-N 2 1 337.511 4.259 20 0 EIADMP C[N@@H+](CC[C@@H]1CC1(Cl)Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000822654601 1049781514 /nfs/dbraw/zinc/78/15/14/1049781514.db2.gz NTGAGONNOWMHJP-DLBZAZTESA-N 2 1 341.326 4.024 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171731439 1049786439 /nfs/dbraw/zinc/78/64/39/1049786439.db2.gz BCAYVCOJERKCFZ-SYYKKAFVSA-N 2 1 349.522 4.258 20 0 EIADMP C[NH2+]CCc1cn([C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171760334 1049791492 /nfs/dbraw/zinc/79/14/92/1049791492.db2.gz UDOQZCXTVGNIOX-NQIIRXRSSA-N 2 1 347.506 4.239 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCOc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001171961616 1049824471 /nfs/dbraw/zinc/82/44/71/1049824471.db2.gz ASPAXBUQGQVMHU-HXUWFJFHSA-N 2 1 338.495 4.098 20 0 EIADMP COc1ccc([C@H](C)[NH2+]Cc2occc2C)cc1C[NH+]1CCCCC1 ZINC000813882814 1049830244 /nfs/dbraw/zinc/83/02/44/1049830244.db2.gz LPCZAABIWXELEW-KRWDZBQOSA-N 2 1 342.483 4.433 20 0 EIADMP Fc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000245697643 1049832172 /nfs/dbraw/zinc/83/21/72/1049832172.db2.gz LGIYGHUIYIOZNV-KOUNCHBCSA-N 2 1 338.470 4.153 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccc(N)c1 ZINC001171976942 1049837852 /nfs/dbraw/zinc/83/78/52/1049837852.db2.gz VZUMOZFTTYPJBE-LAUBAEHRSA-N 2 1 337.511 4.363 20 0 EIADMP Fc1cccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000245724103 1049838753 /nfs/dbraw/zinc/83/87/53/1049838753.db2.gz PCXDOLCPOOGIHU-DKUWSORSSA-N 2 1 338.470 4.153 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2CCCc3cnccc32)CC[N@H+]1Cc1ccccc1 ZINC001171980484 1049839475 /nfs/dbraw/zinc/83/94/75/1049839475.db2.gz VNXRCFCSOBXWHF-IRLDBZIGSA-N 2 1 349.522 4.492 20 0 EIADMP CCC[N@H+](C1CCOCC1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985806 1049840219 /nfs/dbraw/zinc/84/02/19/1049840219.db2.gz BVTHSKVYTNVKBI-NRFANRHFSA-N 2 1 344.543 4.321 20 0 EIADMP CCC[N@@H+](C1CCOCC1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985806 1049840221 /nfs/dbraw/zinc/84/02/21/1049840221.db2.gz BVTHSKVYTNVKBI-NRFANRHFSA-N 2 1 344.543 4.321 20 0 EIADMP CCC[NH+](C1CCOCC1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985806 1049840222 /nfs/dbraw/zinc/84/02/22/1049840222.db2.gz BVTHSKVYTNVKBI-NRFANRHFSA-N 2 1 344.543 4.321 20 0 EIADMP CCC[NH+](C1CCOCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985806 1049840226 /nfs/dbraw/zinc/84/02/26/1049840226.db2.gz BVTHSKVYTNVKBI-NRFANRHFSA-N 2 1 344.543 4.321 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CC[C@@H](c3cccnc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171985389 1049840599 /nfs/dbraw/zinc/84/05/99/1049840599.db2.gz WAWRLKIWNLBWIJ-YADHBBJMSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CC[C@@H](c3cccnc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171985389 1049840602 /nfs/dbraw/zinc/84/06/02/1049840602.db2.gz WAWRLKIWNLBWIJ-YADHBBJMSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CC[C@@H](c3cccnc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171985389 1049840604 /nfs/dbraw/zinc/84/06/04/1049840604.db2.gz WAWRLKIWNLBWIJ-YADHBBJMSA-N 2 1 349.522 4.314 20 0 EIADMP CC(C)[N@H+](CCCCCO)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171986809 1049840671 /nfs/dbraw/zinc/84/06/71/1049840671.db2.gz MNRPQPKHQQCBPA-NRFANRHFSA-N 2 1 346.559 4.303 20 0 EIADMP CC(C)[N@@H+](CCCCCO)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171986809 1049840675 /nfs/dbraw/zinc/84/06/75/1049840675.db2.gz MNRPQPKHQQCBPA-NRFANRHFSA-N 2 1 346.559 4.303 20 0 EIADMP CC(C)[NH+](CCCCCO)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171986809 1049840676 /nfs/dbraw/zinc/84/06/76/1049840676.db2.gz MNRPQPKHQQCBPA-NRFANRHFSA-N 2 1 346.559 4.303 20 0 EIADMP CC(C)[NH+](CCCCCO)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171986809 1049840677 /nfs/dbraw/zinc/84/06/77/1049840677.db2.gz MNRPQPKHQQCBPA-NRFANRHFSA-N 2 1 346.559 4.303 20 0 EIADMP CC1(C)C[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CCCO1 ZINC001172075184 1049844948 /nfs/dbraw/zinc/84/49/48/1049844948.db2.gz OLEYCVMRKDQPMX-AERCQKQUSA-N 2 1 342.527 4.073 20 0 EIADMP CC1(C)C[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CCCO1 ZINC001172075184 1049844951 /nfs/dbraw/zinc/84/49/51/1049844951.db2.gz OLEYCVMRKDQPMX-AERCQKQUSA-N 2 1 342.527 4.073 20 0 EIADMP CC1(C)C[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCO1 ZINC001172075184 1049844952 /nfs/dbraw/zinc/84/49/52/1049844952.db2.gz OLEYCVMRKDQPMX-AERCQKQUSA-N 2 1 342.527 4.073 20 0 EIADMP CC1(C)C[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCO1 ZINC001172075184 1049844954 /nfs/dbraw/zinc/84/49/54/1049844954.db2.gz OLEYCVMRKDQPMX-AERCQKQUSA-N 2 1 342.527 4.073 20 0 EIADMP CC[N@H+](Cc1ccncc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172071942 1049845378 /nfs/dbraw/zinc/84/53/78/1049845378.db2.gz AWAAHARGSRCBPF-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP CC[N@@H+](Cc1ccncc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172071942 1049845384 /nfs/dbraw/zinc/84/53/84/1049845384.db2.gz AWAAHARGSRCBPF-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP CC[NH+](Cc1ccncc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172071942 1049845386 /nfs/dbraw/zinc/84/53/86/1049845386.db2.gz AWAAHARGSRCBPF-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP CC[NH+](Cc1ccncc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172071942 1049845389 /nfs/dbraw/zinc/84/53/89/1049845389.db2.gz AWAAHARGSRCBPF-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP CC(C)N([C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C[NH3+] ZINC001172079172 1049846489 /nfs/dbraw/zinc/84/64/89/1049846489.db2.gz MPWZEBRRXDPQCZ-WKCHPHFGSA-N 2 1 343.559 4.020 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CC(c4cccnc4)C2)C3)cc1 ZINC001172084536 1049847976 /nfs/dbraw/zinc/84/79/76/1049847976.db2.gz YMFFQKQELOIIHH-NUNAXRQHSA-N 2 1 347.506 4.067 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CC(c4cccnc4)C2)C3)cc1 ZINC001172084536 1049847978 /nfs/dbraw/zinc/84/79/78/1049847978.db2.gz YMFFQKQELOIIHH-NUNAXRQHSA-N 2 1 347.506 4.067 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCO1 ZINC001172063205 1049849988 /nfs/dbraw/zinc/84/99/88/1049849988.db2.gz ABXKNBSNWPNGOL-NCYKPQTJSA-N 2 1 342.527 4.119 20 0 EIADMP Cc1ccc(CN[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)nc1 ZINC001172061905 1049850013 /nfs/dbraw/zinc/85/00/13/1049850013.db2.gz JQEWVUBPLRKFMO-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)nc1 ZINC001172061905 1049850016 /nfs/dbraw/zinc/85/00/16/1049850016.db2.gz JQEWVUBPLRKFMO-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)nc1 ZINC001172061905 1049850017 /nfs/dbraw/zinc/85/00/17/1049850017.db2.gz JQEWVUBPLRKFMO-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccn1)C1CCCCC1)C2 ZINC001172128075 1049853037 /nfs/dbraw/zinc/85/30/37/1049853037.db2.gz NYOIHDNAMMORKP-AERCQKQUSA-N 2 1 327.516 4.232 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccn1)C1CCCCC1)C2 ZINC001172128075 1049853038 /nfs/dbraw/zinc/85/30/38/1049853038.db2.gz NYOIHDNAMMORKP-AERCQKQUSA-N 2 1 327.516 4.232 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+](Cc1ccccn1)C1CCCCC1)C2 ZINC001172128075 1049853040 /nfs/dbraw/zinc/85/30/40/1049853040.db2.gz NYOIHDNAMMORKP-AERCQKQUSA-N 2 1 327.516 4.232 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+](Cc1ccccn1)C1CCCCC1)C2 ZINC001172128075 1049853042 /nfs/dbraw/zinc/85/30/42/1049853042.db2.gz NYOIHDNAMMORKP-AERCQKQUSA-N 2 1 327.516 4.232 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccnc1 ZINC001172069619 1049853487 /nfs/dbraw/zinc/85/34/87/1049853487.db2.gz VTHZOJRCJNEBRA-MVWVFHAYSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccnc1 ZINC001172069619 1049853489 /nfs/dbraw/zinc/85/34/89/1049853489.db2.gz VTHZOJRCJNEBRA-MVWVFHAYSA-N 2 1 335.495 4.318 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](N[C@H](c1ccccc1)[C@H]([NH3+])c1ccccc1)C2 ZINC001172101590 1049855522 /nfs/dbraw/zinc/85/55/22/1049855522.db2.gz ZQJMJDQJRVPUSB-XNBWIAOKSA-N 2 1 349.522 4.033 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3cccc(C(F)(F)F)c3)CC1)C2 ZINC001172104344 1049856491 /nfs/dbraw/zinc/85/64/91/1049856491.db2.gz BQQSODGMLYYGOP-BJWYYQGGSA-N 2 1 338.417 4.299 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3cccc(C(F)(F)F)c3)CC1)C2 ZINC001172104344 1049856493 /nfs/dbraw/zinc/85/64/93/1049856493.db2.gz BQQSODGMLYYGOP-BJWYYQGGSA-N 2 1 338.417 4.299 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccc1)Cc1ccccn1)C2 ZINC001172120826 1049858218 /nfs/dbraw/zinc/85/82/18/1049858218.db2.gz NGSSBJUJXLETQF-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccc1)Cc1ccccn1)C2 ZINC001172120826 1049858223 /nfs/dbraw/zinc/85/82/23/1049858223.db2.gz NGSSBJUJXLETQF-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+](Cc1ccccc1)Cc1ccccn1)C2 ZINC001172120826 1049858224 /nfs/dbraw/zinc/85/82/24/1049858224.db2.gz NGSSBJUJXLETQF-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+](Cc1ccccc1)Cc1ccccn1)C2 ZINC001172120826 1049858225 /nfs/dbraw/zinc/85/82/25/1049858225.db2.gz NGSSBJUJXLETQF-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](n1cc(C(C)(C)C[NH3+])c3ccccc31)C2 ZINC001172114063 1049859068 /nfs/dbraw/zinc/85/90/68/1049859068.db2.gz LSIOAIAKBMDSFN-BJWYYQGGSA-N 2 1 325.500 4.065 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccnc(Cl)c2F)cc1 ZINC000823602896 1049862422 /nfs/dbraw/zinc/86/24/22/1049862422.db2.gz VFXCXMWKHIAQCG-UHFFFAOYSA-N 2 1 335.854 4.006 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C[C@@H]1C ZINC001172379934 1049885854 /nfs/dbraw/zinc/88/58/54/1049885854.db2.gz UJZIVSXLMXZTKI-HBFSDRIKSA-N 2 1 330.516 4.392 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001172339794 1049888658 /nfs/dbraw/zinc/88/86/58/1049888658.db2.gz QQODUWZMEHHNIH-RBUKOAKNSA-N 2 1 348.531 4.161 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172355841 1049894139 /nfs/dbraw/zinc/89/41/39/1049894139.db2.gz WQAJDXWGMKZMFR-UXHICEINSA-N 2 1 346.559 4.424 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001172446145 1049914840 /nfs/dbraw/zinc/91/48/40/1049914840.db2.gz ISHMXWZCLOJJIJ-ICSRJNTNSA-N 2 1 348.531 4.160 20 0 EIADMP CC(C)OCC[C@@H](C)[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172453240 1049915906 /nfs/dbraw/zinc/91/59/06/1049915906.db2.gz FRPUHDBNGXOMTI-IFMALSPDSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@@H](C)[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172453240 1049915909 /nfs/dbraw/zinc/91/59/09/1049915909.db2.gz FRPUHDBNGXOMTI-IFMALSPDSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@@H](C)[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172453240 1049915914 /nfs/dbraw/zinc/91/59/14/1049915914.db2.gz FRPUHDBNGXOMTI-IFMALSPDSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172456909 1049916104 /nfs/dbraw/zinc/91/61/04/1049916104.db2.gz JLWADPOVWBJSBC-IRFCIJBXSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172456909 1049916109 /nfs/dbraw/zinc/91/61/09/1049916109.db2.gz JLWADPOVWBJSBC-IRFCIJBXSA-N 2 1 332.532 4.080 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@@H](C)C1 ZINC000246263812 1049942332 /nfs/dbraw/zinc/94/23/32/1049942332.db2.gz AADPSAOILARXLX-RDJZCZTQSA-N 2 1 335.561 4.053 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC001172546725 1049946530 /nfs/dbraw/zinc/94/65/30/1049946530.db2.gz PHGFMRLCTISBTC-MDNUFGMLSA-N 2 1 334.507 4.434 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172721647 1049964542 /nfs/dbraw/zinc/96/45/42/1049964542.db2.gz IIPPCFCULXSBKH-XUVXKRRUSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172721647 1049964543 /nfs/dbraw/zinc/96/45/43/1049964543.db2.gz IIPPCFCULXSBKH-XUVXKRRUSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172721647 1049964546 /nfs/dbraw/zinc/96/45/46/1049964546.db2.gz IIPPCFCULXSBKH-XUVXKRRUSA-N 2 1 332.919 4.146 20 0 EIADMP Cc1ccc[nH+]c1N1CCC([NH2+]C2CCC3(CCCC3)CC2)CC1 ZINC001172724711 1049966005 /nfs/dbraw/zinc/96/60/05/1049966005.db2.gz XZDIIYUBMBDSFJ-UHFFFAOYSA-N 2 1 327.516 4.451 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@@H]2Cc3ccc(Cl)cc3C2)CC1 ZINC001172713689 1049972023 /nfs/dbraw/zinc/97/20/23/1049972023.db2.gz YAEREEJUGRGTMV-MISYRCLQSA-N 2 1 332.919 4.322 20 0 EIADMP CC1(C)CC([NH2+]Cc2cnc(-c3cccs3)s2)CC(C)(C)[NH2+]1 ZINC000083447574 1049981249 /nfs/dbraw/zinc/98/12/49/1049981249.db2.gz ABXCOGVYBJRMNG-UHFFFAOYSA-N 2 1 335.542 4.270 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)[C@H](C)c2nc3ccccc3s2)C1 ZINC000247000630 1050009217 /nfs/dbraw/zinc/00/92/17/1050009217.db2.gz KRQPFRGJNKNSJB-HRCADAONSA-N 2 1 331.529 4.110 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000247060769 1050012030 /nfs/dbraw/zinc/01/20/30/1050012030.db2.gz NUFZEZZDBLTINP-RDJZCZTQSA-N 2 1 341.524 4.119 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cnc2ccsc2c1 ZINC000247177739 1050016655 /nfs/dbraw/zinc/01/66/55/1050016655.db2.gz VBHCNGHWZKVUEC-HZPDHXFCSA-N 2 1 331.529 4.459 20 0 EIADMP Cc1c([C@H](C)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cnn1C(C)C ZINC000248716671 1050074583 /nfs/dbraw/zinc/07/45/83/1050074583.db2.gz RPPYYGBKOWFJBI-RYRKJORJSA-N 2 1 332.536 4.076 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cnn1C(C)C ZINC000248716671 1050074587 /nfs/dbraw/zinc/07/45/87/1050074587.db2.gz RPPYYGBKOWFJBI-RYRKJORJSA-N 2 1 332.536 4.076 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cnn1C(C)C ZINC000248716671 1050074590 /nfs/dbraw/zinc/07/45/90/1050074590.db2.gz RPPYYGBKOWFJBI-RYRKJORJSA-N 2 1 332.536 4.076 20 0 EIADMP Cc1c([C@H](C)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cnn1C(C)C ZINC000248716665 1050074680 /nfs/dbraw/zinc/07/46/80/1050074680.db2.gz RPPYYGBKOWFJBI-BQFCYCMXSA-N 2 1 332.536 4.076 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cnn1C(C)C ZINC000248716665 1050074686 /nfs/dbraw/zinc/07/46/86/1050074686.db2.gz RPPYYGBKOWFJBI-BQFCYCMXSA-N 2 1 332.536 4.076 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cnn1C(C)C ZINC000248716665 1050074689 /nfs/dbraw/zinc/07/46/89/1050074689.db2.gz RPPYYGBKOWFJBI-BQFCYCMXSA-N 2 1 332.536 4.076 20 0 EIADMP FC(F)(F)C1CCC(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000248762413 1050078060 /nfs/dbraw/zinc/07/80/60/1050078060.db2.gz WIUANNIINMIKRO-VLWBHCEFSA-N 2 1 344.465 4.304 20 0 EIADMP FC(F)(F)C1CCC(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000248762413 1050078066 /nfs/dbraw/zinc/07/80/66/1050078066.db2.gz WIUANNIINMIKRO-VLWBHCEFSA-N 2 1 344.465 4.304 20 0 EIADMP FC(F)(F)C1CCC(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000248762413 1050078072 /nfs/dbraw/zinc/07/80/72/1050078072.db2.gz WIUANNIINMIKRO-VLWBHCEFSA-N 2 1 344.465 4.304 20 0 EIADMP Cc1cccc(NC[C@@H]2CC[N@H+](C[C@H]3CCC4(CCCCC4)O3)C2)[nH+]1 ZINC000248825140 1050079757 /nfs/dbraw/zinc/07/97/57/1050079757.db2.gz KFZDXKRMGIGMTG-RBUKOAKNSA-N 2 1 343.515 4.006 20 0 EIADMP Cc1cccc(NC[C@@H]2CC[N@@H+](C[C@H]3CCC4(CCCCC4)O3)C2)[nH+]1 ZINC000248825140 1050079766 /nfs/dbraw/zinc/07/97/66/1050079766.db2.gz KFZDXKRMGIGMTG-RBUKOAKNSA-N 2 1 343.515 4.006 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@H]3CCCc4occc43)C2)c1 ZINC000248831301 1050079871 /nfs/dbraw/zinc/07/98/71/1050079871.db2.gz HLDHEGANXGXYTB-QAPCUYQASA-N 2 1 330.497 4.220 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CCCc4occc43)C2)c1 ZINC000248831301 1050079874 /nfs/dbraw/zinc/07/98/74/1050079874.db2.gz HLDHEGANXGXYTB-QAPCUYQASA-N 2 1 330.497 4.220 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCCNc2ccccc2)C3)cc1 ZINC000248997056 1050087206 /nfs/dbraw/zinc/08/72/06/1050087206.db2.gz PGWYTTYZMSJKKF-WBDAEOGXSA-N 2 1 349.522 4.274 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)C1CCSCC1 ZINC000249958596 1050109119 /nfs/dbraw/zinc/10/91/19/1050109119.db2.gz JLHCBNXBLPTMCE-QILLFSRXSA-N 2 1 338.586 4.252 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)C1CCSCC1 ZINC000249958596 1050109121 /nfs/dbraw/zinc/10/91/21/1050109121.db2.gz JLHCBNXBLPTMCE-QILLFSRXSA-N 2 1 338.586 4.252 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828184 1050165718 /nfs/dbraw/zinc/16/57/18/1050165718.db2.gz JGOCMNSVYYYDSQ-PMVMPFDFSA-N 2 1 349.522 4.019 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)[C@@H](C)C1)CC2 ZINC001172825365 1050166191 /nfs/dbraw/zinc/16/61/91/1050166191.db2.gz GLUVZEQILGDFHR-WUMKDDEVSA-N 2 1 348.534 4.495 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)[C@@H](C)C1)CC2 ZINC001172825365 1050166199 /nfs/dbraw/zinc/16/61/99/1050166199.db2.gz GLUVZEQILGDFHR-WUMKDDEVSA-N 2 1 348.534 4.495 20 0 EIADMP Cc1cc(Cl)cc(C)c1C[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC001177244847 1050173840 /nfs/dbraw/zinc/17/38/40/1050173840.db2.gz IEKXCPPXCSAAJR-UHFFFAOYSA-N 2 1 342.914 4.495 20 0 EIADMP Cc1cc(Cl)cc(C)c1C[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC001177244847 1050173850 /nfs/dbraw/zinc/17/38/50/1050173850.db2.gz IEKXCPPXCSAAJR-UHFFFAOYSA-N 2 1 342.914 4.495 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cccnc1Cl ZINC001177256657 1050174857 /nfs/dbraw/zinc/17/48/57/1050174857.db2.gz LCNCAWMUYCEION-MRXNPFEDSA-N 2 1 343.902 4.399 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cccnc1Cl ZINC001177256657 1050174865 /nfs/dbraw/zinc/17/48/65/1050174865.db2.gz LCNCAWMUYCEION-MRXNPFEDSA-N 2 1 343.902 4.399 20 0 EIADMP CCC1(C[NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)CCOCC1 ZINC001177257639 1050174903 /nfs/dbraw/zinc/17/49/03/1050174903.db2.gz XRVARCNPUAFOJQ-IBGZPJMESA-N 2 1 344.543 4.215 20 0 EIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccc(F)cc2Cl)[C@H](C)C1 ZINC001172864989 1050175047 /nfs/dbraw/zinc/17/50/47/1050175047.db2.gz JFLZOMWEYHLLBZ-HBUWYVDXSA-N 2 1 326.887 4.119 20 0 EIADMP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC001177256391 1050175671 /nfs/dbraw/zinc/17/56/71/1050175671.db2.gz DYPAKMVNKXKTPW-YUXAGFNASA-N 2 1 344.543 4.356 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CC2(CCCC2)Oc2ccccc21 ZINC000090461152 1050179350 /nfs/dbraw/zinc/17/93/50/1050179350.db2.gz NYCFYHUGMNNSSP-ZAWLATJESA-N 2 1 328.500 4.141 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@H]3CC[N@@H+]4CCCC[C@H]34)cc2)c1 ZINC001177303099 1050180093 /nfs/dbraw/zinc/18/00/93/1050180093.db2.gz CARGDNOLROFULN-LEWJYISDSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@H]3CC[N@H+]4CCCC[C@H]34)cc2)c1 ZINC001177303099 1050180101 /nfs/dbraw/zinc/18/01/01/1050180101.db2.gz CARGDNOLROFULN-LEWJYISDSA-N 2 1 340.442 4.334 20 0 EIADMP CCC[C@@H](C[NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)c1ccccc1 ZINC001177363699 1050203079 /nfs/dbraw/zinc/20/30/79/1050203079.db2.gz ZFXFBIPISXCWLS-FQEVSTJZSA-N 2 1 334.467 4.249 20 0 EIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cccc(Cl)c2Br)CC1 ZINC001206303141 1050217085 /nfs/dbraw/zinc/21/70/85/1050217085.db2.gz BQKGNFJEPUPLAJ-HNNXBMFYSA-N 2 1 345.712 4.053 20 0 EIADMP C[C@@H](CSc1ccc(Cl)cc1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC001172879496 1050219280 /nfs/dbraw/zinc/21/92/80/1050219280.db2.gz NVXATUXQJVMKDJ-AWEZNQCLSA-N 2 1 326.937 4.094 20 0 EIADMP C[C@@H]1CCC[C@@](C[NH2+]C2CCC3(COC(C)(C)C3)CC2)([NH+](C)C)C1 ZINC001177441402 1050220636 /nfs/dbraw/zinc/22/06/36/1050220636.db2.gz ALTXUIWVQFKMDQ-AXIYNFMDSA-N 2 1 336.564 4.214 20 0 EIADMP CO[C@@H]1CCC[C@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001172922261 1050235900 /nfs/dbraw/zinc/23/59/00/1050235900.db2.gz GMXLSBDRIXULET-AIKVAWSJSA-N 2 1 342.527 4.072 20 0 EIADMP C[N@@H+](Cc1ccccc1C[NH2+]C[C@@H]1CCC=CO1)C1CCCCC1 ZINC000774975075 1050243846 /nfs/dbraw/zinc/24/38/46/1050243846.db2.gz AHBRVAGVNYROEU-NRFANRHFSA-N 2 1 328.500 4.233 20 0 EIADMP Cc1cc(Br)cc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1 ZINC000774977438 1050246656 /nfs/dbraw/zinc/24/66/56/1050246656.db2.gz QCUKNADJEKFSAO-UHFFFAOYSA-N 2 1 339.321 4.110 20 0 EIADMP COc1ccccc1[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000091284475 1050248512 /nfs/dbraw/zinc/24/85/12/1050248512.db2.gz BSYNNMADZKSCCJ-IIBYNOLFSA-N 2 1 328.500 4.000 20 0 EIADMP CCC(CC)[N@H+](C1CCC2(CCOCC2)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173043680 1050271279 /nfs/dbraw/zinc/27/12/79/1050271279.db2.gz GCKVYZGJEOXFAE-UAPYVXQJSA-N 2 1 336.564 4.486 20 0 EIADMP CCC1(CC)CCC([NH2+]CC2([NH+]3CCCCC3)CCOCC2)CC1 ZINC001177718912 1050286115 /nfs/dbraw/zinc/28/61/15/1050286115.db2.gz NWTRANBIWPLIMF-UHFFFAOYSA-N 2 1 336.564 4.360 20 0 EIADMP CCCOC1CCC([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001173095684 1050286838 /nfs/dbraw/zinc/28/68/38/1050286838.db2.gz DWAYZVOCRXRNGW-UHFFFAOYSA-N 2 1 344.543 4.369 20 0 EIADMP CCCC[N@H+]1CCCC[C@@H]1CNC1CC[NH+](C2CCCCC2)CC1 ZINC001177744129 1050291243 /nfs/dbraw/zinc/29/12/43/1050291243.db2.gz RSXMYEQMKFCAPP-OAQYLSRUSA-N 2 1 335.580 4.028 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](C)[C@@H](C)Cc2ccccc2OC)CC1 ZINC001173113311 1050309699 /nfs/dbraw/zinc/30/96/99/1050309699.db2.gz MZBUNHBKDJKSFE-KKXNLOMOSA-N 2 1 332.532 4.211 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@@H](c3cccc(OC)c3)C2)CC1 ZINC001173113106 1050309796 /nfs/dbraw/zinc/30/97/96/1050309796.db2.gz HEZOERYGOTWEBE-XEVCZEQESA-N 2 1 330.516 4.138 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H]2c2cccc(OC)c2)CC1 ZINC001173114315 1050309898 /nfs/dbraw/zinc/30/98/98/1050309898.db2.gz GEELUYRMOCCQSE-GZNCHQMQSA-N 2 1 330.516 4.485 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1F ZINC001177919734 1050329798 /nfs/dbraw/zinc/32/97/98/1050329798.db2.gz PHBBNQCMXZDDBH-DNVCBOLYSA-N 2 1 348.487 4.069 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ccc1F ZINC001177919734 1050329833 /nfs/dbraw/zinc/32/98/33/1050329833.db2.gz PHBBNQCMXZDDBH-DNVCBOLYSA-N 2 1 348.487 4.069 20 0 EIADMP Fc1ccccc1C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001178285384 1050428725 /nfs/dbraw/zinc/42/87/25/1050428725.db2.gz QAXIYOGTYUTDBU-RZUBCFFCSA-N 2 1 338.470 4.216 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC001178284842 1050429419 /nfs/dbraw/zinc/42/94/19/1050429419.db2.gz CTZVDLJPZFNAEF-XPWALMASSA-N 2 1 334.507 4.385 20 0 EIADMP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173343036 1050432224 /nfs/dbraw/zinc/43/22/24/1050432224.db2.gz GKYKFAJMGBBABW-SFTDATJTSA-N 2 1 348.575 4.455 20 0 EIADMP C[NH+](C)CC1(C[NH2+]Cc2ccccc2OC2CCCC2)CCCC1 ZINC001178448939 1050461795 /nfs/dbraw/zinc/46/17/95/1050461795.db2.gz FEOZXPJPWZMHMO-UHFFFAOYSA-N 2 1 330.516 4.220 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1CCC[N@@H+](C)CC1 ZINC001173541795 1050475702 /nfs/dbraw/zinc/47/57/02/1050475702.db2.gz DAOQWMZFJIOVAQ-DZGCQCFKSA-N 2 1 329.315 4.388 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1C[C@H]2CC[N@@H+](C1)[C@H]2C ZINC001173545881 1050477187 /nfs/dbraw/zinc/47/71/87/1050477187.db2.gz BNYALNXTLBIJLA-OCVGTWLNSA-N 2 1 341.326 4.387 20 0 EIADMP CC[C@H]1CCC[C@H]1C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001178748940 1050541634 /nfs/dbraw/zinc/54/16/34/1050541634.db2.gz XLBDKKXEAVXVIK-OALUTQOASA-N 2 1 332.507 4.249 20 0 EIADMP COCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCCCC1 ZINC001178868246 1050575734 /nfs/dbraw/zinc/57/57/34/1050575734.db2.gz QBSWRXNTCXRYEI-PZJWPPBQSA-N 2 1 344.543 4.226 20 0 EIADMP COCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCCCC1 ZINC001178868246 1050575748 /nfs/dbraw/zinc/57/57/48/1050575748.db2.gz QBSWRXNTCXRYEI-PZJWPPBQSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001179024654 1050603927 /nfs/dbraw/zinc/60/39/27/1050603927.db2.gz OAXCISMVKFWALT-OUFMZXHOSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001179024654 1050603931 /nfs/dbraw/zinc/60/39/31/1050603931.db2.gz OAXCISMVKFWALT-OUFMZXHOSA-N 2 1 334.507 4.433 20 0 EIADMP Cc1cc(C[NH2+][C@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)cc(C)n1 ZINC001179771692 1050768483 /nfs/dbraw/zinc/76/84/83/1050768483.db2.gz LAWFQMQHBCCFBL-VJBWXMMDSA-N 2 1 349.522 4.089 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc3ccnc(Cl)c3s2)C[C@H]1C ZINC001179899199 1050807238 /nfs/dbraw/zinc/80/72/38/1050807238.db2.gz ZIUJLKSTQUOODP-TZMCWYRMSA-N 2 1 337.920 4.254 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3ccnc(Cl)c3s2)C[C@H]1C ZINC001179899199 1050807241 /nfs/dbraw/zinc/80/72/41/1050807241.db2.gz ZIUJLKSTQUOODP-TZMCWYRMSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc3ccnc(Cl)c3s2)C[C@H]1C ZINC001179899199 1050807246 /nfs/dbraw/zinc/80/72/46/1050807246.db2.gz ZIUJLKSTQUOODP-TZMCWYRMSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc3ccnc(Cl)c3s2)C[C@H]1C ZINC001179899199 1050807256 /nfs/dbraw/zinc/80/72/56/1050807256.db2.gz ZIUJLKSTQUOODP-TZMCWYRMSA-N 2 1 337.920 4.254 20 0 EIADMP CC[N@@H+](CC1CC[NH+](C)CC1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC001179937047 1050823133 /nfs/dbraw/zinc/82/31/33/1050823133.db2.gz JGIQFKGGGJWZKU-AWEZNQCLSA-N 2 1 328.422 4.430 20 0 EIADMP CC[N@@H+](CC1CC[NH+](C)CC1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC001179937049 1050823718 /nfs/dbraw/zinc/82/37/18/1050823718.db2.gz JGIQFKGGGJWZKU-CQSZACIVSA-N 2 1 328.422 4.430 20 0 EIADMP Oc1cc(Cl)cc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC001180123462 1050892181 /nfs/dbraw/zinc/89/21/81/1050892181.db2.gz ANKAASDGUQOBTR-UHFFFAOYSA-N 2 1 336.907 4.134 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)C1 ZINC000619772504 1050908211 /nfs/dbraw/zinc/90/82/11/1050908211.db2.gz JGHQESKZPMLGOC-HXUWFJFHSA-N 2 1 337.511 4.276 20 0 EIADMP Cc1cc(F)ncc1C[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC001180225921 1050920398 /nfs/dbraw/zinc/92/03/98/1050920398.db2.gz XCGUDBPIQJLAAH-QGZVFWFLSA-N 2 1 333.495 4.006 20 0 EIADMP CC[N@@H+](Cc1ccc(OCCC[NH+](C)C)cc1)Cc1ccccc1F ZINC001204269944 1051005237 /nfs/dbraw/zinc/00/52/37/1051005237.db2.gz MGNLWLONFAPDGV-UHFFFAOYSA-N 2 1 344.474 4.178 20 0 EIADMP C[C@H](CCC1CCCCC1)[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC001180802465 1051087404 /nfs/dbraw/zinc/08/74/04/1051087404.db2.gz QWLFDKWMGRIRJH-GCJKJVERSA-N 2 1 344.543 4.092 20 0 EIADMP C[C@@H]([NH2+]C1(C[NH2+][C@@H](C)C2CCOCC2)CCCC1)c1ccccc1 ZINC000153859519 1051239197 /nfs/dbraw/zinc/23/91/97/1051239197.db2.gz UUVXUARTHPRJJI-ZWKOTPCHSA-N 2 1 330.516 4.055 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CC3([C@H]4CCCCO4)CCC3)C2)CC1 ZINC001190651126 1051244773 /nfs/dbraw/zinc/24/47/73/1051244773.db2.gz JFEXTMCRUHUJDX-NHCUHLMSSA-N 2 1 348.575 4.170 20 0 EIADMP COc1ccccc1CCC[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC001190652078 1051245386 /nfs/dbraw/zinc/24/53/86/1051245386.db2.gz VPDOHUCAEBVNTD-FQEVSTJZSA-N 2 1 344.543 4.072 20 0 EIADMP CC(C)(C[N@H+]1CCC[C@](F)(C[NH3+])CC1)Sc1ccc(Cl)cc1 ZINC001205537937 1051254869 /nfs/dbraw/zinc/25/48/69/1051254869.db2.gz KQUIWSUSUAXUHU-QGZVFWFLSA-N 2 1 344.927 4.364 20 0 EIADMP C[C@@H](O)C[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CCCCC1 ZINC001190855563 1051292800 /nfs/dbraw/zinc/29/28/00/1051292800.db2.gz SYKMPHFJZNERDW-LJQANCHMSA-N 2 1 344.543 4.188 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1cncs1 ZINC000268835724 1051395754 /nfs/dbraw/zinc/39/57/54/1051395754.db2.gz SFOQRWXVGBYLHK-JKSUJKDBSA-N 2 1 329.513 4.368 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cc2cc(Br)ccc2o1 ZINC000271902765 1051556053 /nfs/dbraw/zinc/55/60/53/1051556053.db2.gz VXQQSJNMBHSFGL-GFCCVEGCSA-N 2 1 349.272 4.108 20 0 EIADMP c1ccc(C[N@@H+]2CC=C(Nc3ccc(C[NH+]4CCCC4)cc3)CC2)cc1 ZINC001175506401 1051638333 /nfs/dbraw/zinc/63/83/33/1051638333.db2.gz XPZHFOLJAQHQSB-UHFFFAOYSA-N 2 1 347.506 4.484 20 0 EIADMP Clc1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c2ncccc12 ZINC000157444599 1051638551 /nfs/dbraw/zinc/63/85/51/1051638551.db2.gz OFWWYHUOCGYYAM-QGZVFWFLSA-N 2 1 343.902 4.339 20 0 EIADMP Clc1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c2ncccc12 ZINC000157444599 1051638556 /nfs/dbraw/zinc/63/85/56/1051638556.db2.gz OFWWYHUOCGYYAM-QGZVFWFLSA-N 2 1 343.902 4.339 20 0 EIADMP CCc1nc2c(s1)[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CCC2 ZINC000157534971 1051648603 /nfs/dbraw/zinc/64/86/03/1051648603.db2.gz REBMUDXRWFHDSH-KRWDZBQOSA-N 2 1 347.572 4.470 20 0 EIADMP CC(C)C[N@H+](Cc1cc(Cl)nc(Cl)c1)CC1CC[NH+](C)CC1 ZINC001175601951 1051667391 /nfs/dbraw/zinc/66/73/91/1051667391.db2.gz ZHOZPYJWRZGZLW-UHFFFAOYSA-N 2 1 344.330 4.188 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000158103816 1051712298 /nfs/dbraw/zinc/71/22/98/1051712298.db2.gz VWGONZGOKZVIMA-UONOGXRCSA-N 2 1 346.462 4.333 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000158103947 1051712392 /nfs/dbraw/zinc/71/23/92/1051712392.db2.gz VWGONZGOKZVIMA-ZIAGYGMSSA-N 2 1 346.462 4.333 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158196608 1051724076 /nfs/dbraw/zinc/72/40/76/1051724076.db2.gz GRRPLLLPXRNGFU-MAUKXSAKSA-N 2 1 343.540 4.035 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000158196608 1051724091 /nfs/dbraw/zinc/72/40/91/1051724091.db2.gz GRRPLLLPXRNGFU-MAUKXSAKSA-N 2 1 343.540 4.035 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158218917 1051728467 /nfs/dbraw/zinc/72/84/67/1051728467.db2.gz GATLDIWAESYHMD-GOEBONIOSA-N 2 1 329.513 4.111 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000158218917 1051728478 /nfs/dbraw/zinc/72/84/78/1051728478.db2.gz GATLDIWAESYHMD-GOEBONIOSA-N 2 1 329.513 4.111 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CCc2ncc(C)cc2C)CC1)CC1CC1 ZINC001192501285 1051748807 /nfs/dbraw/zinc/74/88/07/1051748807.db2.gz MHSJRADLGUCHEJ-UHFFFAOYSA-N 2 1 343.559 4.075 20 0 EIADMP C[C@H]1CC[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)CC[C@@H]1C[NH3+] ZINC001205602229 1051757082 /nfs/dbraw/zinc/75/70/82/1051757082.db2.gz HUAYSQCOFGMPIQ-NWDGAFQWSA-N 2 1 334.813 4.166 20 0 EIADMP Cc1nc2c(s1)[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)CCC2 ZINC000158591395 1051762454 /nfs/dbraw/zinc/76/24/54/1051762454.db2.gz XVXAWIHLAXMMKM-HLLBOEOZSA-N 2 1 335.561 4.177 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1cccc(OC(F)(F)F)c1 ZINC000775549666 1051815722 /nfs/dbraw/zinc/81/57/22/1051815722.db2.gz ZGZFYQFQQKMWJZ-UKRRQHHQSA-N 2 1 330.394 4.110 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001193249482 1051890312 /nfs/dbraw/zinc/89/03/12/1051890312.db2.gz NAPLJYBWCOVLHG-GOEBONIOSA-N 2 1 338.442 4.031 20 0 EIADMP C[C@@H]1CC[N@@H+](Cc2c(Cl)cccc2C(F)(F)F)CC[C@H]1C[NH3+] ZINC001205628553 1051914473 /nfs/dbraw/zinc/91/44/73/1051914473.db2.gz VZXUTCYMPLUGOM-NEPJUHHUSA-N 2 1 334.813 4.166 20 0 EIADMP CCC1([NH+]2CCC2)CC[NH+]([C@@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC001176235381 1051968722 /nfs/dbraw/zinc/96/87/22/1051968722.db2.gz VUWILKKCXNQKCG-HNNXBMFYSA-N 2 1 338.442 4.299 20 0 EIADMP CCOc1ccc([C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)C(C)C)cc1OCC ZINC000164445300 1052030401 /nfs/dbraw/zinc/03/04/01/1052030401.db2.gz FZIGHMXKQSJQIS-PLMTUMEDSA-N 2 1 348.531 4.253 20 0 EIADMP CCOc1ccc([C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)C(C)C)cc1OCC ZINC000164445300 1052030418 /nfs/dbraw/zinc/03/04/18/1052030418.db2.gz FZIGHMXKQSJQIS-PLMTUMEDSA-N 2 1 348.531 4.253 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(SC)c(OC)c2)CC1 ZINC000164485586 1052031355 /nfs/dbraw/zinc/03/13/55/1052031355.db2.gz IDYZMUHEWQIWHR-HNNXBMFYSA-N 2 1 336.545 4.332 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CCc3cccc(F)c3)C2)s1 ZINC001194152587 1052088164 /nfs/dbraw/zinc/08/81/64/1052088164.db2.gz DUHOQJFECXYZTM-GOSISDBHSA-N 2 1 346.515 4.192 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CCc3cccc(F)c3)C2)s1 ZINC001194152587 1052088171 /nfs/dbraw/zinc/08/81/71/1052088171.db2.gz DUHOQJFECXYZTM-GOSISDBHSA-N 2 1 346.515 4.192 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CCc3cccc(F)c3)C2)s1 ZINC001194152587 1052088179 /nfs/dbraw/zinc/08/81/79/1052088179.db2.gz DUHOQJFECXYZTM-GOSISDBHSA-N 2 1 346.515 4.192 20 0 EIADMP Cc1cc(Br)cc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c1 ZINC000774826203 1052162180 /nfs/dbraw/zinc/16/21/80/1052162180.db2.gz LKAIXOZYLDHKCG-UHFFFAOYSA-N 2 1 339.321 4.062 20 0 EIADMP Cc1cc(Br)cc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1 ZINC000774826203 1052162183 /nfs/dbraw/zinc/16/21/83/1052162183.db2.gz LKAIXOZYLDHKCG-UHFFFAOYSA-N 2 1 339.321 4.062 20 0 EIADMP CC(C)(C)[C@@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)CCO1 ZINC001176995894 1052217201 /nfs/dbraw/zinc/21/72/01/1052217201.db2.gz OZRZIDWLPAFGCJ-NRFANRHFSA-N 2 1 344.543 4.310 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cc(Cl)cc3cccnc32)CC1 ZINC000171940396 1052461968 /nfs/dbraw/zinc/46/19/68/1052461968.db2.gz HNHIBJJQBNRIEK-UHFFFAOYSA-N 2 1 331.891 4.194 20 0 EIADMP c1cc2c(s1)CCC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000336707954 1052513173 /nfs/dbraw/zinc/51/31/73/1052513173.db2.gz JFXYQAFAHHBICT-MJGOQNOKSA-N 2 1 326.509 4.237 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCCNc3ccccc32)CC1 ZINC000192687692 1052629991 /nfs/dbraw/zinc/62/99/91/1052629991.db2.gz MHGRULDOIOBBLR-QHCPKHFHSA-N 2 1 349.522 4.496 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000177933335 1052694535 /nfs/dbraw/zinc/69/45/35/1052694535.db2.gz RGILGGXUTLPYBU-OPYAIIAOSA-N 2 1 338.495 4.051 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)c2ccccc12 ZINC000178698638 1052710972 /nfs/dbraw/zinc/71/09/72/1052710972.db2.gz VSZYMPOIUZTXHU-CVEARBPZSA-N 2 1 337.467 4.340 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cc(C)ccc1OC(F)F ZINC000178698356 1052711707 /nfs/dbraw/zinc/71/17/07/1052711707.db2.gz RTFNLQJAQWAKPP-KBPBESRZSA-N 2 1 337.414 4.088 20 0 EIADMP CC[C@@H](C)Oc1cc(C[NH2+]CCC[NH+]2CCC(C)CC2)ccc1OC ZINC000624018929 1052853713 /nfs/dbraw/zinc/85/37/13/1052853713.db2.gz AXOIBAKTBPBPRM-GOSISDBHSA-N 2 1 348.531 4.084 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000624121280 1052867482 /nfs/dbraw/zinc/86/74/82/1052867482.db2.gz SCYUWCGFGVJXEN-PMPSAXMXSA-N 2 1 331.529 4.110 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cn2)c1 ZINC000183326715 1052970299 /nfs/dbraw/zinc/97/02/99/1052970299.db2.gz CSDARGJWRGZEEO-QFIPXVFZSA-N 2 1 349.453 4.162 20 0 EIADMP CC(C)c1cnc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)s1 ZINC000183557724 1052977664 /nfs/dbraw/zinc/97/76/64/1052977664.db2.gz ZXAXYAKHVRQHFC-UHFFFAOYSA-N 2 1 331.529 4.397 20 0 EIADMP CC(C)c1cnc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)s1 ZINC000183557724 1052977665 /nfs/dbraw/zinc/97/76/65/1052977665.db2.gz ZXAXYAKHVRQHFC-UHFFFAOYSA-N 2 1 331.529 4.397 20 0 EIADMP C[C@H]([NH2+]CCSc1ccccc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185706657 1053021364 /nfs/dbraw/zinc/02/13/64/1053021364.db2.gz JJEFSPWWSXWCRU-JKSUJKDBSA-N 2 1 336.520 4.160 20 0 EIADMP COc1ccc(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000381343448 1053069617 /nfs/dbraw/zinc/06/96/17/1053069617.db2.gz LATOABLAJNQDGQ-OAQYLSRUSA-N 2 1 338.495 4.087 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc2ccccc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382169308 1053158650 /nfs/dbraw/zinc/15/86/50/1053158650.db2.gz PKKQCTFSXKLHFD-XMSQKQJNSA-N 2 1 345.490 4.235 20 0 EIADMP CO[C@H](C)C[N@H+]1CCCCC[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001194940897 1053191528 /nfs/dbraw/zinc/19/15/28/1053191528.db2.gz CZCUHPVLRNEPBN-DENIHFKCSA-N 2 1 344.543 4.178 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000383360163 1053329184 /nfs/dbraw/zinc/32/91/84/1053329184.db2.gz SHQAORAQKSFPSW-DOTOQJQBSA-N 2 1 330.422 4.138 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)o1 ZINC000383543028 1053354618 /nfs/dbraw/zinc/35/46/18/1053354618.db2.gz UXPFVLFNVNGUBZ-UWVAXJGDSA-N 2 1 326.484 4.458 20 0 EIADMP CSc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000383677411 1053374713 /nfs/dbraw/zinc/37/47/13/1053374713.db2.gz NSCKIMJFFTYGOC-XLIONFOSSA-N 2 1 340.536 4.409 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cnn(-c2ccccc2)c1 ZINC000764965140 1053403302 /nfs/dbraw/zinc/40/33/02/1053403302.db2.gz URPKBSGTXBHZTN-RBUKOAKNSA-N 2 1 340.515 4.178 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)CSC(C)(C)C)CC1 ZINC000765051924 1053425530 /nfs/dbraw/zinc/42/55/30/1053425530.db2.gz OAGNFWYKVOIIDV-QGZVFWFLSA-N 2 1 334.573 4.469 20 0 EIADMP Fc1cc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cnc1Cl ZINC000865404377 1053491584 /nfs/dbraw/zinc/49/15/84/1053491584.db2.gz GDTGXTXRHDXCSI-UHFFFAOYSA-N 2 1 347.865 4.150 20 0 EIADMP CC(C)O[C@@H]1CCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001195809843 1053495289 /nfs/dbraw/zinc/49/52/89/1053495289.db2.gz OCABUJYUOPJIID-OAQYLSRUSA-N 2 1 330.516 4.062 20 0 EIADMP c1cc2c(s1)CCC[C@H]2[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000102196040 1053503939 /nfs/dbraw/zinc/50/39/39/1053503939.db2.gz WBPCLGZKKWPKJK-LJQANCHMSA-N 2 1 326.509 4.380 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2COc3ccccc3C2)cc1 ZINC000765333876 1053507520 /nfs/dbraw/zinc/50/75/20/1053507520.db2.gz MIIZSKQGEJQHOQ-WMZOPIPTSA-N 2 1 347.462 4.083 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]CC[C@@H]3CCCS3)CC23CC3)cc1 ZINC000865725614 1053579176 /nfs/dbraw/zinc/57/91/76/1053579176.db2.gz NCPJRROVXDZHGU-OALUTQOASA-N 2 1 330.541 4.059 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CC[C@@H]3CCCS3)CC23CC3)cc1 ZINC000865725614 1053579185 /nfs/dbraw/zinc/57/91/85/1053579185.db2.gz NCPJRROVXDZHGU-OALUTQOASA-N 2 1 330.541 4.059 20 0 EIADMP Cc1cnc(Cl)c(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC000921526259 1053583475 /nfs/dbraw/zinc/58/34/75/1053583475.db2.gz CDYQILCZEXXENA-UHFFFAOYSA-N 2 1 331.891 4.173 20 0 EIADMP Cc1cnc(Cl)c(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1 ZINC000921526259 1053583482 /nfs/dbraw/zinc/58/34/82/1053583482.db2.gz CDYQILCZEXXENA-UHFFFAOYSA-N 2 1 331.891 4.173 20 0 EIADMP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000765506208 1053587541 /nfs/dbraw/zinc/58/75/41/1053587541.db2.gz CYVYVDLNTWIZPU-JKSUJKDBSA-N 2 1 340.602 4.470 20 0 EIADMP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000765506208 1053587551 /nfs/dbraw/zinc/58/75/51/1053587551.db2.gz CYVYVDLNTWIZPU-JKSUJKDBSA-N 2 1 340.602 4.470 20 0 EIADMP CC(F)(F)C(C)(C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000865788900 1053594071 /nfs/dbraw/zinc/59/40/71/1053594071.db2.gz ISNXSMVHXOBKLL-QGZVFWFLSA-N 2 1 336.470 4.455 20 0 EIADMP CC(F)(F)C(C)(C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000865788900 1053594086 /nfs/dbraw/zinc/59/40/86/1053594086.db2.gz ISNXSMVHXOBKLL-QGZVFWFLSA-N 2 1 336.470 4.455 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](CCc1ccccc1)c1ccccn1 ZINC000866258948 1053667630 /nfs/dbraw/zinc/66/76/30/1053667630.db2.gz DQHDGMBGKDRLAH-PGRDOPGGSA-N 2 1 348.494 4.186 20 0 EIADMP C[C@H]1CCCCN1c1cccc(N2C[C@@H](CC[NH3+])c3ccccc32)[nH+]1 ZINC001168544414 1053701687 /nfs/dbraw/zinc/70/16/87/1053701687.db2.gz OPMQTRPQWKYGPR-DLBZAZTESA-N 2 1 336.483 4.045 20 0 EIADMP C[C@@H]([NH2+]Cc1cc(F)c(F)c(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386394581 1053704517 /nfs/dbraw/zinc/70/45/17/1053704517.db2.gz VVTKSJJVECQCDM-PBHICJAKSA-N 2 1 348.412 4.104 20 0 EIADMP C[C@@H]([NH2+]Cc1cc(F)c(F)c(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386394581 1053704536 /nfs/dbraw/zinc/70/45/36/1053704536.db2.gz VVTKSJJVECQCDM-PBHICJAKSA-N 2 1 348.412 4.104 20 0 EIADMP CCC1([NH+](C)C)CC[NH+]([C@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC001196684878 1053735021 /nfs/dbraw/zinc/73/50/21/1053735021.db2.gz ORFMEOQWLOQOLD-CQSZACIVSA-N 2 1 344.421 4.452 20 0 EIADMP Cc1ccc(C2CC([NH2+]C[C@@H]3CC[N@@H+](Cc4ccccc4)C3)C2)cc1 ZINC000386481545 1053743564 /nfs/dbraw/zinc/74/35/64/1053743564.db2.gz WGKZQVYKOUKNDP-RBKXMNCYSA-N 2 1 334.507 4.353 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386578558 1053782116 /nfs/dbraw/zinc/78/21/16/1053782116.db2.gz ZGJCZCGMRKYEEG-SGXKBVARSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@]1(C)C[N@@H+](CC1CCCCC1)C2 ZINC001196962257 1053814364 /nfs/dbraw/zinc/81/43/64/1053814364.db2.gz PZWZQYNMLPJBRQ-SZPZYZBQSA-N 2 1 326.528 4.411 20 0 EIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@]1(C)C[N@H+](CC1CCCCC1)C2 ZINC001196962257 1053814367 /nfs/dbraw/zinc/81/43/67/1053814367.db2.gz PZWZQYNMLPJBRQ-SZPZYZBQSA-N 2 1 326.528 4.411 20 0 EIADMP C[C@]12C[NH+](CC3CCCCC3)C[C@@]1(C)C[N@H+](Cc1ccccc1)C2 ZINC001196962257 1053814369 /nfs/dbraw/zinc/81/43/69/1053814369.db2.gz PZWZQYNMLPJBRQ-SZPZYZBQSA-N 2 1 326.528 4.411 20 0 EIADMP C[C@]12C[NH+](CC3CCCCC3)C[C@@]1(C)C[N@@H+](Cc1ccccc1)C2 ZINC001196962257 1053814371 /nfs/dbraw/zinc/81/43/71/1053814371.db2.gz PZWZQYNMLPJBRQ-SZPZYZBQSA-N 2 1 326.528 4.411 20 0 EIADMP C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866705975 1053818743 /nfs/dbraw/zinc/81/87/43/1053818743.db2.gz DIKSJQPYWGWZOK-MGPUTAFESA-N 2 1 327.472 4.100 20 0 EIADMP C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866705975 1053818751 /nfs/dbraw/zinc/81/87/51/1053818751.db2.gz DIKSJQPYWGWZOK-MGPUTAFESA-N 2 1 327.472 4.100 20 0 EIADMP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2csc(-c3ccsc3)n2)C1 ZINC000866705604 1053818986 /nfs/dbraw/zinc/81/89/86/1053818986.db2.gz DMQWZMZPANOZPF-QGZVFWFLSA-N 2 1 335.542 4.069 20 0 EIADMP CC(C)(C)[C@@]1(C[NH3+])CC[N@@H+](Cc2csc(-c3ccsc3)n2)C1 ZINC000866705604 1053818989 /nfs/dbraw/zinc/81/89/89/1053818989.db2.gz DMQWZMZPANOZPF-QGZVFWFLSA-N 2 1 335.542 4.069 20 0 EIADMP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000765704532 1053851545 /nfs/dbraw/zinc/85/15/45/1053851545.db2.gz ZEQKDTGUVDKPLU-NFBKMPQASA-N 2 1 334.507 4.137 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2F)c2ccccc2)CC[N@@H+]1C ZINC000429522089 1053960922 /nfs/dbraw/zinc/96/09/22/1053960922.db2.gz SHSLCSGVHHYLPI-PBEJRMEISA-N 2 1 326.459 4.182 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2F)c2ccccc2)CC[N@H+]1C ZINC000429522089 1053960934 /nfs/dbraw/zinc/96/09/34/1053960934.db2.gz SHSLCSGVHHYLPI-PBEJRMEISA-N 2 1 326.459 4.182 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccccc2CC(F)(F)F)CC1 ZINC000624307394 1054165120 /nfs/dbraw/zinc/16/51/20/1054165120.db2.gz ITONNCRVTQKAAV-UHFFFAOYSA-N 2 1 328.422 4.144 20 0 EIADMP CC(C)(C)n1cncc1[C@H]1CCCN(Cc2cc(F)ccc2F)C1 ZINC001198791744 1054266780 /nfs/dbraw/zinc/26/67/80/1054266780.db2.gz YKQOSAKAWLVCQL-AWEZNQCLSA-N 2 1 333.426 4.296 20 0 EIADMP CC(C)(C)n1cncc1[C@@H]1CCCN(Cc2cc(F)ccc2F)C1 ZINC001198791752 1054269132 /nfs/dbraw/zinc/26/91/32/1054269132.db2.gz YKQOSAKAWLVCQL-CQSZACIVSA-N 2 1 333.426 4.296 20 0 EIADMP Cc1cc(C)c([C@H](C)[N@H+]2C[C@@]34C[NH+](C)C[C@]3(C2)CCCC4)c(C)c1 ZINC001198821551 1054276227 /nfs/dbraw/zinc/27/62/27/1054276227.db2.gz SSALMYGBKKHHAS-ILWGZMRPSA-N 2 1 326.528 4.481 20 0 EIADMP Cc1cc(C)c([C@H](C)[NH+]2C[C@@]34C[N@H+](C)C[C@]3(C2)CCCC4)c(C)c1 ZINC001198821551 1054276248 /nfs/dbraw/zinc/27/62/48/1054276248.db2.gz SSALMYGBKKHHAS-ILWGZMRPSA-N 2 1 326.528 4.481 20 0 EIADMP Cc1cc(C)c([C@H](C)[NH+]2C[C@@]34C[N@@H+](C)C[C@]3(C2)CCCC4)c(C)c1 ZINC001198821551 1054276257 /nfs/dbraw/zinc/27/62/57/1054276257.db2.gz SSALMYGBKKHHAS-ILWGZMRPSA-N 2 1 326.528 4.481 20 0 EIADMP CC[C@@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C(C)(C)CC ZINC000872036487 1054353362 /nfs/dbraw/zinc/35/33/62/1054353362.db2.gz SOUKHKDRJNREFY-GOSISDBHSA-N 2 1 335.536 4.308 20 0 EIADMP Cc1cc(C[NH2+]CCC[N@@H+](C)C(C)C)ccc1Oc1cccnc1 ZINC001199207842 1054363911 /nfs/dbraw/zinc/36/39/11/1054363911.db2.gz CLKMYVSUTNOXRT-UHFFFAOYSA-N 2 1 327.472 4.002 20 0 EIADMP Cc1cc(C[NH2+]CCC[N@H+](C)C(C)C)ccc1Oc1cccnc1 ZINC001199207842 1054363924 /nfs/dbraw/zinc/36/39/24/1054363924.db2.gz CLKMYVSUTNOXRT-UHFFFAOYSA-N 2 1 327.472 4.002 20 0 EIADMP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)C1 ZINC001199265852 1054376181 /nfs/dbraw/zinc/37/61/81/1054376181.db2.gz FANKTOINVGYHLA-BVYCBKJFSA-N 2 1 344.543 4.498 20 0 EIADMP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2ccc(SC(F)F)cc2)C1 ZINC001199328867 1054392137 /nfs/dbraw/zinc/39/21/37/1054392137.db2.gz KQMXAJSUEUNRIG-GJZGRUSLSA-N 2 1 342.499 4.459 20 0 EIADMP Cc1nc(C[N@@H+](C)CCCCCC[NH3+])oc1-c1ccc(Cl)cc1 ZINC000872155588 1054412627 /nfs/dbraw/zinc/41/26/27/1054412627.db2.gz RTCGPHPMLYHAHJ-UHFFFAOYSA-N 2 1 335.879 4.254 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCO1 ZINC001199629670 1054435785 /nfs/dbraw/zinc/43/57/85/1054435785.db2.gz LRCRXIZUNPPZKK-PXNSSMCTSA-N 2 1 330.516 4.108 20 0 EIADMP C[C@]1(CN[C@@H]2CCCc3scnc32)CC[N@@H+](Cc2ccccc2)C1 ZINC000858414667 1054485054 /nfs/dbraw/zinc/48/50/54/1054485054.db2.gz FWWSCRMYXDMFKV-YLJYHZDGSA-N 2 1 341.524 4.022 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[NH+](CC3CCCCC3)C[C@H]21 ZINC001201397859 1054773900 /nfs/dbraw/zinc/77/39/00/1054773900.db2.gz VITGYLMICPSTTD-CEMLEFRQSA-N 2 1 341.543 4.194 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[NH+](CC3CCCCC3)C[C@H]21 ZINC001201397859 1054773914 /nfs/dbraw/zinc/77/39/14/1054773914.db2.gz VITGYLMICPSTTD-CEMLEFRQSA-N 2 1 341.543 4.194 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[N@H+](CC3CCCCC3)C[C@H]21 ZINC001201397859 1054773927 /nfs/dbraw/zinc/77/39/27/1054773927.db2.gz VITGYLMICPSTTD-CEMLEFRQSA-N 2 1 341.543 4.194 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[N@@H+](CC3CCCCC3)C[C@H]21 ZINC001201397859 1054773941 /nfs/dbraw/zinc/77/39/41/1054773941.db2.gz VITGYLMICPSTTD-CEMLEFRQSA-N 2 1 341.543 4.194 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[NH+](CC3CCCCC3)C[C@@H]21 ZINC001201397858 1054774528 /nfs/dbraw/zinc/77/45/28/1054774528.db2.gz VITGYLMICPSTTD-BAGYTPMASA-N 2 1 341.543 4.194 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[NH+](CC3CCCCC3)C[C@@H]21 ZINC001201397858 1054774543 /nfs/dbraw/zinc/77/45/43/1054774543.db2.gz VITGYLMICPSTTD-BAGYTPMASA-N 2 1 341.543 4.194 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[N@H+](CC3CCCCC3)C[C@@H]21 ZINC001201397858 1054774559 /nfs/dbraw/zinc/77/45/59/1054774559.db2.gz VITGYLMICPSTTD-BAGYTPMASA-N 2 1 341.543 4.194 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[N@@H+](CC3CCCCC3)C[C@@H]21 ZINC001201397858 1054774576 /nfs/dbraw/zinc/77/45/76/1054774576.db2.gz VITGYLMICPSTTD-BAGYTPMASA-N 2 1 341.543 4.194 20 0 EIADMP CCC[C@H](C)C[N@@H+]1CCc2c(C[NH+](C)Cc3ccco3)cncc2C1 ZINC001201543405 1054836087 /nfs/dbraw/zinc/83/60/87/1054836087.db2.gz GFWXFYIADKYHAS-KRWDZBQOSA-N 2 1 341.499 4.101 20 0 EIADMP CCC[C@H](C)C[N@H+]1CCc2c(C[NH+](C)Cc3ccco3)cncc2C1 ZINC001201543405 1054836090 /nfs/dbraw/zinc/83/60/90/1054836090.db2.gz GFWXFYIADKYHAS-KRWDZBQOSA-N 2 1 341.499 4.101 20 0 EIADMP CCC[C@H](C)C[NH+]1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001201543405 1054836095 /nfs/dbraw/zinc/83/60/95/1054836095.db2.gz GFWXFYIADKYHAS-KRWDZBQOSA-N 2 1 341.499 4.101 20 0 EIADMP CCC[C@H](C)C[NH+]1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001201543405 1054836096 /nfs/dbraw/zinc/83/60/96/1054836096.db2.gz GFWXFYIADKYHAS-KRWDZBQOSA-N 2 1 341.499 4.101 20 0 EIADMP CCCC[C@H](CC)C[N@H+]1CC[C@H]2[C@H](CCN2Cc2nccs2)C1 ZINC001201566369 1054849900 /nfs/dbraw/zinc/84/99/00/1054849900.db2.gz SPGPANVGVLYGMR-KSZLIROESA-N 2 1 335.561 4.256 20 0 EIADMP CCCC[C@H](CC)C[N@H+]1CC[C@H]2[C@@H](CCN2Cc2nccs2)C1 ZINC001201566365 1054850676 /nfs/dbraw/zinc/85/06/76/1054850676.db2.gz SPGPANVGVLYGMR-BZSNNMDCSA-N 2 1 335.561 4.256 20 0 EIADMP CCCC[C@H](CC)C[N@H+]1CC[C@@H]2[C@H](CCN2Cc2nccs2)C1 ZINC001201566372 1054850947 /nfs/dbraw/zinc/85/09/47/1054850947.db2.gz SPGPANVGVLYGMR-RCCFBDPRSA-N 2 1 335.561 4.256 20 0 EIADMP c1ccc(CC[NH+]2CCC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1 ZINC001201606055 1054862042 /nfs/dbraw/zinc/86/20/42/1054862042.db2.gz FKCNNUFDCUTEGW-HSZRJFAPSA-N 2 1 334.507 4.217 20 0 EIADMP c1ccc(CC[N@H+]2CCCC3=C[C@H]4C[C@H](C[NH+]5CCCC[C@H]45)[C@@H]32)cc1 ZINC001201606052 1054862196 /nfs/dbraw/zinc/86/21/96/1054862196.db2.gz FGSIRGMOVHTFBN-WBADGQHESA-N 2 1 336.523 4.124 20 0 EIADMP c1ccc(CC[NH+]2CCCC3=C[C@H]4C[C@H](C[N@@H+]5CCCC[C@H]45)[C@@H]32)cc1 ZINC001201606052 1054862201 /nfs/dbraw/zinc/86/22/01/1054862201.db2.gz FGSIRGMOVHTFBN-WBADGQHESA-N 2 1 336.523 4.124 20 0 EIADMP c1ccc(CC[NH+]2CCCC3=C[C@H]4C[C@H](C[N@H+]5CCCC[C@H]45)[C@@H]32)cc1 ZINC001201606052 1054862205 /nfs/dbraw/zinc/86/22/05/1054862205.db2.gz FGSIRGMOVHTFBN-WBADGQHESA-N 2 1 336.523 4.124 20 0 EIADMP COc1ccc(C)cc1CN[C@H](Cn1ccnc1)c1ccc(C)cc1C ZINC001201600808 1054862412 /nfs/dbraw/zinc/86/24/12/1054862412.db2.gz ODLITZXYILMBHY-OAQYLSRUSA-N 2 1 349.478 4.348 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201609251 1054863955 /nfs/dbraw/zinc/86/39/55/1054863955.db2.gz FEKULCPALOKNJL-XZOQPEGZSA-N 2 1 334.507 4.073 20 0 EIADMP c1ccc(CC[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201609251 1054863958 /nfs/dbraw/zinc/86/39/58/1054863958.db2.gz FEKULCPALOKNJL-XZOQPEGZSA-N 2 1 334.507 4.073 20 0 EIADMP c1ccc(CC[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201609251 1054863963 /nfs/dbraw/zinc/86/39/63/1054863963.db2.gz FEKULCPALOKNJL-XZOQPEGZSA-N 2 1 334.507 4.073 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+]Cc2cccc(-c3ccc(Cl)cc3)c2)CC1 ZINC001201665210 1054879849 /nfs/dbraw/zinc/87/98/49/1054879849.db2.gz XLIACCLNLGVJPJ-UHFFFAOYSA-N 2 1 326.871 4.359 20 0 EIADMP CCCCCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201755219 1054897787 /nfs/dbraw/zinc/89/77/87/1054897787.db2.gz UPSUUPRRYPCDPR-SESVDKBCSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201755219 1054897790 /nfs/dbraw/zinc/89/77/90/1054897790.db2.gz UPSUUPRRYPCDPR-SESVDKBCSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201755219 1054897798 /nfs/dbraw/zinc/89/77/98/1054897798.db2.gz UPSUUPRRYPCDPR-SESVDKBCSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201755219 1054897802 /nfs/dbraw/zinc/89/78/02/1054897802.db2.gz UPSUUPRRYPCDPR-SESVDKBCSA-N 2 1 329.532 4.194 20 0 EIADMP CC(C)=CCC[C@@H](C)CC[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001201983086 1054959418 /nfs/dbraw/zinc/95/94/18/1054959418.db2.gz XGZRTKXPADXZSJ-LJQANCHMSA-N 2 1 336.564 4.334 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(Cl)c2N)[C@H]1c1cccs1 ZINC000877055175 1055009395 /nfs/dbraw/zinc/00/93/95/1055009395.db2.gz QEWFPIMDIQQQGI-KDOFPFPSSA-N 2 1 349.931 4.156 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cccc(Cl)c2N)[C@H]1c1cccs1 ZINC000877055175 1055009408 /nfs/dbraw/zinc/00/94/08/1055009408.db2.gz QEWFPIMDIQQQGI-KDOFPFPSSA-N 2 1 349.931 4.156 20 0 EIADMP FC(F)C1(C[NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000671762703 1055054000 /nfs/dbraw/zinc/05/40/00/1055054000.db2.gz GYPRWQFEIDKXDS-CEXWTWQISA-N 2 1 348.481 4.312 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1c(OC(F)F)ccc2ccccc21 ZINC000069754105 1055120683 /nfs/dbraw/zinc/12/06/83/1055120683.db2.gz WIJUBRMISDBHOC-UHFFFAOYSA-N 2 1 345.393 4.126 20 0 EIADMP COCC(C)(C)CC[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877803737 1055123625 /nfs/dbraw/zinc/12/36/25/1055123625.db2.gz JDMAKYZATZYEAT-ICSRJNTNSA-N 2 1 330.516 4.007 20 0 EIADMP COCC(C)(C)CC[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877803737 1055123631 /nfs/dbraw/zinc/12/36/31/1055123631.db2.gz JDMAKYZATZYEAT-ICSRJNTNSA-N 2 1 330.516 4.007 20 0 EIADMP FC(F)(F)CCC[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001202397177 1055169991 /nfs/dbraw/zinc/16/99/91/1055169991.db2.gz YVBIIFYCNGVMIJ-UHFFFAOYSA-N 2 1 346.462 4.379 20 0 EIADMP FC(F)(F)CCC[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001202444051 1055176682 /nfs/dbraw/zinc/17/66/82/1055176682.db2.gz COAPXRUNKSPPMH-ZWKOTPCHSA-N 2 1 340.433 4.173 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001202444051 1055176689 /nfs/dbraw/zinc/17/66/89/1055176689.db2.gz COAPXRUNKSPPMH-ZWKOTPCHSA-N 2 1 340.433 4.173 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001202444051 1055176692 /nfs/dbraw/zinc/17/66/92/1055176692.db2.gz COAPXRUNKSPPMH-ZWKOTPCHSA-N 2 1 340.433 4.173 20 0 EIADMP c1cc(OC2CCCCC2)ccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000166421086 1055572433 /nfs/dbraw/zinc/57/24/33/1055572433.db2.gz BOSRNQNHHAITAX-RBUKOAKNSA-N 2 1 328.500 4.115 20 0 EIADMP CSC[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccc(C(F)(F)F)cc1 ZINC000542847842 1056226241 /nfs/dbraw/zinc/22/62/41/1056226241.db2.gz UKYVTNSBJPPPDZ-SWLSCSKDSA-N 2 1 334.451 4.039 20 0 EIADMP C[C@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)CCC[C@H]1C[NH3+] ZINC001205995741 1060512590 /nfs/dbraw/zinc/51/25/90/1060512590.db2.gz PTMFGELENJHKPF-RYUDHWBXSA-N 2 1 334.813 4.166 20 0 EIADMP CC(C)C[C@H](Cc1ccccc1)[NH+]1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001169071045 1060629303 /nfs/dbraw/zinc/62/93/03/1060629303.db2.gz UCQVXYPOOQFBRT-OAQYLSRUSA-N 2 1 326.528 4.062 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccccc1Br)C2 ZINC001169124266 1060651572 /nfs/dbraw/zinc/65/15/72/1060651572.db2.gz BFCXBWYXSHPULW-LDDOYCOJSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccccc1Br)C2 ZINC001169124266 1060651576 /nfs/dbraw/zinc/65/15/76/1060651576.db2.gz BFCXBWYXSHPULW-LDDOYCOJSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1ccccc1Br)C2 ZINC001169124266 1060651579 /nfs/dbraw/zinc/65/15/79/1060651579.db2.gz BFCXBWYXSHPULW-LDDOYCOJSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1ccccc1Br)C2 ZINC001169124266 1060651582 /nfs/dbraw/zinc/65/15/82/1060651582.db2.gz BFCXBWYXSHPULW-LDDOYCOJSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCc3ccccc3[C@@H]1c1ccccc1)C2 ZINC001169143233 1060663471 /nfs/dbraw/zinc/66/34/71/1060663471.db2.gz ZCLCIAGQCXTXRG-KGSLCBSSSA-N 2 1 332.491 4.259 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCc3ccccc3[C@@H]1c1ccccc1)C2 ZINC001169143233 1060663478 /nfs/dbraw/zinc/66/34/78/1060663478.db2.gz ZCLCIAGQCXTXRG-KGSLCBSSSA-N 2 1 332.491 4.259 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCc3ccccc3[C@@H]1c1ccccc1)C2 ZINC001169143233 1060663486 /nfs/dbraw/zinc/66/34/86/1060663486.db2.gz ZCLCIAGQCXTXRG-KGSLCBSSSA-N 2 1 332.491 4.259 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccc(C(F)(F)F)c(Cl)c2)CC1 ZINC001169244191 1060716351 /nfs/dbraw/zinc/71/63/51/1060716351.db2.gz GXVAXFVIVIVPOL-LLVKDONJSA-N 2 1 334.813 4.494 20 0 EIADMP CC[NH+]1CCC([N@@H+]2CC[C@H](c3ccc(OC(C)(C)C)cc3)C2)CC1 ZINC001169269043 1060753210 /nfs/dbraw/zinc/75/32/10/1060753210.db2.gz UMDIRRWEBKNNKX-SFHVURJKSA-N 2 1 330.516 4.138 20 0 EIADMP CC[NH+]1CCC([N@H+]2CC[C@H](c3ccc(OC(C)(C)C)cc3)C2)CC1 ZINC001169269043 1060753224 /nfs/dbraw/zinc/75/32/24/1060753224.db2.gz UMDIRRWEBKNNKX-SFHVURJKSA-N 2 1 330.516 4.138 20 0 EIADMP C[NH+](C)CCC(C)(C)Nc1[nH+]ccc2ccn(Cc3ccccc3)c21 ZINC001169715805 1060916777 /nfs/dbraw/zinc/91/67/77/1060916777.db2.gz IMQRUIJZQXQRDO-UHFFFAOYSA-N 2 1 336.483 4.227 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188302 1032078174 /nfs/dbraw/zinc/07/81/74/1032078174.db2.gz CTDPQNUXXFUXKW-PGRDOPGGSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188302 1032078192 /nfs/dbraw/zinc/07/81/92/1032078192.db2.gz CTDPQNUXXFUXKW-PGRDOPGGSA-N 2 1 347.506 4.211 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+]C3CC[NH+](C(C)(C)C)CC3)cc2)cs1 ZINC000532209587 1032092545 /nfs/dbraw/zinc/09/25/45/1032092545.db2.gz RVRDIQLTRNTIJP-UHFFFAOYSA-N 2 1 343.540 4.471 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(Br)cs1 ZINC000194089593 1032200052 /nfs/dbraw/zinc/20/00/52/1032200052.db2.gz HLGNFXNWUSTWBA-LLVKDONJSA-N 2 1 345.350 4.424 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2nc(-c3ccccc3)c[nH]2)c1 ZINC000194242548 1032252049 /nfs/dbraw/zinc/25/20/49/1032252049.db2.gz QJQMBZKFQYKBKT-UHFFFAOYSA-N 2 1 348.494 4.208 20 0 EIADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2ccccc2C(C)(C)C)CC1 ZINC000532845863 1032357244 /nfs/dbraw/zinc/35/72/44/1032357244.db2.gz XGMPUVZVEXOWIW-IBGZPJMESA-N 2 1 345.575 4.052 20 0 EIADMP C[N@H+](Cc1ccc2cc[nH]c2c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000529535980 1032442480 /nfs/dbraw/zinc/44/24/80/1032442480.db2.gz VHLRMZPUHIRLBJ-HXUWFJFHSA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1ccc2cc[nH]c2c1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000529535980 1032442483 /nfs/dbraw/zinc/44/24/83/1032442483.db2.gz VHLRMZPUHIRLBJ-HXUWFJFHSA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1ccc2cc[nH]c2c1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000529535980 1032442487 /nfs/dbraw/zinc/44/24/87/1032442487.db2.gz VHLRMZPUHIRLBJ-HXUWFJFHSA-N 2 1 333.479 4.122 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc32)C1 ZINC000450363665 1032446056 /nfs/dbraw/zinc/44/60/56/1032446056.db2.gz VVCWVIMBGLGNOV-ZDUSSCGKSA-N 2 1 337.389 4.032 20 0 EIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccncc1 ZINC000245750723 1032459633 /nfs/dbraw/zinc/45/96/33/1032459633.db2.gz TZBIKJDSJZDLTG-KJJMTIBFSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@@H](c1ccc(C[NH+](C)C[C@H]2CCC[N@H+](C)C2)cc1)C(F)(F)F ZINC000450431107 1032494195 /nfs/dbraw/zinc/49/41/95/1032494195.db2.gz XPOJINKSSNXVRP-HOCLYGCPSA-N 2 1 328.422 4.126 20 0 EIADMP C[C@@H](c1ccc(C[NH+](C)C[C@H]2CCC[N@@H+](C)C2)cc1)C(F)(F)F ZINC000450431107 1032494202 /nfs/dbraw/zinc/49/42/02/1032494202.db2.gz XPOJINKSSNXVRP-HOCLYGCPSA-N 2 1 328.422 4.126 20 0 EIADMP FC1(F)CC(C[N@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)C1 ZINC000450451539 1032508440 /nfs/dbraw/zinc/50/84/40/1032508440.db2.gz HWCBVUCYSLUPBZ-LJQANCHMSA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC(C[NH+]2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)C1 ZINC000450451539 1032508445 /nfs/dbraw/zinc/50/84/45/1032508445.db2.gz HWCBVUCYSLUPBZ-LJQANCHMSA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC(C[NH+]2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)C1 ZINC000450451539 1032508452 /nfs/dbraw/zinc/50/84/52/1032508452.db2.gz HWCBVUCYSLUPBZ-LJQANCHMSA-N 2 1 334.454 4.020 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1 ZINC000450470707 1032518113 /nfs/dbraw/zinc/51/81/13/1032518113.db2.gz UVNPPVXDKTVPNW-AWEZNQCLSA-N 2 1 328.422 4.269 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1 ZINC000450470707 1032518124 /nfs/dbraw/zinc/51/81/24/1032518124.db2.gz UVNPPVXDKTVPNW-AWEZNQCLSA-N 2 1 328.422 4.269 20 0 EIADMP c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000178294496 1032528301 /nfs/dbraw/zinc/52/83/01/1032528301.db2.gz PWVZAIJTWNGJOY-HXUWFJFHSA-N 2 1 340.511 4.430 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000178700645 1032544712 /nfs/dbraw/zinc/54/47/12/1032544712.db2.gz FLUZIUKNKLJEHS-MLGOLLRUSA-N 2 1 335.904 4.308 20 0 EIADMP C[N@@H+](CC1CCN(c2cc[nH+]cc2)CC1)C[C@H]1CCCCC1(F)F ZINC000450638616 1032608679 /nfs/dbraw/zinc/60/86/79/1032608679.db2.gz JDSGJXDHLPXBLI-QGZVFWFLSA-N 2 1 337.458 4.055 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512421913 1032730065 /nfs/dbraw/zinc/73/00/65/1032730065.db2.gz NDYXPASSZAGEPV-GOSISDBHSA-N 2 1 338.495 4.184 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512421913 1032730080 /nfs/dbraw/zinc/73/00/80/1032730080.db2.gz NDYXPASSZAGEPV-GOSISDBHSA-N 2 1 338.495 4.184 20 0 EIADMP CC[N@@H+](C)C[C@H]1CCN(Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469883 1032787873 /nfs/dbraw/zinc/78/78/73/1032787873.db2.gz MPIVYTSXCKPHGO-GOSISDBHSA-N 2 1 340.511 4.401 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469883 1032787883 /nfs/dbraw/zinc/78/78/83/1032787883.db2.gz MPIVYTSXCKPHGO-GOSISDBHSA-N 2 1 340.511 4.401 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469883 1032787895 /nfs/dbraw/zinc/78/78/95/1032787895.db2.gz MPIVYTSXCKPHGO-GOSISDBHSA-N 2 1 340.511 4.401 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469883 1032787909 /nfs/dbraw/zinc/78/79/09/1032787909.db2.gz MPIVYTSXCKPHGO-GOSISDBHSA-N 2 1 340.511 4.401 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469883 1032787914 /nfs/dbraw/zinc/78/79/14/1032787914.db2.gz MPIVYTSXCKPHGO-GOSISDBHSA-N 2 1 340.511 4.401 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000530460219 1019000094 /nfs/dbraw/zinc/00/00/94/1019000094.db2.gz WUSCCFFUABZEHW-PBHICJAKSA-N 2 1 338.282 4.195 20 0 EIADMP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)c1cc2cc(Br)ccc2o1 ZINC000312443914 1019090474 /nfs/dbraw/zinc/09/04/74/1019090474.db2.gz CKIDJDLFEHGRHS-NWDGAFQWSA-N 2 1 339.277 4.044 20 0 EIADMP COc1cc(-c2ccccc2)ccc1CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000512454021 1032821032 /nfs/dbraw/zinc/82/10/32/1032821032.db2.gz NKIGCFLPSIFGOR-NHCUHLMSSA-N 2 1 336.479 4.079 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000512454021 1032821033 /nfs/dbraw/zinc/82/10/33/1032821033.db2.gz NKIGCFLPSIFGOR-NHCUHLMSSA-N 2 1 336.479 4.079 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000512454021 1032821034 /nfs/dbraw/zinc/82/10/34/1032821034.db2.gz NKIGCFLPSIFGOR-NHCUHLMSSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000432814817 1032860935 /nfs/dbraw/zinc/86/09/35/1032860935.db2.gz BIRCCNUGZUCPAJ-HXUWFJFHSA-N 2 1 338.495 4.278 20 0 EIADMP C[C@@]1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCS1 ZINC000180158593 1020077373 /nfs/dbraw/zinc/07/73/73/1020077373.db2.gz JQRNVYDRXVKTCH-NXEWRWPSSA-N 2 1 330.541 4.057 20 0 EIADMP COc1ccc([C@@H]([NH2+]C[C@H](C)Cn2cc[nH+]c2C)c2ccccc2)cc1 ZINC000180442122 1020114152 /nfs/dbraw/zinc/11/41/52/1020114152.db2.gz PCHXJTOOBZSSSB-JTSKRJEESA-N 2 1 349.478 4.215 20 0 EIADMP C[C@@H](c1ccc(Br)cc1)[N@@H+](C)CCC[NH+]1CCCCC1 ZINC001209452977 1020362395 /nfs/dbraw/zinc/36/23/95/1020362395.db2.gz AYZNUSNDZWHYMC-HNNXBMFYSA-N 2 1 339.321 4.318 20 0 EIADMP Cc1cccc2cc[nH+]c(N3Cc4ccccc4C4(CC[NH2+]CC4)C3)c12 ZINC001167163917 1020444034 /nfs/dbraw/zinc/44/40/34/1020444034.db2.gz YRNZNXDOHVBZPN-UHFFFAOYSA-N 2 1 343.474 4.185 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+]([C@@H]3CCc4ccc(F)cc43)C2)CC1 ZINC001167256149 1020684511 /nfs/dbraw/zinc/68/45/11/1020684511.db2.gz UFIOHYIHHBURPV-DYESRHJHSA-N 2 1 330.491 4.257 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@H+]([C@@H]3CCc4ccc(F)cc43)C2)CC1 ZINC001167256149 1020684519 /nfs/dbraw/zinc/68/45/19/1020684519.db2.gz UFIOHYIHHBURPV-DYESRHJHSA-N 2 1 330.491 4.257 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547831561 1020779569 /nfs/dbraw/zinc/77/95/69/1020779569.db2.gz ACPRCCVYUZNZTO-GBAJDQEWSA-N 2 1 344.543 4.080 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)C(C)(C)C)c1 ZINC000655720816 1020917123 /nfs/dbraw/zinc/91/71/23/1020917123.db2.gz HAXYTUFZWXDZPS-NHCUHLMSSA-N 2 1 344.543 4.315 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C[C@H]3CCCO3)CC1)CC2 ZINC000655756716 1020943779 /nfs/dbraw/zinc/94/37/79/1020943779.db2.gz WUGYURVYYGTJHN-IFMALSPDSA-N 2 1 342.527 4.030 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccncc1F ZINC000340473420 1021083949 /nfs/dbraw/zinc/08/39/49/1021083949.db2.gz CGINCOILXCFMIC-KRWDZBQOSA-N 2 1 341.474 4.303 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000309744357 1021459721 /nfs/dbraw/zinc/45/97/21/1021459721.db2.gz SYLILSLEHDTYAU-INIZCTEOSA-N 2 1 334.916 4.403 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000309744357 1021459744 /nfs/dbraw/zinc/45/97/44/1021459744.db2.gz SYLILSLEHDTYAU-INIZCTEOSA-N 2 1 334.916 4.403 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)s1 ZINC000376165592 1021638942 /nfs/dbraw/zinc/63/89/42/1021638942.db2.gz ZQUICPWTRUDVGG-MORSLUCNSA-N 2 1 329.513 4.104 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1ccn(C)n1 ZINC000414068372 1021784844 /nfs/dbraw/zinc/78/48/44/1021784844.db2.gz JQQIOPUBBARSIS-KRWDZBQOSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)c1ccn(C)n1 ZINC000414068372 1021784865 /nfs/dbraw/zinc/78/48/65/1021784865.db2.gz JQQIOPUBBARSIS-KRWDZBQOSA-N 2 1 340.515 4.035 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C[C@@H]3C[C@H]3c3ccccc3)CC2)cc1 ZINC000163504569 1021800898 /nfs/dbraw/zinc/80/08/98/1021800898.db2.gz XEYKCBIZUFHGDN-GMAHTHKFSA-N 2 1 334.507 4.087 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1csc(-c2ccccc2)n1 ZINC000414085168 1021825032 /nfs/dbraw/zinc/82/50/32/1021825032.db2.gz YCHDIZMNQGUJPL-HUUCEWRRSA-N 2 1 340.496 4.302 20 0 EIADMP C[NH+](C/C=C/C[N@H+](C)Cc1cccc(F)c1)Cc1cccc(F)c1 ZINC000613366037 1021895540 /nfs/dbraw/zinc/89/55/40/1021895540.db2.gz SQGKZNXQACHGGP-ONEGZZNKSA-N 2 1 330.422 4.085 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1csc(-c2ccccc2)n1 ZINC000414131395 1021901592 /nfs/dbraw/zinc/90/15/92/1021901592.db2.gz XRFIYNOJICDSLX-OAHLLOKOSA-N 2 1 340.496 4.446 20 0 EIADMP Fc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1Cl ZINC000379769107 1021944160 /nfs/dbraw/zinc/94/41/60/1021944160.db2.gz NTLLKXVKSFFIDG-SFHVURJKSA-N 2 1 346.877 4.481 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000564429264 1022007898 /nfs/dbraw/zinc/00/78/98/1022007898.db2.gz PNXWTFOCIKYGHC-PZJWPPBQSA-N 2 1 337.511 4.343 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000564429264 1022007909 /nfs/dbraw/zinc/00/79/09/1022007909.db2.gz PNXWTFOCIKYGHC-PZJWPPBQSA-N 2 1 337.511 4.343 20 0 EIADMP COc1ccc2cc([C@H](C)[NH2+]CC[C@@H]3CCC[N@@H+](C)C3)ccc2c1 ZINC000414171312 1022022886 /nfs/dbraw/zinc/02/28/86/1022022886.db2.gz DFFQWXZJZKMYHY-IRXDYDNUSA-N 2 1 326.484 4.231 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[N@H+](C)C[C@@H]1CCn2cc[nH+]c2C1 ZINC000377861680 1022058054 /nfs/dbraw/zinc/05/80/54/1022058054.db2.gz SKJQCZDGKLGLBT-ZIAGYGMSSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[N@@H+](C)C[C@@H]1CCn2cc[nH+]c2C1 ZINC000377861680 1022058065 /nfs/dbraw/zinc/05/80/65/1022058065.db2.gz SKJQCZDGKLGLBT-ZIAGYGMSSA-N 2 1 337.389 4.157 20 0 EIADMP COC1CC([NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C1 ZINC000580576412 1022223427 /nfs/dbraw/zinc/22/34/27/1022223427.db2.gz SQKFVRYYMULQCH-AGONQYTISA-N 2 1 348.918 4.021 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000580579099 1022229231 /nfs/dbraw/zinc/22/92/31/1022229231.db2.gz WXOBWQBZFPIJNY-QRQLOZEOSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000580579099 1022229250 /nfs/dbraw/zinc/22/92/50/1022229250.db2.gz WXOBWQBZFPIJNY-QRQLOZEOSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)C[C@@H]2CCC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000580579099 1022229278 /nfs/dbraw/zinc/22/92/78/1022229278.db2.gz WXOBWQBZFPIJNY-QRQLOZEOSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)C[C@@H]2CCC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000580579099 1022229304 /nfs/dbraw/zinc/22/93/04/1022229304.db2.gz WXOBWQBZFPIJNY-QRQLOZEOSA-N 2 1 336.470 4.407 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000471602659 1022308180 /nfs/dbraw/zinc/30/81/80/1022308180.db2.gz CTHLLGUDIXOTHK-BQFCYCMXSA-N 2 1 344.524 4.318 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc(SCC)c1 ZINC000564611457 1022314443 /nfs/dbraw/zinc/31/44/43/1022314443.db2.gz CJZJKAZLJJHQGX-UHFFFAOYSA-N 2 1 331.529 4.470 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc(SCC)c1 ZINC000564611457 1022314463 /nfs/dbraw/zinc/31/44/63/1022314463.db2.gz CJZJKAZLJJHQGX-UHFFFAOYSA-N 2 1 331.529 4.470 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC(C)(C)OCC2CC2)cc1 ZINC000414252146 1022322172 /nfs/dbraw/zinc/32/21/72/1022322172.db2.gz CGLNGUCBJBNREA-OAHLLOKOSA-N 2 1 327.472 4.037 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cnc(-c4cccs4)s3)C2)CC1 ZINC000580636672 1022332035 /nfs/dbraw/zinc/33/20/35/1022332035.db2.gz ZNZWOZQUOSBSNF-HNNXBMFYSA-N 2 1 347.553 4.035 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Br)s1 ZINC000088163908 1022550566 /nfs/dbraw/zinc/55/05/66/1022550566.db2.gz XDUHJBGCTDZDSX-WODVXLOZSA-N 2 1 343.334 4.177 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC(C)(C)c2cccnc2)cc1 ZINC000414331004 1022574956 /nfs/dbraw/zinc/57/49/56/1022574956.db2.gz JTWIGIDISFABSS-MRXNPFEDSA-N 2 1 334.467 4.204 20 0 EIADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000236819376 1022656448 /nfs/dbraw/zinc/65/64/48/1022656448.db2.gz FAYZNICHHCFMPD-UHFFFAOYSA-N 2 1 334.813 4.321 20 0 EIADMP Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)n1 ZINC000186568683 1022675060 /nfs/dbraw/zinc/67/50/60/1022675060.db2.gz LQVTZTOONZTEKR-ZFWWWQNUSA-N 2 1 340.496 4.400 20 0 EIADMP c1nc(C2CCCC2)sc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647544381 1022786044 /nfs/dbraw/zinc/78/60/44/1022786044.db2.gz ZQMGYVMKVYWLFK-DLBZAZTESA-N 2 1 333.545 4.012 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CCC[C@H]([C@H](C)[NH3+])C3)s2)cc1 ZINC000430556799 1023006412 /nfs/dbraw/zinc/00/64/12/1023006412.db2.gz VKDCODRWJDXUEO-YJBOKZPZSA-N 2 1 343.540 4.493 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000624120500 1023086337 /nfs/dbraw/zinc/08/63/37/1023086337.db2.gz ALQHHGVSMURXMY-HUUCEWRRSA-N 2 1 344.421 4.010 20 0 EIADMP FC(F)c1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000178663849 1023165532 /nfs/dbraw/zinc/16/55/32/1023165532.db2.gz JHCMDIKLSGJTAT-UHFFFAOYSA-N 2 1 330.422 4.378 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)[C@@H]3C[C@H]3c3cccs3)CC2)[nH+]1 ZINC000417300771 1023249269 /nfs/dbraw/zinc/24/92/69/1023249269.db2.gz AYPNLCNLYVHTGB-RYQLBKOJSA-N 2 1 341.524 4.202 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@H+](C)[C@@H]2CCCC[C@@H]2c2ccccc2)s1 ZINC000414535013 1023252579 /nfs/dbraw/zinc/25/25/79/1023252579.db2.gz VYRZTDZVOQIZBP-RTBURBONSA-N 2 1 343.540 4.363 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@@H+](C)[C@@H]2CCCC[C@@H]2c2ccccc2)s1 ZINC000414535013 1023252589 /nfs/dbraw/zinc/25/25/89/1023252589.db2.gz VYRZTDZVOQIZBP-RTBURBONSA-N 2 1 343.540 4.363 20 0 EIADMP Brc1cccc2c1CCC[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000341188596 1023340218 /nfs/dbraw/zinc/34/02/18/1023340218.db2.gz MWPJBJJWRZJEBD-LBTNJELSSA-N 2 1 349.316 4.043 20 0 EIADMP C[C@@H](NCc1nsc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000660258046 1023394843 /nfs/dbraw/zinc/39/48/43/1023394843.db2.gz YVVYQIVNLLVQSE-CABCVRRESA-N 2 1 329.513 4.039 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2CC2(Cl)Cl)CC1 ZINC000728688751 1023395441 /nfs/dbraw/zinc/39/54/41/1023395441.db2.gz TZHBVXBJPKFBRT-QGZVFWFLSA-N 2 1 341.326 4.024 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H](OC)c1ccc(Cl)cc1 ZINC000549163193 1023405299 /nfs/dbraw/zinc/40/52/99/1023405299.db2.gz ZDBOCFFMFXVEME-GOSISDBHSA-N 2 1 349.906 4.199 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H](OC)c1ccc(Cl)cc1 ZINC000549163193 1023405302 /nfs/dbraw/zinc/40/53/02/1023405302.db2.gz ZDBOCFFMFXVEME-GOSISDBHSA-N 2 1 349.906 4.199 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(N[C@H](CCC[NH3+])c2ccccc2)CC1 ZINC000415052865 1023410129 /nfs/dbraw/zinc/41/01/29/1023410129.db2.gz LVQOOQNRRYKSRT-QIJUGHKUSA-N 2 1 343.559 4.099 20 0 EIADMP CSc1cc(C)ccc1C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415085907 1023434173 /nfs/dbraw/zinc/43/41/73/1023434173.db2.gz RABQSZALTJMZBW-MOPGFXCFSA-N 2 1 326.509 4.300 20 0 EIADMP Cc1sc([C@@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)nc1-c1ccc(Cl)cc1 ZINC000415088849 1023439318 /nfs/dbraw/zinc/43/93/18/1023439318.db2.gz VSTVZXKMXCAMNQ-OCCSQVGLSA-N 2 1 349.931 4.422 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]CCOc3cccc4ccccc43)CC[NH2+]2)cc1 ZINC000415093828 1023439589 /nfs/dbraw/zinc/43/95/89/1023439589.db2.gz WEZHASLTYYDVHJ-IRLDBZIGSA-N 2 1 346.474 4.302 20 0 EIADMP C[C@H](C[N@@H+](C)C[C@H]1CCC[NH+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078107 1023491441 /nfs/dbraw/zinc/49/14/41/1023491441.db2.gz ZUTLUDNOUHBORZ-CABCVRRESA-N 2 1 328.422 4.083 20 0 EIADMP C[C@H](C[NH+](C)C[C@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078107 1023491442 /nfs/dbraw/zinc/49/14/42/1023491442.db2.gz ZUTLUDNOUHBORZ-CABCVRRESA-N 2 1 328.422 4.083 20 0 EIADMP C[C@H](C[NH+](C)C[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078107 1023491448 /nfs/dbraw/zinc/49/14/48/1023491448.db2.gz ZUTLUDNOUHBORZ-CABCVRRESA-N 2 1 328.422 4.083 20 0 EIADMP C[C@@H](C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500106264 1023505012 /nfs/dbraw/zinc/50/50/12/1023505012.db2.gz ZLIHJQSZQXBZLJ-JKSUJKDBSA-N 2 1 340.433 4.227 20 0 EIADMP C[C@H](C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500106263 1023505116 /nfs/dbraw/zinc/50/51/16/1023505116.db2.gz ZLIHJQSZQXBZLJ-HZPDHXFCSA-N 2 1 340.433 4.227 20 0 EIADMP CCc1ccc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)cn1 ZINC000581693910 1023616125 /nfs/dbraw/zinc/61/61/25/1023616125.db2.gz VAGZZFNXVJSKFU-GOSISDBHSA-N 2 1 329.532 4.121 20 0 EIADMP Cc1c(NC(=O)C(C)(C)C)cc[nH+]c1NCCC[N@H+]1CCCC[C@@H]1C ZINC001167751769 1023626646 /nfs/dbraw/zinc/62/66/46/1023626646.db2.gz OFGKIBIUZUQZLG-HNNXBMFYSA-N 2 1 346.519 4.051 20 0 EIADMP Cc1c(NC(=O)C(C)(C)C)cc[nH+]c1NCCC[N@@H+]1CCCC[C@@H]1C ZINC001167751769 1023626653 /nfs/dbraw/zinc/62/66/53/1023626653.db2.gz OFGKIBIUZUQZLG-HNNXBMFYSA-N 2 1 346.519 4.051 20 0 EIADMP COc1c(Cl)cc(Cl)cc1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000511526647 1023635517 /nfs/dbraw/zinc/63/55/17/1023635517.db2.gz PZPQUSOCNKLMTL-UHFFFAOYSA-N 2 1 345.314 4.166 20 0 EIADMP CC[C@@H](Cc1cccs1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000684410402 1023661042 /nfs/dbraw/zinc/66/10/42/1023661042.db2.gz XPGGXCXUAWJJDX-OALUTQOASA-N 2 1 328.525 4.181 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2cnccc2c1 ZINC000398135724 1023700857 /nfs/dbraw/zinc/70/08/57/1023700857.db2.gz KYXLTWZHIKTRGV-WZONZLPQSA-N 2 1 345.490 4.235 20 0 EIADMP COc1ccc(F)c(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1 ZINC000549760771 1033155343 /nfs/dbraw/zinc/15/53/43/1033155343.db2.gz BROPSHVLSSPLIX-AUUYWEPGSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(F)c(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1 ZINC000549760771 1033155372 /nfs/dbraw/zinc/15/53/72/1033155372.db2.gz BROPSHVLSSPLIX-AUUYWEPGSA-N 2 1 348.487 4.069 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000581847179 1023762429 /nfs/dbraw/zinc/76/24/29/1023762429.db2.gz XUMGTXUDNDRSLE-SCZPIIQISA-N 2 1 326.406 4.040 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cncs1 ZINC000164179052 1023783063 /nfs/dbraw/zinc/78/30/63/1023783063.db2.gz ZUXDWNZAYBFXOM-INIZCTEOSA-N 2 1 329.513 4.370 20 0 EIADMP Fc1ccc(/C=C/C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000511784738 1023881786 /nfs/dbraw/zinc/88/17/86/1023881786.db2.gz HTRSVHHRMMMBJK-QTWIXLPOSA-N 2 1 342.433 4.090 20 0 EIADMP FC1(F)CC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000430750925 1024010468 /nfs/dbraw/zinc/01/04/68/1024010468.db2.gz QOJRTGZZCGJBAI-VNTMZGSJSA-N 2 1 348.481 4.312 20 0 EIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(OC(F)F)cc1 ZINC000164687586 1024800803 /nfs/dbraw/zinc/80/08/03/1024800803.db2.gz DPOMZSHYKHTADR-KRWDZBQOSA-N 2 1 337.414 4.314 20 0 EIADMP CC(C)c1ccc(C[C@@H](C)[NH2+]Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000511924624 1024802128 /nfs/dbraw/zinc/80/21/28/1024802128.db2.gz DUQYSUXJFYEWOA-OAHLLOKOSA-N 2 1 331.529 4.049 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(F)cc1OC(F)F ZINC000164699223 1024809634 /nfs/dbraw/zinc/80/96/34/1024809634.db2.gz SAXOQPPFLFWOCL-LBPRGKRZSA-N 2 1 341.377 4.063 20 0 EIADMP COCC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000510959287 1024866614 /nfs/dbraw/zinc/86/66/14/1024866614.db2.gz GEZQVOSMCFXMIE-VTHDOGFWSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1cscn1 ZINC000535777398 1024935299 /nfs/dbraw/zinc/93/52/99/1024935299.db2.gz FGNCJOQWENFDDQ-IXDOHACOSA-N 2 1 343.540 4.472 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1cscn1 ZINC000535777398 1024935306 /nfs/dbraw/zinc/93/53/06/1024935306.db2.gz FGNCJOQWENFDDQ-IXDOHACOSA-N 2 1 343.540 4.472 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000684611410 1025055989 /nfs/dbraw/zinc/05/59/89/1025055989.db2.gz GLMNPPYBBXFDNC-REWPJTCUSA-N 2 1 349.522 4.425 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2csc(-c3ccccc3F)n2)[C@@H]1CCC[NH3+] ZINC000662314539 1025067600 /nfs/dbraw/zinc/06/76/00/1025067600.db2.gz FGXLNKQFKYGFDO-RDTXWAMCSA-N 2 1 347.503 4.289 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2csc(-c3ccc(F)cc3)n2)[C@@H]1CCC[NH3+] ZINC000662317060 1025071640 /nfs/dbraw/zinc/07/16/40/1025071640.db2.gz ZFVASFICDVYIHB-RDTXWAMCSA-N 2 1 347.503 4.289 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2Oc2cccnc2)[C@@H]1CCC[NH3+] ZINC000662317204 1025072354 /nfs/dbraw/zinc/07/23/54/1025072354.db2.gz PBWKHETXHFCFNJ-YLJYHZDGSA-N 2 1 339.483 4.213 20 0 EIADMP FC(F)(F)C1CCC(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)CC1 ZINC000663346949 1025142025 /nfs/dbraw/zinc/14/20/25/1025142025.db2.gz YKKGRYCBZUZCRM-WIHSUSGWSA-N 2 1 332.454 4.067 20 0 EIADMP Oc1ccc(Cl)c(F)c1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000190727635 1025192465 /nfs/dbraw/zinc/19/24/65/1025192465.db2.gz HYEUQOHYSPGKEE-UHFFFAOYSA-N 2 1 348.849 4.070 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3cccc4cccnc43)CC2)n2c1CCCC2 ZINC000278876975 1025274019 /nfs/dbraw/zinc/27/40/19/1025274019.db2.gz MRCVVPDSBKQIEL-UHFFFAOYSA-N 2 1 346.478 4.147 20 0 EIADMP CC1CC([NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000467740791 1025284565 /nfs/dbraw/zinc/28/45/65/1025284565.db2.gz AKWVDAIVXNDBBB-IFVKIFKYSA-N 2 1 340.433 4.476 20 0 EIADMP CC1CC([NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000467740791 1025284577 /nfs/dbraw/zinc/28/45/77/1025284577.db2.gz AKWVDAIVXNDBBB-IFVKIFKYSA-N 2 1 340.433 4.476 20 0 EIADMP COCCC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1 ZINC000663465251 1025388235 /nfs/dbraw/zinc/38/82/35/1025388235.db2.gz IUTILJYPQAACOD-RXVVDRJESA-N 2 1 348.506 4.005 20 0 EIADMP Clc1cccc(C2CC([NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)C2)c1 ZINC000663466629 1025397058 /nfs/dbraw/zinc/39/70/58/1025397058.db2.gz WDABFGAASSKFTG-VQSBYGRUSA-N 2 1 332.919 4.298 20 0 EIADMP Fc1ccc2c(c1)[C@@H](NC[C@H]1CCC[N@@H+](CC3CC3)C1)CCS2 ZINC000663467764 1025409717 /nfs/dbraw/zinc/40/97/17/1025409717.db2.gz HZBSOABAFSPTNQ-QAPCUYQASA-N 2 1 334.504 4.074 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC3CC3)C1)CCS2 ZINC000663467764 1025409723 /nfs/dbraw/zinc/40/97/23/1025409723.db2.gz HZBSOABAFSPTNQ-QAPCUYQASA-N 2 1 334.504 4.074 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC3CC3)C1)CCS2 ZINC000663467764 1025409732 /nfs/dbraw/zinc/40/97/32/1025409732.db2.gz HZBSOABAFSPTNQ-QAPCUYQASA-N 2 1 334.504 4.074 20 0 EIADMP C[C@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469908 1025416095 /nfs/dbraw/zinc/41/60/95/1025416095.db2.gz RREQOHPAMNBVOG-GOEBONIOSA-N 2 1 338.442 4.061 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469908 1025416106 /nfs/dbraw/zinc/41/61/06/1025416106.db2.gz RREQOHPAMNBVOG-GOEBONIOSA-N 2 1 338.442 4.061 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469908 1025416115 /nfs/dbraw/zinc/41/61/15/1025416115.db2.gz RREQOHPAMNBVOG-GOEBONIOSA-N 2 1 338.442 4.061 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000518796442 1025489760 /nfs/dbraw/zinc/48/97/60/1025489760.db2.gz HKWZKMVMXDMGBN-HXUWFJFHSA-N 2 1 330.516 4.077 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccncc1 ZINC000638678803 1025666396 /nfs/dbraw/zinc/66/63/96/1025666396.db2.gz TWNPLTHOEYWALZ-BVSLBCMMSA-N 2 1 335.495 4.490 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccncc1 ZINC000638678803 1025666411 /nfs/dbraw/zinc/66/64/11/1025666411.db2.gz TWNPLTHOEYWALZ-BVSLBCMMSA-N 2 1 335.495 4.490 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(-c3scnc3C)cc2)CC1 ZINC000657294274 1025726379 /nfs/dbraw/zinc/72/63/79/1025726379.db2.gz KZVYCIVKXHGKGM-UHFFFAOYSA-N 2 1 329.513 4.083 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(F)c(F)c2F)cc1 ZINC000657297929 1025779498 /nfs/dbraw/zinc/77/94/98/1025779498.db2.gz QHAMEULTUQTSPH-UHFFFAOYSA-N 2 1 336.401 4.236 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001167833349 1025782204 /nfs/dbraw/zinc/78/22/04/1025782204.db2.gz APSSOASVHKWFRF-IFMALSPDSA-N 2 1 345.575 4.093 20 0 EIADMP Fc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c(F)c1F ZINC000657298973 1025782312 /nfs/dbraw/zinc/78/23/12/1025782312.db2.gz ZYCXUAONZYECAS-UHFFFAOYSA-N 2 1 348.412 4.380 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1c1cccc(C(=O)OC)c1 ZINC001167834082 1025811371 /nfs/dbraw/zinc/81/13/71/1025811371.db2.gz HLINSFRWUMWWCZ-FXAWDEMLSA-N 2 1 346.515 4.121 20 0 EIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)CCn1ccc2cc(Cl)ccc21 ZINC001167510002 1025826598 /nfs/dbraw/zinc/82/65/98/1025826598.db2.gz SHRLLUWZYMIDFP-GOSISDBHSA-N 2 1 333.907 4.101 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)CCn1ccc2cc(Cl)ccc21 ZINC001167510002 1025826601 /nfs/dbraw/zinc/82/66/01/1025826601.db2.gz SHRLLUWZYMIDFP-GOSISDBHSA-N 2 1 333.907 4.101 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)CCn1ccc2cc(Cl)ccc21 ZINC001167510002 1025826603 /nfs/dbraw/zinc/82/66/03/1025826603.db2.gz SHRLLUWZYMIDFP-GOSISDBHSA-N 2 1 333.907 4.101 20 0 EIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)CCn1ccc2cc(Cl)ccc21 ZINC001167510003 1025827255 /nfs/dbraw/zinc/82/72/55/1025827255.db2.gz SHRLLUWZYMIDFP-SFHVURJKSA-N 2 1 333.907 4.101 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)CCn1ccc2cc(Cl)ccc21 ZINC001167510003 1025827261 /nfs/dbraw/zinc/82/72/61/1025827261.db2.gz SHRLLUWZYMIDFP-SFHVURJKSA-N 2 1 333.907 4.101 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)CCn1ccc2cc(Cl)ccc21 ZINC001167510003 1025827264 /nfs/dbraw/zinc/82/72/64/1025827264.db2.gz SHRLLUWZYMIDFP-SFHVURJKSA-N 2 1 333.907 4.101 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H]2CCCOc3c(C)cc(Cl)cc32)CC1 ZINC000431323824 1025842115 /nfs/dbraw/zinc/84/21/15/1025842115.db2.gz QGILRKJDOYHBAC-SFHVURJKSA-N 2 1 336.907 4.326 20 0 EIADMP CCCOc1ccccc1[C@H](CC(C)C)[NH2+]CCn1cc[nH+]c1C ZINC000342318644 1025845605 /nfs/dbraw/zinc/84/56/05/1025845605.db2.gz FDKPAACXIQYMDI-IBGZPJMESA-N 2 1 329.488 4.357 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](CC)[C@H]1CCN(Cc2ccccc2)C1 ZINC001167838965 1025851691 /nfs/dbraw/zinc/85/16/91/1025851691.db2.gz XGONZEJYRFVWEM-IRLDBZIGSA-N 2 1 345.575 4.093 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H](Cc2ccc(OC)cc2)C1 ZINC001167839903 1025855444 /nfs/dbraw/zinc/85/54/44/1025855444.db2.gz COTPULONLFKIGA-FPOVZHCZSA-N 2 1 346.559 4.460 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H](Cc2ccc(OC)cc2)C1 ZINC001167839901 1025855627 /nfs/dbraw/zinc/85/56/27/1025855627.db2.gz COTPULONLFKIGA-CTNGQTDRSA-N 2 1 346.559 4.460 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(SC(F)F)cc1 ZINC000278943183 1025856134 /nfs/dbraw/zinc/85/61/34/1025856134.db2.gz KJZVIACXTKNKGS-OLZOCXBDSA-N 2 1 337.439 4.111 20 0 EIADMP [NH3+]Cc1cn(C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccc(Cl)cc12 ZINC001167967109 1025865100 /nfs/dbraw/zinc/86/51/00/1025865100.db2.gz BVNJVSJWTSRULH-JWTNVVGKSA-N 2 1 343.902 4.331 20 0 EIADMP c1ccc(CCCC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000137699259 1025870254 /nfs/dbraw/zinc/87/02/54/1025870254.db2.gz WYTAPNDYYSKNIM-UHFFFAOYSA-N 2 1 336.523 4.306 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2ccc3occc3c2)CC1 ZINC000512084893 1025915320 /nfs/dbraw/zinc/91/53/20/1025915320.db2.gz SBQCICMFDJLVSL-UHFFFAOYSA-N 2 1 334.463 4.495 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1cc2ccccc2o1 ZINC000432424947 1025917013 /nfs/dbraw/zinc/91/70/13/1025917013.db2.gz KODMTGGKFFCYTP-LAUBAEHRSA-N 2 1 344.499 4.220 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1cc2ccccc2o1 ZINC000432424947 1025917039 /nfs/dbraw/zinc/91/70/39/1025917039.db2.gz KODMTGGKFFCYTP-LAUBAEHRSA-N 2 1 344.499 4.220 20 0 EIADMP [NH3+][C@H]1CCc2c(c3ccccc3n2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C1 ZINC001167968902 1025934787 /nfs/dbraw/zinc/93/47/87/1025934787.db2.gz WMPMNLASEJZUPL-HTUJPFKRSA-N 2 1 349.522 4.035 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C12CCC2 ZINC000344082738 1025975178 /nfs/dbraw/zinc/97/51/78/1025975178.db2.gz ZOMYSKSZMRPCKW-UIAACRFSSA-N 2 1 339.483 4.179 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]Cc3ccc4occc4c3)C2)c1 ZINC000512099164 1025995198 /nfs/dbraw/zinc/99/51/98/1025995198.db2.gz KIORRWVZZGROFT-QGZVFWFLSA-N 2 1 340.492 4.496 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]Cc3ccc4occc4c3)C2)c1 ZINC000512099164 1025995229 /nfs/dbraw/zinc/99/52/29/1025995229.db2.gz KIORRWVZZGROFT-QGZVFWFLSA-N 2 1 340.492 4.496 20 0 EIADMP [NH3+][C@@H]1CCc2c3ccccc3n(C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)c2C1 ZINC001167969834 1026031111 /nfs/dbraw/zinc/03/11/11/1026031111.db2.gz FRZCUZAOTXHITM-KAKFPZCNSA-N 2 1 349.522 4.035 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(C)c(Br)s2)C1 ZINC000512130020 1026079327 /nfs/dbraw/zinc/07/93/27/1026079327.db2.gz MNMSTUIGANKHDT-CHWSQXEVSA-N 2 1 345.350 4.202 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H]2CCCC[C@@H]2Cc2ccccc2)s1 ZINC000512135406 1026107792 /nfs/dbraw/zinc/10/77/92/1026107792.db2.gz JVHSKQHOKCTOAY-IEBWSBKVSA-N 2 1 343.540 4.096 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000431353862 1026149810 /nfs/dbraw/zinc/14/98/10/1026149810.db2.gz XCSHWZKNYSTUFS-HLIPFELVSA-N 2 1 328.500 4.240 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3cccc4cc[nH]c43)C2)CC1 ZINC000512164658 1026193291 /nfs/dbraw/zinc/19/32/91/1026193291.db2.gz DBUNJRVFSADZPT-GOSISDBHSA-N 2 1 325.500 4.112 20 0 EIADMP Fc1cccc2c1CCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167975191 1026217758 /nfs/dbraw/zinc/21/77/58/1026217758.db2.gz LGPDVTPZXAAVKM-IMOOIFFWSA-N 2 1 328.475 4.198 20 0 EIADMP Fc1ccc2c(c1)CCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167975120 1026221280 /nfs/dbraw/zinc/22/12/80/1026221280.db2.gz HWAZKHWRQNKKDQ-QYYYHEGRSA-N 2 1 328.475 4.198 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(C3CCC3)cc2)[C@@H](C)C1 ZINC000550138372 1026224393 /nfs/dbraw/zinc/22/43/93/1026224393.db2.gz DKRAVRWHUSBTAN-AVRDEDQJSA-N 2 1 344.543 4.181 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000344306329 1026237012 /nfs/dbraw/zinc/23/70/12/1026237012.db2.gz WHYZKULLOBYBJN-LBPRGKRZSA-N 2 1 331.312 4.284 20 0 EIADMP CCc1nc2c(s1)[C@@H]([N@H+](C)CCCCn1cc[nH+]c1C)CCC2 ZINC000163326853 1026369866 /nfs/dbraw/zinc/36/98/66/1026369866.db2.gz TVJQJDOVXRRWQS-INIZCTEOSA-N 2 1 332.517 4.000 20 0 EIADMP CCc1nc2c(s1)[C@@H]([N@@H+](C)CCCCn1cc[nH+]c1C)CCC2 ZINC000163326853 1026369877 /nfs/dbraw/zinc/36/98/77/1026369877.db2.gz TVJQJDOVXRRWQS-INIZCTEOSA-N 2 1 332.517 4.000 20 0 EIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CS1 ZINC000709726464 1026426161 /nfs/dbraw/zinc/42/61/61/1026426161.db2.gz MGPVRDJLBULYDN-NZSAHSFTSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CS1 ZINC000709726464 1026426167 /nfs/dbraw/zinc/42/61/67/1026426167.db2.gz MGPVRDJLBULYDN-NZSAHSFTSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cccc3[nH]ccc32)C1 ZINC000512210342 1026471550 /nfs/dbraw/zinc/47/15/50/1026471550.db2.gz CRSIVWJQOHJUJC-QZTJIDSGSA-N 2 1 325.500 4.254 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cccc3[nH]ccc32)C1 ZINC000512210342 1026471555 /nfs/dbraw/zinc/47/15/55/1026471555.db2.gz CRSIVWJQOHJUJC-QZTJIDSGSA-N 2 1 325.500 4.254 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000512210342 1026471562 /nfs/dbraw/zinc/47/15/62/1026471562.db2.gz CRSIVWJQOHJUJC-QZTJIDSGSA-N 2 1 325.500 4.254 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cccc3[nH]ccc32)C1 ZINC000512210344 1026472661 /nfs/dbraw/zinc/47/26/61/1026472661.db2.gz CRSIVWJQOHJUJC-ROUUACIJSA-N 2 1 325.500 4.254 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cccc3[nH]ccc32)C1 ZINC000512210344 1026472665 /nfs/dbraw/zinc/47/26/65/1026472665.db2.gz CRSIVWJQOHJUJC-ROUUACIJSA-N 2 1 325.500 4.254 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000512210344 1026472671 /nfs/dbraw/zinc/47/26/71/1026472671.db2.gz CRSIVWJQOHJUJC-ROUUACIJSA-N 2 1 325.500 4.254 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cc[nH]c32)C1 ZINC000512214518 1026475967 /nfs/dbraw/zinc/47/59/67/1026475967.db2.gz WOIPRMWVYADPDZ-ZWKOTPCHSA-N 2 1 325.500 4.254 20 0 EIADMP C[N@H+]1C[C@@H](C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)[C@H](c2ccccc2)C1 ZINC000647249291 1026495843 /nfs/dbraw/zinc/49/58/43/1026495843.db2.gz PRQVQXNUXQPPBY-MALNDZBISA-N 2 1 349.522 4.043 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657430659 1026644149 /nfs/dbraw/zinc/64/41/49/1026644149.db2.gz ULRYCYSNZXYOSA-WBVHZDCISA-N 2 1 346.490 4.110 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000657430659 1026644154 /nfs/dbraw/zinc/64/41/54/1026644154.db2.gz ULRYCYSNZXYOSA-WBVHZDCISA-N 2 1 346.490 4.110 20 0 EIADMP Fc1ccc(C[N@@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000432666729 1026699342 /nfs/dbraw/zinc/69/93/42/1026699342.db2.gz FOYNEZMQYYHLQA-GOSISDBHSA-N 2 1 330.472 4.032 20 0 EIADMP C[C@H](NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512333833 1026725302 /nfs/dbraw/zinc/72/53/02/1026725302.db2.gz XOSKDQZJOVRKRN-RBUKOAKNSA-N 2 1 347.591 4.026 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512333833 1026725318 /nfs/dbraw/zinc/72/53/18/1026725318.db2.gz XOSKDQZJOVRKRN-RBUKOAKNSA-N 3 1 347.591 4.026 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512333833 1026725324 /nfs/dbraw/zinc/72/53/24/1026725324.db2.gz XOSKDQZJOVRKRN-RBUKOAKNSA-N 3 1 347.591 4.026 20 0 EIADMP Cc1ccc2cc(C[NH2+]C[C@@H]3CC[N@@H+](Cc4ccccc4)C3)[nH]c2c1 ZINC000657452858 1026769687 /nfs/dbraw/zinc/76/96/87/1026769687.db2.gz LPDQIEBPXQPAID-IBGZPJMESA-N 2 1 333.479 4.088 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000507506129 1026819158 /nfs/dbraw/zinc/81/91/58/1026819158.db2.gz FGDOEMJZILTWKW-BBTUJRGHSA-N 2 1 337.511 4.348 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OC(C)C)c(OC)c2)CC1 ZINC000125275299 1026822716 /nfs/dbraw/zinc/82/27/16/1026822716.db2.gz CXXPZFLECIADAD-MRXNPFEDSA-N 2 1 334.504 4.007 20 0 EIADMP CCC(CC)(C[NH2+][C@H](C)[C@H]1CCCOC1)[NH2+][C@H](C)c1ccccc1 ZINC000507523757 1026826886 /nfs/dbraw/zinc/82/68/86/1026826886.db2.gz DIHGUZFQXRVDBV-GGPKGHCWSA-N 2 1 332.532 4.301 20 0 EIADMP CCc1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)s1 ZINC000582584284 1026833054 /nfs/dbraw/zinc/83/30/54/1026833054.db2.gz RZMIOGGIFKMXKX-UHFFFAOYSA-N 2 1 329.513 4.223 20 0 EIADMP C[C@@H](Cc1ccsc1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000582586269 1026834100 /nfs/dbraw/zinc/83/41/00/1026834100.db2.gz LHWAMJVGWAAZDD-LRGNLBRXSA-N 2 1 340.536 4.464 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCCc4cccnc43)C2)c1 ZINC000684956485 1026889893 /nfs/dbraw/zinc/88/98/93/1026889893.db2.gz ZWYUICVBXZSXPD-VQIMIIECSA-N 2 1 341.524 4.022 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CCCc4cccnc43)C2)c1 ZINC000684956485 1026889894 /nfs/dbraw/zinc/88/98/94/1026889894.db2.gz ZWYUICVBXZSXPD-VQIMIIECSA-N 2 1 341.524 4.022 20 0 EIADMP Clc1c[nH+]ccc1N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000431473882 1026958990 /nfs/dbraw/zinc/95/89/90/1026958990.db2.gz CGXQRWSOTIHGKA-UHFFFAOYSA-N 2 1 341.886 4.228 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC1([NH+](C)C)CCCC1 ZINC000474497958 1027149182 /nfs/dbraw/zinc/14/91/82/1027149182.db2.gz ZMTPONJSBJRXNJ-CABCVRRESA-N 2 1 331.529 4.252 20 0 EIADMP 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 1027164281 /nfs/dbraw/zinc/16/42/81/1027164281.db2.gz SEHWPXBTUMHCPE-VMUDFCTBSA-N 2 1 328.422 4.127 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(CNc2cc[nH+]c3ccc(C)cc23)cn1 ZINC000302174910 1027243415 /nfs/dbraw/zinc/24/34/15/1027243415.db2.gz WNUOJVHHGQPWDT-UHFFFAOYSA-N 2 1 329.407 4.044 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000342858337 1027330316 /nfs/dbraw/zinc/33/03/16/1027330316.db2.gz DCNLWTCVLLTBQH-JOCHJYFZSA-N 2 1 331.463 4.229 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000342858337 1027330331 /nfs/dbraw/zinc/33/03/31/1027330331.db2.gz DCNLWTCVLLTBQH-JOCHJYFZSA-N 2 1 331.463 4.229 20 0 EIADMP Cc1cc(N[C@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)cc[nH+]1 ZINC000302570441 1027336398 /nfs/dbraw/zinc/33/63/98/1027336398.db2.gz PHNBPSQXZSXLTL-KRWDZBQOSA-N 2 1 335.373 4.095 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CSc3ccccc32)C[C@H]1c1ccccc1 ZINC000453217928 1027340683 /nfs/dbraw/zinc/34/06/83/1027340683.db2.gz JPMCNZVXWICEMB-HBFSDRIKSA-N 2 1 338.520 4.301 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CSc3ccccc32)C[C@H]1c1ccccc1 ZINC000453217928 1027340697 /nfs/dbraw/zinc/34/06/97/1027340697.db2.gz JPMCNZVXWICEMB-HBFSDRIKSA-N 2 1 338.520 4.301 20 0 EIADMP Cc1ccc(CCC[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)cn1 ZINC000474730299 1027448122 /nfs/dbraw/zinc/44/81/22/1027448122.db2.gz PCRCGSJJFZSXJS-IBGZPJMESA-N 2 1 337.511 4.138 20 0 EIADMP C[C@@]1(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1(F)F ZINC000657669284 1027482624 /nfs/dbraw/zinc/48/26/24/1027482624.db2.gz CMKFETUZMODAON-QZTJIDSGSA-N 2 1 334.454 4.209 20 0 EIADMP C[C@@]1(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1(F)F ZINC000657669284 1027482636 /nfs/dbraw/zinc/48/26/36/1027482636.db2.gz CMKFETUZMODAON-QZTJIDSGSA-N 2 1 334.454 4.209 20 0 EIADMP Oc1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)C3(CC3)C1)CC2 ZINC000657695098 1027614025 /nfs/dbraw/zinc/61/40/25/1027614025.db2.gz ZIBDHOMYADSHSV-UGKGYDQZSA-N 2 1 348.490 4.166 20 0 EIADMP Oc1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)C3(CC3)C1)CC2 ZINC000657695098 1027614042 /nfs/dbraw/zinc/61/40/42/1027614042.db2.gz ZIBDHOMYADSHSV-UGKGYDQZSA-N 2 1 348.490 4.166 20 0 EIADMP COc1ccc([C@H](C)[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995135 1027739900 /nfs/dbraw/zinc/73/99/00/1027739900.db2.gz XJSCPQUYZLSESJ-LATSOQNDSA-N 2 1 328.500 4.093 20 0 EIADMP COc1ccc([C@H](C)[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167995135 1027739931 /nfs/dbraw/zinc/73/99/31/1027739931.db2.gz XJSCPQUYZLSESJ-LATSOQNDSA-N 2 1 328.500 4.093 20 0 EIADMP COc1ccc([C@H](C)[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167995135 1027739955 /nfs/dbraw/zinc/73/99/55/1027739955.db2.gz XJSCPQUYZLSESJ-LATSOQNDSA-N 2 1 328.500 4.093 20 0 EIADMP Fc1ccc([C@@H]2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)C2)cc1 ZINC001167994511 1027750880 /nfs/dbraw/zinc/75/08/80/1027750880.db2.gz HAOQCUJGGIISIX-OKCRPCIYSA-N 2 1 328.475 4.020 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCc2ccc(Br)cc21 ZINC000338012553 1027761024 /nfs/dbraw/zinc/76/10/24/1027761024.db2.gz SDDRQCFPGXADGS-KRWDZBQOSA-N 2 1 348.288 4.011 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000249124405 1027790709 /nfs/dbraw/zinc/79/07/09/1027790709.db2.gz UNCDKBBRJUTRME-COXVUDFISA-N 2 1 326.406 4.025 20 0 EIADMP Fc1ccccc1[C@H]1CC[N@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)C1 ZINC001167995639 1027792445 /nfs/dbraw/zinc/79/24/45/1027792445.db2.gz MCOPMQVTBIFADW-HTUJPFKRSA-N 2 1 328.475 4.020 20 0 EIADMP Fc1ccccc1[C@H]1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C1 ZINC001167995639 1027792464 /nfs/dbraw/zinc/79/24/64/1027792464.db2.gz MCOPMQVTBIFADW-HTUJPFKRSA-N 2 1 328.475 4.020 20 0 EIADMP Fc1ccccc1[C@H]1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C1 ZINC001167995639 1027792486 /nfs/dbraw/zinc/79/24/86/1027792486.db2.gz MCOPMQVTBIFADW-HTUJPFKRSA-N 2 1 328.475 4.020 20 0 EIADMP c1ccc([C@H]2CSCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167995833 1027812266 /nfs/dbraw/zinc/81/22/66/1027812266.db2.gz RJUWSKKWXGFWSR-JGUMPVPUSA-N 2 1 342.552 4.182 20 0 EIADMP c1ccc([C@H]2CSCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167995833 1027812268 /nfs/dbraw/zinc/81/22/68/1027812268.db2.gz RJUWSKKWXGFWSR-JGUMPVPUSA-N 2 1 342.552 4.182 20 0 EIADMP c1ccc([C@H]2CSCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995833 1027812270 /nfs/dbraw/zinc/81/22/70/1027812270.db2.gz RJUWSKKWXGFWSR-JGUMPVPUSA-N 2 1 342.552 4.182 20 0 EIADMP c1ccc([C@H]2CSCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995833 1027812275 /nfs/dbraw/zinc/81/22/75/1027812275.db2.gz RJUWSKKWXGFWSR-JGUMPVPUSA-N 2 1 342.552 4.182 20 0 EIADMP CC(F)(F)CCC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167648722 1027851582 /nfs/dbraw/zinc/85/15/82/1027851582.db2.gz XLXFZCVLFLCJPK-RTBURBONSA-N 2 1 336.470 4.408 20 0 EIADMP CC(F)(F)CCC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001167648722 1027851586 /nfs/dbraw/zinc/85/15/86/1027851586.db2.gz XLXFZCVLFLCJPK-RTBURBONSA-N 2 1 336.470 4.408 20 0 EIADMP CC(F)(F)CCC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001167648722 1027851596 /nfs/dbraw/zinc/85/15/96/1027851596.db2.gz XLXFZCVLFLCJPK-RTBURBONSA-N 2 1 336.470 4.408 20 0 EIADMP CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cs1 ZINC000162321357 1027855806 /nfs/dbraw/zinc/85/58/06/1027855806.db2.gz DOTLMCVMHDGIHE-LSDHHAIUSA-N 2 1 347.528 4.058 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCc3c2cccc3C)cc1F ZINC000153692800 1027872860 /nfs/dbraw/zinc/87/28/60/1027872860.db2.gz MUUBPXHVNIWXAB-FQEVSTJZSA-N 2 1 335.426 4.405 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCC[NH+]2CCCCC2)ccc1OC(C)C ZINC000444607303 1027887784 /nfs/dbraw/zinc/88/77/84/1027887784.db2.gz IJCOOROTYJUIMT-QGZVFWFLSA-N 2 1 334.504 4.009 20 0 EIADMP C[C@@H]1CC([N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168044900 1027888399 /nfs/dbraw/zinc/88/83/99/1027888399.db2.gz HLNMXZKLZJFLDL-LFEHRJTNSA-N 2 1 334.454 4.015 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2)cc1F ZINC000153726379 1027893086 /nfs/dbraw/zinc/89/30/86/1027893086.db2.gz IVNVEQPLPPZYCR-ZDUSSCGKSA-N 2 1 327.378 4.310 20 0 EIADMP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)C2)c1 ZINC000280803822 1027894180 /nfs/dbraw/zinc/89/41/80/1027894180.db2.gz LBRWSLUVFNRDMD-LEUOFYLZSA-N 2 1 338.417 4.168 20 0 EIADMP C[N@@H+]1CCCC12CC[NH+](Cc1ccc(-c3ccsc3)cc1)CC2 ZINC000444682238 1027964778 /nfs/dbraw/zinc/96/47/78/1027964778.db2.gz ZIOCJPCZPDRHIT-UHFFFAOYSA-N 2 1 326.509 4.475 20 0 EIADMP C[N@H+]1CCCC12CC[NH+](Cc1ccc(-c3ccsc3)cc1)CC2 ZINC000444682238 1027964807 /nfs/dbraw/zinc/96/48/07/1027964807.db2.gz ZIOCJPCZPDRHIT-UHFFFAOYSA-N 2 1 326.509 4.475 20 0 EIADMP 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 1027965051 /nfs/dbraw/zinc/96/50/51/1027965051.db2.gz LGSLDZACRGQSPI-IRCVMFFPSA-N 2 1 348.481 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168045844 1027965070 /nfs/dbraw/zinc/96/50/70/1027965070.db2.gz LGSLDZACRGQSPI-IRCVMFFPSA-N 2 1 348.481 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168045844 1027965092 /nfs/dbraw/zinc/96/50/92/1027965092.db2.gz LGSLDZACRGQSPI-IRCVMFFPSA-N 2 1 348.481 4.405 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000520460117 1028044666 /nfs/dbraw/zinc/04/46/66/1028044666.db2.gz XUCYOUUHUYTUOZ-CBBWQLFWSA-N 2 1 326.937 4.213 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000346158408 1028289495 /nfs/dbraw/zinc/28/94/95/1028289495.db2.gz BPGBVVUZILURNG-UHFFFAOYSA-N 2 1 336.439 4.114 20 0 EIADMP CCC[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1ccc(F)cc1 ZINC000346189716 1028296737 /nfs/dbraw/zinc/29/67/37/1028296737.db2.gz ZBWTUPSAZDUOCN-UHFFFAOYSA-N 2 1 338.430 4.127 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC[N@@H+]1C ZINC000280948327 1028298755 /nfs/dbraw/zinc/29/87/55/1028298755.db2.gz XCUBHQRGRDSTPW-CSFVBSKPSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC[N@H+]1C ZINC000280948327 1028298775 /nfs/dbraw/zinc/29/87/75/1028298775.db2.gz XCUBHQRGRDSTPW-CSFVBSKPSA-N 2 1 326.406 4.024 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)Cc1cccc2ccccc21 ZINC000346164603 1028299173 /nfs/dbraw/zinc/29/91/73/1028299173.db2.gz DMUKWZWIUGPYRG-UHFFFAOYSA-N 2 1 342.446 4.361 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@]3(C2)CCCCO3)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168048484 1028301151 /nfs/dbraw/zinc/30/11/51/1028301151.db2.gz VXDAOMLZXPHMNN-MXNKGDRCSA-N 2 1 342.527 4.073 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCCC[C@H]1Cc1ccccc1 ZINC000346174696 1028305292 /nfs/dbraw/zinc/30/52/92/1028305292.db2.gz MQOJYBRFZAWBAL-QFIPXVFZSA-N 2 1 346.478 4.173 20 0 EIADMP Fc1cncc([C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C2CC2)c1 ZINC000281500116 1028656111 /nfs/dbraw/zinc/65/61/11/1028656111.db2.gz GQUBDGKJIQRLJJ-FQEVSTJZSA-N 2 1 331.479 4.059 20 0 EIADMP C[C@H](CC[NH2+][C@H]1CC2(CCC2)Oc2ccccc21)[NH+]1CCCCC1 ZINC000346868723 1028803683 /nfs/dbraw/zinc/80/36/83/1028803683.db2.gz CLLIAUIEOVXVDK-MJGOQNOKSA-N 2 1 328.500 4.287 20 0 EIADMP CCCCOc1ccc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)cc1OCC ZINC000508540928 1028872910 /nfs/dbraw/zinc/87/29/10/1028872910.db2.gz IBYJGYZQZALWGW-LJQANCHMSA-N 2 1 348.531 4.038 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)C[C@@H]2CCC[NH+](C)C2)cc1OCC ZINC000508540928 1028872918 /nfs/dbraw/zinc/87/29/18/1028872918.db2.gz IBYJGYZQZALWGW-LJQANCHMSA-N 2 1 348.531 4.038 20 0 EIADMP CCCCOc1ccc(C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)cc1OCC ZINC000508540928 1028872930 /nfs/dbraw/zinc/87/29/30/1028872930.db2.gz IBYJGYZQZALWGW-LJQANCHMSA-N 2 1 348.531 4.038 20 0 EIADMP CCCCOc1ccc(C[NH+](C)C[C@@H]2CCC[N@@H+](C)C2)cc1OCC ZINC000508540928 1028872931 /nfs/dbraw/zinc/87/29/31/1028872931.db2.gz IBYJGYZQZALWGW-LJQANCHMSA-N 2 1 348.531 4.038 20 0 EIADMP CC[N@H+](Cc1cccnc1)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168055654 1029202604 /nfs/dbraw/zinc/20/26/04/1029202604.db2.gz XCSAUPZYCMKESZ-RTBURBONSA-N 2 1 337.511 4.345 20 0 EIADMP CC[N@@H+](Cc1cccnc1)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168055654 1029202616 /nfs/dbraw/zinc/20/26/16/1029202616.db2.gz XCSAUPZYCMKESZ-RTBURBONSA-N 2 1 337.511 4.345 20 0 EIADMP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000278441986 1029230610 /nfs/dbraw/zinc/23/06/10/1029230610.db2.gz UTDHKWXRNOPOOX-MRXNPFEDSA-N 2 1 341.474 4.193 20 0 EIADMP CCc1nc(C[NH+]2CCC(CC[N@@H+](CC)CC3CC3)CC2)cs1 ZINC000536142067 1029250550 /nfs/dbraw/zinc/25/05/50/1029250550.db2.gz ZUGFFKRAIAICBB-UHFFFAOYSA-N 2 1 335.561 4.040 20 0 EIADMP CCc1nc(C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)cs1 ZINC000536142067 1029250563 /nfs/dbraw/zinc/25/05/63/1029250563.db2.gz ZUGFFKRAIAICBB-UHFFFAOYSA-N 2 1 335.561 4.040 20 0 EIADMP CC(C)CCOc1ccc(C[N@H+]2CCCC23CC[NH+](C)CC3)cc1 ZINC000475126178 1029280703 /nfs/dbraw/zinc/28/07/03/1029280703.db2.gz AYOHPSMPGBRSSM-UHFFFAOYSA-N 2 1 330.516 4.172 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000583957368 1029418147 /nfs/dbraw/zinc/41/81/47/1029418147.db2.gz VVSFGDNBXSTBSZ-FGCJYXMVSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000583957368 1029418151 /nfs/dbraw/zinc/41/81/51/1029418151.db2.gz VVSFGDNBXSTBSZ-FGCJYXMVSA-N 2 1 338.417 4.325 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000475281266 1029497223 /nfs/dbraw/zinc/49/72/23/1029497223.db2.gz PWKAYWQMCYOSJW-SJLPKXTDSA-N 2 1 336.470 4.312 20 0 EIADMP CCC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccn1 ZINC000158893898 1029611679 /nfs/dbraw/zinc/61/16/79/1029611679.db2.gz JCPZEZCTUFCBCQ-PKOBYXMFSA-N 2 1 343.540 4.486 20 0 EIADMP CCC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccn1 ZINC000158893898 1029611687 /nfs/dbraw/zinc/61/16/87/1029611687.db2.gz JCPZEZCTUFCBCQ-PKOBYXMFSA-N 2 1 343.540 4.486 20 0 EIADMP CC[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000657829510 1029628039 /nfs/dbraw/zinc/62/80/39/1029628039.db2.gz DMGYTQPDBKJGQL-INIZCTEOSA-N 2 1 340.433 4.243 20 0 EIADMP CC(C)[N@H+](Cc1ccccc1N(C)C1CC[NH+](C)CC1)CC1CCC1 ZINC000446923457 1029640459 /nfs/dbraw/zinc/64/04/59/1029640459.db2.gz VQRMQQULZCLXIU-UHFFFAOYSA-N 2 1 343.559 4.228 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc2ccncc2s1 ZINC000657837990 1029732539 /nfs/dbraw/zinc/73/25/39/1029732539.db2.gz LTXXPTONJRQIOW-HZPDHXFCSA-N 2 1 331.529 4.459 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cc2cnccc2o1 ZINC000657839675 1029733482 /nfs/dbraw/zinc/73/34/82/1029733482.db2.gz YJQALDRHKRUTQW-IXDOHACOSA-N 2 1 329.488 4.237 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000090586602 1029867780 /nfs/dbraw/zinc/86/77/80/1029867780.db2.gz XSWBVFZLUNSTIJ-VWPQPMDRSA-N 2 1 344.543 4.112 20 0 EIADMP CCc1ccc([C@@H](CO)[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000090844062 1029870544 /nfs/dbraw/zinc/87/05/44/1029870544.db2.gz VTPNTRGOTUWVND-KSFYIVLOSA-N 2 1 349.478 4.127 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000657864815 1029890753 /nfs/dbraw/zinc/89/07/53/1029890753.db2.gz RYQPWSRTROZTFR-LLVKDONJSA-N 2 1 345.796 4.085 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)s2)cc1 ZINC000092073921 1029899346 /nfs/dbraw/zinc/89/93/46/1029899346.db2.gz UZXRSIDLULWDBM-MRXNPFEDSA-N 2 1 338.480 4.221 20 0 EIADMP FC(F)Oc1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)cc1Cl ZINC000092073916 1029899852 /nfs/dbraw/zinc/89/98/52/1029899852.db2.gz NMLJQVHCWHLZHB-LBPRGKRZSA-N 2 1 341.789 4.044 20 0 EIADMP COc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1Cl ZINC000450728076 1029932792 /nfs/dbraw/zinc/93/27/92/1029932792.db2.gz NYJVSADYNSVNNL-ZBFHGGJFSA-N 2 1 336.907 4.091 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCc2cc(Cl)cc(Cl)c2)CC1 ZINC000447345097 1030024371 /nfs/dbraw/zinc/02/43/71/1030024371.db2.gz IADUTGDUIORBST-UHFFFAOYSA-N 2 1 329.315 4.341 20 0 EIADMP Cc1ccc(C)c([C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000392266637 1030079677 /nfs/dbraw/zinc/07/96/77/1030079677.db2.gz OQQNUZCYDRYQMX-AUSIDOKSSA-N 2 1 334.507 4.467 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447522310 1030117767 /nfs/dbraw/zinc/11/77/67/1030117767.db2.gz QDISWBXQPROLSE-ZIBCJSCZSA-N 2 1 338.495 4.386 20 0 EIADMP CC[C@@H]([NH3+])C[NH2+][C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000219493108 1030138008 /nfs/dbraw/zinc/13/80/08/1030138008.db2.gz RQAXWBBKZCRCEN-QPUJVOFHSA-N 2 1 328.300 4.112 20 0 EIADMP FC1(F)CC[C@@H](C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC000450981559 1030158185 /nfs/dbraw/zinc/15/81/85/1030158185.db2.gz IYLQQWYUBYFUKN-MOPGFXCFSA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC[C@@H](C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC000450981559 1030158207 /nfs/dbraw/zinc/15/82/07/1030158207.db2.gz IYLQQWYUBYFUKN-MOPGFXCFSA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC[C@@H](C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC000450981559 1030158218 /nfs/dbraw/zinc/15/82/18/1030158218.db2.gz IYLQQWYUBYFUKN-MOPGFXCFSA-N 2 1 334.454 4.020 20 0 EIADMP CCOC1CCC([NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)CC1 ZINC000657885676 1030182676 /nfs/dbraw/zinc/18/26/76/1030182676.db2.gz BFGFRVNBDTUSJL-RMFNQSEZSA-N 2 1 336.545 4.068 20 0 EIADMP CCOC1CCC([NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CC1 ZINC000657885676 1030182697 /nfs/dbraw/zinc/18/26/97/1030182697.db2.gz BFGFRVNBDTUSJL-RMFNQSEZSA-N 2 1 336.545 4.068 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000447578778 1030206269 /nfs/dbraw/zinc/20/62/69/1030206269.db2.gz HHPZPIHSPBNQDP-OKYOBFRVSA-N 2 1 334.454 4.350 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000447601015 1030219825 /nfs/dbraw/zinc/21/98/25/1030219825.db2.gz OLWXYLCKDDCTBF-DBXWQHBBSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000447601015 1030219840 /nfs/dbraw/zinc/21/98/40/1030219840.db2.gz OLWXYLCKDDCTBF-DBXWQHBBSA-N 2 1 338.495 4.399 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@H]2CCCCS2)C3)cc1 ZINC000447601366 1030223651 /nfs/dbraw/zinc/22/36/51/1030223651.db2.gz PKMPQMPGHGZDEZ-YSTOQKLRSA-N 2 1 330.541 4.057 20 0 EIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(-c2ccccc2F)s1 ZINC000530407357 1030378002 /nfs/dbraw/zinc/37/80/02/1030378002.db2.gz SJBSNLNYMMUZMF-CYBMUJFWSA-N 2 1 329.444 4.181 20 0 EIADMP C([C@H]1CCC2(CCCC2)O1)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000530410445 1030380630 /nfs/dbraw/zinc/38/06/30/1030380630.db2.gz SOSOOMKJSPFJDI-WOJBJXKFSA-N 2 1 334.548 4.066 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]CC2(F)CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000526989030 1030384084 /nfs/dbraw/zinc/38/40/84/1030384084.db2.gz PLZBWFSPKBIQFY-GOEBONIOSA-N 2 1 344.396 4.180 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]CC2(F)CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000526989030 1030384104 /nfs/dbraw/zinc/38/41/04/1030384104.db2.gz PLZBWFSPKBIQFY-GOEBONIOSA-N 2 1 344.396 4.180 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]CC2(F)CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000526989032 1030385804 /nfs/dbraw/zinc/38/58/04/1030385804.db2.gz PLZBWFSPKBIQFY-ZBFHGGJFSA-N 2 1 344.396 4.180 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]CC2(F)CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000526989032 1030385809 /nfs/dbraw/zinc/38/58/09/1030385809.db2.gz PLZBWFSPKBIQFY-ZBFHGGJFSA-N 2 1 344.396 4.180 20 0 EIADMP CSCC1CCC([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000708573364 1030398306 /nfs/dbraw/zinc/39/83/06/1030398306.db2.gz IWENDDZNZUOBEN-PPXMBRMGSA-N 2 1 346.584 4.266 20 0 EIADMP CC(C)[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1 ZINC000530460366 1030435878 /nfs/dbraw/zinc/43/58/78/1030435878.db2.gz NYUUNOITHUFQKP-INIZCTEOSA-N 2 1 326.271 4.256 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C[C@@H](C)c2ccc(F)cc2)CC1 ZINC000527115845 1030499499 /nfs/dbraw/zinc/49/94/99/1030499499.db2.gz PRUYJMPROBUWGZ-GOSISDBHSA-N 2 1 340.486 4.492 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(C(F)F)nc2)C1 ZINC000657932237 1030635618 /nfs/dbraw/zinc/63/56/18/1030635618.db2.gz VAJNSEPGZLPTBD-CABCVRRESA-N 2 1 325.447 4.038 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(C(F)F)nc2)C1 ZINC000657932237 1030635635 /nfs/dbraw/zinc/63/56/35/1030635635.db2.gz VAJNSEPGZLPTBD-CABCVRRESA-N 2 1 325.447 4.038 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000685665174 1030665483 /nfs/dbraw/zinc/66/54/83/1030665483.db2.gz HDQIYFLOXYCNAU-APWZRJJASA-N 2 1 343.540 4.404 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000685665174 1030665497 /nfs/dbraw/zinc/66/54/97/1030665497.db2.gz HDQIYFLOXYCNAU-APWZRJJASA-N 2 1 343.540 4.404 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCc2c1cccc2F ZINC000398131414 1030711693 /nfs/dbraw/zinc/71/16/93/1030711693.db2.gz JQSJITNNAOJIFK-NPFVIJTESA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCc2c1cccc2F ZINC000398131414 1030711711 /nfs/dbraw/zinc/71/17/11/1030711711.db2.gz JQSJITNNAOJIFK-NPFVIJTESA-N 2 1 338.470 4.313 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)cc1 ZINC000658235988 1030894104 /nfs/dbraw/zinc/89/41/04/1030894104.db2.gz GYZFYURWVOIVQQ-LHSJRXKWSA-N 2 1 333.435 4.224 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2C(C)(C)C2(F)F)CC1 ZINC000658281057 1030935986 /nfs/dbraw/zinc/93/59/86/1030935986.db2.gz NJQMTKPCXKYHON-DAWZGUTISA-N 2 1 336.470 4.311 20 0 EIADMP CC1(C)[C@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1(F)F ZINC000658280751 1030936752 /nfs/dbraw/zinc/93/67/52/1030936752.db2.gz LCKZLVROWVDLOO-MHORFTMASA-N 2 1 334.454 4.063 20 0 EIADMP C[C@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319485 1030980422 /nfs/dbraw/zinc/98/04/22/1030980422.db2.gz CHDFHURGPJGCHJ-RXVVDRJESA-N 2 1 335.495 4.035 20 0 EIADMP C[NH+]1CCC(Oc2ccc(CNc3[nH+]ccc4ccccc43)cc2)CC1 ZINC000528006436 1031029869 /nfs/dbraw/zinc/02/98/69/1031029869.db2.gz CUKWGOAMVUUDQL-UHFFFAOYSA-N 2 1 347.462 4.320 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCc3cccnc3CC2)CC1 ZINC000421830398 1031036490 /nfs/dbraw/zinc/03/64/90/1031036490.db2.gz JUUDDVRAZPSZLW-WIYYLYMNSA-N 2 1 349.522 4.144 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CSCCc2ccccc21 ZINC000532459798 1031101162 /nfs/dbraw/zinc/10/11/62/1031101162.db2.gz MGUXAHSFRAMYGF-YLJYHZDGSA-N 2 1 332.557 4.261 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)[C@H](C)C1 ZINC000532459608 1031111840 /nfs/dbraw/zinc/11/18/40/1031111840.db2.gz MDFXGJZBQIDVMJ-XMSQKQJNSA-N 2 1 338.495 4.086 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)[C@@H](C)C1 ZINC000532459605 1031112131 /nfs/dbraw/zinc/11/21/31/1031112131.db2.gz MDFXGJZBQIDVMJ-AVRDEDQJSA-N 2 1 338.495 4.086 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2cccc(CO)c2)cc1 ZINC000305672206 1031217779 /nfs/dbraw/zinc/21/77/79/1031217779.db2.gz XPOIYOKZABIRBF-JKSUJKDBSA-N 2 1 335.451 4.085 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccccc1OCc1ccccc1 ZINC000532507297 1031230224 /nfs/dbraw/zinc/23/02/24/1031230224.db2.gz RGQQYFDMWJSTCR-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP CC1CCC([NH2+][C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2[NH3+])CC1 ZINC001168203172 1031255498 /nfs/dbraw/zinc/25/54/98/1031255498.db2.gz GXRCNPFWMASZBL-IALNAAFSSA-N 2 1 332.491 4.142 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCOC3(CCC3)C2)C1 ZINC000449082170 1031436936 /nfs/dbraw/zinc/43/69/36/1031436936.db2.gz LFFHJTMAZISQNL-WIYYLYMNSA-N 2 1 342.527 4.110 20 0 EIADMP COc1cc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc2ccccc21 ZINC000449087642 1031448985 /nfs/dbraw/zinc/44/89/85/1031448985.db2.gz GTIAUYWDCXAYLT-UHFFFAOYSA-N 2 1 326.484 4.201 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H](C)[C@H]3CCCC[C@H]3C)CC2)oc1C ZINC000449123518 1031460461 /nfs/dbraw/zinc/46/04/61/1031460461.db2.gz NIJAEHUGBAJREP-MDYRTPRTSA-N 2 1 347.547 4.308 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(C)(C)c1cccc(C(F)(F)F)c1 ZINC000531710573 1031495193 /nfs/dbraw/zinc/49/51/93/1031495193.db2.gz ZCYGXQBPVUCTLM-JKIFEVAISA-N 2 1 342.449 4.301 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C[C@@H]1CCCO1)C1CCC(C)CC1 ZINC000124464765 1031531624 /nfs/dbraw/zinc/53/16/24/1031531624.db2.gz GPNFBOPXCDUPQU-UUKMXZOPSA-N 2 1 333.520 4.031 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C[C@@H]1CCCO1)C1CCC(C)CC1 ZINC000124464765 1031531651 /nfs/dbraw/zinc/53/16/51/1031531651.db2.gz GPNFBOPXCDUPQU-UUKMXZOPSA-N 2 1 333.520 4.031 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cc(-c3ccccc3)nn2C)CC1 ZINC000453087432 1031577244 /nfs/dbraw/zinc/57/72/44/1031577244.db2.gz PSCVPGPDDKWSAU-KRWDZBQOSA-N 2 1 340.515 4.002 20 0 EIADMP C[C@H](Cc1ccoc1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000449307335 1031614807 /nfs/dbraw/zinc/61/48/07/1031614807.db2.gz OVJRKERVUWOMJD-XLIONFOSSA-N 2 1 326.484 4.101 20 0 EIADMP C[C@H](Cc1ccoc1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000449307335 1031614830 /nfs/dbraw/zinc/61/48/30/1031614830.db2.gz OVJRKERVUWOMJD-XLIONFOSSA-N 2 1 326.484 4.101 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000453122038 1031615023 /nfs/dbraw/zinc/61/50/23/1031615023.db2.gz DYKKGSXCDRARBX-KSZLIROESA-N 2 1 339.483 4.397 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000125892718 1031619624 /nfs/dbraw/zinc/61/96/24/1031619624.db2.gz DAWSDYWFVDZYSA-PKOBYXMFSA-N 2 1 328.500 4.143 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000125892718 1031619637 /nfs/dbraw/zinc/61/96/37/1031619637.db2.gz DAWSDYWFVDZYSA-PKOBYXMFSA-N 2 1 328.500 4.143 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H](C)c1cc(F)cc(F)c1 ZINC000449324591 1031623988 /nfs/dbraw/zinc/62/39/88/1031623988.db2.gz GHYDGHBWFRKUQY-OAHLLOKOSA-N 2 1 335.442 4.239 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H](C)c1cc(F)cc(F)c1 ZINC000449324591 1031623995 /nfs/dbraw/zinc/62/39/95/1031623995.db2.gz GHYDGHBWFRKUQY-OAHLLOKOSA-N 2 1 335.442 4.239 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2ccccn2)CC[N@@H+]1Cc1ccccc1 ZINC000449399228 1031705092 /nfs/dbraw/zinc/70/50/92/1031705092.db2.gz YTJBVJYGUFZZGF-UYAOXDASSA-N 2 1 337.511 4.002 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2ccccn2)CC[N@H+]1Cc1ccccc1 ZINC000449399228 1031705098 /nfs/dbraw/zinc/70/50/98/1031705098.db2.gz YTJBVJYGUFZZGF-UYAOXDASSA-N 2 1 337.511 4.002 20 0 EIADMP FC(F)C1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)CC1 ZINC000453228682 1031747496 /nfs/dbraw/zinc/74/74/96/1031747496.db2.gz UTBGRQFFYXVERG-RCCFBDPRSA-N 2 1 334.454 4.065 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)CC1 ZINC000531943173 1031823849 /nfs/dbraw/zinc/82/38/49/1031823849.db2.gz VRILKBVOKHWYQC-CQSZACIVSA-N 2 1 344.421 4.356 20 0 EIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CCC[NH+](C)C ZINC000531931831 1031838558 /nfs/dbraw/zinc/83/85/58/1031838558.db2.gz WBGCGVJWCONZMO-GFCCVEGCSA-N 2 1 337.920 4.374 20 0 EIADMP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000449560319 1031848106 /nfs/dbraw/zinc/84/81/06/1031848106.db2.gz JJJMNEODENUPIH-BLBKINPUSA-N 2 1 342.527 4.177 20 0 EIADMP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453344915 1031871773 /nfs/dbraw/zinc/87/17/73/1031871773.db2.gz JJZNKHIKURKFJZ-OOKSDGMUSA-N 2 1 339.527 4.439 20 0 EIADMP C[C@@H]1C[C@@H](NCc2ccc(Oc3ccccc3F)c(F)c2)CC[N@H+]1C ZINC000531980818 1031926104 /nfs/dbraw/zinc/92/61/04/1031926104.db2.gz SJRBQFYSZUUVNW-ZBFHGGJFSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CCN1C ZINC000531980818 1031926110 /nfs/dbraw/zinc/92/61/10/1031926110.db2.gz SJRBQFYSZUUVNW-ZBFHGGJFSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CC[N@@H+]1C ZINC000531980818 1031926122 /nfs/dbraw/zinc/92/61/22/1031926122.db2.gz SJRBQFYSZUUVNW-ZBFHGGJFSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CC[N@H+]1C ZINC000531980818 1031926126 /nfs/dbraw/zinc/92/61/26/1031926126.db2.gz SJRBQFYSZUUVNW-ZBFHGGJFSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(F)c(Br)c1 ZINC000453408199 1031943910 /nfs/dbraw/zinc/94/39/10/1031943910.db2.gz SMWSMUIIWFMGFK-GFCCVEGCSA-N 2 1 343.284 4.113 20 0 EIADMP COc1ccc2cc([C@H](C)[NH2+]CCCC[N@@H+](C)C3CC3)ccc2c1 ZINC000453443330 1031969573 /nfs/dbraw/zinc/96/95/73/1031969573.db2.gz YRUODZHKAHDMOQ-INIZCTEOSA-N 2 1 326.484 4.373 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+]C[C@H]3C(C)=CCC[C@@H]3C)CC2)oc1C ZINC000134186515 1031994893 /nfs/dbraw/zinc/99/48/93/1031994893.db2.gz RDOAYLQZCNPGCZ-JXFKEZNVSA-N 2 1 345.531 4.085 20 0 EIADMP Cc1cnc([C@@H](C)[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)o1 ZINC000433048674 1033725741 /nfs/dbraw/zinc/72/57/41/1033725741.db2.gz YCHJZLPQAAVRTO-GOSISDBHSA-N 2 1 339.483 4.032 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCC2)c1)c1nccs1 ZINC000411518277 1033956172 /nfs/dbraw/zinc/95/61/72/1033956172.db2.gz OVGUYLQJWJAHOO-GOSISDBHSA-N 2 1 329.513 4.370 20 0 EIADMP C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1cccc(C[NH+](C)C)c1 ZINC000924897261 1034800996 /nfs/dbraw/zinc/80/09/96/1034800996.db2.gz GHYLNLZQOOEPPW-MRXNPFEDSA-N 2 1 335.451 4.254 20 0 EIADMP COCc1ccccc1/C=C(/C)C[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000509921702 1034850466 /nfs/dbraw/zinc/85/04/66/1034850466.db2.gz BBCLHUXFOWCZPX-XWMMGPHDSA-N 2 1 344.543 4.481 20 0 EIADMP COc1ccsc1C[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513495371 1034987055 /nfs/dbraw/zinc/98/70/55/1034987055.db2.gz OWKUOZIHKDCVIU-SJLPKXTDSA-N 2 1 344.524 4.147 20 0 EIADMP COc1ccc(C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000513513011 1035007380 /nfs/dbraw/zinc/00/73/80/1035007380.db2.gz QZNFYGCYPMSIMR-RXVVDRJESA-N 2 1 338.495 4.086 20 0 EIADMP C[C@@H](c1nc2ccccc2n1C(F)F)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000345694439 1035282377 /nfs/dbraw/zinc/28/23/77/1035282377.db2.gz KLEWDFIPKYKBBT-LBPRGKRZSA-N 2 1 345.397 4.095 20 0 EIADMP C[N@@H+](CCSc1ccccc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501070073 1035368029 /nfs/dbraw/zinc/36/80/29/1035368029.db2.gz QWSRTQCWTLOMCP-UHFFFAOYSA-N 2 1 341.524 4.022 20 0 EIADMP C[N@@H+](CC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCCc2ccccc21 ZINC000501077849 1035373555 /nfs/dbraw/zinc/37/35/55/1035373555.db2.gz PELMWVMJUJJIEK-QFIPXVFZSA-N 2 1 335.495 4.307 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000501423741 1035443165 /nfs/dbraw/zinc/44/31/65/1035443165.db2.gz OJDHFAZUHJSFJS-UVQBRAAOSA-N 2 1 340.433 4.430 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420327451 1035532903 /nfs/dbraw/zinc/53/29/03/1035532903.db2.gz LDPLGFBKDPYTHZ-KBMXLJTQSA-N 2 1 326.406 4.088 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CCN(Cc2cnc(Cl)s2)CC1 ZINC000151166254 1035543033 /nfs/dbraw/zinc/54/30/33/1035543033.db2.gz URQWISNVSVAYFE-CQSZACIVSA-N 2 1 341.952 4.273 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000568768694 1035696339 /nfs/dbraw/zinc/69/63/39/1035696339.db2.gz DRFFOXOECVKAOF-IAGOWNOFSA-N 2 1 344.474 4.130 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000568768694 1035696348 /nfs/dbraw/zinc/69/63/48/1035696348.db2.gz DRFFOXOECVKAOF-IAGOWNOFSA-N 2 1 344.474 4.130 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](CSc1ccccc1)C(C)C ZINC000491031776 1035777265 /nfs/dbraw/zinc/77/72/65/1035777265.db2.gz NWUFFEDQEJYUPS-LPHOPBHVSA-N 2 1 331.529 4.234 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@@H]3CC)CC2)cs1 ZINC000502035699 1035812889 /nfs/dbraw/zinc/81/28/89/1035812889.db2.gz QZBHHYZFBKJSAX-PKOBYXMFSA-N 2 1 349.588 4.476 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CCOC4(CCCCC4)C3)CC2)cc1 ZINC000268993244 1036021088 /nfs/dbraw/zinc/02/10/88/1036021088.db2.gz WOPZJZLIPGFQTA-OAQYLSRUSA-N 2 1 342.527 4.123 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C/C=C/c1ccc(F)c(F)c1 ZINC000571366251 1036045335 /nfs/dbraw/zinc/04/53/35/1036045335.db2.gz WOEYIAHBGJWCSU-GQCTYLIASA-N 2 1 333.426 4.149 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C/C=C/c1ccc(F)c(F)c1 ZINC000571366251 1036045360 /nfs/dbraw/zinc/04/53/60/1036045360.db2.gz WOEYIAHBGJWCSU-GQCTYLIASA-N 2 1 333.426 4.149 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1 ZINC000502452272 1036222344 /nfs/dbraw/zinc/22/23/44/1036222344.db2.gz MJPVPWYTKLPIJQ-JBACZVJFSA-N 2 1 344.543 4.445 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccc3[nH]ccc3c2)CC1 ZINC000571776360 1036250693 /nfs/dbraw/zinc/25/06/93/1036250693.db2.gz ZBSUFGTXQPUMKU-QGZVFWFLSA-N 2 1 333.479 4.483 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)oc1C ZINC000502476731 1036255625 /nfs/dbraw/zinc/25/56/25/1036255625.db2.gz YRGTYGGBRPCHRW-ZWOKBUDYSA-N 2 1 326.484 4.458 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000502476731 1036255641 /nfs/dbraw/zinc/25/56/41/1036255641.db2.gz YRGTYGGBRPCHRW-ZWOKBUDYSA-N 2 1 326.484 4.458 20 0 EIADMP COc1ccccc1/C=C\C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000588177758 1036285600 /nfs/dbraw/zinc/28/56/00/1036285600.db2.gz FPBIHGYKSGUNJN-IMMRNYSZSA-N 2 1 330.516 4.056 20 0 EIADMP Fc1cccc([C@H]2C[C@H]2[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000906589322 1036337107 /nfs/dbraw/zinc/33/71/07/1036337107.db2.gz VNXQATCLNPJVKK-WOJBJXKFSA-N 2 1 339.458 4.094 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000572243020 1036470991 /nfs/dbraw/zinc/47/09/91/1036470991.db2.gz HHUBFJPLNPPRPW-IRXDYDNUSA-N 2 1 333.545 4.012 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502688542 1036484844 /nfs/dbraw/zinc/48/48/44/1036484844.db2.gz WYVSZTGKEQXXIC-OTWHNJEPSA-N 2 1 346.563 4.407 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccncc2Cl)c1 ZINC000421826865 1036785069 /nfs/dbraw/zinc/78/50/69/1036785069.db2.gz VBFGOHGIJQYWTR-HNNXBMFYSA-N 2 1 331.891 4.426 20 0 EIADMP COC1([C@@H](C)[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)CCCC1 ZINC000421828658 1036786852 /nfs/dbraw/zinc/78/68/52/1036786852.db2.gz DSAGICYHLUPHPW-ZWKOTPCHSA-N 2 1 330.516 4.149 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2[nH]nc3ccccc32)cc1 ZINC000589640197 1036855369 /nfs/dbraw/zinc/85/53/69/1036855369.db2.gz FXIFMWHWMVAOQQ-KRWDZBQOSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C/C=C/c1ccncc1 ZINC000486944398 1036898963 /nfs/dbraw/zinc/89/89/63/1036898963.db2.gz PMNQBJUKCOWGFW-ZLQZBKBYSA-N 2 1 335.495 4.259 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C/C=C/c2ccncc2)cc1 ZINC000486965475 1036904913 /nfs/dbraw/zinc/90/49/13/1036904913.db2.gz JGTXQNGCAIFUJG-OQBYNLHGSA-N 2 1 335.495 4.259 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C/C=C\c2ccncc2)cc1 ZINC000486965472 1036906090 /nfs/dbraw/zinc/90/60/90/1036906090.db2.gz JGTXQNGCAIFUJG-GJEJWFRCSA-N 2 1 335.495 4.259 20 0 EIADMP COc1cccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1F ZINC000253355715 1036923029 /nfs/dbraw/zinc/92/30/29/1036923029.db2.gz GLQOQHJBVSAVJY-BEFAXECRSA-N 2 1 348.487 4.069 20 0 EIADMP COc1cccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1F ZINC000253355715 1036923071 /nfs/dbraw/zinc/92/30/71/1036923071.db2.gz GLQOQHJBVSAVJY-BEFAXECRSA-N 2 1 348.487 4.069 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1nccn1C ZINC000271742684 1037002351 /nfs/dbraw/zinc/00/23/51/1037002351.db2.gz VSIHOSLEWFWZNZ-XLIONFOSSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1nccn1C ZINC000271742684 1037002369 /nfs/dbraw/zinc/00/23/69/1037002369.db2.gz VSIHOSLEWFWZNZ-XLIONFOSSA-N 2 1 340.515 4.035 20 0 EIADMP CCS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000590243506 1037019547 /nfs/dbraw/zinc/01/95/47/1037019547.db2.gz PDJDLFLXPWRRAS-NMLBUPMWSA-N 2 1 332.557 4.476 20 0 EIADMP CCS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000590243506 1037019562 /nfs/dbraw/zinc/01/95/62/1037019562.db2.gz PDJDLFLXPWRRAS-NMLBUPMWSA-N 2 1 332.557 4.476 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CCO1 ZINC000272009904 1037080567 /nfs/dbraw/zinc/08/05/67/1037080567.db2.gz LSVVMQGFIRVGFL-NMIHRBCNSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CCO1 ZINC000272009904 1037080588 /nfs/dbraw/zinc/08/05/88/1037080588.db2.gz LSVVMQGFIRVGFL-NMIHRBCNSA-N 2 1 344.543 4.080 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000272265921 1037149273 /nfs/dbraw/zinc/14/92/73/1037149273.db2.gz AKVPTBQQKHUFBX-TXPKVOOTSA-N 2 1 343.902 4.296 20 0 EIADMP Cc1ccc(OCCC[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc1C ZINC000590786218 1037167038 /nfs/dbraw/zinc/16/70/38/1037167038.db2.gz IPEHDEPUUONODP-UHFFFAOYSA-N 2 1 332.532 4.125 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)s1 ZINC000272419342 1037184591 /nfs/dbraw/zinc/18/45/91/1037184591.db2.gz NATYPDVVJZRJFA-REPLKXPHSA-N 2 1 341.524 4.045 20 0 EIADMP COCC[C@H]([NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccco1 ZINC000272536341 1037214659 /nfs/dbraw/zinc/21/46/59/1037214659.db2.gz JXAXVJXMHKDYAQ-BEFAXECRSA-N 2 1 339.439 4.202 20 0 EIADMP COCC1([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCCCC1 ZINC000668810966 1037301044 /nfs/dbraw/zinc/30/10/44/1037301044.db2.gz KTLWDOBRBKVXLB-FQEVSTJZSA-N 2 1 342.527 4.123 20 0 EIADMP COCC1([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCCCC1 ZINC000668810966 1037301051 /nfs/dbraw/zinc/30/10/51/1037301051.db2.gz KTLWDOBRBKVXLB-FQEVSTJZSA-N 2 1 342.527 4.123 20 0 EIADMP [NH3+][C@@H](C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C1CC1 ZINC000573082396 1037346172 /nfs/dbraw/zinc/34/61/72/1037346172.db2.gz AFPGXLCZCACSDB-GJZGRUSLSA-N 2 1 347.915 4.168 20 0 EIADMP FC(F)(F)c1cccc(C[NH2+]C2CC[NH+]([C@@H]3C[C@H]4C[C@H]4C3)CC2)c1 ZINC001167948420 1037478446 /nfs/dbraw/zinc/47/84/46/1037478446.db2.gz MLIDJUIGUHJGGH-JLVBRIDZSA-N 2 1 338.417 4.058 20 0 EIADMP Cc1cnc([C@H](C)C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000273508584 1037486471 /nfs/dbraw/zinc/48/64/71/1037486471.db2.gz ZZDNCGACKAIKLA-MDZRGWNJSA-N 2 1 343.540 4.055 20 0 EIADMP Clc1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1Cl ZINC000488419449 1037573288 /nfs/dbraw/zinc/57/32/88/1037573288.db2.gz LZUBDEHQABMMJP-UHFFFAOYSA-N 2 1 327.299 4.301 20 0 EIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC000488423316 1037579435 /nfs/dbraw/zinc/57/94/35/1037579435.db2.gz WMNRYTSGQLCEHA-OALUTQOASA-N 2 1 332.557 4.161 20 0 EIADMP CC(C)(C)[C@H]1C[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CS1 ZINC000488426869 1037586936 /nfs/dbraw/zinc/58/69/36/1037586936.db2.gz TWBCWTFSKHWRCH-VQTJNVASSA-N 2 1 346.584 4.203 20 0 EIADMP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000414653263 1037679981 /nfs/dbraw/zinc/67/99/81/1037679981.db2.gz DZPOVSDMMAIABT-KBPBESRZSA-N 2 1 341.480 4.116 20 0 EIADMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000414653263 1037679998 /nfs/dbraw/zinc/67/99/98/1037679998.db2.gz DZPOVSDMMAIABT-KBPBESRZSA-N 2 1 341.480 4.116 20 0 EIADMP C[C@H](CC[NH2+][C@@H](C)c1c[nH+]ccc1N)c1cccc(C(F)(F)F)c1 ZINC000422803323 1037836599 /nfs/dbraw/zinc/83/65/99/1037836599.db2.gz CPJYLGINQGHFMN-OLZOCXBDSA-N 2 1 337.389 4.357 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1OC ZINC000422891845 1037852784 /nfs/dbraw/zinc/85/27/84/1037852784.db2.gz LROLOKBQLDMQMX-GDIGMMSISA-N 2 1 340.467 4.279 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@H](C)C[C@@H]3CCCCC[NH2+]3)o2)cs1 ZINC000422947074 1037885818 /nfs/dbraw/zinc/88/58/18/1037885818.db2.gz PSDSTPMVNGOMBV-HIFRSBDPSA-N 2 1 333.501 4.112 20 0 EIADMP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423052558 1037937581 /nfs/dbraw/zinc/93/75/81/1037937581.db2.gz QSANYEQCZBHXHY-SLEUVZQESA-N 2 1 333.476 4.042 20 0 EIADMP c1ccc(C[N@@H+](Cc2ccc3ccccc3c2)[C@@H]2CCC[NH2+]CC2)nc1 ZINC000414714042 1037938783 /nfs/dbraw/zinc/93/87/83/1037938783.db2.gz LLVFCQSNJFIYLP-HSZRJFAPSA-N 2 1 345.490 4.379 20 0 EIADMP c1ccc(C[N@H+](Cc2ccc3ccccc3c2)[C@@H]2CCC[NH2+]CC2)nc1 ZINC000414714042 1037938799 /nfs/dbraw/zinc/93/87/99/1037938799.db2.gz LLVFCQSNJFIYLP-HSZRJFAPSA-N 2 1 345.490 4.379 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000503864814 1037948882 /nfs/dbraw/zinc/94/88/82/1037948882.db2.gz WHCQLJBKTOXWRK-VQIMIIECSA-N 2 1 336.470 4.312 20 0 EIADMP CCCc1cccc(C[N@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)c1 ZINC000414717958 1037976791 /nfs/dbraw/zinc/97/67/91/1037976791.db2.gz QJCGXYLXMHYBNG-JOCHJYFZSA-N 2 1 337.511 4.178 20 0 EIADMP CCCc1cccc(C[N@@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)c1 ZINC000414717958 1037976835 /nfs/dbraw/zinc/97/68/35/1037976835.db2.gz QJCGXYLXMHYBNG-JOCHJYFZSA-N 2 1 337.511 4.178 20 0 EIADMP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H](Cc2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423127486 1037978019 /nfs/dbraw/zinc/97/80/19/1037978019.db2.gz UBKOBEJXPQQDNE-BMGDILEWSA-N 2 1 334.385 4.142 20 0 EIADMP COCCC[C@H](C[NH2+][C@@H](C)c1c[nH+]ccc1N)c1ccc(Cl)cc1 ZINC000423108393 1037982407 /nfs/dbraw/zinc/98/24/07/1037982407.db2.gz RDOQSNXLDIRKOU-GOEBONIOSA-N 2 1 347.890 4.009 20 0 EIADMP C[C@@H]([NH2+]CC1CCC(F)(F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000503906432 1038004707 /nfs/dbraw/zinc/00/47/07/1038004707.db2.gz ZKOOACSSMHPGAJ-VQIMIIECSA-N 2 1 336.470 4.312 20 0 EIADMP Clc1ccc([C@@H]2CC[C@H]([NH2+]CCC[NH2+]Cc3cccnc3)C2)cc1 ZINC000423186586 1038015762 /nfs/dbraw/zinc/01/57/62/1038015762.db2.gz LBVSDVWEWPZJBB-QUCCMNQESA-N 2 1 343.902 4.141 20 0 EIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000423181039 1038035199 /nfs/dbraw/zinc/03/51/99/1038035199.db2.gz CAQPIFNIWLLHFS-QGZVFWFLSA-N 2 1 343.540 4.413 20 0 EIADMP C[C@@H]([NH2+][C@H](C[NH3+])C1CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423265115 1038072457 /nfs/dbraw/zinc/07/24/57/1038072457.db2.gz ASMDIMQBGMAXIX-AMIZOPFISA-N 2 1 340.311 4.112 20 0 EIADMP CCCC[C@@H](C[NH3+])[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423300564 1038129105 /nfs/dbraw/zinc/12/91/05/1038129105.db2.gz RVYXQEZZFNBWTG-RBUKOAKNSA-N 2 1 331.891 4.126 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1F ZINC000423477308 1038249058 /nfs/dbraw/zinc/24/90/58/1038249058.db2.gz SJTJBDUPSVBDSG-FRIZHTMISA-N 2 1 348.412 4.148 20 0 EIADMP Cc1cc(N)cc(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000423480786 1038252631 /nfs/dbraw/zinc/25/26/31/1038252631.db2.gz PRHLTSJRNIXMSO-UHFFFAOYSA-N 2 1 337.511 4.110 20 0 EIADMP CC[N@H+]1CC[C@@H](CN[C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000490168567 1038366962 /nfs/dbraw/zinc/36/69/62/1038366962.db2.gz XJWDOVWJSQMGBJ-YWZLYKJASA-N 2 1 346.877 4.500 20 0 EIADMP C[C@@H](c1ccccc1Br)[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000490296179 1038453702 /nfs/dbraw/zinc/45/37/02/1038453702.db2.gz DAIDTGWHCNMIOH-STQMWFEESA-N 2 1 334.261 4.113 20 0 EIADMP CC[N@@H+](CCC1CC[NH+]([C@@H](C)c2ccc(F)nc2)CC1)CC1CC1 ZINC001168423920 1038609944 /nfs/dbraw/zinc/60/99/44/1038609944.db2.gz RWADSDUYNXPVRS-INIZCTEOSA-N 2 1 333.495 4.116 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000539050700 1038798393 /nfs/dbraw/zinc/79/83/93/1038798393.db2.gz QBZXBNXLVIXRNG-HOTGVXAUSA-N 2 1 340.458 4.307 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)c(F)c1 ZINC000539072303 1038821663 /nfs/dbraw/zinc/82/16/63/1038821663.db2.gz PJLGDIXAFNPVBJ-ZNMIVQPWSA-N 2 1 342.886 4.019 20 0 EIADMP c1csc([C@H](Cc2ccncc2)[NH2+]C2CC([NH+]3CCCCC3)C2)c1 ZINC000424359224 1038823213 /nfs/dbraw/zinc/82/32/13/1038823213.db2.gz YCLSRIYXTYVYJX-ACBHZAAOSA-N 2 1 341.524 4.033 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(C)cc2C)[C@H](C)C1 ZINC000480887605 1038854251 /nfs/dbraw/zinc/85/42/51/1038854251.db2.gz FMIFRNMICOYHPG-SBHAEUEKSA-N 2 1 332.532 4.091 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000539163211 1038865199 /nfs/dbraw/zinc/86/51/99/1038865199.db2.gz ONUNWJJIMVWOOT-KBXCAEBGSA-N 2 1 340.433 4.476 20 0 EIADMP COc1ccc([C@H]([NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)C2CC2)cc1 ZINC000539215680 1038886616 /nfs/dbraw/zinc/88/66/16/1038886616.db2.gz BZBQSDINQUHZDR-LAUBAEHRSA-N 2 1 330.516 4.104 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1ccc(F)cc1)C1CCCC1 ZINC000539217826 1038888232 /nfs/dbraw/zinc/88/82/32/1038888232.db2.gz NLILVAAOJPXVII-YWZLYKJASA-N 2 1 329.463 4.488 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@H]1C ZINC000537616543 1038890832 /nfs/dbraw/zinc/89/08/32/1038890832.db2.gz PHXBAZPBNWAIHE-TZMCWYRMSA-N 2 1 346.849 4.246 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@H]1C ZINC000537616543 1038890833 /nfs/dbraw/zinc/89/08/33/1038890833.db2.gz PHXBAZPBNWAIHE-TZMCWYRMSA-N 2 1 346.849 4.246 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@H]1C ZINC000537616543 1038890835 /nfs/dbraw/zinc/89/08/35/1038890835.db2.gz PHXBAZPBNWAIHE-TZMCWYRMSA-N 2 1 346.849 4.246 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@H]1C ZINC000537616543 1038890836 /nfs/dbraw/zinc/89/08/36/1038890836.db2.gz PHXBAZPBNWAIHE-TZMCWYRMSA-N 2 1 346.849 4.246 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@@H](Oc3ccc(Cl)cc3)C2)CC1 ZINC001168327414 1038915137 /nfs/dbraw/zinc/91/51/37/1038915137.db2.gz NFAUTDHWRGNZDU-FAFZWHIHSA-N 2 1 336.907 4.056 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 ZINC000462120573 1038939368 /nfs/dbraw/zinc/93/93/68/1038939368.db2.gz UKPSHLOKUJQFIP-TUNNFDKTSA-N 2 1 326.528 4.252 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000481032543 1038953558 /nfs/dbraw/zinc/95/35/58/1038953558.db2.gz FCQMNYNJJPNSKN-OXQOHEQNSA-N 2 1 328.525 4.003 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccc(Br)cc2)C1 ZINC000481027712 1038970953 /nfs/dbraw/zinc/97/09/53/1038970953.db2.gz WRTCKLVHDILORN-WMLDXEAASA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000481037769 1038989669 /nfs/dbraw/zinc/98/96/69/1038989669.db2.gz MXZOEKCCSCVWBB-WBMJQRKESA-N 2 1 327.299 4.302 20 0 EIADMP C[C@@H](c1ccc(Br)cc1)[N@@H+](C)C1CCC([NH+](C)C)CC1 ZINC001168333695 1039033590 /nfs/dbraw/zinc/03/35/90/1039033590.db2.gz BVRUGMCKUZGQHZ-IGEOTXOUSA-N 2 1 339.321 4.315 20 0 EIADMP C[C@H](C[N@H+](C)[C@@H]1CCC[NH+](C[C@@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333543 1039066689 /nfs/dbraw/zinc/06/66/89/1039066689.db2.gz TZEKGJJZFHRWMC-JHJVBQTASA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[N@@H+](C)[C@@H]1CCC[NH+](C[C@@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333543 1039066708 /nfs/dbraw/zinc/06/67/08/1039066708.db2.gz TZEKGJJZFHRWMC-JHJVBQTASA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[NH+](C)[C@@H]1CCC[N@H+](C[C@@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333543 1039066713 /nfs/dbraw/zinc/06/67/13/1039066713.db2.gz TZEKGJJZFHRWMC-JHJVBQTASA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[NH+](C)[C@@H]1CCC[N@@H+](C[C@@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333543 1039066733 /nfs/dbraw/zinc/06/67/33/1039066733.db2.gz TZEKGJJZFHRWMC-JHJVBQTASA-N 2 1 348.375 4.170 20 0 EIADMP CCOc1cccc(CN(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000552059528 1039079906 /nfs/dbraw/zinc/07/99/06/1039079906.db2.gz IQRPXOKIBSBCEU-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CCOc1cccc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000552059528 1039079930 /nfs/dbraw/zinc/07/99/30/1039079930.db2.gz IQRPXOKIBSBCEU-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CCOc1cccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000552059528 1039079950 /nfs/dbraw/zinc/07/99/50/1039079950.db2.gz IQRPXOKIBSBCEU-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP C[C@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(F)(F)F ZINC000552067022 1039091612 /nfs/dbraw/zinc/09/16/12/1039091612.db2.gz YUJLUOJZLYMZBV-ODIFPOPNSA-N 2 1 328.422 4.218 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)s1 ZINC000090417979 1039228342 /nfs/dbraw/zinc/22/83/42/1039228342.db2.gz RGCXYAPLSABFQA-QEORTHHSSA-N 2 1 335.542 4.247 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)s1 ZINC000090417979 1039228355 /nfs/dbraw/zinc/22/83/55/1039228355.db2.gz RGCXYAPLSABFQA-QEORTHHSSA-N 2 1 335.542 4.247 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(OCc3ccccc3)c2)C1 ZINC000481294925 1039232251 /nfs/dbraw/zinc/23/22/51/1039232251.db2.gz MZQGGPMAXWLLAT-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc3ccccc3c2OC(F)F)C1 ZINC000481296914 1039233394 /nfs/dbraw/zinc/23/33/94/1039233394.db2.gz BDIMYOLMVBQDEG-HUUCEWRRSA-N 2 1 348.437 4.434 20 0 EIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccccc2OCc2ccccc2)C1 ZINC000481309901 1039259564 /nfs/dbraw/zinc/25/95/64/1039259564.db2.gz NBTWJEGDINKQBU-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccccc2OCc2ccccc2)C1 ZINC000481309901 1039259601 /nfs/dbraw/zinc/25/96/01/1039259601.db2.gz NBTWJEGDINKQBU-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000481322922 1039288954 /nfs/dbraw/zinc/28/89/54/1039288954.db2.gz NYEMHFXCEYJGSL-BFHYXJOUSA-N 2 1 345.314 4.081 20 0 EIADMP CCC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1cccc(C(F)(F)F)c1 ZINC000481325248 1039296705 /nfs/dbraw/zinc/29/67/05/1039296705.db2.gz VBJJTDJWJMBBMT-WMLDXEAASA-N 2 1 328.422 4.478 20 0 EIADMP CC(C)CCOCC[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000552251204 1039312832 /nfs/dbraw/zinc/31/28/32/1039312832.db2.gz NSNLZRCUKCTMNX-UHFFFAOYSA-N 2 1 332.532 4.082 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc(-c3ccncc3)c2)CC1 ZINC000534347267 1039335117 /nfs/dbraw/zinc/33/51/17/1039335117.db2.gz MFUADOYCWQICTQ-UHFFFAOYSA-N 2 1 337.511 4.301 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](c2ccc(C)cc2)C2CC2)cn1 ZINC000091288580 1039357860 /nfs/dbraw/zinc/35/78/60/1039357860.db2.gz KSTGWVMFHXGJSC-OAQYLSRUSA-N 2 1 332.451 4.125 20 0 EIADMP CC(C)(C)C1CC([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000555606180 1039434133 /nfs/dbraw/zinc/43/41/33/1039434133.db2.gz FWGSJICIOKNNAI-UHFFFAOYSA-N 2 1 332.507 4.247 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)CCOc2ccc(Cl)cc2Cl)CC1 ZINC000514008158 1039459931 /nfs/dbraw/zinc/45/99/31/1039459931.db2.gz BWNLVSQNXDBRDX-UHFFFAOYSA-N 2 1 345.314 4.177 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCOc2ccc(Cl)cc2Cl)CC1 ZINC000514008158 1039459945 /nfs/dbraw/zinc/45/99/45/1039459945.db2.gz BWNLVSQNXDBRDX-UHFFFAOYSA-N 2 1 345.314 4.177 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc(Cl)c(F)c2)C1 ZINC000065931958 1039596512 /nfs/dbraw/zinc/59/65/12/1039596512.db2.gz OKRCHJVIQMWFRP-GASCZTMLSA-N 2 1 326.887 4.327 20 0 EIADMP Cc1cc(F)ccc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434669299 1039804288 /nfs/dbraw/zinc/80/42/88/1039804288.db2.gz HVLQWSJHFLVLKP-UHFFFAOYSA-N 2 1 327.447 4.047 20 0 EIADMP c1[nH+]c(C2CC[NH+](C[C@@H]3CCc4ccccc4C3)CC2)n2c1CCCC2 ZINC000434690972 1039813127 /nfs/dbraw/zinc/81/31/27/1039813127.db2.gz MCGRRTBASXBAFM-GOSISDBHSA-N 2 1 349.522 4.204 20 0 EIADMP c1[nH+]c(C2CC[NH+](C[C@H]3CCc4ccccc4C3)CC2)n2c1CCCC2 ZINC000434690973 1039813478 /nfs/dbraw/zinc/81/34/78/1039813478.db2.gz MCGRRTBASXBAFM-SFHVURJKSA-N 2 1 349.522 4.204 20 0 EIADMP c1ccc(CSCCC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000534869024 1039821350 /nfs/dbraw/zinc/82/13/50/1039821350.db2.gz QJCYXANTBLRFNH-FQEVSTJZSA-N 2 1 332.557 4.260 20 0 EIADMP c1[nH+]c(C2CC[NH+](CCSc3ccccc3)CC2)n2c1CCCC2 ZINC000434747839 1039858503 /nfs/dbraw/zinc/85/85/03/1039858503.db2.gz RUXIBMINOVZGJM-UHFFFAOYSA-N 2 1 341.524 4.191 20 0 EIADMP CSc1ccccc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434736619 1039858838 /nfs/dbraw/zinc/85/88/38/1039858838.db2.gz MKIWVYBAVQQXHF-UHFFFAOYSA-N 2 1 341.524 4.321 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000534955302 1039868404 /nfs/dbraw/zinc/86/84/04/1039868404.db2.gz OQRYNTMQTRULEF-MRXNPFEDSA-N 2 1 340.496 4.071 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000534955302 1039868405 /nfs/dbraw/zinc/86/84/05/1039868405.db2.gz OQRYNTMQTRULEF-MRXNPFEDSA-N 2 1 340.496 4.071 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc(F)cc3)CC2)C[C@@H]1c1ccccc1 ZINC000551006688 1039868685 /nfs/dbraw/zinc/86/86/85/1039868685.db2.gz IISIIFPBGRWMBW-LEWJYISDSA-N 2 1 338.470 4.282 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC2(c3ccc(F)cc3)CC2)C[C@@H]1c1ccccc1 ZINC000551006688 1039868688 /nfs/dbraw/zinc/86/86/88/1039868688.db2.gz IISIIFPBGRWMBW-LEWJYISDSA-N 2 1 338.470 4.282 20 0 EIADMP Cc1cc(C)cc(OCC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551014357 1039877017 /nfs/dbraw/zinc/87/70/17/1039877017.db2.gz SIQYIRQHVBCDSP-IRLDBZIGSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1cc(C)cc(OCC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551014357 1039877023 /nfs/dbraw/zinc/87/70/23/1039877023.db2.gz SIQYIRQHVBCDSP-IRLDBZIGSA-N 2 1 338.495 4.107 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2cccc3cccnc32)C[C@H]1c1ccccc1 ZINC000556050202 1039889060 /nfs/dbraw/zinc/88/90/60/1039889060.db2.gz DCGZXGVXCLYKFW-YADHBBJMSA-N 2 1 345.490 4.202 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2cccc3cccnc32)C[C@H]1c1ccccc1 ZINC000556050202 1039889065 /nfs/dbraw/zinc/88/90/65/1039889065.db2.gz DCGZXGVXCLYKFW-YADHBBJMSA-N 2 1 345.490 4.202 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cl)cc1 ZINC000481923493 1039898160 /nfs/dbraw/zinc/89/81/60/1039898160.db2.gz OQOFGLIBMMFBKR-FOIQADDNSA-N 2 1 328.887 4.437 20 0 EIADMP Cc1cc2[nH]c(C[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)cc2c(C)c1 ZINC000482002676 1039944419 /nfs/dbraw/zinc/94/44/19/1039944419.db2.gz BIZSYCRKYKZKCA-GOSISDBHSA-N 2 1 325.500 4.093 20 0 EIADMP Cc1cc2[nH]c(C[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)cc2c(C)c1 ZINC000482002676 1039944433 /nfs/dbraw/zinc/94/44/33/1039944433.db2.gz BIZSYCRKYKZKCA-GOSISDBHSA-N 2 1 325.500 4.093 20 0 EIADMP CC(C)OC1CC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC000535078867 1039950243 /nfs/dbraw/zinc/95/02/43/1039950243.db2.gz KWPWAHPQDZMNHC-UHFFFAOYSA-N 2 1 332.532 4.034 20 0 EIADMP C[NH+](C)CCCC1CC[NH+](Cc2csc(C3CCCC3)n2)CC1 ZINC000123279587 1039995341 /nfs/dbraw/zinc/99/53/41/1039995341.db2.gz QHUUTTRNKRTWFG-UHFFFAOYSA-N 2 1 335.561 4.355 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCNc2cccc(F)c2)C[C@@H]1c1ccccc1 ZINC000551170356 1040015023 /nfs/dbraw/zinc/01/50/23/1040015023.db2.gz SVFBJGBZJQMLIK-NHCUHLMSSA-N 2 1 341.474 4.053 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCNc2cccc(F)c2)C[C@@H]1c1ccccc1 ZINC000551170356 1040015043 /nfs/dbraw/zinc/01/50/43/1040015043.db2.gz SVFBJGBZJQMLIK-NHCUHLMSSA-N 2 1 341.474 4.053 20 0 EIADMP CCO[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccccc1 ZINC000551174995 1040018535 /nfs/dbraw/zinc/01/85/35/1040018535.db2.gz DXBBAXBMINPPBH-BHIFYINESA-N 2 1 338.495 4.189 20 0 EIADMP CCO[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccccc1 ZINC000551174995 1040018550 /nfs/dbraw/zinc/01/85/50/1040018550.db2.gz DXBBAXBMINPPBH-BHIFYINESA-N 2 1 338.495 4.189 20 0 EIADMP C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000514633506 1040067401 /nfs/dbraw/zinc/06/74/01/1040067401.db2.gz GARKPRQOZDCAPG-AVRDEDQJSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)CC[N@@H+]1C ZINC000482246485 1040091267 /nfs/dbraw/zinc/09/12/67/1040091267.db2.gz SBLQQUFUWRYHIF-MAODMQOUSA-N 2 1 326.459 4.182 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)CC[N@H+]1C ZINC000482246485 1040091289 /nfs/dbraw/zinc/09/12/89/1040091289.db2.gz SBLQQUFUWRYHIF-MAODMQOUSA-N 2 1 326.459 4.182 20 0 EIADMP Fc1cccc(Cl)c1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167958016 1040124380 /nfs/dbraw/zinc/12/43/80/1040124380.db2.gz ATOJIIGSGWWZDV-MQVJKMGUSA-N 2 1 336.882 4.017 20 0 EIADMP c1cc2[nH+]ccc(N3CC[C@@]4(CC[N@@H+](Cc5ccccc5)C4)C3)c2s1 ZINC000553334952 1040141243 /nfs/dbraw/zinc/14/12/43/1040141243.db2.gz JXJAJZQISDEOFU-OAQYLSRUSA-N 2 1 349.503 4.399 20 0 EIADMP c1cc2[nH+]ccc(N3CC[C@@]4(CC[N@H+](Cc5ccccc5)C4)C3)c2s1 ZINC000553334952 1040141258 /nfs/dbraw/zinc/14/12/58/1040141258.db2.gz JXJAJZQISDEOFU-OAQYLSRUSA-N 2 1 349.503 4.399 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(c2cccc(F)c2F)CC1 ZINC000514701623 1040155781 /nfs/dbraw/zinc/15/57/81/1040155781.db2.gz FRNCJXPRIHFPTC-UHFFFAOYSA-N 2 1 333.426 4.130 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1OC(F)F ZINC000482331042 1040179653 /nfs/dbraw/zinc/17/96/53/1040179653.db2.gz VLRHBSDHGGUXFG-NVXWUHKLSA-N 2 1 340.458 4.449 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1OC(F)F ZINC000482331042 1040179671 /nfs/dbraw/zinc/17/96/71/1040179671.db2.gz VLRHBSDHGGUXFG-NVXWUHKLSA-N 2 1 340.458 4.449 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000482434324 1040242452 /nfs/dbraw/zinc/24/24/52/1040242452.db2.gz FNKLMMJLDYXELO-IEBWSBKVSA-N 2 1 326.459 4.041 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc3ccccc3)C1)CC2 ZINC000482436772 1040244357 /nfs/dbraw/zinc/24/43/57/1040244357.db2.gz JKFZVVXQHNJRHN-NZQKXSOJSA-N 2 1 334.507 4.137 20 0 EIADMP C[C@H](NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441685 1040249432 /nfs/dbraw/zinc/24/94/32/1040249432.db2.gz VPIMHNQDQPTRNK-FUHWJXTLSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441685 1040249446 /nfs/dbraw/zinc/24/94/46/1040249446.db2.gz VPIMHNQDQPTRNK-FUHWJXTLSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441685 1040249456 /nfs/dbraw/zinc/24/94/56/1040249456.db2.gz VPIMHNQDQPTRNK-FUHWJXTLSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCc2c1cc(Br)cc2Cl ZINC000535509423 1040311197 /nfs/dbraw/zinc/31/11/97/1040311197.db2.gz ZRVGIZTWZSSSTH-BONVTDFDSA-N 2 1 345.712 4.020 20 0 EIADMP Cc1oc2ccccc2c1C[N@H+](Cc1ccccn1)[C@@H]1CCC[NH2+]CC1 ZINC000435395059 1040350207 /nfs/dbraw/zinc/35/02/07/1040350207.db2.gz QPGIBFUVLIVLJA-LJQANCHMSA-N 2 1 349.478 4.281 20 0 EIADMP Cc1oc2ccccc2c1C[N@@H+](Cc1ccccn1)[C@@H]1CCC[NH2+]CC1 ZINC000435395059 1040350228 /nfs/dbraw/zinc/35/02/28/1040350228.db2.gz QPGIBFUVLIVLJA-LJQANCHMSA-N 2 1 349.478 4.281 20 0 EIADMP Cc1ccc2cc(C[NH+]3CCC(c4[nH+]cc5n4CCCC5)CC3)[nH]c2c1 ZINC000668084740 1040374865 /nfs/dbraw/zinc/37/48/65/1040374865.db2.gz UTDRCMRCSXIHJK-UHFFFAOYSA-N 2 1 348.494 4.389 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(Br)c2C)C[C@H]1C ZINC000535585291 1040387369 /nfs/dbraw/zinc/38/73/69/1040387369.db2.gz LMYGJAYGHLZJDU-CJNGLKHVSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(Br)c2C)C[C@H]1C ZINC000535585291 1040387387 /nfs/dbraw/zinc/38/73/87/1040387387.db2.gz LMYGJAYGHLZJDU-CJNGLKHVSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(Br)c2C)C[C@H]1C ZINC000535585291 1040387405 /nfs/dbraw/zinc/38/74/05/1040387405.db2.gz LMYGJAYGHLZJDU-CJNGLKHVSA-N 2 1 339.321 4.062 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2c(s1)CCC2 ZINC000479467133 1040389922 /nfs/dbraw/zinc/38/99/22/1040389922.db2.gz VDPXLYFPHNQKBN-SJLPKXTDSA-N 2 1 340.536 4.410 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000551533795 1040391956 /nfs/dbraw/zinc/39/19/56/1040391956.db2.gz QOCIATXHKCPLEQ-NKGKWGDASA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000551533795 1040391971 /nfs/dbraw/zinc/39/19/71/1040391971.db2.gz QOCIATXHKCPLEQ-NKGKWGDASA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1 ZINC000479468651 1040394777 /nfs/dbraw/zinc/39/47/77/1040394777.db2.gz ZFMWULRPQZTNRE-GDBMZVCRSA-N 2 1 348.412 4.277 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1 ZINC000479468651 1040394787 /nfs/dbraw/zinc/39/47/87/1040394787.db2.gz ZFMWULRPQZTNRE-GDBMZVCRSA-N 2 1 348.412 4.277 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2Sc2ccccc2)CC[N@@H+]1C ZINC000482639580 1040402835 /nfs/dbraw/zinc/40/28/35/1040402835.db2.gz DRJZPEZXEKOMTC-SJLPKXTDSA-N 2 1 326.509 4.410 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2Sc2ccccc2)CC[N@H+]1C ZINC000482639580 1040402842 /nfs/dbraw/zinc/40/28/42/1040402842.db2.gz DRJZPEZXEKOMTC-SJLPKXTDSA-N 2 1 326.509 4.410 20 0 EIADMP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479524120 1040421949 /nfs/dbraw/zinc/42/19/49/1040421949.db2.gz HCFROGRAHJCMMZ-ALLBUHFWSA-N 2 1 328.500 4.024 20 0 EIADMP FC(F)(F)c1cc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)ccc1Cl ZINC000666998148 1040437497 /nfs/dbraw/zinc/43/74/97/1040437497.db2.gz FHIMDTRLMTWUQG-LBPRGKRZSA-N 2 1 332.797 4.123 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+]Cc2cc(Cl)ccc2OC2CCCC2)CC1 ZINC000539546792 1040534751 /nfs/dbraw/zinc/53/47/51/1040534751.db2.gz JIJSPFSDDNZYNO-UHFFFAOYSA-N 2 1 334.891 4.013 20 0 EIADMP Fc1cccc([C@H]2C[C@H]([NH2+]C3CC[NH+](Cc4ccccc4)CC3)C2)c1 ZINC000435750071 1040583456 /nfs/dbraw/zinc/58/34/56/1040583456.db2.gz WKYQREMPLLYCLQ-XYWHTSSQSA-N 2 1 338.470 4.326 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000284934435 1040723978 /nfs/dbraw/zinc/72/39/78/1040723978.db2.gz DOZKVIXVQAPUHK-ONZKCSKKSA-N 2 1 344.543 4.224 20 0 EIADMP CCCOc1ccc(C(C)(C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000483280795 1040804792 /nfs/dbraw/zinc/80/47/92/1040804792.db2.gz RHMFGCAFOVXHRJ-UHFFFAOYSA-N 2 1 329.488 4.285 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@H]1C ZINC000539820933 1040816784 /nfs/dbraw/zinc/81/67/84/1040816784.db2.gz MABFMRKCGFJNEY-IEBWSBKVSA-N 2 1 348.531 4.035 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@H]1C ZINC000539820933 1040816795 /nfs/dbraw/zinc/81/67/95/1040816795.db2.gz MABFMRKCGFJNEY-IEBWSBKVSA-N 2 1 348.531 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@H]1C ZINC000539820933 1040816800 /nfs/dbraw/zinc/81/68/00/1040816800.db2.gz MABFMRKCGFJNEY-IEBWSBKVSA-N 2 1 348.531 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@H]1C ZINC000539820933 1040816802 /nfs/dbraw/zinc/81/68/02/1040816802.db2.gz MABFMRKCGFJNEY-IEBWSBKVSA-N 2 1 348.531 4.035 20 0 EIADMP C[N@@H+](Cc1ccnn1-c1cc[nH+]cc1)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000668235279 1040819597 /nfs/dbraw/zinc/81/95/97/1040819597.db2.gz HRDSXDUIDXKPBP-RTWAWAEBSA-N 2 1 332.451 4.035 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cnc(-c3ccc(C)cc3)s2)[C@@H](C)C1 ZINC000539835704 1040828169 /nfs/dbraw/zinc/82/81/69/1040828169.db2.gz PAMZFRRVIUKVTQ-LPHOPBHVSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cnc(-c3ccc(C)cc3)s2)[C@@H](C)C1 ZINC000539835704 1040828183 /nfs/dbraw/zinc/82/81/83/1040828183.db2.gz PAMZFRRVIUKVTQ-LPHOPBHVSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cnc(-c3ccc(C)cc3)s2)[C@@H](C)C1 ZINC000539835704 1040828192 /nfs/dbraw/zinc/82/81/92/1040828192.db2.gz PAMZFRRVIUKVTQ-LPHOPBHVSA-N 2 1 343.540 4.281 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483472228 1040870377 /nfs/dbraw/zinc/87/03/77/1040870377.db2.gz JXRLRQRQQOEODL-UKPHBRMFSA-N 2 1 342.405 4.062 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000483472228 1040870387 /nfs/dbraw/zinc/87/03/87/1040870387.db2.gz JXRLRQRQQOEODL-UKPHBRMFSA-N 2 1 342.405 4.062 20 0 EIADMP COC1CC[NH+](C2(C[NH2+]C3CCC(C(C)C)CC3)CCCC2)CC1 ZINC000462746484 1040894050 /nfs/dbraw/zinc/89/40/50/1040894050.db2.gz UDDHMWMCNLVGOU-UHFFFAOYSA-N 2 1 336.564 4.214 20 0 EIADMP CC(C)(C)C1CCC([NH2+]CC2([NH+]3CCCCC3)CCOCC2)CC1 ZINC000462748130 1040896051 /nfs/dbraw/zinc/89/60/51/1040896051.db2.gz BPFCBCSZOSNUCB-UHFFFAOYSA-N 2 1 336.564 4.216 20 0 EIADMP CC[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000537940135 1040906519 /nfs/dbraw/zinc/90/65/19/1040906519.db2.gz VNUXUOXSFYICHU-VCOUNFBDSA-N 2 1 344.543 4.082 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000537952086 1040919453 /nfs/dbraw/zinc/91/94/53/1040919453.db2.gz PJKBCEQAMVFONV-PGRDOPGGSA-N 2 1 338.495 4.004 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000537964909 1040935075 /nfs/dbraw/zinc/93/50/75/1040935075.db2.gz KGLPODONKJGHIU-NWDGAFQWSA-N 2 1 326.271 4.485 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@H]3C)cc2)cc1 ZINC000537988487 1040966067 /nfs/dbraw/zinc/96/60/67/1040966067.db2.gz VGGQQABYWYUOLS-HYFFOGBASA-N 2 1 338.495 4.181 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000537991008 1040967574 /nfs/dbraw/zinc/96/75/74/1040967574.db2.gz QBXCBWGKXUQIKK-QAPCUYQASA-N 2 1 348.943 4.444 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000537991007 1040970400 /nfs/dbraw/zinc/97/04/00/1040970400.db2.gz QBXCBWGKXUQIKK-MAUKXSAKSA-N 2 1 348.943 4.444 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]C[C@@H](C)Cn3cc[nH+]c3C)c(C)c2c1 ZINC000537967508 1040970778 /nfs/dbraw/zinc/97/07/78/1040970778.db2.gz MAUSEWCWGVPPIP-UKRRQHHQSA-N 2 1 341.455 4.242 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1 ZINC000537967958 1040971584 /nfs/dbraw/zinc/97/15/84/1040971584.db2.gz JBVNGAMMIQMOEF-SGLNWRHMSA-N 2 1 325.500 4.390 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000483737430 1040992003 /nfs/dbraw/zinc/99/20/03/1040992003.db2.gz VDDUFOJCKWMKQL-WMLDXEAASA-N 2 1 340.433 4.057 20 0 EIADMP CC[N@@H+](Cc1ccccc1N(C)C1CC[NH+](C)CC1)CC(C)(C)C ZINC000462834339 1041016109 /nfs/dbraw/zinc/01/61/09/1041016109.db2.gz PHBXBRBPPCZPAP-UHFFFAOYSA-N 2 1 331.548 4.085 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCOC1CCCCC1 ZINC000480161053 1041017659 /nfs/dbraw/zinc/01/76/59/1041017659.db2.gz QQCCWXVBJBAORJ-DENIHFKCSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCOC1CCCCC1 ZINC000480161053 1041017678 /nfs/dbraw/zinc/01/76/78/1041017678.db2.gz QQCCWXVBJBAORJ-DENIHFKCSA-N 2 1 344.543 4.226 20 0 EIADMP C[N@H+]1CCC[C@@H](CNc2cc[nH+]c3ccccc23)[C@H]1c1cccs1 ZINC000462880168 1041062623 /nfs/dbraw/zinc/06/26/23/1041062623.db2.gz AYCYIJGZNYDHIW-YWZLYKJASA-N 2 1 337.492 4.213 20 0 EIADMP COc1ccc(Cl)c2c1CCC[C@H]2[N@H+](C)CCCc1c[nH+]cn1C ZINC000653779829 1041064104 /nfs/dbraw/zinc/06/41/04/1041064104.db2.gz FFFABEBTAYDGFW-QGZVFWFLSA-N 2 1 347.890 4.024 20 0 EIADMP COc1ccc(Cl)c2c1CCC[C@H]2[N@@H+](C)CCCc1c[nH+]cn1C ZINC000653779829 1041064136 /nfs/dbraw/zinc/06/41/36/1041064136.db2.gz FFFABEBTAYDGFW-QGZVFWFLSA-N 2 1 347.890 4.024 20 0 EIADMP C[N@@H+](CCCNC1CC[NH+](C2CCCCC2)CC1)C1CCCCC1 ZINC000480256007 1041123391 /nfs/dbraw/zinc/12/33/91/1041123391.db2.gz YCWTTYMTDXPNMB-UHFFFAOYSA-N 2 1 335.580 4.028 20 0 EIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000480253196 1041136105 /nfs/dbraw/zinc/13/61/05/1041136105.db2.gz WOSGGUXKBRVXJV-SJLPKXTDSA-N 2 1 342.449 4.262 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000436399884 1041203080 /nfs/dbraw/zinc/20/30/80/1041203080.db2.gz GUVWAWGODCBOAG-HUUCEWRRSA-N 2 1 329.463 4.050 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000540170826 1041213833 /nfs/dbraw/zinc/21/38/33/1041213833.db2.gz PQQFQAZQSDWNND-CEXWTWQISA-N 2 1 348.531 4.015 20 0 EIADMP CC[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)s1 ZINC000540172347 1041215709 /nfs/dbraw/zinc/21/57/09/1041215709.db2.gz AHHVLYODOODIHU-ZNMIVQPWSA-N 2 1 344.952 4.332 20 0 EIADMP COc1ccc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c(C)c1 ZINC000540163697 1041225842 /nfs/dbraw/zinc/22/58/42/1041225842.db2.gz HGTLTCIQDKRYPI-MRXNPFEDSA-N 2 1 335.451 4.349 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cc(Br)ccc1F ZINC000484464524 1041254760 /nfs/dbraw/zinc/25/47/60/1041254760.db2.gz DUJFLMUTKXAJPU-IACUBPJLSA-N 2 1 343.284 4.112 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]C[C@@H]1CC2c3ccccc3C1c1ccccc12 ZINC000540194448 1041268622 /nfs/dbraw/zinc/26/86/22/1041268622.db2.gz ITZWRVHOUMJDPF-CGHMBIMXSA-N 2 1 346.518 4.214 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000484506255 1041285722 /nfs/dbraw/zinc/28/57/22/1041285722.db2.gz QWQIYKVHYFRSQP-NQIIRXRSSA-N 2 1 338.495 4.004 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000484506255 1041285752 /nfs/dbraw/zinc/28/57/52/1041285752.db2.gz QWQIYKVHYFRSQP-NQIIRXRSSA-N 2 1 338.495 4.004 20 0 EIADMP C[C@@H]1CCN(c2cc[nH+]c3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000463062554 1041297000 /nfs/dbraw/zinc/29/70/00/1041297000.db2.gz ADRYIGWLBKLRMO-GOSISDBHSA-N 2 1 331.463 4.336 20 0 EIADMP Cc1cccc(OCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000463072627 1041317361 /nfs/dbraw/zinc/31/73/61/1041317361.db2.gz RAKDZKVTZMFKDX-CTNGQTDRSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1cccc(OCC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000463072627 1041317374 /nfs/dbraw/zinc/31/73/74/1041317374.db2.gz RAKDZKVTZMFKDX-CTNGQTDRSA-N 2 1 338.495 4.017 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000538408257 1041324724 /nfs/dbraw/zinc/32/47/24/1041324724.db2.gz DDYMHXRTPVSPTJ-QGZVFWFLSA-N 2 1 325.283 4.296 20 0 EIADMP C[N@H+](C[C@@H]1C[C@H]1c1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000463089607 1041329102 /nfs/dbraw/zinc/32/91/02/1041329102.db2.gz DURJWSGWPOHJAZ-GMAHTHKFSA-N 2 1 334.507 4.387 20 0 EIADMP C[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000463089607 1041329117 /nfs/dbraw/zinc/32/91/17/1041329117.db2.gz DURJWSGWPOHJAZ-GMAHTHKFSA-N 2 1 334.507 4.387 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C[C@H]2CCC[N@@H+](C)C2)c2cccc(F)c2)c1 ZINC000554725209 1041352112 /nfs/dbraw/zinc/35/21/12/1041352112.db2.gz PPYKYJGZXBXLJN-DYESRHJHSA-N 2 1 326.459 4.155 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)c2cccc(F)c2)c1 ZINC000554725209 1041352122 /nfs/dbraw/zinc/35/21/22/1041352122.db2.gz PPYKYJGZXBXLJN-DYESRHJHSA-N 2 1 326.459 4.155 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cccc(F)c2F)CC[N@@H+]1Cc1ccccc1 ZINC000463130489 1041355591 /nfs/dbraw/zinc/35/55/91/1041355591.db2.gz WUSQRFQFVWUWJF-QFBILLFUSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cccc(F)c2F)CC[N@H+]1Cc1ccccc1 ZINC000463130489 1041355605 /nfs/dbraw/zinc/35/56/05/1041355605.db2.gz WUSQRFQFVWUWJF-QFBILLFUSA-N 2 1 344.449 4.150 20 0 EIADMP CC(C)[C@@H](C[NH2+]C1CCN(c2ccccc2)CC1)[NH+]1CCC(C)CC1 ZINC000463136611 1041373241 /nfs/dbraw/zinc/37/32/41/1041373241.db2.gz FXHJMIYTWVIJJT-JOCHJYFZSA-N 2 1 343.559 4.002 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCC[C@H]1Oc1cccc(C)c1 ZINC000484659668 1041380698 /nfs/dbraw/zinc/38/06/98/1041380698.db2.gz YSIORNHYRKEWQG-LEWJYISDSA-N 2 1 341.499 4.260 20 0 EIADMP C[C@H]1C[C@H](NC2(c3cccc(F)c3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000538553355 1041417322 /nfs/dbraw/zinc/41/73/22/1041417322.db2.gz DYUMVGSMGUDSCJ-LAUBAEHRSA-N 2 1 338.470 4.458 20 0 EIADMP C[C@H]1C[C@H](NC2(c3cccc(F)c3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000538553355 1041417330 /nfs/dbraw/zinc/41/73/30/1041417330.db2.gz DYUMVGSMGUDSCJ-LAUBAEHRSA-N 2 1 338.470 4.458 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000287312957 1041420809 /nfs/dbraw/zinc/42/08/09/1041420809.db2.gz LIMKKRDSAWGCDW-RYRKJORJSA-N 2 1 325.456 4.007 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000287312957 1041420817 /nfs/dbraw/zinc/42/08/17/1041420817.db2.gz LIMKKRDSAWGCDW-RYRKJORJSA-N 2 1 325.456 4.007 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCC3(CCCC3)O2)cc1 ZINC000554816151 1041424009 /nfs/dbraw/zinc/42/40/09/1041424009.db2.gz KUZWMSAGCUNOTO-OXJNMPFZSA-N 2 1 339.483 4.323 20 0 EIADMP CCc1nc2c(s1)[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)CCC2 ZINC000480635082 1041449078 /nfs/dbraw/zinc/44/90/78/1041449078.db2.gz VNQCFUSMPGBVKH-HOTGVXAUSA-N 2 1 335.561 4.327 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]CCC3Cc4ccccc4C3)CC2)cc1 ZINC000463243206 1041450257 /nfs/dbraw/zinc/45/02/57/1041450257.db2.gz AUBGHSYBBMXDKF-UHFFFAOYSA-N 2 1 348.534 4.088 20 0 EIADMP c1ccc(N2CCC([NH2+]C[C@@H]3CCC[N@H+]3C3CCCCC3)CC2)cc1 ZINC000463247977 1041452668 /nfs/dbraw/zinc/45/26/68/1041452668.db2.gz LIAWPQJVVYILDE-QFIPXVFZSA-N 2 1 341.543 4.042 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cccc(C(C)C)c2)[C@H](C)C1 ZINC000480674044 1041464777 /nfs/dbraw/zinc/46/47/77/1041464777.db2.gz WPLMDACGDOAROX-NQIIRXRSSA-N 2 1 332.532 4.037 20 0 EIADMP COc1cccc(CCC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000540462546 1041470886 /nfs/dbraw/zinc/47/08/86/1041470886.db2.gz URLBGZFHJHEBHT-KRWDZBQOSA-N 2 1 349.478 4.473 20 0 EIADMP COc1cc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC000195133233 1041484085 /nfs/dbraw/zinc/48/40/85/1041484085.db2.gz KOGIPFUHFQOKQY-FUHWJXTLSA-N 2 1 342.458 4.007 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Br)cc2C)C[C@@H]1C ZINC000538718058 1041487484 /nfs/dbraw/zinc/48/74/84/1041487484.db2.gz RUEVPYXSJWBQJQ-YOEHRIQHSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Br)cc2C)C[C@@H]1C ZINC000538718058 1041487491 /nfs/dbraw/zinc/48/74/91/1041487491.db2.gz RUEVPYXSJWBQJQ-YOEHRIQHSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Br)cc2C)C[C@@H]1C ZINC000538718058 1041487492 /nfs/dbraw/zinc/48/74/92/1041487492.db2.gz RUEVPYXSJWBQJQ-YOEHRIQHSA-N 2 1 339.321 4.062 20 0 EIADMP C[C@H]([NH2+]Cc1cnc(C2CC2)s1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000538704669 1041495379 /nfs/dbraw/zinc/49/53/79/1041495379.db2.gz VTZKZYYHOUOBFC-MAUKXSAKSA-N 2 1 341.524 4.021 20 0 EIADMP C[C@H]([NH2+]Cc1cnc(C2CC2)s1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000538704669 1041495393 /nfs/dbraw/zinc/49/53/93/1041495393.db2.gz VTZKZYYHOUOBFC-MAUKXSAKSA-N 2 1 341.524 4.021 20 0 EIADMP C[C@H]([NH2+]Cc1cnc(C2CC2)s1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000538704672 1041496214 /nfs/dbraw/zinc/49/62/14/1041496214.db2.gz VTZKZYYHOUOBFC-YJBOKZPZSA-N 2 1 341.524 4.021 20 0 EIADMP C[C@H]([NH2+]Cc1cnc(C2CC2)s1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000538704672 1041496224 /nfs/dbraw/zinc/49/62/24/1041496224.db2.gz VTZKZYYHOUOBFC-YJBOKZPZSA-N 2 1 341.524 4.021 20 0 EIADMP Cc1cccc(COc2ccc(C[NH2+][C@@H]3CC[N@H+](C)C[C@@H]3C)cc2)c1 ZINC000480753975 1041508678 /nfs/dbraw/zinc/50/86/78/1041508678.db2.gz COSKOHGXJMVQEU-PGRDOPGGSA-N 2 1 338.495 4.004 20 0 EIADMP Cc1cccc(COc2ccc(C[NH2+][C@H]3CC[N@H+](C)C[C@H]3C)cc2)c1 ZINC000480753974 1041509540 /nfs/dbraw/zinc/50/95/40/1041509540.db2.gz COSKOHGXJMVQEU-GCJKJVERSA-N 2 1 338.495 4.004 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@H](C)C1 ZINC000538738084 1041512786 /nfs/dbraw/zinc/51/27/86/1041512786.db2.gz XIQIWUQQKYQSQO-WBVHZDCISA-N 2 1 340.458 4.067 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@H](C)C1 ZINC000538738084 1041512802 /nfs/dbraw/zinc/51/28/02/1041512802.db2.gz XIQIWUQQKYQSQO-WBVHZDCISA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@H](C)C1 ZINC000538738084 1041512817 /nfs/dbraw/zinc/51/28/17/1041512817.db2.gz XIQIWUQQKYQSQO-WBVHZDCISA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@H](C)C1 ZINC000538738084 1041512830 /nfs/dbraw/zinc/51/28/30/1041512830.db2.gz XIQIWUQQKYQSQO-WBVHZDCISA-N 2 1 340.458 4.067 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1c(F)cccc1F ZINC000402035867 1041514100 /nfs/dbraw/zinc/51/41/00/1041514100.db2.gz CYEQTXKRDYQTRO-IERDGZPVSA-N 2 1 344.449 4.008 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccccc4F)o3)CC[C@H]21 ZINC000538799166 1041540022 /nfs/dbraw/zinc/54/00/22/1041540022.db2.gz RRENVKHCEKAYTI-HNAYVOBHSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(-c4ccccc4F)o3)CC[C@H]21 ZINC000538799166 1041540029 /nfs/dbraw/zinc/54/00/29/1041540029.db2.gz RRENVKHCEKAYTI-HNAYVOBHSA-N 2 1 328.431 4.002 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000540708623 1041606663 /nfs/dbraw/zinc/60/66/63/1041606663.db2.gz ZMGCHYBLRFFWJO-MSOLQXFVSA-N 2 1 338.417 4.193 20 0 EIADMP CSC1(C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000516822417 1041773887 /nfs/dbraw/zinc/77/38/87/1041773887.db2.gz RHMOIXYPNLBTRD-MJGOQNOKSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@H]([NH2+]CCCCCOc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000437784864 1041908612 /nfs/dbraw/zinc/90/86/12/1041908612.db2.gz KZZOXKLAYQHDDO-VQTJNVASSA-N 2 1 344.543 4.478 20 0 EIADMP Cn1ccnc1C[C@@H]1CCC[N@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000437791852 1041913219 /nfs/dbraw/zinc/91/32/19/1041913219.db2.gz HTYPVOCBVOQNKU-DWLFOUALSA-N 2 1 337.511 4.185 20 0 EIADMP CC[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)CC(F)(F)F ZINC000402688691 1041947227 /nfs/dbraw/zinc/94/72/27/1041947227.db2.gz HENLUERVXJSJIO-BQFCYCMXSA-N 2 1 342.449 4.465 20 0 EIADMP Fc1ccc2c(c1)CC[C@@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001168438771 1042065708 /nfs/dbraw/zinc/06/57/08/1042065708.db2.gz ODZJDEQHKCYARD-LEWJYISDSA-N 2 1 330.491 4.023 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CC[C@H](Cc4ccccc4)C3)CC2)[nH+]c1 ZINC000438187458 1042081950 /nfs/dbraw/zinc/08/19/50/1042081950.db2.gz JAPIAAHJECBWBK-IRLDBZIGSA-N 2 1 349.522 4.360 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CC[C@@](C)(c4ccccc4)C3)CC2)[nH+]1 ZINC000438190844 1042083854 /nfs/dbraw/zinc/08/38/54/1042083854.db2.gz NRSFRKGUEVKLPO-JTHBVZDNSA-N 2 1 349.522 4.459 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CC[C@@](C)(c4ccccc4)C3)CC2)[nH+]c1 ZINC000438194491 1042085328 /nfs/dbraw/zinc/08/53/28/1042085328.db2.gz ZQUBKCZUVCAHSK-JTHBVZDNSA-N 2 1 349.522 4.459 20 0 EIADMP Cc1cc(NC2CC[NH+](CC3CC3)CC2)c[nH+]c1N1CCCC[C@@H]1C ZINC000541881587 1042155665 /nfs/dbraw/zinc/15/56/65/1042155665.db2.gz MHLUOVBQDDIACS-KRWDZBQOSA-N 2 1 342.531 4.055 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000464779853 1042160593 /nfs/dbraw/zinc/16/05/93/1042160593.db2.gz PZQPZHGFENNRBO-LSDHHAIUSA-N 2 1 326.431 4.013 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000464779853 1042160594 /nfs/dbraw/zinc/16/05/94/1042160594.db2.gz PZQPZHGFENNRBO-LSDHHAIUSA-N 2 1 326.431 4.013 20 0 EIADMP C[N@@H+](CCOC1CCCCCC1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464831477 1042189166 /nfs/dbraw/zinc/18/91/66/1042189166.db2.gz AINANSGXTQPSSA-OAQYLSRUSA-N 2 1 344.543 4.180 20 0 EIADMP C[NH+](CCOC1CCCCCC1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464831477 1042189170 /nfs/dbraw/zinc/18/91/70/1042189170.db2.gz AINANSGXTQPSSA-OAQYLSRUSA-N 2 1 344.543 4.180 20 0 EIADMP C[NH+](CCOC1CCCCCC1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464831477 1042189175 /nfs/dbraw/zinc/18/91/75/1042189175.db2.gz AINANSGXTQPSSA-OAQYLSRUSA-N 2 1 344.543 4.180 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc3c(c2)CCC(C)(C)O3)CC1 ZINC000506371283 1042354734 /nfs/dbraw/zinc/35/47/34/1042354734.db2.gz UEQINKRUGAZMCQ-UHFFFAOYSA-N 2 1 330.516 4.095 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(F)cc2)CC1 ZINC000438826975 1042371405 /nfs/dbraw/zinc/37/14/05/1042371405.db2.gz AELYBQSMEMKCFG-UHFFFAOYSA-N 2 1 326.459 4.359 20 0 EIADMP c1cncc(-c2cccc(C[NH+]3CCC([NH+]4CCCCC4)CC3)c2)c1 ZINC000506383067 1042371500 /nfs/dbraw/zinc/37/15/00/1042371500.db2.gz FNZPYIDMYBWFOU-UHFFFAOYSA-N 2 1 335.495 4.199 20 0 EIADMP COc1ccc(Oc2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H](C)C3)cc2)cc1 ZINC000542322936 1042387952 /nfs/dbraw/zinc/38/79/52/1042387952.db2.gz NGRSGYTZFYGJTN-SJLPKXTDSA-N 2 1 340.467 4.060 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCOc2ccccc2)C1 ZINC000303657678 1042492748 /nfs/dbraw/zinc/49/27/48/1042492748.db2.gz VEFNWMSIQKHOGN-WOJBJXKFSA-N 2 1 330.516 4.042 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCOc2ccccc2)C1 ZINC000303657678 1042492751 /nfs/dbraw/zinc/49/27/51/1042492751.db2.gz VEFNWMSIQKHOGN-WOJBJXKFSA-N 2 1 330.516 4.042 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCOc2ccccc2)C1 ZINC000303657678 1042492753 /nfs/dbraw/zinc/49/27/53/1042492753.db2.gz VEFNWMSIQKHOGN-WOJBJXKFSA-N 2 1 330.516 4.042 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C2Cc3ccccc3C2)CC1 ZINC000518412751 1042509965 /nfs/dbraw/zinc/50/99/65/1042509965.db2.gz PEMIEEVCGXZFTC-UHFFFAOYSA-N 2 1 334.507 4.187 20 0 EIADMP c1cc(C[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc(OCC2CCCCC2)c1 ZINC000518767822 1042676972 /nfs/dbraw/zinc/67/69/72/1042676972.db2.gz TUSZRKVKSBEVFJ-HXUWFJFHSA-N 2 1 342.527 4.220 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000518793744 1042695680 /nfs/dbraw/zinc/69/56/80/1042695680.db2.gz ARLAMMNGYNLRBK-MRXNPFEDSA-N 2 1 346.421 4.189 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000177271294 1042832807 /nfs/dbraw/zinc/83/28/07/1042832807.db2.gz BCQKTQWZGYLIGF-DLBZAZTESA-N 2 1 344.524 4.320 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000177271294 1042832810 /nfs/dbraw/zinc/83/28/10/1042832810.db2.gz BCQKTQWZGYLIGF-DLBZAZTESA-N 2 1 344.524 4.320 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310496027 1042838673 /nfs/dbraw/zinc/83/86/73/1042838673.db2.gz IGVQSMDGTQGHOW-LNLFQRSKSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310496027 1042838676 /nfs/dbraw/zinc/83/86/76/1042838676.db2.gz IGVQSMDGTQGHOW-LNLFQRSKSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2[nH]ccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310902524 1042847322 /nfs/dbraw/zinc/84/73/22/1042847322.db2.gz BIVARKOEYZDMIA-FXAWDEMLSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000311107640 1042853102 /nfs/dbraw/zinc/85/31/02/1042853102.db2.gz DNOGWAUZWYLNOY-AZUAARDMSA-N 2 1 338.495 4.345 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000311107640 1042853103 /nfs/dbraw/zinc/85/31/03/1042853103.db2.gz DNOGWAUZWYLNOY-AZUAARDMSA-N 2 1 338.495 4.345 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000178413556 1042865655 /nfs/dbraw/zinc/86/56/55/1042865655.db2.gz UUGHTDINXHYBOD-INIZCTEOSA-N 2 1 343.540 4.179 20 0 EIADMP CC[C@H]1C[C@H](C[NH+]2CCC(CC[N@@H+](CC)CC3CC3)CC2)CCO1 ZINC000507774389 1042876107 /nfs/dbraw/zinc/87/61/07/1042876107.db2.gz KAIQIBJWPBKJSN-RTWAWAEBSA-N 2 1 336.564 4.026 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(Oc2ccc(C)c(C)c2)CC1 ZINC000179040051 1042884415 /nfs/dbraw/zinc/88/44/15/1042884415.db2.gz UADXNJNDJWYYMD-UHFFFAOYSA-N 2 1 341.499 4.132 20 0 EIADMP C[N@@H+](C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1)C(C)(C)Cc1ccccc1 ZINC001168004618 1042932093 /nfs/dbraw/zinc/93/20/93/1042932093.db2.gz WQOMWQFIJILJGL-WCRBZPEASA-N 2 1 326.528 4.345 20 0 EIADMP C[NH+](C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C(C)(C)Cc1ccccc1 ZINC001168004618 1042932099 /nfs/dbraw/zinc/93/20/99/1042932099.db2.gz WQOMWQFIJILJGL-WCRBZPEASA-N 2 1 326.528 4.345 20 0 EIADMP C[NH+](C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C(C)(C)Cc1ccccc1 ZINC001168004618 1042932104 /nfs/dbraw/zinc/93/21/04/1042932104.db2.gz WQOMWQFIJILJGL-WCRBZPEASA-N 2 1 326.528 4.345 20 0 EIADMP Fc1ccc(C[C@@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001168005139 1042957754 /nfs/dbraw/zinc/95/77/54/1042957754.db2.gz GPWLLWTUNYLQMQ-CCDCCJRHSA-N 2 1 342.502 4.238 20 0 EIADMP Fc1ccc(C[C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001168005139 1042957759 /nfs/dbraw/zinc/95/77/59/1042957759.db2.gz GPWLLWTUNYLQMQ-CCDCCJRHSA-N 2 1 342.502 4.238 20 0 EIADMP Fc1ccc(C[C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001168005139 1042957766 /nfs/dbraw/zinc/95/77/66/1042957766.db2.gz GPWLLWTUNYLQMQ-CCDCCJRHSA-N 2 1 342.502 4.238 20 0 EIADMP COc1ccccc1C[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168006342 1043000523 /nfs/dbraw/zinc/00/05/23/1043000523.db2.gz NIDUDXQMYVTUSJ-RMFSNUHRSA-N 2 1 338.495 4.226 20 0 EIADMP COc1ccccc1C[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168006342 1043000539 /nfs/dbraw/zinc/00/05/39/1043000539.db2.gz NIDUDXQMYVTUSJ-RMFSNUHRSA-N 2 1 338.495 4.226 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc2cc(OC)ccc2c1 ZINC000152418195 1043005967 /nfs/dbraw/zinc/00/59/67/1043005967.db2.gz ANTQRRABYMDJEE-ZHRRBRCNSA-N 2 1 338.495 4.373 20 0 EIADMP Cc1nc2ccc(C[NH2+][C@@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)cc2s1 ZINC000494196803 1043032138 /nfs/dbraw/zinc/03/21/38/1043032138.db2.gz ZQWZDBXORQQKLX-WMLDXEAASA-N 2 1 343.540 4.347 20 0 EIADMP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(OC)cc1 ZINC000183192849 1043039903 /nfs/dbraw/zinc/03/99/03/1043039903.db2.gz KIMIAYUJTQNZJD-CDXJDZJCSA-N 2 1 330.516 4.389 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]3CCCCC3)oc21 ZINC000391917588 1043078402 /nfs/dbraw/zinc/07/84/02/1043078402.db2.gz DHJNADBIUBIOKJ-HZPDHXFCSA-N 2 1 330.472 4.214 20 0 EIADMP FC(F)(F)C1CCC(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)CC1 ZINC000185515750 1043193526 /nfs/dbraw/zinc/19/35/26/1043193526.db2.gz JDCMIQWOELRJOT-JCYILVPMSA-N 2 1 332.454 4.305 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C[C@H]3CCC[C@@H](C)C3)CC2)cs1 ZINC000507933408 1043200568 /nfs/dbraw/zinc/20/05/68/1043200568.db2.gz CJBVEYGGORRWEA-AEFFLSMTSA-N 2 1 349.588 4.333 20 0 EIADMP CC[C@@H](Cc1ccccc1)[N@H+](CC)Cc1ncc(C[NH+](C)C)s1 ZINC000347864981 1043255509 /nfs/dbraw/zinc/25/55/09/1043255509.db2.gz OFCAORZHHTUWIC-KRWDZBQOSA-N 2 1 331.529 4.048 20 0 EIADMP CC[C@@H](Cc1ccccc1)[N@@H+](CC)Cc1ncc(C[NH+](C)C)s1 ZINC000347864981 1043255513 /nfs/dbraw/zinc/25/55/13/1043255513.db2.gz OFCAORZHHTUWIC-KRWDZBQOSA-N 2 1 331.529 4.048 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)C3CCC(F)(F)CC3)CC2)[nH+]c1 ZINC000474023429 1043261194 /nfs/dbraw/zinc/26/11/94/1043261194.db2.gz LXENTVAEONPYTJ-OAHLLOKOSA-N 2 1 337.458 4.162 20 0 EIADMP [NH3+]C1(C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CCCC1 ZINC000665249748 1043263399 /nfs/dbraw/zinc/26/33/99/1043263399.db2.gz YMMSKMPEZHFQLK-HNNXBMFYSA-N 2 1 327.497 4.049 20 0 EIADMP COc1ccc(-c2csc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000166764568 1043312192 /nfs/dbraw/zinc/31/21/92/1043312192.db2.gz FLTLUMNUFXXGPQ-QZTJIDSGSA-N 2 1 342.508 4.140 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(O)c1 ZINC001168011831 1043353757 /nfs/dbraw/zinc/35/37/57/1043353757.db2.gz SWLIBAJODVIKML-BMQTXXJKSA-N 2 1 338.495 4.484 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(O)c1 ZINC001168011831 1043353770 /nfs/dbraw/zinc/35/37/70/1043353770.db2.gz SWLIBAJODVIKML-BMQTXXJKSA-N 2 1 338.495 4.484 20 0 EIADMP [NH3+][C@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2C(F)(F)F)CC1 ZINC001205102923 1043397746 /nfs/dbraw/zinc/39/77/46/1043397746.db2.gz WKICSPCEONWRQF-LBPRGKRZSA-N 2 1 340.311 4.037 20 0 EIADMP [NH3+][C@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2C(F)(F)F)CC1 ZINC001205102923 1043397752 /nfs/dbraw/zinc/39/77/52/1043397752.db2.gz WKICSPCEONWRQF-LBPRGKRZSA-N 2 1 340.311 4.037 20 0 EIADMP COCC[N@@H+](C)CC[C@@H](N[C@@H](C)c1cccs1)c1ccccc1 ZINC000165985375 1043411459 /nfs/dbraw/zinc/41/14/59/1043411459.db2.gz IUGVXLXLOZMACR-FUHWJXTLSA-N 2 1 332.513 4.108 20 0 EIADMP COCCN(C)CC[C@@H]([NH2+][C@@H](C)c1cccs1)c1ccccc1 ZINC000165985375 1043411461 /nfs/dbraw/zinc/41/14/61/1043411461.db2.gz IUGVXLXLOZMACR-FUHWJXTLSA-N 2 1 332.513 4.108 20 0 EIADMP Cc1nc2ccc(C[NH2+]CCCC[N@@H+]3CCC[C@@H](C)C3)cc2s1 ZINC000494385261 1043459680 /nfs/dbraw/zinc/45/96/80/1043459680.db2.gz LYCJIMWAPQCUQV-OAHLLOKOSA-N 2 1 331.529 4.206 20 0 EIADMP C[C@H]([NH2+]Cc1cc2ccccc2[nH]1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000681390517 1043731586 /nfs/dbraw/zinc/73/15/86/1043731586.db2.gz NDKONQWKLCBASK-PXNSSMCTSA-N 2 1 333.479 4.168 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cnn1C(C)C ZINC000191325073 1043808414 /nfs/dbraw/zinc/80/84/14/1043808414.db2.gz OOSJFIPDGVCXJN-QZTJIDSGSA-N 2 1 342.531 4.334 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)cnn1C(C)C ZINC000191325073 1043808416 /nfs/dbraw/zinc/80/84/16/1043808416.db2.gz OOSJFIPDGVCXJN-QZTJIDSGSA-N 2 1 342.531 4.334 20 0 EIADMP C[C@@H](CC[NH2+][C@H]1Cc2[nH]c3ccccc3c2C1)[N@@H+](C)Cc1ccccc1 ZINC000442761583 1043824920 /nfs/dbraw/zinc/82/49/20/1043824920.db2.gz CLGFFSRCVFZRFL-PKOBYXMFSA-N 2 1 347.506 4.135 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1)[N@@H+](C)Cc1ccccc1 ZINC000442761582 1043825738 /nfs/dbraw/zinc/82/57/38/1043825738.db2.gz CLGFFSRCVFZRFL-MJGOQNOKSA-N 2 1 347.506 4.135 20 0 EIADMP C[C@H](CC[NH2+][C@H]1Cc2[nH]c3ccccc3c2C1)[N@@H+](C)Cc1ccccc1 ZINC000442761581 1043826082 /nfs/dbraw/zinc/82/60/82/1043826082.db2.gz CLGFFSRCVFZRFL-IEBWSBKVSA-N 2 1 347.506 4.135 20 0 EIADMP COc1ccc(Cl)c(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000192178677 1043890078 /nfs/dbraw/zinc/89/00/78/1043890078.db2.gz HQHKYOXSRLNJGC-LSDHHAIUSA-N 2 1 336.907 4.091 20 0 EIADMP COc1ccc(Cl)c(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000192178677 1043890082 /nfs/dbraw/zinc/89/00/82/1043890082.db2.gz HQHKYOXSRLNJGC-LSDHHAIUSA-N 2 1 336.907 4.091 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000674878089 1043907164 /nfs/dbraw/zinc/90/71/64/1043907164.db2.gz BIQAGPVUEGQPLJ-PMACEKPBSA-N 2 1 347.522 4.169 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000674878089 1043907177 /nfs/dbraw/zinc/90/71/77/1043907177.db2.gz BIQAGPVUEGQPLJ-PMACEKPBSA-N 2 1 347.522 4.169 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCOC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000674910093 1043933856 /nfs/dbraw/zinc/93/38/56/1043933856.db2.gz ZVYMRMPLJIOGFN-AZUAARDMSA-N 2 1 332.532 4.177 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCOC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC000674910093 1043933892 /nfs/dbraw/zinc/93/38/92/1043933892.db2.gz ZVYMRMPLJIOGFN-AZUAARDMSA-N 2 1 332.532 4.177 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)CCCOC(C)(C)C)CC[NH+]1Cc1ccccc1 ZINC000674910093 1043933903 /nfs/dbraw/zinc/93/39/03/1043933903.db2.gz ZVYMRMPLJIOGFN-AZUAARDMSA-N 2 1 332.532 4.177 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)CCCOC(C)(C)C)CC[NH+]1Cc1ccccc1 ZINC000674910093 1043933925 /nfs/dbraw/zinc/93/39/25/1043933925.db2.gz ZVYMRMPLJIOGFN-AZUAARDMSA-N 2 1 332.532 4.177 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2ccccc2n1 ZINC000195138722 1044027351 /nfs/dbraw/zinc/02/73/51/1044027351.db2.gz DQALDPSPLPZFMJ-ICSRJNTNSA-N 2 1 345.490 4.408 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc2ccccc2n1 ZINC000195138722 1044027368 /nfs/dbraw/zinc/02/73/68/1044027368.db2.gz DQALDPSPLPZFMJ-ICSRJNTNSA-N 2 1 345.490 4.408 20 0 EIADMP CS[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)C(C)(C)C ZINC000542499935 1044229167 /nfs/dbraw/zinc/22/91/67/1044229167.db2.gz RTNWSLRFRBTEIY-QXAKKESOSA-N 2 1 334.573 4.264 20 0 EIADMP CCCCOCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168016924 1044284801 /nfs/dbraw/zinc/28/48/01/1044284801.db2.gz WJBFZLJRFFXOEE-CEQLMSFQSA-N 2 1 332.532 4.224 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]CC2CCC(C(F)(F)F)CC2)C1 ZINC000466360375 1044319933 /nfs/dbraw/zinc/31/99/33/1044319933.db2.gz CNDICPVHFOECHL-GTPINHCMSA-N 2 1 334.470 4.457 20 0 EIADMP CC(C)[NH2+]C1CC[NH+](CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC000177705561 1044436381 /nfs/dbraw/zinc/43/63/81/1044436381.db2.gz LFLVELPNSBVRNN-UHFFFAOYSA-N 2 1 328.422 4.100 20 0 EIADMP C[C@@H]1C[C@@H](n2ncc3c2cccc3C[NH3+])C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168021938 1044460007 /nfs/dbraw/zinc/46/00/07/1044460007.db2.gz RINSYHCZVPXDHM-XEMDLRDOSA-N 2 1 348.494 4.109 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCC(C)(C)c2ccccc2)[C@H](C)C1 ZINC000675770734 1044485553 /nfs/dbraw/zinc/48/55/53/1044485553.db2.gz YLVAVAKSBPVVMV-TZIWHRDSSA-N 2 1 346.559 4.081 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)o1 ZINC000675787068 1044497476 /nfs/dbraw/zinc/49/74/76/1044497476.db2.gz SVTXWRNOXOGXNX-PKOBYXMFSA-N 2 1 326.484 4.405 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)o1 ZINC000675787068 1044497495 /nfs/dbraw/zinc/49/74/95/1044497495.db2.gz SVTXWRNOXOGXNX-PKOBYXMFSA-N 2 1 326.484 4.405 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000675790081 1044501664 /nfs/dbraw/zinc/50/16/64/1044501664.db2.gz RCMADJNBHUDIDA-UWJYYQICSA-N 2 1 333.479 4.168 20 0 EIADMP c1ccc(C[C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000480753801 1044581707 /nfs/dbraw/zinc/58/17/07/1044581707.db2.gz BUMSKTPRWUPYRM-KNQAVFIVSA-N 2 1 326.528 4.252 20 0 EIADMP C[C@H]1CC([NH2+][C@H]2CCCc3cccnc32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168024177 1044595520 /nfs/dbraw/zinc/59/55/20/1044595520.db2.gz BWXRMZUZGKPNTO-SPEDKVCISA-N 2 1 349.522 4.490 20 0 EIADMP CSCC1CCC([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000395169778 1044617878 /nfs/dbraw/zinc/61/78/78/1044617878.db2.gz WCQVFJCAZZTGCA-IOJLRTSASA-N 2 1 332.557 4.020 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000359943105 1044651297 /nfs/dbraw/zinc/65/12/97/1044651297.db2.gz PSPRUQWKDFYUCS-YJBOKZPZSA-N 2 1 336.520 4.464 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]C[C@H]3CCC4(CCC4)O3)CC[N@@H+]2C2CC2)cc1 ZINC000895677917 1044845401 /nfs/dbraw/zinc/84/54/01/1044845401.db2.gz TXMRSVJHRKMXOT-NRSPTQNISA-N 2 1 340.511 4.046 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]C[C@H]3CCC4(CCC4)O3)CC[N@H+]2C2CC2)cc1 ZINC000895677917 1044845402 /nfs/dbraw/zinc/84/54/02/1044845402.db2.gz TXMRSVJHRKMXOT-NRSPTQNISA-N 2 1 340.511 4.046 20 0 EIADMP Cc1nccn1CCCC[N@@H+](CCc1ccccc1)Cc1cccnc1 ZINC000429285681 1044891848 /nfs/dbraw/zinc/89/18/48/1044891848.db2.gz OVBLUDPEGBGVND-UHFFFAOYSA-N 2 1 348.494 4.112 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](CCc1ccccc1)Cc1cccnc1 ZINC000429285681 1044891850 /nfs/dbraw/zinc/89/18/50/1044891850.db2.gz OVBLUDPEGBGVND-UHFFFAOYSA-N 2 1 348.494 4.112 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](CCc1ccccc1)Cc1cccnc1 ZINC000429285681 1044891851 /nfs/dbraw/zinc/89/18/51/1044891851.db2.gz OVBLUDPEGBGVND-UHFFFAOYSA-N 2 1 348.494 4.112 20 0 EIADMP CCC[C@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1cccnc1 ZINC000544570185 1044945001 /nfs/dbraw/zinc/94/50/01/1044945001.db2.gz WPZYJFSKSXZZKF-NQIIRXRSSA-N 2 1 325.500 4.423 20 0 EIADMP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000347913513 1044998907 /nfs/dbraw/zinc/99/89/07/1044998907.db2.gz AEMWYYDXMLOGKU-QZTJIDSGSA-N 2 1 340.515 4.096 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000495420360 1045089354 /nfs/dbraw/zinc/08/93/54/1045089354.db2.gz HJDBUSOGTGQOEJ-ZIFCJYIRSA-N 2 1 328.525 4.179 20 0 EIADMP CCc1ccc(C[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cn1 ZINC000347777730 1045106524 /nfs/dbraw/zinc/10/65/24/1045106524.db2.gz JDQVHASJEZGXAN-XMSQKQJNSA-N 2 1 337.511 4.129 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@@H](C)CCc3ccccc3)CCCC2)CC1 ZINC000495445480 1045130180 /nfs/dbraw/zinc/13/01/80/1045130180.db2.gz WIEDGYDPPABASQ-IBGZPJMESA-N 2 1 344.543 4.021 20 0 EIADMP COC1(C[C@H](C)[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCC1 ZINC000429432497 1045133981 /nfs/dbraw/zinc/13/39/81/1045133981.db2.gz XHPNMCZOAMYBFU-JKSUJKDBSA-N 2 1 327.472 4.179 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)[C@H](C)c1nc2ccccc2o1 ZINC000626062810 1045165969 /nfs/dbraw/zinc/16/59/69/1045165969.db2.gz HJBRBAVZNYWQMN-MRXNPFEDSA-N 2 1 337.467 4.473 20 0 EIADMP CC(C)c1cc(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)on1 ZINC000671747807 1045179410 /nfs/dbraw/zinc/17/94/10/1045179410.db2.gz PHPSSJCUQIVZCD-UHFFFAOYSA-N 2 1 341.499 4.331 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1scnc1C1CC1 ZINC000486962681 1045221972 /nfs/dbraw/zinc/22/19/72/1045221972.db2.gz DLMINUMKKWXXRR-UHFFFAOYSA-N 2 1 329.513 4.151 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2scnc2C2CC2)[C@@H]1c1cccs1 ZINC000487272402 1045224546 /nfs/dbraw/zinc/22/45/46/1045224546.db2.gz SCFNNOWRBPJRBO-KBXCAEBGSA-N 2 1 347.553 4.255 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2scnc2C2CC2)[C@@H]1c1cccs1 ZINC000487272402 1045224556 /nfs/dbraw/zinc/22/45/56/1045224556.db2.gz SCFNNOWRBPJRBO-KBXCAEBGSA-N 2 1 347.553 4.255 20 0 EIADMP c1ccc2c(c1)cccc2CSCC[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000611104246 1045250522 /nfs/dbraw/zinc/25/05/22/1045250522.db2.gz PSHBKXVINBBEIP-PMACEKPBSA-N 2 1 340.536 4.289 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)c(C)c2c1 ZINC000161627021 1045304461 /nfs/dbraw/zinc/30/44/61/1045304461.db2.gz RZXOLPJXFOKLJW-ARFHVFGLSA-N 2 1 328.456 4.027 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)c(C)c2c1 ZINC000161627021 1045304465 /nfs/dbraw/zinc/30/44/65/1045304465.db2.gz RZXOLPJXFOKLJW-ARFHVFGLSA-N 2 1 328.456 4.027 20 0 EIADMP CC(C)CCOc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC000236588273 1045360429 /nfs/dbraw/zinc/36/04/29/1045360429.db2.gz HDVIJLNPXUFXPP-IHWFROFDSA-N 2 1 330.516 4.216 20 0 EIADMP C/C(=C/c1ccccc1)C[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000236701520 1045364047 /nfs/dbraw/zinc/36/40/47/1045364047.db2.gz NCNAKZCMSKCHLL-OWFGXHLJSA-N 2 1 334.507 4.244 20 0 EIADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000236933309 1045369971 /nfs/dbraw/zinc/36/99/71/1045369971.db2.gz DDMDEMCIEMXRGN-CQSZACIVSA-N 2 1 334.410 4.046 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000236933309 1045369979 /nfs/dbraw/zinc/36/99/79/1045369979.db2.gz DDMDEMCIEMXRGN-CQSZACIVSA-N 2 1 334.410 4.046 20 0 EIADMP C[N@@H+](CCC[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1)Cc1ccccc1 ZINC000237095141 1045374736 /nfs/dbraw/zinc/37/47/36/1045374736.db2.gz BUXAZRPSNGJMET-SJORKVTESA-N 2 1 328.422 4.219 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000237103191 1045375599 /nfs/dbraw/zinc/37/55/99/1045375599.db2.gz UOVPIPUGJVRPSG-SFTDATJTSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+][C@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC000237103191 1045375603 /nfs/dbraw/zinc/37/56/03/1045375603.db2.gz UOVPIPUGJVRPSG-SFTDATJTSA-N 2 1 336.479 4.079 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000237539627 1045388120 /nfs/dbraw/zinc/38/81/20/1045388120.db2.gz LBUCXXLULATHRN-YJBOKZPZSA-N 2 1 330.422 4.108 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000237539627 1045388125 /nfs/dbraw/zinc/38/81/25/1045388125.db2.gz LBUCXXLULATHRN-YJBOKZPZSA-N 2 1 330.422 4.108 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000429531726 1045676258 /nfs/dbraw/zinc/67/62/58/1045676258.db2.gz SFKZTMZPRWGJSX-HIFRSBDPSA-N 2 1 330.394 4.062 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(F)c1 ZINC000398050260 1045826970 /nfs/dbraw/zinc/82/69/70/1045826970.db2.gz XICDCJDPPBXVGM-FIKGOQFSSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(F)c1 ZINC000398050260 1045826976 /nfs/dbraw/zinc/82/69/76/1045826976.db2.gz XICDCJDPPBXVGM-FIKGOQFSSA-N 2 1 326.459 4.387 20 0 EIADMP COc1ccccc1[C@H](C)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398142366 1045830636 /nfs/dbraw/zinc/83/06/36/1045830636.db2.gz MUDSXZGCDMZNTG-WFXMLNOXSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398142366 1045830641 /nfs/dbraw/zinc/83/06/41/1045830641.db2.gz MUDSXZGCDMZNTG-WFXMLNOXSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398142366 1045830644 /nfs/dbraw/zinc/83/06/44/1045830644.db2.gz MUDSXZGCDMZNTG-WFXMLNOXSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398142366 1045830646 /nfs/dbraw/zinc/83/06/46/1045830646.db2.gz MUDSXZGCDMZNTG-WFXMLNOXSA-N 2 1 338.495 4.256 20 0 EIADMP CC[C@@H]1C[C@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000509454724 1045944268 /nfs/dbraw/zinc/94/42/68/1045944268.db2.gz OKVHKSGRKNUCFY-NJYVYQBISA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@@H]1C[C@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000509454724 1045944279 /nfs/dbraw/zinc/94/42/79/1045944279.db2.gz OKVHKSGRKNUCFY-NJYVYQBISA-N 2 1 344.543 4.082 20 0 EIADMP Cc1cccc(COc2ccc([C@@H](C)[NH2+]C3CC[NH+](C)CC3)cc2)c1 ZINC000161523429 1046003839 /nfs/dbraw/zinc/00/38/39/1046003839.db2.gz DFPQUWUZHAGPDH-GOSISDBHSA-N 2 1 338.495 4.319 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000161613074 1046006370 /nfs/dbraw/zinc/00/63/70/1046006370.db2.gz BTFUURMQZUDJHZ-CKEIUWERSA-N 2 1 340.433 4.055 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000261754440 1046144705 /nfs/dbraw/zinc/14/47/05/1046144705.db2.gz KKPOEVDPLISGBH-DNVCBOLYSA-N 2 1 329.513 4.111 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000261754440 1046144719 /nfs/dbraw/zinc/14/47/19/1046144719.db2.gz KKPOEVDPLISGBH-DNVCBOLYSA-N 2 1 329.513 4.111 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000261932079 1046166268 /nfs/dbraw/zinc/16/62/68/1046166268.db2.gz LROFGFGVTRBGQM-IAGOWNOFSA-N 2 1 343.540 4.419 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc3c[nH]nc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000124056525 1046214387 /nfs/dbraw/zinc/21/43/87/1046214387.db2.gz NFIPLXHZFKSXIP-UTKZUKDTSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc3c[nH]nc3c2)CC[N@H+]1Cc1ccccc1 ZINC000124056525 1046214404 /nfs/dbraw/zinc/21/44/04/1046214404.db2.gz NFIPLXHZFKSXIP-UTKZUKDTSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc3c[nH]nc3c2)CC[NH+]1Cc1ccccc1 ZINC000124056525 1046214409 /nfs/dbraw/zinc/21/44/09/1046214409.db2.gz NFIPLXHZFKSXIP-UTKZUKDTSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc3c[nH]nc3c2)CC[NH+]1Cc1ccccc1 ZINC000124056525 1046214418 /nfs/dbraw/zinc/21/44/18/1046214418.db2.gz NFIPLXHZFKSXIP-UTKZUKDTSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CC(C)(C)OC2(C)C)CC1 ZINC000125176327 1046290321 /nfs/dbraw/zinc/29/03/21/1046290321.db2.gz VLODVMLGVFQSCA-APWZRJJASA-N 2 1 330.516 4.148 20 0 EIADMP C[C@H](NC1(c2ccccc2F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508717792 1046374050 /nfs/dbraw/zinc/37/40/50/1046374050.db2.gz IBOBXUSGNOHDRE-HKUYNNGSSA-N 2 1 338.470 4.315 20 0 EIADMP C[C@H]([NH2+]C1(c2ccccc2F)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508717792 1046374067 /nfs/dbraw/zinc/37/40/67/1046374067.db2.gz IBOBXUSGNOHDRE-HKUYNNGSSA-N 2 1 338.470 4.315 20 0 EIADMP C[C@H]([NH2+]C1(c2ccccc2F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508717792 1046374085 /nfs/dbraw/zinc/37/40/85/1046374085.db2.gz IBOBXUSGNOHDRE-HKUYNNGSSA-N 2 1 338.470 4.315 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)C/C(C)=C\c2ccccc2COC)C[C@H]1C ZINC000508719528 1046376854 /nfs/dbraw/zinc/37/68/54/1046376854.db2.gz NYAFEXDQTIJWHJ-LDQLGUEGSA-N 2 1 330.516 4.041 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C(C)=C\c2ccccc2COC)C[C@H]1C ZINC000508719528 1046376870 /nfs/dbraw/zinc/37/68/70/1046376870.db2.gz NYAFEXDQTIJWHJ-LDQLGUEGSA-N 2 1 330.516 4.041 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C(C)=C\c2ccccc2COC)C[C@H]1C ZINC000508719528 1046376886 /nfs/dbraw/zinc/37/68/86/1046376886.db2.gz NYAFEXDQTIJWHJ-LDQLGUEGSA-N 2 1 330.516 4.041 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508722737 1046424473 /nfs/dbraw/zinc/42/44/73/1046424473.db2.gz UGQANSABYXSSDN-PKOBYXMFSA-N 2 1 328.525 4.099 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)CC2)[nH+]1 ZINC000127049323 1046598277 /nfs/dbraw/zinc/59/82/77/1046598277.db2.gz PZLNNIRXJVNTCU-TZIWHRDSSA-N 2 1 335.495 4.285 20 0 EIADMP COc1ccc2cc(C[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000536659491 1046607972 /nfs/dbraw/zinc/60/79/72/1046607972.db2.gz IHFCBYNRXBMBLV-NRFANRHFSA-N 2 1 338.495 4.299 20 0 EIADMP c1ccc(-c2cccc3c2OCC[C@@H]3[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000459411910 1046630353 /nfs/dbraw/zinc/63/03/53/1046630353.db2.gz KGPYPFJEIPNYPE-QFIPXVFZSA-N 2 1 348.490 4.394 20 0 EIADMP Fc1ccccc1-c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)o1 ZINC000536662757 1046635330 /nfs/dbraw/zinc/63/53/30/1046635330.db2.gz XORVGCOWJOTPAL-INIZCTEOSA-N 2 1 328.431 4.003 20 0 EIADMP Fc1ccccc1-c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)o1 ZINC000536662757 1046635339 /nfs/dbraw/zinc/63/53/39/1046635339.db2.gz XORVGCOWJOTPAL-INIZCTEOSA-N 2 1 328.431 4.003 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379618868 1046710778 /nfs/dbraw/zinc/71/07/78/1046710778.db2.gz AULDSWBTRGOMNB-DYESRHJHSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3cc[nH]c3c2)CC[N@H+]1Cc1ccccc1 ZINC000379618868 1046710791 /nfs/dbraw/zinc/71/07/91/1046710791.db2.gz AULDSWBTRGOMNB-DYESRHJHSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@@H](NCc2ccc(F)cc2F)CC[N@H+]1Cc1ccccc1 ZINC000379622199 1046715031 /nfs/dbraw/zinc/71/50/31/1046715031.db2.gz GEOHMLPKQHEPCZ-BEFAXECRSA-N 2 1 330.422 4.108 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCSc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379633873 1046733420 /nfs/dbraw/zinc/73/34/20/1046733420.db2.gz URYGALTTXQCGGD-ICSRJNTNSA-N 2 1 340.536 4.421 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCSc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379633873 1046733433 /nfs/dbraw/zinc/73/34/33/1046733433.db2.gz URYGALTTXQCGGD-ICSRJNTNSA-N 2 1 340.536 4.421 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cc(F)ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000379644805 1046739142 /nfs/dbraw/zinc/73/91/42/1046739142.db2.gz CPYLNOWWZTYXQS-QGCDCVKKSA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cc(F)ccc32)CC[N@H+]1Cc1ccccc1 ZINC000379644805 1046739156 /nfs/dbraw/zinc/73/91/56/1046739156.db2.gz CPYLNOWWZTYXQS-QGCDCVKKSA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC000379647796 1046741024 /nfs/dbraw/zinc/74/10/24/1046741024.db2.gz LDHKQHFRDZSORX-YFXJRYMSSA-N 2 1 334.507 4.187 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC000379647796 1046741027 /nfs/dbraw/zinc/74/10/27/1046741027.db2.gz LDHKQHFRDZSORX-YFXJRYMSSA-N 2 1 334.507 4.187 20 0 EIADMP Clc1ccc([C@@H]2C[C@H]2C[NH2+]C2CC[NH+](C3CC3)CC2)c(Cl)c1 ZINC000459595710 1046802925 /nfs/dbraw/zinc/80/29/25/1046802925.db2.gz SZGXHGBMYXJABO-YVEFUNNKSA-N 2 1 339.310 4.313 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1 ZINC000536858199 1046826718 /nfs/dbraw/zinc/82/67/18/1046826718.db2.gz PSWKXBKDNBPPHB-VXGBXAGGSA-N 2 1 326.271 4.485 20 0 EIADMP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc3c[nH+]cn3c2)CC1 ZINC000459660682 1046844195 /nfs/dbraw/zinc/84/41/95/1046844195.db2.gz OVCAEAKRHNNHDF-UHFFFAOYSA-N 3 1 342.531 4.103 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1 ZINC000537013242 1046894302 /nfs/dbraw/zinc/89/43/02/1046894302.db2.gz WQYCXHLSAQYORA-LLGFUMIMSA-N 2 1 329.532 4.338 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1 ZINC000537013241 1046894699 /nfs/dbraw/zinc/89/46/99/1046894699.db2.gz WQYCXHLSAQYORA-FIKGOQFSSA-N 2 1 329.532 4.338 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@@H]3CCC[N@H+](CC(C)C)C3)oc21 ZINC000537305927 1047089235 /nfs/dbraw/zinc/08/92/35/1047089235.db2.gz CRDOZOLEGWVXMP-SJORKVTESA-N 2 1 344.499 4.460 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@@H]3CCC[N@@H+](CC(C)C)C3)oc21 ZINC000537305927 1047089252 /nfs/dbraw/zinc/08/92/52/1047089252.db2.gz CRDOZOLEGWVXMP-SJORKVTESA-N 2 1 344.499 4.460 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCc3nc(Cl)ccc32)C1 ZINC000806131619 1047124289 /nfs/dbraw/zinc/12/42/89/1047124289.db2.gz LFQHFACZTQITPY-UXLLHSPISA-N 2 1 335.923 4.070 20 0 EIADMP Clc1nc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc2ccccc21 ZINC000788479287 1047198894 /nfs/dbraw/zinc/19/88/94/1047198894.db2.gz QVKPQXDIGDRRDK-UHFFFAOYSA-N 2 1 343.902 4.196 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000537406729 1047200319 /nfs/dbraw/zinc/20/03/19/1047200319.db2.gz IAAGTFBSTJYNCM-ZDFPQIBNSA-N 2 1 344.543 4.080 20 0 EIADMP CC[NH+](CC)CCC[N@H+]1CCCCC[C@H]1C[C@H](O)c1cccs1 ZINC000788482683 1047213296 /nfs/dbraw/zinc/21/32/96/1047213296.db2.gz QLFJBWRDWADLMA-ROUUACIJSA-N 2 1 338.561 4.148 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(Cl)nc21 ZINC000788527564 1047227126 /nfs/dbraw/zinc/22/71/26/1047227126.db2.gz NKJQLBFDEFMYLO-GOSISDBHSA-N 2 1 343.902 4.352 20 0 EIADMP COc1ccc(C[NH2+]CCC[N@H+]2CCCC[C@H]2C)c2ccccc12 ZINC000325425006 1047239692 /nfs/dbraw/zinc/23/96/92/1047239692.db2.gz XKJZUNXCWRALHW-QGZVFWFLSA-N 2 1 326.484 4.203 20 0 EIADMP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2COCc3cccc(Cl)c32)c1 ZINC000788595331 1047242105 /nfs/dbraw/zinc/24/21/05/1047242105.db2.gz SCUAUEJLNREISJ-IBGZPJMESA-N 2 1 344.886 4.153 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2COCc3cccc(Cl)c32)c1 ZINC000788595331 1047242120 /nfs/dbraw/zinc/24/21/20/1047242120.db2.gz SCUAUEJLNREISJ-IBGZPJMESA-N 2 1 344.886 4.153 20 0 EIADMP CC(C)c1nc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cs1 ZINC000556075639 1047433315 /nfs/dbraw/zinc/43/33/15/1047433315.db2.gz DGGBLIQOHPWMPT-HKUYNNGSSA-N 2 1 343.540 4.234 20 0 EIADMP CC(C)c1nc(CC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cs1 ZINC000556075639 1047433322 /nfs/dbraw/zinc/43/33/22/1047433322.db2.gz DGGBLIQOHPWMPT-HKUYNNGSSA-N 2 1 343.540 4.234 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)CC1 ZINC000129635240 1047451542 /nfs/dbraw/zinc/45/15/42/1047451542.db2.gz GHCSOOPSNOCAJG-LJQANCHMSA-N 2 1 328.500 4.287 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCCc3c(O)cccc32)C1 ZINC000556236333 1047602160 /nfs/dbraw/zinc/60/21/60/1047602160.db2.gz QNECRCSOTKRISO-QKLQHJQFSA-N 2 1 330.516 4.117 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@H](c3ccncc3)C3CC3)CC23CC3)cc1 ZINC000898319174 1047621252 /nfs/dbraw/zinc/62/12/52/1047621252.db2.gz AGVIOLJACPGLIP-VXKWHMMOSA-N 2 1 347.506 4.320 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@H](c3ccncc3)C3CC3)CC23CC3)cc1 ZINC000898319174 1047621257 /nfs/dbraw/zinc/62/12/57/1047621257.db2.gz AGVIOLJACPGLIP-VXKWHMMOSA-N 2 1 347.506 4.320 20 0 EIADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000556385434 1047723900 /nfs/dbraw/zinc/72/39/00/1047723900.db2.gz HIAPUILOFFZKCE-CQSZACIVSA-N 2 1 349.931 4.283 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000556385434 1047723905 /nfs/dbraw/zinc/72/39/05/1047723905.db2.gz HIAPUILOFFZKCE-CQSZACIVSA-N 2 1 349.931 4.283 20 0 EIADMP C[C@H](CCc1ccc(O)cc1)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550643954 1047801260 /nfs/dbraw/zinc/80/12/60/1047801260.db2.gz HYXWBVCNOOBVMN-AGHHOFFYSA-N 2 1 338.495 4.138 20 0 EIADMP C[C@H](CCc1ccc(O)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550643954 1047801265 /nfs/dbraw/zinc/80/12/65/1047801265.db2.gz HYXWBVCNOOBVMN-AGHHOFFYSA-N 2 1 338.495 4.138 20 0 EIADMP C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550643957 1047803869 /nfs/dbraw/zinc/80/38/69/1047803869.db2.gz HYXWBVCNOOBVMN-ZNLUXHQJSA-N 2 1 338.495 4.138 20 0 EIADMP C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550643957 1047803870 /nfs/dbraw/zinc/80/38/70/1047803870.db2.gz HYXWBVCNOOBVMN-ZNLUXHQJSA-N 2 1 338.495 4.138 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665005 1047809759 /nfs/dbraw/zinc/80/97/59/1047809759.db2.gz CMRGHDSDGSEBPD-FPDPHYFHSA-N 2 1 344.449 4.493 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665005 1047809762 /nfs/dbraw/zinc/80/97/62/1047809762.db2.gz CMRGHDSDGSEBPD-FPDPHYFHSA-N 2 1 344.449 4.493 20 0 EIADMP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000556590217 1047830571 /nfs/dbraw/zinc/83/05/71/1047830571.db2.gz TWXKLECJMUBYKM-MCEIDBOGSA-N 2 1 344.543 4.289 20 0 EIADMP C[C@@H]1C[C@@H](N(C)Cc2cnc(-c3ccc(Cl)cc3)s2)CC[N@H+]1C ZINC000556598241 1047834579 /nfs/dbraw/zinc/83/45/79/1047834579.db2.gz IWCZBWCXMXAXIZ-CJNGLKHVSA-N 2 1 349.931 4.378 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cnc(-c3ccc(Cl)cc3)s2)CCN1C ZINC000556598241 1047834580 /nfs/dbraw/zinc/83/45/80/1047834580.db2.gz IWCZBWCXMXAXIZ-CJNGLKHVSA-N 2 1 349.931 4.378 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cnc(-c3ccc(Cl)cc3)s2)CCN1C ZINC000556598241 1047834581 /nfs/dbraw/zinc/83/45/81/1047834581.db2.gz IWCZBWCXMXAXIZ-CJNGLKHVSA-N 2 1 349.931 4.378 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCO[C@@H]3CCCC[C@@H]3C)C2)CC1 ZINC000498881063 1047896580 /nfs/dbraw/zinc/89/65/80/1047896580.db2.gz QYBNAQFZDAAKKN-PWRODBHTSA-N 2 1 336.564 4.026 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCO[C@@H]3CCCC[C@@H]3C)C2)CC1 ZINC000498881063 1047896585 /nfs/dbraw/zinc/89/65/85/1047896585.db2.gz QYBNAQFZDAAKKN-PWRODBHTSA-N 2 1 336.564 4.026 20 0 EIADMP C[N@@H+](C1CCC([NH3+])CC1)[C@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171063035 1047905982 /nfs/dbraw/zinc/90/59/82/1047905982.db2.gz LAKUISFDEYPUSC-NRXISQOPSA-N 2 1 327.299 4.052 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CCc3cc(Cl)cc(Cl)c3C1)C2 ZINC001171064057 1047915594 /nfs/dbraw/zinc/91/55/94/1047915594.db2.gz QKFRMPOPSRKBAG-JONQDZQNSA-N 2 1 339.310 4.066 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3cc(Cl)cc(Cl)c3C1)C2 ZINC001171064059 1047917547 /nfs/dbraw/zinc/91/75/47/1047917547.db2.gz QKFRMPOPSRKBAG-LVQVYYBASA-N 2 1 339.310 4.066 20 0 EIADMP COC1CCC(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000514953578 1048087681 /nfs/dbraw/zinc/08/76/81/1048087681.db2.gz IFEYFHCNXCTYQE-BCKAPOECSA-N 2 1 330.516 4.007 20 0 EIADMP COC1CCC(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000514953578 1048087693 /nfs/dbraw/zinc/08/76/93/1048087693.db2.gz IFEYFHCNXCTYQE-BCKAPOECSA-N 2 1 330.516 4.007 20 0 EIADMP FC1(F)CC([NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000556887851 1048101764 /nfs/dbraw/zinc/10/17/64/1048101764.db2.gz MGQXTUWWPAZQGA-YTQUADARSA-N 2 1 334.454 4.065 20 0 EIADMP COc1c(F)cc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)cc1Cl ZINC001143847339 1048226532 /nfs/dbraw/zinc/22/65/32/1048226532.db2.gz JAGJXAVOUMBLLL-UHFFFAOYSA-N 2 1 342.886 4.040 20 0 EIADMP FC1(F)C[C@@]12CC[NH+](CCCCCC[N@@H+]1CC[C@@]3(CC3(F)F)C1)C2 ZINC000844470876 1048355607 /nfs/dbraw/zinc/35/56/07/1048355607.db2.gz MCXCVOUUDILSJK-HZPDHXFCSA-N 2 1 348.428 4.009 20 0 EIADMP c1ccc(C[C@@H]2C[C@H]2[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000499215469 1048422409 /nfs/dbraw/zinc/42/24/09/1048422409.db2.gz QDIBNRAWADIYQP-GNADVCDUSA-N 2 1 346.518 4.403 20 0 EIADMP Cc1ccccc1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499247078 1048480196 /nfs/dbraw/zinc/48/01/96/1048480196.db2.gz UZHQWTBPJUPFIE-NUNAXRQHSA-N 2 1 334.507 4.323 20 0 EIADMP Cc1nc2ccc(C[N@H+](C)Cc3ccc(C[NH+](C)C)cc3)cc2s1 ZINC000809737010 1048509940 /nfs/dbraw/zinc/50/99/40/1048509940.db2.gz BDGRFIIHSKHIOT-UHFFFAOYSA-N 2 1 339.508 4.298 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc(-c3cccnc3)c2)cc1 ZINC000809739114 1048510715 /nfs/dbraw/zinc/51/07/15/1048510715.db2.gz XVFCPHLFDRQVOX-UHFFFAOYSA-N 2 1 345.490 4.442 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)C/C=C\c2ccc(F)c(F)c2)cc1 ZINC000809738809 1048513828 /nfs/dbraw/zinc/51/38/28/1048513828.db2.gz KTNCHWGXUACSFM-PLNGDYQASA-N 2 1 330.422 4.172 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc2cccc(OC)c2o1 ZINC000809755578 1048520078 /nfs/dbraw/zinc/52/00/78/1048520078.db2.gz LHVOKNYPGVJSQQ-UHFFFAOYSA-N 2 1 341.455 4.113 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc2cccc(OC)c2o1 ZINC000809755578 1048520087 /nfs/dbraw/zinc/52/00/87/1048520087.db2.gz LHVOKNYPGVJSQQ-UHFFFAOYSA-N 2 1 341.455 4.113 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccccc2OC)CC1)CC1CC1 ZINC000557079967 1048522711 /nfs/dbraw/zinc/52/27/11/1048522711.db2.gz HGSXREBZDHHTCX-UHFFFAOYSA-N 2 1 330.516 4.029 20 0 EIADMP Cc1ccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CCCC2)c(C)c1 ZINC000815657328 1048560082 /nfs/dbraw/zinc/56/00/82/1048560082.db2.gz WAXDOUNLMTZSDR-IHWFROFDSA-N 2 1 326.528 4.330 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+][C@H](C)c1ccc(Br)nc1 ZINC000810215433 1048684483 /nfs/dbraw/zinc/68/44/83/1048684483.db2.gz FHLHMWFVXMVGKT-CQSZACIVSA-N 2 1 342.325 4.007 20 0 EIADMP C[C@H]([NH2+]CC[C@]1(C)C[C@]1(F)Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000846036810 1048801251 /nfs/dbraw/zinc/80/12/51/1048801251.db2.gz MKEGJTXCXXRTEE-GDAAHCPNSA-N 2 1 338.898 4.191 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cc(F)c(F)cc2Cl)CC1 ZINC001144726189 1048825725 /nfs/dbraw/zinc/82/57/25/1048825725.db2.gz HSIXHXWOELEBAT-UHFFFAOYSA-N 2 1 330.850 4.170 20 0 EIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(F)cc1 ZINC000846145991 1048833376 /nfs/dbraw/zinc/83/33/76/1048833376.db2.gz PVQGBJOBZLCCMP-SFTDATJTSA-N 2 1 348.506 4.146 20 0 EIADMP Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@H+]1CCCCCC[NH3+] ZINC000846219420 1048843996 /nfs/dbraw/zinc/84/39/96/1048843996.db2.gz QLOXHHPYNDYYQU-MRXNPFEDSA-N 2 1 340.943 4.157 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000846796460 1048898693 /nfs/dbraw/zinc/89/86/93/1048898693.db2.gz KILPZZHKQVKCIF-KRWDZBQOSA-N 2 1 337.389 4.209 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000846796460 1048898694 /nfs/dbraw/zinc/89/86/94/1048898694.db2.gz KILPZZHKQVKCIF-KRWDZBQOSA-N 2 1 337.389 4.209 20 0 EIADMP [NH3+]C1(c2ccccc2)CC[NH+]([C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911154 1049185682 /nfs/dbraw/zinc/18/56/82/1049185682.db2.gz UDJHERJZCDKWJE-SFHVURJKSA-N 2 1 340.898 4.147 20 0 EIADMP Oc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)CCC2 ZINC000812719602 1049548760 /nfs/dbraw/zinc/54/87/60/1049548760.db2.gz ZAQCTYWEXTUBMZ-JOCHJYFZSA-N 2 1 342.527 4.404 20 0 EIADMP Clc1ccccc1C[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccoc1 ZINC000820807865 1049553381 /nfs/dbraw/zinc/55/33/81/1049553381.db2.gz SLJHQHGLYBTXAI-MGPUTAFESA-N 2 1 344.886 4.291 20 0 EIADMP Clc1ccccc1C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccoc1 ZINC000820807865 1049553409 /nfs/dbraw/zinc/55/34/09/1049553409.db2.gz SLJHQHGLYBTXAI-MGPUTAFESA-N 2 1 344.886 4.291 20 0 EIADMP Clc1ccccc1C[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccoc1 ZINC000820807867 1049555591 /nfs/dbraw/zinc/55/55/91/1049555591.db2.gz SLJHQHGLYBTXAI-YWZLYKJASA-N 2 1 344.886 4.291 20 0 EIADMP Clc1ccccc1C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccoc1 ZINC000820807867 1049555626 /nfs/dbraw/zinc/55/56/26/1049555626.db2.gz SLJHQHGLYBTXAI-YWZLYKJASA-N 2 1 344.886 4.291 20 0 EIADMP Fc1cc(F)c2c(c1)C[C@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001171381933 1049576538 /nfs/dbraw/zinc/57/65/38/1049576538.db2.gz VZKRYRLXMKFBAI-RBUKOAKNSA-N 2 1 348.481 4.163 20 0 EIADMP Fc1cc(F)c2c(c1)C[C@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001171381933 1049576549 /nfs/dbraw/zinc/57/65/49/1049576549.db2.gz VZKRYRLXMKFBAI-RBUKOAKNSA-N 2 1 348.481 4.163 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cccc3[nH]ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000080338888 1049578943 /nfs/dbraw/zinc/57/89/43/1049578943.db2.gz XORJODDTUXQPOY-FXAWDEMLSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cccc3[nH]ccc32)CC[N@H+]1Cc1ccccc1 ZINC000080338888 1049578956 /nfs/dbraw/zinc/57/89/56/1049578956.db2.gz XORJODDTUXQPOY-FXAWDEMLSA-N 2 1 333.479 4.311 20 0 EIADMP FC1(F)CCC[C@H]1C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716704541 1049704370 /nfs/dbraw/zinc/70/43/70/1049704370.db2.gz GIHUGJXMZINIDQ-VJANTYMQSA-N 2 1 334.454 4.065 20 0 EIADMP Fc1cc2c(cc1F)C[C@@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001171486351 1049716312 /nfs/dbraw/zinc/71/63/12/1049716312.db2.gz BPLIABWPBCWRNO-OALUTQOASA-N 2 1 348.481 4.163 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH+]1CCC([N@@H+](C)Cc3ccccc3)CC1)C2 ZINC001171571133 1049758589 /nfs/dbraw/zinc/75/85/89/1049758589.db2.gz SFHWRLHZTUYAIL-QHCPKHFHSA-N 2 1 348.534 4.449 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCOc3ccc(Cl)cc32)CC1(C)C ZINC001171628718 1049762651 /nfs/dbraw/zinc/76/26/51/1049762651.db2.gz HSKOBSHUPPUXGL-INIZCTEOSA-N 2 1 336.907 4.405 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]C2CC[NH+](CC3CCCCC3)CC2)CC1(C)C ZINC001171626041 1049767747 /nfs/dbraw/zinc/76/77/47/1049767747.db2.gz TZSXCGPTUKOIOQ-UHFFFAOYSA-N 3 1 349.607 4.272 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@@H](CCO)c2cccc(Cl)c2)CC1(C)C ZINC001171623132 1049767867 /nfs/dbraw/zinc/76/78/67/1049767867.db2.gz LJEJHJZAHQKBLL-KRWDZBQOSA-N 2 1 338.923 4.005 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@@H](c2ccncc2Cl)C2CC2)CC1(C)C ZINC001171627160 1049769084 /nfs/dbraw/zinc/76/90/84/1049769084.db2.gz MREVEDSQUVGYIT-QGZVFWFLSA-N 2 1 335.923 4.427 20 0 EIADMP Cc1ccc(CC[C@H](C)N(c2cccc(C)[nH+]2)C2CC[NH2+]CC2)cc1 ZINC001171683090 1049776790 /nfs/dbraw/zinc/77/67/90/1049776790.db2.gz ZCZSFCYVJZRDQP-IBGZPJMESA-N 2 1 337.511 4.278 20 0 EIADMP Cc1ccc([C@]2(C)C[N@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)CCO2)cc1 ZINC001171639472 1049778435 /nfs/dbraw/zinc/77/84/35/1049778435.db2.gz LAGYASBLBOIDLC-QFIPXVFZSA-N 2 1 344.543 4.194 20 0 EIADMP Cc1ccc([C@]2(C)C[N@@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)CCO2)cc1 ZINC001171639472 1049778441 /nfs/dbraw/zinc/77/84/41/1049778441.db2.gz LAGYASBLBOIDLC-QFIPXVFZSA-N 2 1 344.543 4.194 20 0 EIADMP C[C@@H]([NH3+])Cc1cn([C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171733308 1049786796 /nfs/dbraw/zinc/78/67/96/1049786796.db2.gz QEARQCZLYKTWFO-OPYAIIAOSA-N 2 1 347.506 4.367 20 0 EIADMP C[C@H]1C[C@H](NC(=[NH2+])c2cccc3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC001171733925 1049798605 /nfs/dbraw/zinc/79/86/05/1049798605.db2.gz KEAHRFUYTXSYHN-PXNSSMCTSA-N 2 1 343.474 4.418 20 0 EIADMP C[C@H]1C[C@H](NC(=[NH2+])c2cccc3ccccc32)C[N@H+]1Cc1ccccc1 ZINC001171733925 1049798613 /nfs/dbraw/zinc/79/86/13/1049798613.db2.gz KEAHRFUYTXSYHN-PXNSSMCTSA-N 2 1 343.474 4.418 20 0 EIADMP C[C@H]([NH3+])c1cn([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171740732 1049801390 /nfs/dbraw/zinc/80/13/90/1049801390.db2.gz LEFBZQQWOYYPFO-ZIFCJYIRSA-N 2 1 333.479 4.497 20 0 EIADMP C[C@H]([NH3+])c1cn([C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171740725 1049801672 /nfs/dbraw/zinc/80/16/72/1049801672.db2.gz LEFBZQQWOYYPFO-AOIWGVFYSA-N 2 1 333.479 4.497 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+]([C@H]2Cc3cccc(F)c3C2)C2CCCCC2)CC1 ZINC001171786025 1049805011 /nfs/dbraw/zinc/80/50/11/1049805011.db2.gz WNEXOCXEPJGJGN-WDSOQIARSA-N 2 1 330.491 4.198 20 0 EIADMP Fc1cccc2c1C[C@@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001170997065 1049808205 /nfs/dbraw/zinc/80/82/05/1049808205.db2.gz QMHYUUJDASMPIQ-OALUTQOASA-N 2 1 330.491 4.023 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@H+](CC[NH3+])Cc1ccccc1 ZINC001171958057 1049822826 /nfs/dbraw/zinc/82/28/26/1049822826.db2.gz LSFUXBXZLYDUAS-OAHLLOKOSA-N 2 1 336.401 4.097 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+](CC[NH3+])Cc1ccccc1 ZINC001171958057 1049822827 /nfs/dbraw/zinc/82/28/27/1049822827.db2.gz LSFUXBXZLYDUAS-OAHLLOKOSA-N 2 1 336.401 4.097 20 0 EIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC001171961712 1049824334 /nfs/dbraw/zinc/82/43/34/1049824334.db2.gz BGGPRKUOGFDREG-DAYGRLMNSA-N 2 1 342.449 4.345 20 0 EIADMP C[C@@]1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCS1 ZINC000245686796 1049825530 /nfs/dbraw/zinc/82/55/30/1049825530.db2.gz JQRNVYDRXVKTCH-YRPNKDGESA-N 2 1 330.541 4.057 20 0 EIADMP CN1CCC([N@@H+](C2CCCC2)[C@H]2CCc3cccc(F)c3C2)CC1 ZINC001171010077 1049828717 /nfs/dbraw/zinc/82/87/17/1049828717.db2.gz KOKSVYVXQGWFKN-IBGZPJMESA-N 2 1 330.491 4.022 20 0 EIADMP CC[NH+]1CCC([N@H+](C)[C@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171973613 1049835774 /nfs/dbraw/zinc/83/57/74/1049835774.db2.gz LKACSWTUIXMCCV-CQSZACIVSA-N 2 1 328.422 4.053 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)[C@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171973613 1049835776 /nfs/dbraw/zinc/83/57/76/1049835776.db2.gz LKACSWTUIXMCCV-CQSZACIVSA-N 2 1 328.422 4.053 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2CCCc3cccnc32)CC[N@@H+]1Cc1ccccc1 ZINC001171973098 1049835847 /nfs/dbraw/zinc/83/58/47/1049835847.db2.gz VTUCVXONHGCQMR-RTWAWAEBSA-N 2 1 349.522 4.492 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2CCCc3cccnc32)CC[N@H+]1Cc1ccccc1 ZINC001171973098 1049835849 /nfs/dbraw/zinc/83/58/49/1049835849.db2.gz VTUCVXONHGCQMR-RTWAWAEBSA-N 2 1 349.522 4.492 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2ccc3ocnc3c2)CC[N@H+]1Cc1ccccc1 ZINC001171976890 1049837655 /nfs/dbraw/zinc/83/76/55/1049837655.db2.gz VBULHLRRURBDPW-IBGZPJMESA-N 2 1 349.478 4.361 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2CCCc3ncccc32)CC[N@H+]1Cc1ccccc1 ZINC001171982338 1049838346 /nfs/dbraw/zinc/83/83/46/1049838346.db2.gz HJOUFBCACLODOJ-UGKGYDQZSA-N 2 1 349.522 4.492 20 0 EIADMP CC1(C)C[C@H]([NH+]2CC[C@@]3(C2)CCCCO3)CC[N@H+]1Cc1ccccc1 ZINC001171981729 1049838528 /nfs/dbraw/zinc/83/85/28/1049838528.db2.gz NGCUDPYJFMHABE-IFMALSPDSA-N 2 1 342.527 4.075 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CC[C@@]3(C2)CCCCO3)CC[NH+]1Cc1ccccc1 ZINC001171981729 1049838530 /nfs/dbraw/zinc/83/85/30/1049838530.db2.gz NGCUDPYJFMHABE-IFMALSPDSA-N 2 1 342.527 4.075 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CC[C@@]3(C2)CCCCO3)CC[NH+]1Cc1ccccc1 ZINC001171981729 1049838532 /nfs/dbraw/zinc/83/85/32/1049838532.db2.gz NGCUDPYJFMHABE-IFMALSPDSA-N 2 1 342.527 4.075 20 0 EIADMP Fc1cccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000245724108 1049838561 /nfs/dbraw/zinc/83/85/61/1049838561.db2.gz PCXDOLCPOOGIHU-KOUNCHBCSA-N 2 1 338.470 4.153 20 0 EIADMP CCOC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980642 1049839324 /nfs/dbraw/zinc/83/93/24/1049839324.db2.gz SHXZTRVAZQKWKU-NYLDSWQDSA-N 2 1 344.543 4.367 20 0 EIADMP CC1(C)C[C@H]([NH+]2CC[C@H](c3cccnc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171985385 1049839911 /nfs/dbraw/zinc/83/99/11/1049839911.db2.gz WAWRLKIWNLBWIJ-FCHUYYIVSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CC[C@H](c3cccnc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171985385 1049839917 /nfs/dbraw/zinc/83/99/17/1049839917.db2.gz WAWRLKIWNLBWIJ-FCHUYYIVSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CC[C@H](c3cccnc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171985385 1049839918 /nfs/dbraw/zinc/83/99/18/1049839918.db2.gz WAWRLKIWNLBWIJ-FCHUYYIVSA-N 2 1 349.522 4.314 20 0 EIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cn1 ZINC001172061316 1049841963 /nfs/dbraw/zinc/84/19/63/1049841963.db2.gz GAZHKSJMZBEVGU-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cn1 ZINC001172061316 1049841964 /nfs/dbraw/zinc/84/19/64/1049841964.db2.gz GAZHKSJMZBEVGU-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP F[C@@H]1CCCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070337 1049842856 /nfs/dbraw/zinc/84/28/56/1049842856.db2.gz ZFSNHYUYEKLLCT-CGXNFDGLSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070337 1049842858 /nfs/dbraw/zinc/84/28/58/1049842858.db2.gz ZFSNHYUYEKLLCT-CGXNFDGLSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070337 1049842859 /nfs/dbraw/zinc/84/28/59/1049842859.db2.gz ZFSNHYUYEKLLCT-CGXNFDGLSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070337 1049842862 /nfs/dbraw/zinc/84/28/62/1049842862.db2.gz ZFSNHYUYEKLLCT-CGXNFDGLSA-N 2 1 330.491 4.396 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CCCc2ccccn2)C3)cc1 ZINC001172074494 1049843838 /nfs/dbraw/zinc/84/38/38/1049843838.db2.gz VZZQPWWXDFVICF-WBDAEOGXSA-N 2 1 349.522 4.190 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CC[C@H](OCc3ccccc3)CC1)C2 ZINC001172099621 1049849591 /nfs/dbraw/zinc/84/95/91/1049849591.db2.gz LRLYPNARXJVHFH-UZBCKPFNSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CC[C@H](OCc3ccccc3)CC1)C2 ZINC001172099621 1049849593 /nfs/dbraw/zinc/84/95/93/1049849593.db2.gz LRLYPNARXJVHFH-UZBCKPFNSA-N 2 1 342.527 4.119 20 0 EIADMP Cc1cncc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172064426 1049851206 /nfs/dbraw/zinc/85/12/06/1049851206.db2.gz FWAARLMTZRFKDY-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1cncc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172064426 1049851207 /nfs/dbraw/zinc/85/12/07/1049851207.db2.gz FWAARLMTZRFKDY-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP CCC1([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCOCC1 ZINC001172070112 1049852363 /nfs/dbraw/zinc/85/23/63/1049852363.db2.gz MJZVUIBHXBMKTO-MZADTFQBSA-N 2 1 342.527 4.121 20 0 EIADMP FC1(F)CC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172068236 1049852639 /nfs/dbraw/zinc/85/26/39/1049852639.db2.gz PSESVDKMJHPNCN-MKXGPGLRSA-N 2 1 334.454 4.350 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](CCCCCCO)Cc1ccccc1)C2 ZINC001172127465 1049852826 /nfs/dbraw/zinc/85/28/26/1049852826.db2.gz IYFQZENPRLZLPH-KOUNCHBCSA-N 2 1 344.543 4.057 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](CCCCCCO)Cc1ccccc1)C2 ZINC001172127465 1049852829 /nfs/dbraw/zinc/85/28/29/1049852829.db2.gz IYFQZENPRLZLPH-KOUNCHBCSA-N 2 1 344.543 4.057 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+](CCCCCCO)Cc1ccccc1)C2 ZINC001172127465 1049852833 /nfs/dbraw/zinc/85/28/33/1049852833.db2.gz IYFQZENPRLZLPH-KOUNCHBCSA-N 2 1 344.543 4.057 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+](CCCCCCO)Cc1ccccc1)C2 ZINC001172127465 1049852836 /nfs/dbraw/zinc/85/28/36/1049852836.db2.gz IYFQZENPRLZLPH-KOUNCHBCSA-N 2 1 344.543 4.057 20 0 EIADMP C[N@H+](CCc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131987 1049854894 /nfs/dbraw/zinc/85/48/94/1049854894.db2.gz IPYMCVXGYKWBCM-PIIMJCKOSA-N 2 1 340.433 4.195 20 0 EIADMP C[N@@H+](CCc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131987 1049854899 /nfs/dbraw/zinc/85/48/99/1049854899.db2.gz IPYMCVXGYKWBCM-PIIMJCKOSA-N 2 1 340.433 4.195 20 0 EIADMP C[NH+](CCc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172131987 1049854902 /nfs/dbraw/zinc/85/49/02/1049854902.db2.gz IPYMCVXGYKWBCM-PIIMJCKOSA-N 2 1 340.433 4.195 20 0 EIADMP C[NH+](CCc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172131987 1049854904 /nfs/dbraw/zinc/85/49/04/1049854904.db2.gz IPYMCVXGYKWBCM-PIIMJCKOSA-N 2 1 340.433 4.195 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(-c3cccc(Cl)c3)no1)C2 ZINC001172117840 1049858494 /nfs/dbraw/zinc/85/84/94/1049858494.db2.gz NMVKADBDTJMGJC-OSYLJGHBSA-N 2 1 345.874 4.100 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(-c3cccc(Cl)c3)no1)C2 ZINC001172117840 1049858499 /nfs/dbraw/zinc/85/84/99/1049858499.db2.gz NMVKADBDTJMGJC-OSYLJGHBSA-N 2 1 345.874 4.100 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(Cc3ccc(F)cc3)CCC1)C2 ZINC001172111981 1049858599 /nfs/dbraw/zinc/85/85/99/1049858599.db2.gz YMQFVLLVWLSGFJ-ACDBMABISA-N 2 1 330.491 4.143 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@H]3CCC[N@@H+](C(C)C)C3)oc21 ZINC000245918205 1049875150 /nfs/dbraw/zinc/87/51/50/1049875150.db2.gz QJNCDQYCENMTDK-HZPDHXFCSA-N 2 1 330.472 4.212 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@H]3CCC[N@H+](C(C)C)C3)oc21 ZINC000245918205 1049875153 /nfs/dbraw/zinc/87/51/53/1049875153.db2.gz QJNCDQYCENMTDK-HZPDHXFCSA-N 2 1 330.472 4.212 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172320721 1049877498 /nfs/dbraw/zinc/87/74/98/1049877498.db2.gz ZXJMHTGTDVCUPE-JTJHWIPRSA-N 2 1 332.532 4.223 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172320721 1049877501 /nfs/dbraw/zinc/87/75/01/1049877501.db2.gz ZXJMHTGTDVCUPE-JTJHWIPRSA-N 2 1 332.532 4.223 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172326880 1049879641 /nfs/dbraw/zinc/87/96/41/1049879641.db2.gz BSOGAMSJXQTCEL-SVFBPWRDSA-N 2 1 346.559 4.470 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172326880 1049879644 /nfs/dbraw/zinc/87/96/44/1049879644.db2.gz BSOGAMSJXQTCEL-SVFBPWRDSA-N 2 1 346.559 4.470 20 0 EIADMP COc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)cc1 ZINC001172367734 1049897302 /nfs/dbraw/zinc/89/73/02/1049897302.db2.gz MVUZJYWYJNDXKQ-BBTUJRGHSA-N 2 1 344.543 4.116 20 0 EIADMP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC001172575653 1049941797 /nfs/dbraw/zinc/94/17/97/1049941797.db2.gz JOBGNSNWNYYBAT-ZIAGYGMSSA-N 2 1 344.877 4.261 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccccc2OC(F)F)C1 ZINC000246979094 1050008575 /nfs/dbraw/zinc/00/85/75/1050008575.db2.gz JYFCWYIYDOYHQT-CABCVRRESA-N 2 1 326.431 4.059 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccccc2OC(F)F)C1 ZINC000246979094 1050008580 /nfs/dbraw/zinc/00/85/80/1050008580.db2.gz JYFCWYIYDOYHQT-CABCVRRESA-N 2 1 326.431 4.059 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000247060793 1050011849 /nfs/dbraw/zinc/01/18/49/1050011849.db2.gz NUFZEZZDBLTINP-WBVHZDCISA-N 2 1 341.524 4.119 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1)c1cccs1 ZINC000247198782 1050015703 /nfs/dbraw/zinc/01/57/03/1050015703.db2.gz WCXUCJDFWSVSNH-QFBILLFUSA-N 2 1 344.524 4.210 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1)c1cccs1 ZINC000247198782 1050015707 /nfs/dbraw/zinc/01/57/07/1050015707.db2.gz WCXUCJDFWSVSNH-QFBILLFUSA-N 2 1 344.524 4.210 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccccc2OC(F)F)C1 ZINC000247239818 1050018006 /nfs/dbraw/zinc/01/80/06/1050018006.db2.gz YVJHJHZGSCRUKS-GDBMZVCRSA-N 2 1 326.431 4.061 20 0 EIADMP CCOc1ccc([C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)C(C)C)cc1OCC ZINC000247893122 1050036033 /nfs/dbraw/zinc/03/60/33/1050036033.db2.gz FZIGHMXKQSJQIS-YRISNDGFSA-N 2 1 348.531 4.253 20 0 EIADMP CCOc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)C(C)C)cc1OCC ZINC000247893122 1050036039 /nfs/dbraw/zinc/03/60/39/1050036039.db2.gz FZIGHMXKQSJQIS-YRISNDGFSA-N 2 1 348.531 4.253 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(OC)c1 ZINC000248407652 1050054994 /nfs/dbraw/zinc/05/49/94/1050054994.db2.gz UPVBOQBIQYFPDS-IKGGRYGDSA-N 2 1 346.515 4.007 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(OC)c1 ZINC000248407652 1050054998 /nfs/dbraw/zinc/05/49/98/1050054998.db2.gz UPVBOQBIQYFPDS-IKGGRYGDSA-N 2 1 346.515 4.007 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1F ZINC000248410783 1050055040 /nfs/dbraw/zinc/05/50/40/1050055040.db2.gz YGYSTDJZWHMUBS-ZOBUZTSGSA-N 2 1 334.479 4.138 20 0 EIADMP C[C@@H](N[C@@H](C)c1nc2ccccc2o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248545342 1050063933 /nfs/dbraw/zinc/06/39/33/1050063933.db2.gz DHQXAHPTZDNPBA-PMPSAXMXSA-N 2 1 327.472 4.131 20 0 EIADMP Fc1cc(F)cc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000248878546 1050081638 /nfs/dbraw/zinc/08/16/38/1050081638.db2.gz KCTPEMPFXWIGPZ-WKCHPHFGSA-N 2 1 342.433 4.250 20 0 EIADMP Fc1cc(F)cc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000248878546 1050081645 /nfs/dbraw/zinc/08/16/45/1050081645.db2.gz KCTPEMPFXWIGPZ-WKCHPHFGSA-N 2 1 342.433 4.250 20 0 EIADMP Cc1nccnc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000249173666 1050093228 /nfs/dbraw/zinc/09/32/28/1050093228.db2.gz CZGKPYKMOKCVAN-AEFFLSMTSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1nccnc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000249173666 1050093233 /nfs/dbraw/zinc/09/32/33/1050093233.db2.gz CZGKPYKMOKCVAN-AEFFLSMTSA-N 2 1 338.499 4.010 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000090046552 1050151971 /nfs/dbraw/zinc/15/19/71/1050151971.db2.gz MALQIVZUPVOWJJ-VYDXJSESSA-N 2 1 335.561 4.052 20 0 EIADMP C[C@]1(C[NH3+])CCC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC001206295267 1050160112 /nfs/dbraw/zinc/16/01/12/1050160112.db2.gz LURHAFVXERVNIE-KRWDZBQOSA-N 2 1 329.315 4.377 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828348 1050165960 /nfs/dbraw/zinc/16/59/60/1050165960.db2.gz LDVPTFAARPEPCI-DNVJHFABSA-N 2 1 349.522 4.019 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+]C1(C)CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001172839780 1050177433 /nfs/dbraw/zinc/17/74/33/1050177433.db2.gz XBEPDGKTHFQTDK-HSZRJFAPSA-N 2 1 348.534 4.497 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cncc3ccccc32)C1 ZINC001177289661 1050177768 /nfs/dbraw/zinc/17/77/68/1050177768.db2.gz HLYQWRQWYHWYCN-HDICACEKSA-N 2 1 325.500 4.083 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2c(Cl)cccc2N(C)C)C1 ZINC001177299709 1050179504 /nfs/dbraw/zinc/17/95/04/1050179504.db2.gz ZTVCSEKEBQDAAK-MRXNPFEDSA-N 2 1 337.939 4.008 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cccc(F)c1OC(F)F ZINC001177299555 1050180380 /nfs/dbraw/zinc/18/03/80/1050180380.db2.gz VJZFILAIVUSLGC-CQSZACIVSA-N 2 1 344.421 4.171 20 0 EIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H](C)Cc2c(F)cccc2Cl)[C@@H](C)C1 ZINC001172849530 1050188543 /nfs/dbraw/zinc/18/85/43/1050188543.db2.gz NPSIXVIBKSUVMT-IYOUNJFTSA-N 2 1 326.887 4.119 20 0 EIADMP C[C@H](C[NH2+]Cc1ccc(-c2ccc(Cl)cc2)o1)C[NH+]1CCCC1 ZINC001177328985 1050195039 /nfs/dbraw/zinc/19/50/39/1050195039.db2.gz YOAWJBAFXBYHRI-OAHLLOKOSA-N 2 1 332.875 4.422 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+]Cc3cccc4ccccc43)C2)cc1 ZINC001177668927 1050275028 /nfs/dbraw/zinc/27/50/28/1050275028.db2.gz KKSRWJJZCJEDFP-NRFANRHFSA-N 2 1 344.502 4.494 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(F)cc2F)[C@@H]1c1cccs1 ZINC001177920849 1050329148 /nfs/dbraw/zinc/32/91/48/1050329148.db2.gz XGGLHODVPQTFAY-RDTXWAMCSA-N 2 1 336.451 4.199 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(F)cc2F)[C@@H]1c1cccs1 ZINC001177920849 1050329154 /nfs/dbraw/zinc/32/91/54/1050329154.db2.gz XGGLHODVPQTFAY-RDTXWAMCSA-N 2 1 336.451 4.199 20 0 EIADMP [NH3+]CCC[C@H]1CCCC[N@H+](C2CCC(Oc3ccccc3)CC2)C1 ZINC001173201970 1050344151 /nfs/dbraw/zinc/34/41/51/1050344151.db2.gz KUVONQWGPBJSRA-LWEYNCJUSA-N 2 1 330.516 4.218 20 0 EIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001206311177 1050348248 /nfs/dbraw/zinc/34/82/48/1050348248.db2.gz KPQNBEJNQXKSGK-OAHLLOKOSA-N 2 1 334.813 4.310 20 0 EIADMP CCc1ccc(C[C@H](C)[NH+]2CCC3(CCn4c(C)c[nH+]c43)CC2)cc1 ZINC001173241194 1050396006 /nfs/dbraw/zinc/39/60/06/1050396006.db2.gz UHEDDJPIYJTKRN-KRWDZBQOSA-N 2 1 337.511 4.122 20 0 EIADMP CC(C)CSCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001178205141 1050404672 /nfs/dbraw/zinc/40/46/72/1050404672.db2.gz NZIRVVUYNYFZLY-UYAOXDASSA-N 2 1 334.573 4.408 20 0 EIADMP CC(C)CSCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001178205141 1050404685 /nfs/dbraw/zinc/40/46/85/1050404685.db2.gz NZIRVVUYNYFZLY-UYAOXDASSA-N 2 1 334.573 4.408 20 0 EIADMP CC[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CCC[C@@H](N(C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276629 1050405591 /nfs/dbraw/zinc/40/55/91/1050405591.db2.gz CLORNAMJBCZDRP-MMGCJVFTSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CCC[C@@H]([NH+](C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276629 1050405594 /nfs/dbraw/zinc/40/55/94/1050405594.db2.gz CLORNAMJBCZDRP-MMGCJVFTSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CCC[C@@H]([NH+](C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276629 1050405601 /nfs/dbraw/zinc/40/56/01/1050405601.db2.gz CLORNAMJBCZDRP-MMGCJVFTSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([NH+]2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276629 1050405604 /nfs/dbraw/zinc/40/56/04/1050405604.db2.gz CLORNAMJBCZDRP-MMGCJVFTSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([NH+]2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276629 1050405609 /nfs/dbraw/zinc/40/56/09/1050405609.db2.gz CLORNAMJBCZDRP-MMGCJVFTSA-N 2 1 341.543 4.193 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2c1CCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001178331332 1050436424 /nfs/dbraw/zinc/43/64/24/1050436424.db2.gz QCNMOXNMEMRELY-AVRDEDQJSA-N 2 1 334.507 4.176 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3nc(Cl)ccc3s2)C[C@@H]1C ZINC001204236532 1050615266 /nfs/dbraw/zinc/61/52/66/1050615266.db2.gz HVJZJFPMJRXJAF-STQMWFEESA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc3nc(Cl)ccc3s2)C[C@@H]1C ZINC001204236532 1050615275 /nfs/dbraw/zinc/61/52/75/1050615275.db2.gz HVJZJFPMJRXJAF-STQMWFEESA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc3nc(Cl)ccc3s2)C[C@@H]1C ZINC001204236532 1050615286 /nfs/dbraw/zinc/61/52/86/1050615286.db2.gz HVJZJFPMJRXJAF-STQMWFEESA-N 2 1 337.920 4.254 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CC(Nc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001179520732 1050707295 /nfs/dbraw/zinc/70/72/95/1050707295.db2.gz OAKQQOFHDWXYSM-BVRQVQABSA-N 2 1 349.522 4.272 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CC(Nc3ccccc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001179520732 1050707301 /nfs/dbraw/zinc/70/73/01/1050707301.db2.gz OAKQQOFHDWXYSM-BVRQVQABSA-N 2 1 349.522 4.272 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030501 1050860262 /nfs/dbraw/zinc/86/02/62/1050860262.db2.gz NRDOSSHPRXNNBK-QUCCMNQESA-N 2 1 342.527 4.098 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030501 1050860271 /nfs/dbraw/zinc/86/02/71/1050860271.db2.gz NRDOSSHPRXNNBK-QUCCMNQESA-N 2 1 342.527 4.098 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030501 1050860275 /nfs/dbraw/zinc/86/02/75/1050860275.db2.gz NRDOSSHPRXNNBK-QUCCMNQESA-N 2 1 342.527 4.098 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030501 1050860278 /nfs/dbraw/zinc/86/02/78/1050860278.db2.gz NRDOSSHPRXNNBK-QUCCMNQESA-N 2 1 342.527 4.098 20 0 EIADMP Cc1cscc1C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716629531 1051100169 /nfs/dbraw/zinc/10/01/69/1051100169.db2.gz ZQGXIMUYBOPXAN-IHPCNDPISA-N 2 1 326.509 4.199 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(OC)c(Cl)c2)CC1 ZINC001190408448 1051176851 /nfs/dbraw/zinc/17/68/51/1051176851.db2.gz YZLCPEAHODHDTK-UHFFFAOYSA-N 2 1 338.923 4.293 20 0 EIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1)c1cc(F)cc(F)c1 ZINC001181276060 1051195996 /nfs/dbraw/zinc/19/59/96/1051195996.db2.gz IKTYXRWDARYOQY-MGPUTAFESA-N 2 1 336.470 4.455 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000620754058 1051273371 /nfs/dbraw/zinc/27/33/71/1051273371.db2.gz SOFXTINHXNEHQK-INIZCTEOSA-N 2 1 346.421 4.189 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)C1 ZINC000620762237 1051284755 /nfs/dbraw/zinc/28/47/55/1051284755.db2.gz WAZYHKJJEHUQPP-HXUWFJFHSA-N 2 1 337.511 4.274 20 0 EIADMP C[C@@]1(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)CC1(Cl)Cl ZINC001190825829 1051285168 /nfs/dbraw/zinc/28/51/68/1051285168.db2.gz CXYYDJWWJLCWBG-HOTGVXAUSA-N 2 1 333.347 4.158 20 0 EIADMP C[C@@]1(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)CC1(Cl)Cl ZINC001190825829 1051285179 /nfs/dbraw/zinc/28/51/79/1051285179.db2.gz CXYYDJWWJLCWBG-HOTGVXAUSA-N 2 1 333.347 4.158 20 0 EIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C1CC(Sc2ccccc2)C1 ZINC001181935545 1051357279 /nfs/dbraw/zinc/35/72/79/1051357279.db2.gz ZLNYOQKFJFDPDA-FDYSRKEFSA-N 2 1 332.557 4.410 20 0 EIADMP CC(C)(C)c1cccc(OCCC[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1 ZINC001191122417 1051358049 /nfs/dbraw/zinc/35/80/49/1051358049.db2.gz QMHJYWSMSPJNQC-IBGZPJMESA-N 2 1 344.543 4.171 20 0 EIADMP C/C=C/COc1ccc(CC[C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC001182248545 1051440448 /nfs/dbraw/zinc/44/04/48/1051440448.db2.gz ACTTZACVUAOEKS-CFQKCQFKSA-N 2 1 344.543 4.284 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCc2c(Cl)cccc2Cl)C[C@@H]1C ZINC001191417634 1051453559 /nfs/dbraw/zinc/45/35/59/1051453559.db2.gz PZSKEHNRLJOPMB-KBPBESRZSA-N 2 1 329.315 4.341 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCc2c(Cl)cccc2Cl)C[C@@H]1C ZINC001191417634 1051453567 /nfs/dbraw/zinc/45/35/67/1051453567.db2.gz PZSKEHNRLJOPMB-KBPBESRZSA-N 2 1 329.315 4.341 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCc2c(Cl)cccc2Cl)C[C@@H]1C ZINC001191417634 1051453574 /nfs/dbraw/zinc/45/35/74/1051453574.db2.gz PZSKEHNRLJOPMB-KBPBESRZSA-N 2 1 329.315 4.341 20 0 EIADMP C/C=C/COc1ccc(CC[C@@H](C)[NH2+]CC[N@@H+]2CCCC2(C)C)cc1 ZINC001182307448 1051486291 /nfs/dbraw/zinc/48/62/91/1051486291.db2.gz BAEAYVBGZQOTND-ZMBJWTFHSA-N 2 1 344.543 4.427 20 0 EIADMP C/C=C/COc1ccc(CC[C@@H](C)[NH2+]CC[N@H+]2CCCC2(C)C)cc1 ZINC001182307448 1051486297 /nfs/dbraw/zinc/48/62/97/1051486297.db2.gz BAEAYVBGZQOTND-ZMBJWTFHSA-N 2 1 344.543 4.427 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCOC3(CCCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000271503940 1051543254 /nfs/dbraw/zinc/54/32/54/1051543254.db2.gz MJUSKISVOGQVPT-NRSPTQNISA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCOC3(CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000271503940 1051543266 /nfs/dbraw/zinc/54/32/66/1051543266.db2.gz MJUSKISVOGQVPT-NRSPTQNISA-N 2 1 342.527 4.121 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc2c(c1)OCCCO2 ZINC000157896617 1051682242 /nfs/dbraw/zinc/68/22/42/1051682242.db2.gz LBPMRJVUTZSQRU-ROUUACIJSA-N 2 1 346.515 4.153 20 0 EIADMP COc1ccccc1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000158142361 1051719121 /nfs/dbraw/zinc/71/91/21/1051719121.db2.gz BJFQOAQJUJBIEY-MSOLQXFVSA-N 2 1 338.495 4.355 20 0 EIADMP CC(C)O[C@@H](C[N@@H+](C)CCCC[NH+]1CCCCC1)c1ccccc1 ZINC001175687638 1051730546 /nfs/dbraw/zinc/73/05/46/1051730546.db2.gz JSAARRBQGUWRLW-NRFANRHFSA-N 2 1 332.532 4.351 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cncc(Cl)c2)CC1)CC1CC1 ZINC000621272368 1051815366 /nfs/dbraw/zinc/81/53/66/1051815366.db2.gz OJAPMDWKVSBRRL-UHFFFAOYSA-N 2 1 335.923 4.069 20 0 EIADMP Cc1cc(C)cc(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)c1 ZINC000716715829 1051832288 /nfs/dbraw/zinc/83/22/88/1051832288.db2.gz YCFMFOGATKESSX-VABKMULXSA-N 2 1 334.507 4.446 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1)[C@H]1COc2ccccc2C1 ZINC001183379235 1051839473 /nfs/dbraw/zinc/83/94/73/1051839473.db2.gz KTEVZNQFSDNHGY-FBBABVLZSA-N 2 1 342.527 4.013 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1)[C@H]1COc2ccccc2C1 ZINC001183379235 1051839476 /nfs/dbraw/zinc/83/94/76/1051839476.db2.gz KTEVZNQFSDNHGY-FBBABVLZSA-N 2 1 342.527 4.013 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1)[C@@H]1COc2ccccc2C1 ZINC001183379236 1051839730 /nfs/dbraw/zinc/83/97/30/1051839730.db2.gz KTEVZNQFSDNHGY-HFSMHLIXSA-N 2 1 342.527 4.013 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1)[C@@H]1COc2ccccc2C1 ZINC001183379236 1051839734 /nfs/dbraw/zinc/83/97/34/1051839734.db2.gz KTEVZNQFSDNHGY-HFSMHLIXSA-N 2 1 342.527 4.013 20 0 EIADMP CC(C)C[N@@H+](C/C=C/c1ccc(F)c(F)c1)CC1CC[NH+](C)CC1 ZINC001183463220 1051846202 /nfs/dbraw/zinc/84/62/02/1051846202.db2.gz CKQLGNKNVBCZRV-SNAWJCMRSA-N 2 1 336.470 4.278 20 0 EIADMP Cc1cc(C[NH+]2CCC(C)([NH+]3CCCCC3)CC2)cc2cccnc12 ZINC001183683366 1051883732 /nfs/dbraw/zinc/88/37/32/1051883732.db2.gz CKAABGVEGHFIIH-UHFFFAOYSA-N 2 1 337.511 4.384 20 0 EIADMP C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC[C@@H]1C[NH3+] ZINC001205638871 1051968238 /nfs/dbraw/zinc/96/82/38/1051968238.db2.gz SRRAVQMSWDBTCG-ZYHUDNBSSA-N 2 1 335.706 4.454 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1cc(F)ccc1F ZINC000163474589 1051991829 /nfs/dbraw/zinc/99/18/29/1051991829.db2.gz HXVDSJJVLOBYGD-LJQANCHMSA-N 2 1 345.437 4.378 20 0 EIADMP CC(C)c1cc(Br)cc(C[N@@H+]2CCC[C@](C)([NH3+])CC2)c1 ZINC001205296539 1052007089 /nfs/dbraw/zinc/00/70/89/1052007089.db2.gz QXSFYKYXPOBXCE-KRWDZBQOSA-N 2 1 339.321 4.276 20 0 EIADMP CC(C)c1cc(Br)cc(C[N@H+]2CCC[C@](C)([NH3+])CC2)c1 ZINC001205296539 1052007100 /nfs/dbraw/zinc/00/71/00/1052007100.db2.gz QXSFYKYXPOBXCE-KRWDZBQOSA-N 2 1 339.321 4.276 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]CCCCn3cc[nH+]c3C)c(C)c2c1 ZINC000164658278 1052034933 /nfs/dbraw/zinc/03/49/33/1052034933.db2.gz AXTOSFILVBRMQE-HNNXBMFYSA-N 2 1 341.455 4.386 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000164696986 1052037871 /nfs/dbraw/zinc/03/78/71/1052037871.db2.gz GANOEQXCNQOOJL-OAHLLOKOSA-N 2 1 340.496 4.446 20 0 EIADMP CC(C)Cc1ccc(C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC001193991508 1052054344 /nfs/dbraw/zinc/05/43/44/1052054344.db2.gz VSLMXGKPNKDCHG-PSWAGMNNSA-N 2 1 348.534 4.449 20 0 EIADMP CC(C)Cc1ccc(C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC001193991508 1052054352 /nfs/dbraw/zinc/05/43/52/1052054352.db2.gz VSLMXGKPNKDCHG-PSWAGMNNSA-N 2 1 348.534 4.449 20 0 EIADMP CC(C)Cc1ccc(C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC001193991508 1052054366 /nfs/dbraw/zinc/05/43/66/1052054366.db2.gz VSLMXGKPNKDCHG-PSWAGMNNSA-N 2 1 348.534 4.449 20 0 EIADMP CCCC[C@H](CC)C[N@@H+]1CCC[NH+](Cc2ccccc2)CCOCC1 ZINC001176496338 1052085133 /nfs/dbraw/zinc/08/51/33/1052085133.db2.gz QEBMJTXHZFXBPB-NRFANRHFSA-N 2 1 346.559 4.427 20 0 EIADMP CCCC[C@H](CC)C[N@H+]1CCC[NH+](Cc2ccccc2)CCOCC1 ZINC001176496338 1052085144 /nfs/dbraw/zinc/08/51/44/1052085144.db2.gz QEBMJTXHZFXBPB-NRFANRHFSA-N 2 1 346.559 4.427 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCC[N@H+](Cc2ccccc2)CCOCC1 ZINC001176496338 1052085158 /nfs/dbraw/zinc/08/51/58/1052085158.db2.gz QEBMJTXHZFXBPB-NRFANRHFSA-N 2 1 346.559 4.427 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCC[N@@H+](Cc2ccccc2)CCOCC1 ZINC001176496338 1052085167 /nfs/dbraw/zinc/08/51/67/1052085167.db2.gz QEBMJTXHZFXBPB-NRFANRHFSA-N 2 1 346.559 4.427 20 0 EIADMP COc1cccc(C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)c2ccccc2)c1 ZINC000166339925 1052092448 /nfs/dbraw/zinc/09/24/48/1052092448.db2.gz RDWWKJWOKFOJKX-AGHHOFFYSA-N 2 1 338.495 4.051 20 0 EIADMP COc1cccc(C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)c2ccccc2)c1 ZINC000166339925 1052092457 /nfs/dbraw/zinc/09/24/57/1052092457.db2.gz RDWWKJWOKFOJKX-AGHHOFFYSA-N 2 1 338.495 4.051 20 0 EIADMP CC[C@@H](c1ccccc1)[NH+]1CCN(c2cc[nH+]cc2C(F)(F)F)CC1 ZINC001185526369 1052255236 /nfs/dbraw/zinc/25/52/36/1052255236.db2.gz AEFZNJHFCJNLNV-KRWDZBQOSA-N 2 1 349.400 4.374 20 0 EIADMP Cc1cccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)c1C ZINC000622603360 1052343859 /nfs/dbraw/zinc/34/38/59/1052343859.db2.gz WBRRYVDHSAVLMJ-GOSISDBHSA-N 2 1 328.525 4.367 20 0 EIADMP Cc1cccc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1C ZINC000622603360 1052343865 /nfs/dbraw/zinc/34/38/65/1052343865.db2.gz WBRRYVDHSAVLMJ-GOSISDBHSA-N 2 1 328.525 4.367 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000671298594 1052590597 /nfs/dbraw/zinc/59/05/97/1052590597.db2.gz RNQHKZKSIOUJQD-ZWKOTPCHSA-N 2 1 338.417 4.193 20 0 EIADMP COc1cc([C@@H](C)[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349597 1052629953 /nfs/dbraw/zinc/62/99/53/1052629953.db2.gz GFVBJKDFFPRKOM-NVXWUHKLSA-N 2 1 334.504 4.006 20 0 EIADMP COc1cc([C@@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349597 1052629956 /nfs/dbraw/zinc/62/99/56/1052629956.db2.gz GFVBJKDFFPRKOM-NVXWUHKLSA-N 2 1 334.504 4.006 20 0 EIADMP CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623363357 1052635173 /nfs/dbraw/zinc/63/51/73/1052635173.db2.gz PTOYWPKJNXCLKN-MJGOQNOKSA-N 2 1 332.532 4.257 20 0 EIADMP Cc1ccc(C[C@@H](N[C@H]2CC[N@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420810 1052652135 /nfs/dbraw/zinc/65/21/35/1052652135.db2.gz PDUDXHPIRNJCFA-PZJWPPBQSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@@H]([NH2+][C@H]2CCN(C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420810 1052652139 /nfs/dbraw/zinc/65/21/39/1052652139.db2.gz PDUDXHPIRNJCFA-PZJWPPBQSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@@H]([NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420810 1052652143 /nfs/dbraw/zinc/65/21/43/1052652143.db2.gz PDUDXHPIRNJCFA-PZJWPPBQSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420810 1052652145 /nfs/dbraw/zinc/65/21/45/1052652145.db2.gz PDUDXHPIRNJCFA-PZJWPPBQSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000178707818 1052711553 /nfs/dbraw/zinc/71/15/53/1052711553.db2.gz AIQQUUNKCQLZGG-OLZOCXBDSA-N 2 1 341.377 4.077 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC[N@@H+]1C ZINC000179598258 1052743507 /nfs/dbraw/zinc/74/35/07/1052743507.db2.gz QWFCCIPQIIGIAQ-CSMYWGQOSA-N 2 1 326.406 4.229 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC[N@H+]1C ZINC000179598258 1052743510 /nfs/dbraw/zinc/74/35/10/1052743510.db2.gz QWFCCIPQIIGIAQ-CSMYWGQOSA-N 2 1 326.406 4.229 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]C1(c2ccc(Br)cc2)CC1 ZINC000180519969 1052806863 /nfs/dbraw/zinc/80/68/63/1052806863.db2.gz KWIQRPDCXXNJRF-UHFFFAOYSA-N 2 1 348.288 4.013 20 0 EIADMP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000623861236 1052824586 /nfs/dbraw/zinc/82/45/86/1052824586.db2.gz SJGQZRZFOOYSFG-YJYMSZOUSA-N 2 1 343.902 4.273 20 0 EIADMP Fc1ccc(S[C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000623866513 1052825210 /nfs/dbraw/zinc/82/52/10/1052825210.db2.gz YQOTVWTZTDGIBY-IZBJGVDFSA-N 2 1 348.531 4.445 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCCc3scnc32)cc1 ZINC000623853707 1052826546 /nfs/dbraw/zinc/82/65/46/1052826546.db2.gz FEQZYTGDIIZPOB-KRWDZBQOSA-N 2 1 329.513 4.152 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1C(F)(F)F ZINC000623886646 1052833697 /nfs/dbraw/zinc/83/36/97/1052833697.db2.gz HRWBXPJOKJCLBM-RYUDHWBXSA-N 2 1 343.368 4.336 20 0 EIADMP Cc1csc([C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)n1 ZINC000623924195 1052838973 /nfs/dbraw/zinc/83/89/73/1052838973.db2.gz VLRCZIRXESRYOW-AOIWGVFYSA-N 2 1 343.540 4.403 20 0 EIADMP C[C@H]([NH2+]Cc1sccc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381895139 1053108432 /nfs/dbraw/zinc/10/84/32/1053108432.db2.gz UEJAWGRKOWHVIO-GOEBONIOSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@H]([NH2+]Cc1sccc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381895139 1053108455 /nfs/dbraw/zinc/10/84/55/1053108455.db2.gz UEJAWGRKOWHVIO-GOEBONIOSA-N 2 1 334.916 4.402 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@@H]3CCCC34CC4)cc2)CC1 ZINC000850456715 1053235036 /nfs/dbraw/zinc/23/50/36/1053235036.db2.gz HBVFDEPZLGRXMJ-HXUWFJFHSA-N 2 1 327.516 4.209 20 0 EIADMP CC(C)c1cccc2c1OCC[C@H]2[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000339068367 1053260750 /nfs/dbraw/zinc/26/07/50/1053260750.db2.gz GCIBLGXUAGRSOU-KVMCETHSSA-N 2 1 328.500 4.239 20 0 EIADMP CC(C)c1cccc2c1OCC[C@H]2[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000339068367 1053260766 /nfs/dbraw/zinc/26/07/66/1053260766.db2.gz GCIBLGXUAGRSOU-KVMCETHSSA-N 2 1 328.500 4.239 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000383360173 1053328627 /nfs/dbraw/zinc/32/86/27/1053328627.db2.gz SHQAORAQKSFPSW-WBVHZDCISA-N 2 1 330.422 4.138 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)o1 ZINC000383543026 1053353412 /nfs/dbraw/zinc/35/34/12/1053353412.db2.gz UXPFVLFNVNGUBZ-FUHIMQAGSA-N 2 1 326.484 4.458 20 0 EIADMP CCOc1cccc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000385805309 1053549604 /nfs/dbraw/zinc/54/96/04/1053549604.db2.gz NHLNJVUOKPDENL-WIYYLYMNSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866239245 1053661361 /nfs/dbraw/zinc/66/13/61/1053661361.db2.gz RYYFKZPLNXNRRL-LBPRGKRZSA-N 2 1 333.863 4.006 20 0 EIADMP CC(C)[C@H]([NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1)c1ccccn1 ZINC000866247031 1053662566 /nfs/dbraw/zinc/66/25/66/1053662566.db2.gz QHTYVMMTLAXZDL-NRFANRHFSA-N 2 1 325.500 4.409 20 0 EIADMP C[C@H]([NH2+]Cc1cc(F)c(F)c(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386394584 1053705239 /nfs/dbraw/zinc/70/52/39/1053705239.db2.gz VVTKSJJVECQCDM-YOEHRIQHSA-N 2 1 348.412 4.104 20 0 EIADMP C[C@H]([NH2+]Cc1cc(F)c(F)c(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386394584 1053705252 /nfs/dbraw/zinc/70/52/52/1053705252.db2.gz VVTKSJJVECQCDM-YOEHRIQHSA-N 2 1 348.412 4.104 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000386441166 1053728609 /nfs/dbraw/zinc/72/86/09/1053728609.db2.gz PULPQTXNCZANRX-SIKLNZKXSA-N 2 1 338.495 4.258 20 0 EIADMP CCC1([NH+]2CCCC2)CC[NH+](C[C@@H]2CC[C@H](c3ccccc3)O2)CC1 ZINC001196727897 1053732113 /nfs/dbraw/zinc/73/21/13/1053732113.db2.gz OBCNSIVWICNIAK-LEWJYISDSA-N 2 1 342.527 4.247 20 0 EIADMP C[C@]12C[NH+](CCC3CCCC3)C[C@]1(C)C[NH+](Cc1ccccc1)C2 ZINC001196960031 1053815001 /nfs/dbraw/zinc/81/50/01/1053815001.db2.gz CDHZKJYCQVOTLF-FGZHOGPDSA-N 2 1 326.528 4.411 20 0 EIADMP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2csc(-c3ccsc3)n2)C1 ZINC000866705603 1053818842 /nfs/dbraw/zinc/81/88/42/1053818842.db2.gz DMQWZMZPANOZPF-KRWDZBQOSA-N 2 1 335.542 4.069 20 0 EIADMP CC(C)(C)[C@]1(C[NH3+])CC[N@@H+](Cc2csc(-c3ccsc3)n2)C1 ZINC000866705603 1053818845 /nfs/dbraw/zinc/81/88/45/1053818845.db2.gz DMQWZMZPANOZPF-KRWDZBQOSA-N 2 1 335.542 4.069 20 0 EIADMP Cn1cncc1CCC[N@H+]1CC[C@H](c2ccccc2Cl)C1(C)C ZINC001197313425 1053872866 /nfs/dbraw/zinc/87/28/66/1053872866.db2.gz ACPDFIQARNUJBK-QGZVFWFLSA-N 2 1 331.891 4.274 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+]1CC[C@H](c2ccccc2Cl)C1(C)C ZINC001197313425 1053872872 /nfs/dbraw/zinc/87/28/72/1053872872.db2.gz ACPDFIQARNUJBK-QGZVFWFLSA-N 2 1 331.891 4.274 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+]1CC[C@H](c2ccccc2Cl)C1(C)C ZINC001197313425 1053872877 /nfs/dbraw/zinc/87/28/77/1053872877.db2.gz ACPDFIQARNUJBK-QGZVFWFLSA-N 2 1 331.891 4.274 20 0 EIADMP CCC[N@@H+](C[C@@H](OC)C1CCC1)C1CCN(Cc2ccccc2)CC1 ZINC001198641155 1054214543 /nfs/dbraw/zinc/21/45/43/1054214543.db2.gz NFVHSENJYDYGAV-JOCHJYFZSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCO1 ZINC001198799941 1054272931 /nfs/dbraw/zinc/27/29/31/1054272931.db2.gz GFCOXHSTTMXWMR-NRFANRHFSA-N 2 1 344.543 4.310 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)CC1 ZINC000872036621 1054354031 /nfs/dbraw/zinc/35/40/31/1054354031.db2.gz XRZVVOKYNUKNCY-UIFIKXQLSA-N 2 1 344.543 4.395 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+]Cc1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000857782713 1054360805 /nfs/dbraw/zinc/36/08/05/1054360805.db2.gz AQRJZAIUSWAVDI-UHFFFAOYSA-N 2 1 349.356 4.031 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccc2c(c1)CCO2 ZINC000123921772 1054361536 /nfs/dbraw/zinc/36/15/36/1054361536.db2.gz IZIISVGUCJNCKH-NRFANRHFSA-N 2 1 338.495 4.314 20 0 EIADMP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000872082695 1054382661 /nfs/dbraw/zinc/38/26/61/1054382661.db2.gz ZUBKGWYSNOZCGB-IKGGRYGDSA-N 2 1 328.422 4.043 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ncc(Cl)s2)CC1 ZINC000872111750 1054392257 /nfs/dbraw/zinc/39/22/57/1054392257.db2.gz DLFDQVVHOGRMCA-UHFFFAOYSA-N 2 1 349.931 4.329 20 0 EIADMP [NH3+][C@H](C[C@H]1CCC[N@@H+](Cc2csc(C3CC3)n2)C1)C1CCCC1 ZINC000872156698 1054412572 /nfs/dbraw/zinc/41/25/72/1054412572.db2.gz LFYVEBYXQZGNLJ-RDTXWAMCSA-N 2 1 333.545 4.140 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1cccc(OC(F)(F)F)c1 ZINC000858149782 1054425010 /nfs/dbraw/zinc/42/50/10/1054425010.db2.gz UVDUKTQWYMWGNL-OCCSQVGLSA-N 2 1 330.394 4.109 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1cccc(OC(F)(F)F)c1 ZINC000858149782 1054425011 /nfs/dbraw/zinc/42/50/11/1054425011.db2.gz UVDUKTQWYMWGNL-OCCSQVGLSA-N 2 1 330.394 4.109 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(Oc3cccnc3)c(C)c2)C1 ZINC001199842994 1054477141 /nfs/dbraw/zinc/47/71/41/1054477141.db2.gz LSKXXRUTHVZTEX-LJQANCHMSA-N 2 1 339.483 4.004 20 0 EIADMP C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001199963326 1054505456 /nfs/dbraw/zinc/50/54/56/1054505456.db2.gz WJORURSJCVQHEV-DOMZBBRYSA-N 2 1 329.315 4.387 20 0 EIADMP CC(C)(C)[C@]1(C[NH3+])CC[N@@H+](Cc2cnc(-c3cccs3)s2)C1 ZINC000873222895 1054510543 /nfs/dbraw/zinc/51/05/43/1054510543.db2.gz DLELFUQHTRMCGA-KRWDZBQOSA-N 2 1 335.542 4.069 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](C[C@@H]1CC=CCC1)CC2 ZINC001201408957 1054787976 /nfs/dbraw/zinc/78/79/76/1054787976.db2.gz MXIJBXUSFNRJPA-UYAOXDASSA-N 2 1 328.500 4.312 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2cccc(F)c2)C[N@H+]1Cc1ccccc1 ZINC001201492557 1054818797 /nfs/dbraw/zinc/81/87/97/1054818797.db2.gz RJRIQKQDHLBWOC-YLJYHZDGSA-N 2 1 326.459 4.216 20 0 EIADMP C[NH+](C)Cc1ccccc1NC1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001201478186 1054830770 /nfs/dbraw/zinc/83/07/70/1054830770.db2.gz ZZAOKHOLUQHQID-YADHBBJMSA-N 2 1 347.506 4.481 20 0 EIADMP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3nc(Cl)cs3)cc2)CC1 ZINC000876913014 1054981096 /nfs/dbraw/zinc/98/10/96/1054981096.db2.gz NHIIKAWPTGAPIU-UHFFFAOYSA-N 2 1 349.931 4.318 20 0 EIADMP CS[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000877070925 1055011228 /nfs/dbraw/zinc/01/12/28/1055011228.db2.gz YVAQTJYWMDZCNL-RAUXBKROSA-N 2 1 330.541 4.228 20 0 EIADMP CS[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000877070925 1055011244 /nfs/dbraw/zinc/01/12/44/1055011244.db2.gz YVAQTJYWMDZCNL-RAUXBKROSA-N 2 1 330.541 4.228 20 0 EIADMP Cc1c(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)ccnc1F ZINC000862271095 1055041967 /nfs/dbraw/zinc/04/19/67/1055041967.db2.gz CNONWMBYDVEIJU-INIZCTEOSA-N 2 1 341.474 4.051 20 0 EIADMP Clc1ccc([C@H](C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)OCC2CC2)cc1 ZINC000671764599 1055057703 /nfs/dbraw/zinc/05/77/03/1055057703.db2.gz GLEVDHRNUDVPAP-ZCNNSNEGSA-N 2 1 348.918 4.024 20 0 EIADMP Clc1ccc([C@H](C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)OCC2CC2)cc1 ZINC000671764598 1055058378 /nfs/dbraw/zinc/05/83/78/1055058378.db2.gz GLEVDHRNUDVPAP-UFYCRDLUSA-N 2 1 348.918 4.024 20 0 EIADMP C[C@@H](NCc1cc(C(F)(F)F)co1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000878411520 1055297447 /nfs/dbraw/zinc/29/74/47/1055297447.db2.gz LHUJNKKRVBAIKM-OLZOCXBDSA-N 2 1 330.394 4.041 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[C@H](c2ccccc2)O1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000878412323 1055301307 /nfs/dbraw/zinc/30/13/07/1055301307.db2.gz VTUBIBLKFRGRRY-XODARUQUSA-N 2 1 342.527 4.149 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1CC[C@H](c2ccccc2)O1 ZINC000878511832 1055327917 /nfs/dbraw/zinc/32/79/17/1055327917.db2.gz HHQDEDACAKLCPU-WOJBJXKFSA-N 2 1 341.499 4.078 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1CC[C@H](c2ccccc2)O1 ZINC000878511832 1055327940 /nfs/dbraw/zinc/32/79/40/1055327940.db2.gz HHQDEDACAKLCPU-WOJBJXKFSA-N 2 1 341.499 4.078 20 0 EIADMP C[C@@H](Cc1ccccn1)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000655833883 1055701031 /nfs/dbraw/zinc/70/10/31/1055701031.db2.gz HPYIVCXQYGLKPT-NLMOZGTASA-N 2 1 337.511 4.045 20 0 EIADMP C[NH+](C)CCC1CC[NH+](Cc2csc(C3CCCCC3)n2)CC1 ZINC000056522328 1055877585 /nfs/dbraw/zinc/87/75/85/1055877585.db2.gz PVVUFPNBIQPBAP-UHFFFAOYSA-N 2 1 335.561 4.355 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000354505727 1056521366 /nfs/dbraw/zinc/52/13/66/1056521366.db2.gz QPZQVKBPDZLCER-JEYLPNPQSA-N 2 1 331.426 4.319 20 0 EIADMP Clc1cccc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000062426710 1056724616 /nfs/dbraw/zinc/72/46/16/1056724616.db2.gz RLRGFYDHWPCJIU-LJQANCHMSA-N 2 1 328.887 4.342 20 0 EIADMP Brc1ccc(C2([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCC2)cc1 ZINC000180439604 1058612659 /nfs/dbraw/zinc/61/26/59/1058612659.db2.gz ZEUIZNQQZUQMGP-IAGOWNOFSA-N 2 1 349.316 4.045 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+]Cc3ccc4cnccc4c3)C2)cc1 ZINC000388244820 1060275700 /nfs/dbraw/zinc/27/57/00/1060275700.db2.gz FRQWUVJKBABADU-NRFANRHFSA-N 2 1 345.490 4.237 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)c1ccc(C(F)(F)F)cc1)C2 ZINC001169091874 1060647489 /nfs/dbraw/zinc/64/74/89/1060647489.db2.gz WPVKOLGDRFPIEQ-MUJYYYPQSA-N 2 1 326.406 4.155 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CCCc3c(Br)cccc31)C2 ZINC001169118262 1060647608 /nfs/dbraw/zinc/64/76/08/1060647608.db2.gz GEZJYGDACRZKHT-ZUMXRPEOSA-N 2 1 349.316 4.041 20 0 EIADMP CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]C1CC[NH+](CC)CC1 ZINC001169233077 1060705890 /nfs/dbraw/zinc/70/58/90/1060705890.db2.gz JNGXFUSFDWWMFU-HNNXBMFYSA-N 2 1 329.315 4.388 20 0 EIADMP CC[NH+]1CCC([N@@H+]2CCSC[C@H]2c2cccc3ccccc32)CC1 ZINC001169265438 1060712409 /nfs/dbraw/zinc/71/24/09/1060712409.db2.gz WXYVSDYYNHCIKG-NRFANRHFSA-N 2 1 340.536 4.414 20 0 EIADMP CC[NH+]1CCC([N@H+]2CCSC[C@H]2c2cccc3ccccc32)CC1 ZINC001169265438 1060712430 /nfs/dbraw/zinc/71/24/30/1060712430.db2.gz WXYVSDYYNHCIKG-NRFANRHFSA-N 2 1 340.536 4.414 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)CCC[C@@H]1C[NH3+] ZINC001206013209 1060863550 /nfs/dbraw/zinc/86/35/50/1060863550.db2.gz QIVIPSVBQFYZPO-GHMZBOCLSA-N 2 1 335.706 4.454 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c(C)o1 ZINC000767363243 1061212365 /nfs/dbraw/zinc/21/23/65/1061212365.db2.gz VQCVRTWUJONELZ-INIZCTEOSA-N 2 1 326.484 4.418 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Br)cc2)C1 ZINC000532214758 1032094695 /nfs/dbraw/zinc/09/46/95/1032094695.db2.gz LCFFWJGJKWZARJ-CABCVRRESA-N 2 1 339.321 4.220 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@H]3CCc4ccccc43)C2)c1 ZINC000532219515 1032100596 /nfs/dbraw/zinc/10/05/96/1032100596.db2.gz WYNUXRUDTBNCGV-UZLBHIALSA-N 2 1 326.509 4.237 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CCc4ccccc43)C2)c1 ZINC000532219515 1032100609 /nfs/dbraw/zinc/10/06/09/1032100609.db2.gz WYNUXRUDTBNCGV-UZLBHIALSA-N 2 1 326.509 4.237 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2cccc3cc[nH]c32)cc1F ZINC000237650760 1032233385 /nfs/dbraw/zinc/23/33/85/1032233385.db2.gz DKZRKMPYNUFHNZ-UHFFFAOYSA-N 2 1 334.398 4.091 20 0 EIADMP C[C@@H](NCc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)c1nccs1 ZINC000245545490 1032299332 /nfs/dbraw/zinc/29/93/32/1032299332.db2.gz VNILZIOYGUUXGV-IXDOHACOSA-N 2 1 343.540 4.472 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Sc3ccccc3)cc2)CC[N@H+]1C ZINC000532804324 1032323825 /nfs/dbraw/zinc/32/38/25/1032323825.db2.gz BEVNNXQPISFUKI-SJLPKXTDSA-N 2 1 326.509 4.410 20 0 EIADMP CCn1nc(C)c(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)c1C ZINC000648442911 1032381801 /nfs/dbraw/zinc/38/18/01/1032381801.db2.gz QIYKCNMKEVAQDI-UHFFFAOYSA-N 2 1 348.579 4.289 20 0 EIADMP c1cc(-c2nc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)cs2)cs1 ZINC000120626577 1032383511 /nfs/dbraw/zinc/38/35/11/1032383511.db2.gz CZPHGGWUUUKLCK-UHFFFAOYSA-N 2 1 347.553 4.179 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc3[nH]ccc32)[C@@H]1c1cccs1 ZINC000174459975 1032400202 /nfs/dbraw/zinc/40/02/02/1032400202.db2.gz MOKWSDFGHORVAP-OXQOHEQNSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cccc3[nH]ccc32)[C@@H]1c1cccs1 ZINC000174459975 1032400209 /nfs/dbraw/zinc/40/02/09/1032400209.db2.gz MOKWSDFGHORVAP-OXQOHEQNSA-N 2 1 339.508 4.402 20 0 EIADMP CC(C)Oc1ccc2[nH+]ccc(N3CCC(c4[nH]cc[nH+]4)CC3)c2c1 ZINC000450290002 1032403887 /nfs/dbraw/zinc/40/38/87/1032403887.db2.gz CMSNAWIORKFNCD-UHFFFAOYSA-N 2 1 336.439 4.129 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000178697999 1032544149 /nfs/dbraw/zinc/54/41/49/1032544149.db2.gz CHVVFXNGTQOMDL-QWRGUYRKSA-N 2 1 342.306 4.002 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1 ZINC000178703116 1032544475 /nfs/dbraw/zinc/54/44/75/1032544475.db2.gz CIWZXSMVMCLSCV-CHWSQXEVSA-N 2 1 325.378 4.197 20 0 EIADMP CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(OC(F)F)cc1 ZINC000178705697 1032544653 /nfs/dbraw/zinc/54/46/53/1032544653.db2.gz YLYBCDIAWBCDMB-DYVFJYSZSA-N 2 1 337.414 4.170 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)cc1 ZINC000347353631 1032549044 /nfs/dbraw/zinc/54/90/44/1032549044.db2.gz ZKHRTCHYNOIGPT-SCWSEQNSSA-N 2 1 341.499 4.425 20 0 EIADMP Cc1nccn1CCCC[N@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000179266914 1032556836 /nfs/dbraw/zinc/55/68/36/1032556836.db2.gz IAGFELJMGSGEEU-AWEZNQCLSA-N 2 1 328.485 4.274 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000179266914 1032556847 /nfs/dbraw/zinc/55/68/47/1032556847.db2.gz IAGFELJMGSGEEU-AWEZNQCLSA-N 2 1 328.485 4.274 20 0 EIADMP CCOCCC[N@H+]1CC[C@H](N[C@@H](CC)c2ccccc2F)[C@H](C)C1 ZINC000245987139 1032576291 /nfs/dbraw/zinc/57/62/91/1032576291.db2.gz QEVVFDUQGNZUND-UXPWSPDFSA-N 2 1 336.495 4.003 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](CC)c2ccccc2F)[C@H](C)C1 ZINC000245987139 1032576325 /nfs/dbraw/zinc/57/63/25/1032576325.db2.gz QEVVFDUQGNZUND-UXPWSPDFSA-N 2 1 336.495 4.003 20 0 EIADMP C[N@H+]1CC[C@@]2(CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000430148403 1018867842 /nfs/dbraw/zinc/86/78/42/1018867842.db2.gz RTZXWENHQVQJRB-GOSISDBHSA-N 2 1 341.326 4.344 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@H+](CCCCc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000430148403 1018867846 /nfs/dbraw/zinc/86/78/46/1018867846.db2.gz RTZXWENHQVQJRB-GOSISDBHSA-N 2 1 341.326 4.344 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@@H+](CCCCc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000430148403 1018867847 /nfs/dbraw/zinc/86/78/47/1018867847.db2.gz RTZXWENHQVQJRB-GOSISDBHSA-N 2 1 341.326 4.344 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCCO2 ZINC000643545989 1018897587 /nfs/dbraw/zinc/89/75/87/1018897587.db2.gz GTQXRXWZMPNLSA-RHSMWYFYSA-N 2 1 334.891 4.126 20 0 EIADMP CC[NH+](CC)CCC[NH+]1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000530463338 1019007529 /nfs/dbraw/zinc/00/75/29/1019007529.db2.gz NLEFXVUEZNDEED-UHFFFAOYSA-N 2 1 349.906 4.393 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000432788455 1032804780 /nfs/dbraw/zinc/80/47/80/1032804780.db2.gz LCDFVUCJKUSJIN-CQSZACIVSA-N 2 1 334.410 4.141 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000432788455 1032804782 /nfs/dbraw/zinc/80/47/82/1032804782.db2.gz LCDFVUCJKUSJIN-CQSZACIVSA-N 2 1 334.410 4.141 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274794984 1019569235 /nfs/dbraw/zinc/56/92/35/1019569235.db2.gz SSUVZQWOUATOLP-SOLBZPMBSA-N 2 1 343.902 4.296 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274794984 1019569249 /nfs/dbraw/zinc/56/92/49/1019569249.db2.gz SSUVZQWOUATOLP-SOLBZPMBSA-N 2 1 343.902 4.296 20 0 EIADMP CCc1nc([C@H](C)N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000274892559 1019840267 /nfs/dbraw/zinc/84/02/67/1019840267.db2.gz JSALVMWAGPBBNE-XYJFISCASA-N 2 1 343.540 4.267 20 0 EIADMP Fc1cc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)ccc1Cl ZINC000063345197 1020243566 /nfs/dbraw/zinc/24/35/66/1020243566.db2.gz NYISAWIKVXGKIA-UHFFFAOYSA-N 2 1 332.850 4.233 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398187930 1020530231 /nfs/dbraw/zinc/53/02/31/1020530231.db2.gz LVOYFKRDSBKHFI-NJNPRVFISA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398187930 1020530239 /nfs/dbraw/zinc/53/02/39/1020530239.db2.gz LVOYFKRDSBKHFI-NJNPRVFISA-N 2 1 340.486 4.257 20 0 EIADMP Cc1cccc([C@H]([NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)C(C)(C)C)c1 ZINC000655720817 1020917516 /nfs/dbraw/zinc/91/75/16/1020917516.db2.gz HAXYTUFZWXDZPS-RTWAWAEBSA-N 2 1 344.543 4.315 20 0 EIADMP C[N@@H+](C[C@H]1CN(Cc2ccccc2)CCCO1)C1CCCCCCC1 ZINC001167302631 1020978796 /nfs/dbraw/zinc/97/87/96/1020978796.db2.gz RMUKCWJRLUXUTJ-QFIPXVFZSA-N 2 1 344.543 4.322 20 0 EIADMP C[C@H](Cc1ccccn1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000655834514 1020998083 /nfs/dbraw/zinc/99/80/83/1020998083.db2.gz PHQMRUPKEOVFJT-HWHRFOGPSA-N 2 1 349.522 4.045 20 0 EIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1CCCCO1 ZINC000655850667 1021016333 /nfs/dbraw/zinc/01/63/33/1021016333.db2.gz YJJVKOVFKAMJNS-BIRZXAFVSA-N 2 1 342.527 4.119 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccnn2CC2CCC2)cc1 ZINC000631086521 1021020742 /nfs/dbraw/zinc/02/07/42/1021020742.db2.gz AIXSSPKQRJXPKB-MRXNPFEDSA-N 2 1 349.482 4.028 20 0 EIADMP c1cc2ccc(C[N@@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)cc2[nH]1 ZINC001167326857 1021129328 /nfs/dbraw/zinc/12/93/28/1021129328.db2.gz UWVMUIZNRBZRSR-LJQANCHMSA-N 2 1 325.500 4.256 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3[nH]ccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379632393 1021845849 /nfs/dbraw/zinc/84/58/49/1021845849.db2.gz SLGCWNOGMCOFDO-UTKZUKDTSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3[nH]ccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379632393 1021845853 /nfs/dbraw/zinc/84/58/53/1021845853.db2.gz SLGCWNOGMCOFDO-UTKZUKDTSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000157850343 1021852342 /nfs/dbraw/zinc/85/23/42/1021852342.db2.gz HZENDPIAMANXQQ-IBGZPJMESA-N 3 1 335.580 4.028 20 0 EIADMP c1ccc(CC2(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CCCCC2)cc1 ZINC000471592362 1022200166 /nfs/dbraw/zinc/20/01/66/1022200166.db2.gz DJPQTPURGMURLR-SFTDATJTSA-N 2 1 326.528 4.396 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H](OC)c2ccccc2)CC1)CC1CC1 ZINC000549387776 1022202940 /nfs/dbraw/zinc/20/29/40/1022202940.db2.gz PIPYXMHVFSMEPF-JOCHJYFZSA-N 2 1 344.543 4.208 20 0 EIADMP CC[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCOCC1 ZINC000549037995 1022204954 /nfs/dbraw/zinc/20/49/54/1022204954.db2.gz ZBQWMHLBFXJFPM-NHCUHLMSSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCOCC1 ZINC000549037995 1022204972 /nfs/dbraw/zinc/20/49/72/1022204972.db2.gz ZBQWMHLBFXJFPM-NHCUHLMSSA-N 2 1 344.543 4.082 20 0 EIADMP COC1CC([NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C1 ZINC000580576413 1022222201 /nfs/dbraw/zinc/22/22/01/1022222201.db2.gz SQKFVRYYMULQCH-PDQDRIIMSA-N 2 1 348.918 4.021 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(-c3cc[nH]n3)o2)cc1 ZINC000378004906 1022225176 /nfs/dbraw/zinc/22/51/76/1022225176.db2.gz RIBGUCRPFOFIQA-AWEZNQCLSA-N 2 1 347.422 4.015 20 0 EIADMP Cc1cc(OCCC[C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)ccc1Cl ZINC000549041206 1022250922 /nfs/dbraw/zinc/25/09/22/1022250922.db2.gz FVLSDSUTFTYVOX-SJORKVTESA-N 2 1 338.923 4.127 20 0 EIADMP Cc1cc(F)ncc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000892580269 1022313728 /nfs/dbraw/zinc/31/37/28/1022313728.db2.gz ILYADIVFSWCELC-KRWDZBQOSA-N 2 1 341.474 4.193 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000464779832 1022359374 /nfs/dbraw/zinc/35/93/74/1022359374.db2.gz PZQPZHGFENNRBO-GJZGRUSLSA-N 2 1 326.431 4.013 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000464779832 1022359395 /nfs/dbraw/zinc/35/93/95/1022359395.db2.gz PZQPZHGFENNRBO-GJZGRUSLSA-N 2 1 326.431 4.013 20 0 EIADMP CC[C@H]([NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)c1nc(C(F)(F)F)cs1 ZINC000925525156 1022553676 /nfs/dbraw/zinc/55/36/76/1022553676.db2.gz ALLDPPBHAMKNTR-DCAQKATOSA-N 2 1 335.439 4.109 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000310846192 1022647749 /nfs/dbraw/zinc/64/77/49/1022647749.db2.gz IKTMIQOSVWWJRU-TZIWHRDSSA-N 2 1 340.511 4.493 20 0 EIADMP Cc1csc([C@H](C)C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)n1 ZINC000186568702 1022673401 /nfs/dbraw/zinc/67/34/01/1022673401.db2.gz LQVTZTOONZTEKR-HIFRSBDPSA-N 2 1 340.496 4.400 20 0 EIADMP C[C@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC2(C[C@@H]2C[N@@H+](C)C2CC2)CC1 ZINC000378354969 1022738896 /nfs/dbraw/zinc/73/88/96/1022738896.db2.gz MCWWHHIHHORZPY-HZPDHXFCSA-N 2 1 345.531 4.229 20 0 EIADMP c1sc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)nc1-c1ccccc1 ZINC000647542956 1022779047 /nfs/dbraw/zinc/77/90/47/1022779047.db2.gz FGGLESDVRQDVKT-ZWKOTPCHSA-N 2 1 341.524 4.022 20 0 EIADMP Cc1cc2cc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)ccc2[nH]1 ZINC000581026084 1022802427 /nfs/dbraw/zinc/80/24/27/1022802427.db2.gz QHKURDSJSCTSON-IRLDBZIGSA-N 2 1 333.479 4.401 20 0 EIADMP Cc1cc2cc(C[NH2+][C@@H]3CC[N@H+](C)[C@H](c4ccccc4)C3)ccc2[nH]1 ZINC000581026084 1022802430 /nfs/dbraw/zinc/80/24/30/1022802430.db2.gz QHKURDSJSCTSON-IRLDBZIGSA-N 2 1 333.479 4.401 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccnc(Cl)c1 ZINC000160759652 1022822797 /nfs/dbraw/zinc/82/27/97/1022822797.db2.gz ZNPOAJVJVYBDSK-BXWFABGCSA-N 2 1 343.902 4.296 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3cc(N)ccc32)C[C@H]1c1ccccc1 ZINC000423369638 1022860405 /nfs/dbraw/zinc/86/04/05/1022860405.db2.gz SUBYGKHTHQEKMK-NNWRFLSQSA-N 2 1 335.495 4.071 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3cc(N)ccc32)C[C@H]1c1ccccc1 ZINC000423369638 1022860407 /nfs/dbraw/zinc/86/04/07/1022860407.db2.gz SUBYGKHTHQEKMK-NNWRFLSQSA-N 2 1 335.495 4.071 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cccnc2Cl)cc1 ZINC000163563991 1022895381 /nfs/dbraw/zinc/89/53/81/1022895381.db2.gz AUBCNHJDXRDUEU-OAHLLOKOSA-N 2 1 331.891 4.428 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000376672597 1023254985 /nfs/dbraw/zinc/25/49/85/1023254985.db2.gz OJELGPNBPZUIOD-KNQAVFIVSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417347040 1023273623 /nfs/dbraw/zinc/27/36/23/1023273623.db2.gz VOFFRVCFZYDUPB-JZFYCYHFSA-N 2 1 332.557 4.483 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2cscc2C(F)(F)F)C1 ZINC000581576966 1023376036 /nfs/dbraw/zinc/37/60/36/1023376036.db2.gz FLBBBLHZWQFQSI-CYBMUJFWSA-N 2 1 334.451 4.225 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2cscc2C(F)(F)F)C1 ZINC000581576966 1023376043 /nfs/dbraw/zinc/37/60/43/1023376043.db2.gz FLBBBLHZWQFQSI-CYBMUJFWSA-N 2 1 334.451 4.225 20 0 EIADMP C[C@H]([NH2+]CCc1nsc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000660255322 1023388820 /nfs/dbraw/zinc/38/88/20/1023388820.db2.gz BAHHSGGXZQOSBJ-HOTGVXAUSA-N 2 1 343.540 4.081 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccc(Cl)cn1 ZINC000549167912 1023411358 /nfs/dbraw/zinc/41/13/58/1023411358.db2.gz XUGZIVBRIWFBLC-LJQANCHMSA-N 2 1 343.902 4.125 20 0 EIADMP FC(F)(F)c1ccccc1C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415090227 1023433342 /nfs/dbraw/zinc/43/33/42/1023433342.db2.gz XRRFONWZUVSFFI-FUHWJXTLSA-N 2 1 334.385 4.288 20 0 EIADMP Cc1ccc(C)c(OC2CC[NH+](CC[C@@H]3CCCC[N@@H+]3C)CC2)c1 ZINC000472759386 1023511415 /nfs/dbraw/zinc/51/14/15/1023511415.db2.gz KSDKAWSCMDLUBD-IBGZPJMESA-N 2 1 330.516 4.021 20 0 EIADMP C[C@H](C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118180 1023515414 /nfs/dbraw/zinc/51/54/14/1023515414.db2.gz SNSVTIFQPIFYKD-UWWQBHOKSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118180 1023515426 /nfs/dbraw/zinc/51/54/26/1023515426.db2.gz SNSVTIFQPIFYKD-UWWQBHOKSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118180 1023515443 /nfs/dbraw/zinc/51/54/43/1023515443.db2.gz SNSVTIFQPIFYKD-UWWQBHOKSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118179 1023516109 /nfs/dbraw/zinc/51/61/09/1023516109.db2.gz SNSVTIFQPIFYKD-QGPMSJSTSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118179 1023516114 /nfs/dbraw/zinc/51/61/14/1023516114.db2.gz SNSVTIFQPIFYKD-QGPMSJSTSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118179 1023516125 /nfs/dbraw/zinc/51/61/25/1023516125.db2.gz SNSVTIFQPIFYKD-QGPMSJSTSA-N 2 1 340.433 4.225 20 0 EIADMP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@H+]2Cc2cccc(C3CCCC3)c2)C1 ZINC000656785840 1023530348 /nfs/dbraw/zinc/53/03/48/1023530348.db2.gz KEENGOPTWCDCCA-BHIFYINESA-N 2 1 342.527 4.205 20 0 EIADMP C[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1c(Cl)cccc1Cl ZINC000192803765 1023649540 /nfs/dbraw/zinc/64/95/40/1023649540.db2.gz LSGOVHWNZIBVLK-RLAWYHOSSA-N 2 1 327.299 4.312 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000398097548 1023684268 /nfs/dbraw/zinc/68/42/68/1023684268.db2.gz KWUSLTALRXMGNE-JXFKEZNVSA-N 2 1 328.887 4.340 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cn1 ZINC000164118592 1023698607 /nfs/dbraw/zinc/69/86/07/1023698607.db2.gz PVIWOGOKFHIMDE-LQWHRVPQSA-N 2 1 340.515 4.025 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cn1 ZINC000164118592 1023698610 /nfs/dbraw/zinc/69/86/10/1023698610.db2.gz PVIWOGOKFHIMDE-LQWHRVPQSA-N 2 1 340.515 4.025 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cccnc1Cl ZINC000163768165 1023702480 /nfs/dbraw/zinc/70/24/80/1023702480.db2.gz KREZQLBWTDDULD-HNNXBMFYSA-N 2 1 331.891 4.428 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccc(OC)c(OCC(C)C)c2)CC1 ZINC000510468088 1023758484 /nfs/dbraw/zinc/75/84/84/1023758484.db2.gz WURLMGOBYXCVKC-UHFFFAOYSA-N 2 1 348.531 4.036 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(OC)c(OCC(C)C)c2)CC1 ZINC000510468088 1023758489 /nfs/dbraw/zinc/75/84/89/1023758489.db2.gz WURLMGOBYXCVKC-UHFFFAOYSA-N 2 1 348.531 4.036 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(C)c(Br)c2)CC1 ZINC000510468265 1023758641 /nfs/dbraw/zinc/75/86/41/1023758641.db2.gz ZEWYSGXWTKWYFK-UHFFFAOYSA-N 2 1 339.321 4.064 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000500420900 1023814745 /nfs/dbraw/zinc/81/47/45/1023814745.db2.gz LYNUFAJNEXCBOS-RBFDBLARSA-N 2 1 340.433 4.430 20 0 EIADMP COCc1ccccc1/C=C(/C)C[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000511741922 1023854445 /nfs/dbraw/zinc/85/44/45/1023854445.db2.gz XSRDEEXCKRQMCP-CBXNMNPBSA-N 2 1 344.543 4.194 20 0 EIADMP CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000430718151 1023977330 /nfs/dbraw/zinc/97/73/30/1023977330.db2.gz CFGUGCOAVKURKM-CWFSZBLJSA-N 2 1 347.547 4.308 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccccc1)[C@H]1COC(C)(C)C1 ZINC000661199606 1023982255 /nfs/dbraw/zinc/98/22/55/1023982255.db2.gz QIHTWTYOGJRCRM-HXUWFJFHSA-N 2 1 341.499 4.041 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccccc1)[C@H]1COC(C)(C)C1 ZINC000661199606 1023982298 /nfs/dbraw/zinc/98/22/98/1023982298.db2.gz QIHTWTYOGJRCRM-HXUWFJFHSA-N 2 1 341.499 4.041 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000549523509 1024123263 /nfs/dbraw/zinc/12/32/63/1024123263.db2.gz HIPRGPDAKUBYFB-TZYHBYERSA-N 2 1 334.507 4.433 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)CCCOc2ccc(Cl)c(C)c2)C1 ZINC000510653328 1024172996 /nfs/dbraw/zinc/17/29/96/1024172996.db2.gz RERWBZBBXGVHGA-IRXDYDNUSA-N 2 1 338.923 4.127 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)CCCOc2ccc(Cl)c(C)c2)C1 ZINC000510653327 1024173976 /nfs/dbraw/zinc/17/39/76/1024173976.db2.gz RERWBZBBXGVHGA-IAGOWNOFSA-N 2 1 338.923 4.127 20 0 EIADMP CC[N@@H+](CCC[NH2+][C@@H](C)Cc1ccn(C(C)C)n1)C1CCCCC1 ZINC000651910452 1024216619 /nfs/dbraw/zinc/21/66/19/1024216619.db2.gz UJHHDUBONRFOAE-SFHVURJKSA-N 2 1 334.552 4.029 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1cccc(C)c1)c1cccc(F)c1 ZINC000510687010 1024234087 /nfs/dbraw/zinc/23/40/87/1024234087.db2.gz NJQMMFUMUHMWQE-OAQYLSRUSA-N 2 1 337.442 4.408 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)CCCOc1ccc(Cl)c(C)c1 ZINC000510689954 1024234911 /nfs/dbraw/zinc/23/49/11/1024234911.db2.gz YFOKMKBXEMGVJQ-INIZCTEOSA-N 2 1 349.906 4.381 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@@H]([NH3+])[C@H](C)C3)s2)cc1 ZINC000430950049 1024268064 /nfs/dbraw/zinc/26/80/64/1024268064.db2.gz PPHIMICNLXDAGA-RDTXWAMCSA-N 2 1 329.513 4.103 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@@H]([NH3+])[C@H](C)C3)s2)cc1 ZINC000430950049 1024268079 /nfs/dbraw/zinc/26/80/79/1024268079.db2.gz PPHIMICNLXDAGA-RDTXWAMCSA-N 2 1 329.513 4.103 20 0 EIADMP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000510719954 1024312526 /nfs/dbraw/zinc/31/25/26/1024312526.db2.gz KMJLHEZDTASOJB-ZIFCJYIRSA-N 2 1 338.536 4.468 20 0 EIADMP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000510719954 1024312542 /nfs/dbraw/zinc/31/25/42/1024312542.db2.gz KMJLHEZDTASOJB-ZIFCJYIRSA-N 2 1 338.536 4.468 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cccc3ccsc32)[C@H](C)C1 ZINC000652219682 1024390901 /nfs/dbraw/zinc/39/09/01/1024390901.db2.gz IJVSXDVMIVFHGP-VQIMIIECSA-N 2 1 346.540 4.128 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000548483981 1024831212 /nfs/dbraw/zinc/83/12/12/1024831212.db2.gz RGRSLFXTVNAJIW-RSPOEFSDSA-N 2 1 332.557 4.161 20 0 EIADMP COc1ccccc1[C@@H]([NH2+]CCCn1cc[nH+]c1C)C1CCCC1 ZINC000510942859 1024858200 /nfs/dbraw/zinc/85/82/00/1024858200.db2.gz CPXBYHOHCABNAA-FQEVSTJZSA-N 2 1 327.472 4.111 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(F)cc2C(F)(F)F)CC1 ZINC000535811344 1024957893 /nfs/dbraw/zinc/95/78/93/1024957893.db2.gz IAIGCMZUSRNSHA-UHFFFAOYSA-N 2 1 346.412 4.397 20 0 EIADMP c1ccc2sc([C@@H]3CCC[N@@H+]3Cc3cccc4c3CC[NH2+]C4)nc2c1 ZINC000662257468 1025005909 /nfs/dbraw/zinc/00/59/09/1025005909.db2.gz CYCAZAZITDKTLI-IBGZPJMESA-N 2 1 349.503 4.279 20 0 EIADMP COC1(C[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000277057136 1025015255 /nfs/dbraw/zinc/01/52/55/1025015255.db2.gz HQXKEJSVTSXRDZ-XSLAUPDRSA-N 2 1 342.527 4.119 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295867 1025050503 /nfs/dbraw/zinc/05/05/03/1025050503.db2.gz IIEDUBYJKJMPJO-RHSMWYFYSA-N 2 1 338.442 4.061 20 0 EIADMP c1c(C2CC[NH2+]CC2)n[nH]c1C1CC[NH+](CCC2CCCCC2)CC1 ZINC000662327269 1025080780 /nfs/dbraw/zinc/08/07/80/1025080780.db2.gz LRABNWBXSDCBRJ-UHFFFAOYSA-N 2 1 344.547 4.027 20 0 EIADMP Clc1ccc2cccnc2c1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663346932 1025143503 /nfs/dbraw/zinc/14/35/03/1025143503.db2.gz XZJWZTBLHRHDSB-INIZCTEOSA-N 2 1 343.902 4.100 20 0 EIADMP Clc1ccc2cccnc2c1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663346932 1025143516 /nfs/dbraw/zinc/14/35/16/1025143516.db2.gz XZJWZTBLHRHDSB-INIZCTEOSA-N 2 1 343.902 4.100 20 0 EIADMP Cc1cc2c(cc1C)[C@@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CCS2 ZINC000187029163 1025168796 /nfs/dbraw/zinc/16/87/96/1025168796.db2.gz XRWNHAUAWVVWOU-IBGZPJMESA-N 2 1 330.541 4.304 20 0 EIADMP COCC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000510993678 1025272155 /nfs/dbraw/zinc/27/21/55/1025272155.db2.gz GEZQVOSMCFXMIE-BURNTYAHSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@H]1C[C@@H](NC[C@H]2CCC[N@@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469482 1025418134 /nfs/dbraw/zinc/41/81/34/1025418134.db2.gz PRZWXLCTGPLFCM-YSVLISHTSA-N 2 1 336.570 4.385 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469482 1025418139 /nfs/dbraw/zinc/41/81/39/1025418139.db2.gz PRZWXLCTGPLFCM-YSVLISHTSA-N 2 1 336.570 4.385 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469482 1025418141 /nfs/dbraw/zinc/41/81/41/1025418141.db2.gz PRZWXLCTGPLFCM-YSVLISHTSA-N 2 1 336.570 4.385 20 0 EIADMP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@H+]1CC1CC[NH+](C)CC1 ZINC000892034303 1025453192 /nfs/dbraw/zinc/45/31/92/1025453192.db2.gz LUSDRTKUXYCPCT-HXUWFJFHSA-N 2 1 340.515 4.096 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]CCCn1cc[nH+]c1C ZINC000511020908 1025578982 /nfs/dbraw/zinc/57/89/82/1025578982.db2.gz WWXYLTOJYGABJY-MRXNPFEDSA-N 2 1 337.920 4.396 20 0 EIADMP c1c2ccncc2sc1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000657285589 1025619122 /nfs/dbraw/zinc/61/91/22/1025619122.db2.gz KCDSPIHFUZCQPW-UHFFFAOYSA-N 2 1 337.492 4.051 20 0 EIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CCc3[nH+]ccn3C2)c2ccccc2)cc1 ZINC000278923987 1025621324 /nfs/dbraw/zinc/62/13/24/1025621324.db2.gz IEVAPRNHCBEXHZ-GCJKJVERSA-N 2 1 331.463 4.133 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1Cc2cccc(Br)c2C1 ZINC001167827255 1025634921 /nfs/dbraw/zinc/63/49/21/1025634921.db2.gz VHHUXKZHDDODNW-CQSZACIVSA-N 2 1 339.321 4.275 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1Cc2cccc(Br)c2C1 ZINC001167827255 1025634939 /nfs/dbraw/zinc/63/49/39/1025634939.db2.gz VHHUXKZHDDODNW-CQSZACIVSA-N 2 1 339.321 4.275 20 0 EIADMP FC(F)(F)c1ccccc1-c1ccc(C[N@@H+]2CCC[NH2+]CC2)cc1 ZINC001204667925 1025691380 /nfs/dbraw/zinc/69/13/80/1025691380.db2.gz PMVIEFITCXYXQD-UHFFFAOYSA-N 2 1 334.385 4.168 20 0 EIADMP FC(F)(F)c1ccccc1-c1ccc(C[N@H+]2CCC[NH2+]CC2)cc1 ZINC001204667925 1025691397 /nfs/dbraw/zinc/69/13/97/1025691397.db2.gz PMVIEFITCXYXQD-UHFFFAOYSA-N 2 1 334.385 4.168 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCSC[C@@H]1c1ccc(F)cc1 ZINC001167833329 1025788715 /nfs/dbraw/zinc/78/87/15/1025788715.db2.gz AFRDRCNGTCXCIM-QFBILLFUSA-N 2 1 338.536 4.426 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1c1cccc(C(=O)OC)c1 ZINC001167834083 1025810482 /nfs/dbraw/zinc/81/04/82/1025810482.db2.gz HLINSFRWUMWWCZ-PXNSSMCTSA-N 2 1 346.515 4.121 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc(Br)cs1 ZINC000453387228 1025862880 /nfs/dbraw/zinc/86/28/80/1025862880.db2.gz BALBBVUZLGNSDB-NSHDSACASA-N 2 1 331.323 4.036 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC(N[C@H](CCC[NH3+])c3ccccc3)CC2)C1 ZINC000415061581 1025862993 /nfs/dbraw/zinc/86/29/93/1025862993.db2.gz YRSAXICYQKMCBS-BVYCBKJFSA-N 2 1 343.559 4.099 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccc(F)c(F)c1F ZINC000657308056 1025866015 /nfs/dbraw/zinc/86/60/15/1025866015.db2.gz MJIQSAOAPKSAOK-UHFFFAOYSA-N 2 1 336.401 4.234 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1ccc(F)c(F)c1F ZINC000657308056 1025866016 /nfs/dbraw/zinc/86/60/16/1025866016.db2.gz MJIQSAOAPKSAOK-UHFFFAOYSA-N 2 1 336.401 4.234 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@H](CC2CCC2)c2ccccc2)CCCO1 ZINC000432421196 1025899951 /nfs/dbraw/zinc/89/99/51/1025899951.db2.gz OKJFVISBYQILHB-WIYYLYMNSA-N 2 1 330.516 4.008 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+][C@@H](CC2CCC2)c2ccccc2)CCCO1 ZINC000432421195 1025900705 /nfs/dbraw/zinc/90/07/05/1025900705.db2.gz OKJFVISBYQILHB-RXVVDRJESA-N 2 1 330.516 4.008 20 0 EIADMP COc1ccc(F)c(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1 ZINC000550078914 1026009500 /nfs/dbraw/zinc/00/95/00/1026009500.db2.gz GHIBXDICUIREEG-UHFFFAOYSA-N 2 1 342.458 4.110 20 0 EIADMP C[C@H](Cc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167971238 1026066399 /nfs/dbraw/zinc/06/63/99/1026066399.db2.gz UNDOQEAVUGACLR-PHHCVGHBSA-N 2 1 332.919 4.266 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000344165061 1026079864 /nfs/dbraw/zinc/07/98/64/1026079864.db2.gz LCHAAWXHMYWWFE-INIZCTEOSA-N 2 1 337.389 4.090 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000344165061 1026079884 /nfs/dbraw/zinc/07/98/84/1026079884.db2.gz LCHAAWXHMYWWFE-INIZCTEOSA-N 2 1 337.389 4.090 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCCc4ccc(F)cc43)CC2)[nH+]c1 ZINC000344165228 1026082292 /nfs/dbraw/zinc/08/22/92/1026082292.db2.gz JIFRLUUBGJVDIM-HXUWFJFHSA-N 2 1 339.458 4.165 20 0 EIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cc(C)c1O ZINC000582089682 1026117440 /nfs/dbraw/zinc/11/74/40/1026117440.db2.gz QUHZQEVTWLRUNR-IEBWSBKVSA-N 2 1 344.524 4.243 20 0 EIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc(C)c1O ZINC000582089682 1026117448 /nfs/dbraw/zinc/11/74/48/1026117448.db2.gz QUHZQEVTWLRUNR-IEBWSBKVSA-N 2 1 344.524 4.243 20 0 EIADMP C[C@@H](C[NH2+]Cc1cc(Cl)ccc1OC(F)F)C[NH+]1CCCCC1 ZINC000390946620 1026163965 /nfs/dbraw/zinc/16/39/65/1026163965.db2.gz NAPWZZUGQBPWSP-ZDUSSCGKSA-N 2 1 346.849 4.153 20 0 EIADMP CC(C)[C@@H](C[N@@H+](C)C1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000375670146 1026208022 /nfs/dbraw/zinc/20/80/22/1026208022.db2.gz ZSOSOSQKNJGTKJ-JOCHJYFZSA-N 2 1 344.543 4.001 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1cc2cc(Br)ccc2o1 ZINC000049553336 1026296577 /nfs/dbraw/zinc/29/65/77/1026296577.db2.gz AKTJXCCZSDTAAT-VXGBXAGGSA-N 2 1 339.277 4.186 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1ccc(OC(F)F)cc1)C1CCCCC1 ZINC000391126369 1026326455 /nfs/dbraw/zinc/32/64/55/1026326455.db2.gz MGJHITJXZPOZTH-UHFFFAOYSA-N 2 1 326.431 4.032 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1ccc(OC(F)F)cc1)C1CCCCC1 ZINC000391126369 1026326466 /nfs/dbraw/zinc/32/64/66/1026326466.db2.gz MGJHITJXZPOZTH-UHFFFAOYSA-N 2 1 326.431 4.032 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3ccc(Cl)s3)CC2)[nH+]c1 ZINC000163469143 1026374314 /nfs/dbraw/zinc/37/43/14/1026374314.db2.gz SEDDROIIOYQFJZ-ZDUSSCGKSA-N 2 1 335.904 4.425 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CC(C)(C)Cc4occc43)CC2)[nH+]c1 ZINC000163478556 1026379104 /nfs/dbraw/zinc/37/91/04/1026379104.db2.gz WIYNDKBMBCRFDS-GOSISDBHSA-N 2 1 339.483 4.255 20 0 EIADMP COCc1csc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000657389134 1026426869 /nfs/dbraw/zinc/42/68/69/1026426869.db2.gz SBEPBLFPONSVAN-VQIMIIECSA-N 2 1 344.524 4.037 20 0 EIADMP COCc1csc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000657389134 1026426888 /nfs/dbraw/zinc/42/68/88/1026426888.db2.gz SBEPBLFPONSVAN-VQIMIIECSA-N 2 1 344.524 4.037 20 0 EIADMP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000279499965 1026462103 /nfs/dbraw/zinc/46/21/03/1026462103.db2.gz MNBSVWZKAPDWHM-FKPGQJDZSA-N 2 1 330.516 4.005 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(OC)c(OCC)c2)CC1 ZINC000506860103 1026478722 /nfs/dbraw/zinc/47/87/22/1026478722.db2.gz HLPFJVXTXHENLW-UHFFFAOYSA-N 2 1 348.531 4.038 20 0 EIADMP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)cs2)cs1 ZINC000152425241 1026543159 /nfs/dbraw/zinc/54/31/59/1026543159.db2.gz JGYSWIYSQSFGFW-TZMCWYRMSA-N 2 1 347.553 4.315 20 0 EIADMP CSc1ccccc1C[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000511109687 1026552688 /nfs/dbraw/zinc/55/26/88/1026552688.db2.gz KTUOCXYYNOQGPZ-LJQANCHMSA-N 2 1 340.536 4.362 20 0 EIADMP CSc1ccccc1C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000511109687 1026552702 /nfs/dbraw/zinc/55/27/02/1026552702.db2.gz KTUOCXYYNOQGPZ-LJQANCHMSA-N 2 1 340.536 4.362 20 0 EIADMP CSc1ccccc1C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511109687 1026552710 /nfs/dbraw/zinc/55/27/10/1026552710.db2.gz KTUOCXYYNOQGPZ-LJQANCHMSA-N 2 1 340.536 4.362 20 0 EIADMP CSc1ccccc1C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511109687 1026552724 /nfs/dbraw/zinc/55/27/24/1026552724.db2.gz KTUOCXYYNOQGPZ-LJQANCHMSA-N 2 1 340.536 4.362 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000507097392 1026639030 /nfs/dbraw/zinc/63/90/30/1026639030.db2.gz GKCAVCKWNHQNCI-JXAWBTAJSA-N 2 1 330.516 4.041 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657430658 1026644896 /nfs/dbraw/zinc/64/48/96/1026644896.db2.gz ULRYCYSNZXYOSA-RDJZCZTQSA-N 2 1 346.490 4.110 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000657430658 1026644902 /nfs/dbraw/zinc/64/49/02/1026644902.db2.gz ULRYCYSNZXYOSA-RDJZCZTQSA-N 2 1 346.490 4.110 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1cncs1 ZINC000159013131 1026731330 /nfs/dbraw/zinc/73/13/30/1026731330.db2.gz PSIDJEGWTZRNMK-BBWFWOEESA-N 2 1 343.540 4.472 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)c1ccccn1 ZINC000159212985 1026781272 /nfs/dbraw/zinc/78/12/72/1026781272.db2.gz RXSQKRMFTYRBAE-QGZVFWFLSA-N 2 1 335.451 4.157 20 0 EIADMP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000560249303 1026821635 /nfs/dbraw/zinc/82/16/35/1026821635.db2.gz HQXGPUOZLSQWFP-XHIHJMKYSA-N 2 1 344.543 4.431 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)[C@@H]1CCCOC1 ZINC000507511133 1026822358 /nfs/dbraw/zinc/82/23/58/1026822358.db2.gz NXBRGJSJWCKNGF-WIYYLYMNSA-N 2 1 344.543 4.356 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCOc2cccc3ccccc32)C[C@H]1C ZINC001167589380 1026860111 /nfs/dbraw/zinc/86/01/11/1026860111.db2.gz DKKYOBPXNIBJDQ-QUCCMNQESA-N 2 1 340.511 4.413 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCOc2cccc3ccccc32)C[C@H]1C ZINC001167589380 1026860118 /nfs/dbraw/zinc/86/01/18/1026860118.db2.gz DKKYOBPXNIBJDQ-QUCCMNQESA-N 2 1 340.511 4.413 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000560450156 1026936356 /nfs/dbraw/zinc/93/63/56/1026936356.db2.gz DUJORBIGGJHPRO-XMHGGMMESA-N 2 1 344.543 4.289 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1cccc(F)c1 ZINC000188065857 1027070368 /nfs/dbraw/zinc/07/03/68/1027070368.db2.gz IUKRTPVVIKTDGH-IBGZPJMESA-N 2 1 327.447 4.239 20 0 EIADMP FC(F)(F)c1cccc(CCCC[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000474470004 1027097064 /nfs/dbraw/zinc/09/70/64/1027097064.db2.gz CYJYJKDSTSAWOZ-ZWKOTPCHSA-N 2 1 340.433 4.245 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000474481612 1027117134 /nfs/dbraw/zinc/11/71/34/1027117134.db2.gz YJTDCRICZLBETR-QRVBRYPASA-N 2 1 332.532 4.289 20 0 EIADMP Cc1[nH+]c2ccccc2c(N2CC[NH+]([C@H](C)c3cccnc3)CC2)c1C ZINC000302060724 1027200684 /nfs/dbraw/zinc/20/06/84/1027200684.db2.gz CHGDMZKTOIGLKX-GOSISDBHSA-N 2 1 346.478 4.130 20 0 EIADMP CC(C)c1ccccc1NC(=O)[C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000116396409 1027350877 /nfs/dbraw/zinc/35/08/77/1027350877.db2.gz HNFXJUTZHDBPAI-APWZRJJASA-N 2 1 347.547 4.093 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H](C)C3CCCCC3)CC2)cs1 ZINC000474721409 1027438836 /nfs/dbraw/zinc/43/88/36/1027438836.db2.gz HHQSQEAMXDYHOT-MRXNPFEDSA-N 2 1 349.588 4.476 20 0 EIADMP CC(=O)c1c(C)cc(C)c(CN(C)CC[C@@H]2CCCC[N@H+]2C)c1C ZINC000441367422 1027492675 /nfs/dbraw/zinc/49/26/75/1027492675.db2.gz IBXZXZAUCUGHQG-IBGZPJMESA-N 2 1 330.516 4.121 20 0 EIADMP CCCC(O)(CCC)C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000532223776 1027493975 /nfs/dbraw/zinc/49/39/75/1027493975.db2.gz PRVVAYUQLONRCD-INIZCTEOSA-N 2 1 329.488 4.163 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(O)cc32)CC[N@@H+]1Cc1ccccc1 ZINC000657693539 1027578264 /nfs/dbraw/zinc/57/82/64/1027578264.db2.gz MSMLXDZEWSFSFR-ZWDAVXSWSA-N 2 1 336.479 4.022 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(O)cc32)CC[N@H+]1Cc1ccccc1 ZINC000657693539 1027578276 /nfs/dbraw/zinc/57/82/76/1027578276.db2.gz MSMLXDZEWSFSFR-ZWDAVXSWSA-N 2 1 336.479 4.022 20 0 EIADMP CC(C)OC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000090771941 1027580620 /nfs/dbraw/zinc/58/06/20/1027580620.db2.gz BGLCSXKHDHRJOE-NTYOPAKOSA-N 2 1 344.543 4.365 20 0 EIADMP CC(C)OC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000090771941 1027580630 /nfs/dbraw/zinc/58/06/30/1027580630.db2.gz BGLCSXKHDHRJOE-NTYOPAKOSA-N 2 1 344.543 4.365 20 0 EIADMP c1cc(C[NH2+]C2CC([NH+]3CCCCC3)C2)cc(OC2CCCC2)c1 ZINC000475568581 1027653234 /nfs/dbraw/zinc/65/32/34/1027653234.db2.gz NZRRSZIFJKWNNV-UHFFFAOYSA-N 2 1 328.500 4.115 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)C1CCSCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000474942043 1027808426 /nfs/dbraw/zinc/80/84/26/1027808426.db2.gz KKSJKFHPEWBXPL-QKLQHJQFSA-N 2 1 332.557 4.018 20 0 EIADMP c1sc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)nc1C1CCCCC1 ZINC000444597314 1027884508 /nfs/dbraw/zinc/88/45/08/1027884508.db2.gz OOQFUQNVPBIDNP-UHFFFAOYSA-N 2 1 347.572 4.499 20 0 EIADMP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)C2)c1 ZINC000280803816 1027895057 /nfs/dbraw/zinc/89/50/57/1027895057.db2.gz LBRWSLUVFNRDMD-DDBAPUKQSA-N 2 1 338.417 4.168 20 0 EIADMP Cc1ccc2cc(C[NH2+]CCCC[N@@H+]3CCCC[C@@H]3C)ccc2n1 ZINC000189256221 1028110676 /nfs/dbraw/zinc/11/06/76/1028110676.db2.gz FNVCEOSNCRIFOS-SFHVURJKSA-N 2 1 325.500 4.287 20 0 EIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](CCc2ccncc2)CC1)c1ccccc1 ZINC000154137195 1028118444 /nfs/dbraw/zinc/11/84/44/1028118444.db2.gz BAMMGJBSQFZALF-JOCHJYFZSA-N 2 1 337.511 4.075 20 0 EIADMP Fc1cccc(Oc2ccc(CN[C@@H]3CC[N@H+]4CCC[C@H]4C3)cc2)c1 ZINC000443962585 1028123140 /nfs/dbraw/zinc/12/31/40/1028123140.db2.gz GNDYALXWRHLSGA-MOPGFXCFSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)c1 ZINC000443962585 1028123148 /nfs/dbraw/zinc/12/31/48/1028123148.db2.gz GNDYALXWRHLSGA-MOPGFXCFSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)cc2)c1 ZINC000443962585 1028123158 /nfs/dbraw/zinc/12/31/58/1028123158.db2.gz GNDYALXWRHLSGA-MOPGFXCFSA-N 2 1 340.442 4.334 20 0 EIADMP Cc1ccc(OCCC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1C ZINC000523450342 1028126171 /nfs/dbraw/zinc/12/61/71/1028126171.db2.gz RTSWSMIGSDNZJH-HXUWFJFHSA-N 2 1 330.516 4.023 20 0 EIADMP CC1(C)[C@@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1(F)F ZINC000657738977 1028182986 /nfs/dbraw/zinc/18/29/86/1028182986.db2.gz PBHUWWVZDZJIRN-DLBZAZTESA-N 2 1 334.454 4.065 20 0 EIADMP CC1(C)[C@@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1(F)F ZINC000657738977 1028182999 /nfs/dbraw/zinc/18/29/99/1028182999.db2.gz PBHUWWVZDZJIRN-DLBZAZTESA-N 2 1 334.454 4.065 20 0 EIADMP CC[C@H]1c2ccsc2CC[N@@H+]1Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346132374 1028273648 /nfs/dbraw/zinc/27/36/48/1028273648.db2.gz BVIAVWMHJGQXDU-SFHVURJKSA-N 2 1 338.480 4.147 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H]1c1ccc(C)cc1 ZINC000346138782 1028275614 /nfs/dbraw/zinc/27/56/14/1028275614.db2.gz TZMHDYNLLVZOCU-NRFANRHFSA-N 2 1 332.451 4.221 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCCC[C@@H]1Cc1ccccc1 ZINC000346174675 1028304185 /nfs/dbraw/zinc/30/41/85/1028304185.db2.gz MQOJYBRFZAWBAL-JOCHJYFZSA-N 2 1 346.478 4.173 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000346178262 1028308987 /nfs/dbraw/zinc/30/89/87/1028308987.db2.gz OWNGADWMAPIENQ-NRFANRHFSA-N 2 1 346.478 4.173 20 0 EIADMP CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346222499 1028331776 /nfs/dbraw/zinc/33/17/76/1028331776.db2.gz OWHSWDPVWOOCEJ-FQEVSTJZSA-N 2 1 334.467 4.029 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](c1cncc(F)c1)C1CC1 ZINC000281095770 1028374124 /nfs/dbraw/zinc/37/41/24/1028374124.db2.gz AXEQVDAVSVKPNN-NRFANRHFSA-N 2 1 341.474 4.302 20 0 EIADMP COCc1ccc(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)o1 ZINC000125504243 1028418698 /nfs/dbraw/zinc/41/86/98/1028418698.db2.gz IZVNWKNFOZYEKY-QGZVFWFLSA-N 2 1 342.483 4.090 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000583395823 1028657749 /nfs/dbraw/zinc/65/77/49/1028657749.db2.gz NZPPOTNBWWOBQX-LRHZJYQRSA-N 2 1 327.299 4.027 20 0 EIADMP C(=C/C[N@H+]1CCC[C@H]1c1cccnc1)\C[NH+]1CCC[C@@H]1c1cccnc1 ZINC000346978603 1028831278 /nfs/dbraw/zinc/83/12/78/1028831278.db2.gz UEZABGVONGZQNQ-XFDDJKQHSA-N 2 1 348.494 4.007 20 0 EIADMP C(=C/C[N@@H+]1CCC[C@@H]1c1cccnc1)\C[NH+]1CCC[C@H]1c1cccnc1 ZINC000346978603 1028831282 /nfs/dbraw/zinc/83/12/82/1028831282.db2.gz UEZABGVONGZQNQ-XFDDJKQHSA-N 2 1 348.494 4.007 20 0 EIADMP C(=C/C[N@H+]1CCC[C@@H]1c1cccnc1)\C[NH+]1CCC[C@H]1c1cccnc1 ZINC000346978603 1028831290 /nfs/dbraw/zinc/83/12/90/1028831290.db2.gz UEZABGVONGZQNQ-XFDDJKQHSA-N 2 1 348.494 4.007 20 0 EIADMP C[NH2+]Cc1ccccc1C[NH2+]Cc1csc(-c2ccc(C)cc2)n1 ZINC000650719662 1028884667 /nfs/dbraw/zinc/88/46/67/1028884667.db2.gz YGZKYVFEQPHFIL-UHFFFAOYSA-N 2 1 337.492 4.128 20 0 EIADMP CC(C)[N@@H+](CCCn1ccnc1)Cc1cccc(C(F)(F)F)c1 ZINC000343313781 1028906362 /nfs/dbraw/zinc/90/63/62/1028906362.db2.gz KJUVHYKGUCRBEC-UHFFFAOYSA-N 2 1 325.378 4.203 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@@H](c3ccncc3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053360 1029160821 /nfs/dbraw/zinc/16/08/21/1029160821.db2.gz OCGOLJUOUGSCFN-WOIUINJBSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000247057206 1029235972 /nfs/dbraw/zinc/23/59/72/1029235972.db2.gz NPHJKQROAITBMN-BWAGFHJFSA-N 2 1 334.507 4.423 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000157882315 1029260341 /nfs/dbraw/zinc/26/03/41/1029260341.db2.gz RFTIWVPMOVTUCU-MOPGFXCFSA-N 2 1 340.515 4.178 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCOC2CCCCCC2)C1 ZINC000524892635 1029297519 /nfs/dbraw/zinc/29/75/19/1029297519.db2.gz XXUALWYLMPJARX-UXHICEINSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCOC2CCCCCC2)C1 ZINC000524892635 1029297532 /nfs/dbraw/zinc/29/75/32/1029297532.db2.gz XXUALWYLMPJARX-UXHICEINSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCOC2CCCCCC2)C1 ZINC000524892635 1029297546 /nfs/dbraw/zinc/29/75/46/1029297546.db2.gz XXUALWYLMPJARX-UXHICEINSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCOC2CCCCCC2)C1 ZINC000524892635 1029297562 /nfs/dbraw/zinc/29/75/62/1029297562.db2.gz XXUALWYLMPJARX-UXHICEINSA-N 2 1 336.564 4.312 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](CCOC3CCCCCC3)C2)CC1 ZINC000524906959 1029322330 /nfs/dbraw/zinc/32/23/30/1029322330.db2.gz DWCGUNRSCMPZAB-FQEVSTJZSA-N 2 1 336.564 4.170 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCOC3CCCCCC3)C2)CC1 ZINC000524906959 1029322344 /nfs/dbraw/zinc/32/23/44/1029322344.db2.gz DWCGUNRSCMPZAB-FQEVSTJZSA-N 2 1 336.564 4.170 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCOC3CCCCCC3)C2)CC1 ZINC000524906960 1029323306 /nfs/dbraw/zinc/32/33/06/1029323306.db2.gz DWCGUNRSCMPZAB-HXUWFJFHSA-N 2 1 336.564 4.170 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCOC3CCCCCC3)C2)CC1 ZINC000524906960 1029323318 /nfs/dbraw/zinc/32/33/18/1029323318.db2.gz DWCGUNRSCMPZAB-HXUWFJFHSA-N 2 1 336.564 4.170 20 0 EIADMP Cn1c[nH+]cc1CCC[NH2+][C@H](Cc1ccccc1)c1ccccc1F ZINC000583942568 1029393249 /nfs/dbraw/zinc/39/32/49/1029393249.db2.gz ILPRNIUHAZDMPU-OAQYLSRUSA-N 2 1 337.442 4.065 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC000475276619 1029482986 /nfs/dbraw/zinc/48/29/86/1029482986.db2.gz PHGFMRLCTISBTC-MZYLBHOOSA-N 2 1 334.507 4.434 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000508570758 1029535333 /nfs/dbraw/zinc/53/53/33/1029535333.db2.gz RVYQISPHQSKADU-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000508570758 1029535340 /nfs/dbraw/zinc/53/53/40/1029535340.db2.gz RVYQISPHQSKADU-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000508570758 1029535348 /nfs/dbraw/zinc/53/53/48/1029535348.db2.gz RVYQISPHQSKADU-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000508570758 1029535353 /nfs/dbraw/zinc/53/53/53/1029535353.db2.gz RVYQISPHQSKADU-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP Cc1ccc([C@H]([NH2+]CCCC[N@H+]2CCC[C@@H]2CO)C2CCCC2)cc1 ZINC000446820466 1029588621 /nfs/dbraw/zinc/58/86/21/1029588621.db2.gz CWETZLZQBMBPDW-FGZHOGPDSA-N 2 1 344.543 4.053 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)CCCO2 ZINC000359938933 1029603757 /nfs/dbraw/zinc/60/37/57/1029603757.db2.gz AMPAWYZQWOAJIZ-XLIONFOSSA-N 2 1 346.515 4.153 20 0 EIADMP C[NH2+]Cc1cccc(N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168065242 1029646207 /nfs/dbraw/zinc/64/62/07/1029646207.db2.gz VEXHEPXBITZBLO-OPMZPASUSA-N 2 1 337.511 4.260 20 0 EIADMP CSc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000192920276 1029647116 /nfs/dbraw/zinc/64/71/16/1029647116.db2.gz XYWCAFOCGUIQDF-IBGZPJMESA-N 2 1 326.509 4.020 20 0 EIADMP Fc1ccc(C2CC([NH2+]C[C@H]3CC[N@@H+](Cc4ccccc4)C3)C2)cc1 ZINC000192929892 1029647836 /nfs/dbraw/zinc/64/78/36/1029647836.db2.gz KSZQKISOYVJIOZ-HOHBBMLPSA-N 2 1 338.470 4.183 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@@H]([NH3+])C[C@@H]3C)s2)cc1 ZINC000584180408 1029661745 /nfs/dbraw/zinc/66/17/45/1029661745.db2.gz MJDFJSHPRBEJAO-WMLDXEAASA-N 2 1 329.513 4.245 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@@H]([NH3+])C[C@@H]3C)s2)cc1 ZINC000584180408 1029661752 /nfs/dbraw/zinc/66/17/52/1029661752.db2.gz MJDFJSHPRBEJAO-WMLDXEAASA-N 2 1 329.513 4.245 20 0 EIADMP CC[N@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1ccc(C[NH+](C)C)cc1 ZINC000584259676 1029698928 /nfs/dbraw/zinc/69/89/28/1029698928.db2.gz XROYTUHFFOQICE-UHFFFAOYSA-N 2 1 348.494 4.160 20 0 EIADMP CC[N@@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1ccc(C[NH+](C)C)cc1 ZINC000584259676 1029698936 /nfs/dbraw/zinc/69/89/36/1029698936.db2.gz XROYTUHFFOQICE-UHFFFAOYSA-N 2 1 348.494 4.160 20 0 EIADMP CC[N@@H+](Cc1c[nH]c(-c2ccccc2)n1)Cc1ccc(C[NH+](C)C)cc1 ZINC000584259676 1029698952 /nfs/dbraw/zinc/69/89/52/1029698952.db2.gz XROYTUHFFOQICE-UHFFFAOYSA-N 2 1 348.494 4.160 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838283 1029728130 /nfs/dbraw/zinc/72/81/30/1029728130.db2.gz PYOBGHVSNFTFBW-HUUCEWRRSA-N 2 1 325.447 4.182 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(Br)c(Cl)c2)C1 ZINC000657840427 1029747904 /nfs/dbraw/zinc/74/79/04/1029747904.db2.gz GHSFFXIHYYXJAN-NEPJUHHUSA-N 2 1 345.712 4.095 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)c(C)o1 ZINC000278741251 1029777457 /nfs/dbraw/zinc/77/74/57/1029777457.db2.gz NHTSHQJBWCXIIR-OAHLLOKOSA-N 2 1 345.487 4.064 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000301754469 1029804831 /nfs/dbraw/zinc/80/48/31/1029804831.db2.gz CMYYCTCIDYMQPF-LIRRHRJNSA-N 2 1 341.886 4.341 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000301754469 1029804833 /nfs/dbraw/zinc/80/48/33/1029804833.db2.gz CMYYCTCIDYMQPF-LIRRHRJNSA-N 2 1 341.886 4.341 20 0 EIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000081635368 1029810648 /nfs/dbraw/zinc/81/06/48/1029810648.db2.gz HRPNMCLSNRNDHY-MRXNPFEDSA-N 2 1 343.902 4.052 20 0 EIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000081635368 1029810653 /nfs/dbraw/zinc/81/06/53/1029810653.db2.gz HRPNMCLSNRNDHY-MRXNPFEDSA-N 2 1 343.902 4.052 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000081635368 1029810655 /nfs/dbraw/zinc/81/06/55/1029810655.db2.gz HRPNMCLSNRNDHY-MRXNPFEDSA-N 2 1 343.902 4.052 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000081635368 1029810657 /nfs/dbraw/zinc/81/06/57/1029810657.db2.gz HRPNMCLSNRNDHY-MRXNPFEDSA-N 2 1 343.902 4.052 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(F)cc1Cl ZINC000708523248 1029814018 /nfs/dbraw/zinc/81/40/18/1029814018.db2.gz LNYFQECPRRPPNA-QAPCUYQASA-N 2 1 346.877 4.337 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(F)cc1Cl ZINC000708523248 1029814022 /nfs/dbraw/zinc/81/40/22/1029814022.db2.gz LNYFQECPRRPPNA-QAPCUYQASA-N 2 1 346.877 4.337 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000090457525 1029861704 /nfs/dbraw/zinc/86/17/04/1029861704.db2.gz UHSDJFUHKCZLQZ-CTNGQTDRSA-N 2 1 344.543 4.226 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000090457525 1029861708 /nfs/dbraw/zinc/86/17/08/1029861708.db2.gz UHSDJFUHKCZLQZ-CTNGQTDRSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cc3ccccc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000090577300 1029867874 /nfs/dbraw/zinc/86/78/74/1029867874.db2.gz ZCWWCQNRPHHISF-GHTZIAJQSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000090577300 1029867875 /nfs/dbraw/zinc/86/78/75/1029867875.db2.gz ZCWWCQNRPHHISF-GHTZIAJQSA-N 2 1 347.506 4.353 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](c2cccnc2)C(C)C)CC1 ZINC000091287535 1029882674 /nfs/dbraw/zinc/88/26/74/1029882674.db2.gz WZBJNBVSLPNMIT-JOCHJYFZSA-N 2 1 337.511 4.341 20 0 EIADMP CC(C)c1nn(-c2ccccc2)cc1C[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000092071304 1029898814 /nfs/dbraw/zinc/89/88/14/1029898814.db2.gz GLXJQNKNNCDEJH-KRWDZBQOSA-N 2 1 349.482 4.098 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1nc2c(s1)CCCC2 ZINC000093398258 1030004325 /nfs/dbraw/zinc/00/43/25/1030004325.db2.gz KBAYEMORCRGJAB-CVEARBPZSA-N 2 1 335.561 4.327 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccccc1OC(F)(F)F ZINC000121428005 1030110423 /nfs/dbraw/zinc/11/04/23/1030110423.db2.gz WHQMFAJUNWWGBN-QWHCGFSZSA-N 2 1 341.377 4.077 20 0 EIADMP Fc1ccc(C[C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000447536256 1030141086 /nfs/dbraw/zinc/14/10/86/1030141086.db2.gz LZPUEEIWBHOTNO-AVRDEDQJSA-N 2 1 338.470 4.183 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C2(c4ccccc4)CC2)C3)cc1 ZINC000447589011 1030188544 /nfs/dbraw/zinc/18/85/44/1030188544.db2.gz WHKODEOKIONNNL-DKUWSORSSA-N 2 1 332.491 4.461 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000447601017 1030219550 /nfs/dbraw/zinc/21/95/50/1030219550.db2.gz OLWXYLCKDDCTBF-UEXGIBASSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000447601017 1030219565 /nfs/dbraw/zinc/21/95/65/1030219565.db2.gz OLWXYLCKDDCTBF-UEXGIBASSA-N 2 1 338.495 4.399 20 0 EIADMP Cc1c[nH+]ccc1OC1CC[NH+](CCCc2cccc(F)c2)CC1 ZINC000429723997 1030239432 /nfs/dbraw/zinc/23/94/32/1030239432.db2.gz VPZUALPXFXPNJU-UHFFFAOYSA-N 2 1 328.431 4.005 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2c(F)cccc2Cl)[C@H](C)C1 ZINC000447728304 1030292854 /nfs/dbraw/zinc/29/28/54/1030292854.db2.gz LBGSGTHZSMZWOD-RDTXWAMCSA-N 2 1 326.887 4.074 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2c(F)cccc2Cl)[C@H](C)C1 ZINC000447728304 1030292870 /nfs/dbraw/zinc/29/28/70/1030292870.db2.gz LBGSGTHZSMZWOD-RDTXWAMCSA-N 2 1 326.887 4.074 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2c(F)cccc2Cl)[C@H](C)C1 ZINC000447728304 1030292898 /nfs/dbraw/zinc/29/28/98/1030292898.db2.gz LBGSGTHZSMZWOD-RDTXWAMCSA-N 2 1 326.887 4.074 20 0 EIADMP C[C@H]([NH2+]C1(C[NH2+]C2CC(CF)(CF)C2)CCCC1)c1ccccc1 ZINC000657888956 1030296420 /nfs/dbraw/zinc/29/64/20/1030296420.db2.gz OHZZAQQCMLRHID-INIZCTEOSA-N 2 1 336.470 4.327 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000392489837 1030301971 /nfs/dbraw/zinc/30/19/71/1030301971.db2.gz SRUINYLMAVODCI-DLBZAZTESA-N 2 1 326.484 4.492 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000392489837 1030301994 /nfs/dbraw/zinc/30/19/94/1030301994.db2.gz SRUINYLMAVODCI-DLBZAZTESA-N 2 1 326.484 4.492 20 0 EIADMP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CC[N@H+](C(C)C)C2)cc1 ZINC000685455689 1030341994 /nfs/dbraw/zinc/34/19/94/1030341994.db2.gz LFXUHYOGVFTFRB-HRSGFYEVSA-N 2 1 344.543 4.283 20 0 EIADMP C[C@@H]([NH2+]CCCc1ccccc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000530477271 1030447716 /nfs/dbraw/zinc/44/77/16/1030447716.db2.gz XBPRETQYAMNESR-NQIIRXRSSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc2cnccc2o1 ZINC000657968522 1030711076 /nfs/dbraw/zinc/71/10/76/1030711076.db2.gz AVYDFSDXBNKYKE-HRCADAONSA-N 2 1 327.472 4.131 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc2cnccc2o1 ZINC000657968522 1030711095 /nfs/dbraw/zinc/71/10/95/1030711095.db2.gz AVYDFSDXBNKYKE-HRCADAONSA-N 2 1 327.472 4.131 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc2cnccc2o1 ZINC000657968522 1030711117 /nfs/dbraw/zinc/71/11/17/1030711117.db2.gz AVYDFSDXBNKYKE-HRCADAONSA-N 2 1 327.472 4.131 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000398179860 1030731026 /nfs/dbraw/zinc/73/10/26/1030731026.db2.gz WUURNDQBGOEJMI-UTKZUKDTSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3c(F)cccc3F)o2)CCN1C ZINC000093644179 1030741321 /nfs/dbraw/zinc/74/13/21/1030741321.db2.gz KJHJAGJMJGFZQR-KGLIPLIRSA-N 2 1 334.410 4.139 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCCSCC1 ZINC000658004262 1030772194 /nfs/dbraw/zinc/77/21/94/1030772194.db2.gz PBXLDHLCXHURNF-RTBURBONSA-N 2 1 332.557 4.162 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCCSCC1 ZINC000658004262 1030772209 /nfs/dbraw/zinc/77/22/09/1030772209.db2.gz PBXLDHLCXHURNF-RTBURBONSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cc3cc(Cl)cnc3o2)C1 ZINC000648424195 1030783064 /nfs/dbraw/zinc/78/30/64/1030783064.db2.gz DQYQVWHOESZLGU-GASCZTMLSA-N 2 1 349.906 4.329 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccccn1 ZINC000658064689 1030803330 /nfs/dbraw/zinc/80/33/30/1030803330.db2.gz QDBVLIPEOCQMGL-WRHDZBKDSA-N 2 1 349.522 4.075 20 0 EIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH+]2CCC(F)CC2)CC1 ZINC001168188321 1030891502 /nfs/dbraw/zinc/89/15/02/1030891502.db2.gz JHIUORDVQFEKPN-HNNXBMFYSA-N 2 1 338.898 4.169 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC[C@]2(C)CC2(F)F)CC1 ZINC000658217933 1030895088 /nfs/dbraw/zinc/89/50/88/1030895088.db2.gz BEMAXWXEVWKOJD-CTWPCTMYSA-N 2 1 336.470 4.455 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCOc2cccc3ccccc32)C[C@@H]1C ZINC000531140867 1030912314 /nfs/dbraw/zinc/91/23/14/1030912314.db2.gz MCHAGDIHZULHQR-HKUYNNGSSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCOc2cccc3ccccc32)C[C@@H]1C ZINC000531140867 1030912332 /nfs/dbraw/zinc/91/23/32/1030912332.db2.gz MCHAGDIHZULHQR-HKUYNNGSSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCOc2cccc3ccccc32)C[C@@H]1C ZINC000531140867 1030912356 /nfs/dbraw/zinc/91/23/56/1030912356.db2.gz MCHAGDIHZULHQR-HKUYNNGSSA-N 2 1 326.484 4.023 20 0 EIADMP Cc1cnccc1O[C@H]1CC[N@H+]([C@@H](C)Cc2ccc(Cl)cc2)C1 ZINC001168191542 1030969396 /nfs/dbraw/zinc/96/93/96/1030969396.db2.gz GRMJSHFFWUWORU-YJBOKZPZSA-N 2 1 330.859 4.128 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319278 1030978582 /nfs/dbraw/zinc/97/85/82/1030978582.db2.gz YWDQQYRVJZEESP-FGZHOGPDSA-N 2 1 349.522 4.425 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000548873409 1031067648 /nfs/dbraw/zinc/06/76/48/1031067648.db2.gz OMQWRMMMNWQLOR-UHFFFAOYSA-N 2 1 329.831 4.285 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000449084228 1031412377 /nfs/dbraw/zinc/41/23/77/1031412377.db2.gz XABGBPIYMUBUKX-WIYYLYMNSA-N 2 1 342.527 4.252 20 0 EIADMP CSCC1CCC([NH2+]C2CC[NH+](Cc3ccccc3C)CC2)CC1 ZINC000449087067 1031418003 /nfs/dbraw/zinc/41/80/03/1031418003.db2.gz DFNWJJPZOMZIKK-UHFFFAOYSA-N 2 1 346.584 4.471 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCOC4(CCC4)C3)cc2)C1 ZINC000449074139 1031425973 /nfs/dbraw/zinc/42/59/73/1031425973.db2.gz BLRAZDRQHRYDEV-WIYYLYMNSA-N 2 1 342.527 4.110 20 0 EIADMP COc1cc2ccccc2cc1C[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000449073750 1031429835 /nfs/dbraw/zinc/42/98/35/1031429835.db2.gz NYMIMXACTBEVIL-UHFFFAOYSA-N 2 1 326.484 4.058 20 0 EIADMP CC[C@@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C1CCCC1 ZINC000449123771 1031460777 /nfs/dbraw/zinc/46/07/77/1031460777.db2.gz NQSAWBFRTSTFBP-LJQANCHMSA-N 2 1 333.520 4.062 20 0 EIADMP C[C@@H](Cc1ccoc1)[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000449157070 1031486543 /nfs/dbraw/zinc/48/65/43/1031486543.db2.gz FTWIANXPTUIMGD-KRWDZBQOSA-N 2 1 338.451 4.225 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](CN[C@@H](C)c2sccc2Br)C1 ZINC000531702764 1031488108 /nfs/dbraw/zinc/48/81/08/1031488108.db2.gz WGUHFPFAIGUXIU-QWHCGFSZSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2sccc2Br)C1 ZINC000531702764 1031488118 /nfs/dbraw/zinc/48/81/18/1031488118.db2.gz WGUHFPFAIGUXIU-QWHCGFSZSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2sccc2Br)C1 ZINC000531702764 1031488128 /nfs/dbraw/zinc/48/81/28/1031488128.db2.gz WGUHFPFAIGUXIU-QWHCGFSZSA-N 2 1 345.350 4.282 20 0 EIADMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]Cc1cc2cccnc2o1 ZINC000449181026 1031520066 /nfs/dbraw/zinc/52/00/66/1031520066.db2.gz DNPPQZXYNJKPDE-IRXDYDNUSA-N 2 1 349.478 4.074 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2cc3cccnc3o2)C[N@H+]1Cc1ccccc1 ZINC000449217119 1031553417 /nfs/dbraw/zinc/55/34/17/1031553417.db2.gz WZNDHCAMSUOETM-PKOBYXMFSA-N 2 1 349.478 4.218 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccncc1 ZINC000453116536 1031606918 /nfs/dbraw/zinc/60/69/18/1031606918.db2.gz HRQXXIQHTXNLLN-AOIWGVFYSA-N 2 1 329.513 4.267 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccncc1 ZINC000453116536 1031606923 /nfs/dbraw/zinc/60/69/23/1031606923.db2.gz HRQXXIQHTXNLLN-AOIWGVFYSA-N 2 1 329.513 4.267 20 0 EIADMP CC[C@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccncc1 ZINC000453153552 1031631170 /nfs/dbraw/zinc/63/11/70/1031631170.db2.gz VKGGJTCVKCEZRL-GKJHBJHPSA-N 2 1 337.511 4.279 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccn2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449411955 1031696441 /nfs/dbraw/zinc/69/64/41/1031696441.db2.gz DKPLFRXNWBKQJW-JOCHJYFZSA-N 2 1 349.522 4.204 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000453193670 1031703785 /nfs/dbraw/zinc/70/37/85/1031703785.db2.gz GKZLQYYKLZPGLB-QWFCFKBJSA-N 2 1 329.532 4.035 20 0 EIADMP CC(C)Oc1ccc([C@H]2CCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000449560110 1031848075 /nfs/dbraw/zinc/84/80/75/1031848075.db2.gz GEUWPKXYXNJYOZ-YZOZSUJXSA-N 2 1 342.527 4.325 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cccc(COc2ccccc2)c1 ZINC000531939386 1031850679 /nfs/dbraw/zinc/85/06/79/1031850679.db2.gz DMTRBAVYMWBLFY-HMFYCAOWSA-N 2 1 338.495 4.084 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3C)CCCO2 ZINC000453346736 1031872599 /nfs/dbraw/zinc/87/25/99/1031872599.db2.gz KOEVFAOSTMYOOY-MUSFGAPCSA-N 2 1 334.891 4.077 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCCO2 ZINC000453346736 1031872600 /nfs/dbraw/zinc/87/26/00/1031872600.db2.gz KOEVFAOSTMYOOY-MUSFGAPCSA-N 2 1 334.891 4.077 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531963217 1031884217 /nfs/dbraw/zinc/88/42/17/1031884217.db2.gz CTLJBTYWOUYBOW-JQFCIGGWSA-N 2 1 328.422 4.475 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531963217 1031884224 /nfs/dbraw/zinc/88/42/24/1031884224.db2.gz CTLJBTYWOUYBOW-JQFCIGGWSA-N 2 1 328.422 4.475 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000531972413 1031910303 /nfs/dbraw/zinc/91/03/03/1031910303.db2.gz RIVLNIKSUXKXEW-LAUBAEHRSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453405342 1031942238 /nfs/dbraw/zinc/94/22/38/1031942238.db2.gz QJHQZFUBZBBNID-CQSZACIVSA-N 2 1 328.422 4.100 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000532046989 1031997817 /nfs/dbraw/zinc/99/78/17/1031997817.db2.gz YLECONRYLDKCPB-KRWDZBQOSA-N 2 1 349.478 4.293 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@@H]3C[C@H]4C[C@H]4C3)[C@@H](c3ccccc3)C2)cc1 ZINC001167917496 1033844607 /nfs/dbraw/zinc/84/46/07/1033844607.db2.gz MMHMYQVKLXQSAI-HUUMMWPTSA-N 2 1 346.518 4.433 20 0 EIADMP Clc1ccc2cccnc2c1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000512768575 1033894020 /nfs/dbraw/zinc/89/40/20/1033894020.db2.gz FDBRAISRDJILLP-MRXNPFEDSA-N 2 1 343.902 4.196 20 0 EIADMP Clc1ccc2cccnc2c1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000512768575 1033894029 /nfs/dbraw/zinc/89/40/29/1033894029.db2.gz FDBRAISRDJILLP-MRXNPFEDSA-N 2 1 343.902 4.196 20 0 EIADMP C[C@H](C[NH2+]Cc1ccccc1OCc1ccccc1)C[NH+]1CCCC1 ZINC000513070417 1034490387 /nfs/dbraw/zinc/49/03/87/1034490387.db2.gz PHDNGPANAYKWDM-LJQANCHMSA-N 2 1 338.495 4.087 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[N@H+](C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000576438253 1034560898 /nfs/dbraw/zinc/56/08/98/1034560898.db2.gz LPHROHNRFAPWES-ZTMPEJBFSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[NH+](C)[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000576438253 1034560907 /nfs/dbraw/zinc/56/09/07/1034560907.db2.gz LPHROHNRFAPWES-ZTMPEJBFSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000576438253 1034560921 /nfs/dbraw/zinc/56/09/21/1034560921.db2.gz LPHROHNRFAPWES-ZTMPEJBFSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC000576438253 1034560938 /nfs/dbraw/zinc/56/09/38/1034560938.db2.gz LPHROHNRFAPWES-ZTMPEJBFSA-N 2 1 338.442 4.106 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+]CCc3ccc4ccccc4n3)CC2)cc1 ZINC000222825746 1034611327 /nfs/dbraw/zinc/61/13/27/1034611327.db2.gz YCEPMXYVMYMAJF-UHFFFAOYSA-N 2 1 345.490 4.032 20 0 EIADMP CN(c1ccccc1)c1ccc(C[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000022820386 1034821389 /nfs/dbraw/zinc/82/13/89/1034821389.db2.gz UMTWJZCOZVUODK-UHFFFAOYSA-N 2 1 335.495 4.171 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000246556135 1034852766 /nfs/dbraw/zinc/85/27/66/1034852766.db2.gz WWXNLJCOCVAESK-RTWAWAEBSA-N 2 1 336.479 4.079 20 0 EIADMP C[N@H+](C[C@H]1C[C@@H]1c1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513483523 1034974637 /nfs/dbraw/zinc/97/46/37/1034974637.db2.gz DURJWSGWPOHJAZ-FYYLOGMGSA-N 2 1 334.507 4.387 20 0 EIADMP C[N@@H+](C[C@H]1C[C@@H]1c1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513483523 1034974642 /nfs/dbraw/zinc/97/46/42/1034974642.db2.gz DURJWSGWPOHJAZ-FYYLOGMGSA-N 2 1 334.507 4.387 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000501408073 1035439922 /nfs/dbraw/zinc/43/99/22/1035439922.db2.gz TXJQPTJSMYJFAH-ZJCQAOIJSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000501419089 1035440108 /nfs/dbraw/zinc/44/01/08/1035440108.db2.gz FQNARMIUJUEDCK-OWBHPGMISA-N 2 1 338.417 4.325 20 0 EIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000420299091 1035502160 /nfs/dbraw/zinc/50/21/60/1035502160.db2.gz GGBHINVZIOAIMJ-KGLIPLIRSA-N 2 1 326.406 4.230 20 0 EIADMP c1csc([C@@H]2c3ccsc3CC[N@@H+]2CC[C@H]2CCC[NH2+]C2)c1 ZINC000420320516 1035512494 /nfs/dbraw/zinc/51/24/94/1035512494.db2.gz QKXLOIGOHNMZMQ-KDOFPFPSSA-N 2 1 332.538 4.147 20 0 EIADMP CC(C)[NH2+]CCCC[C@H]([NH3+])c1nc(-c2ccc(C(C)C)cc2)no1 ZINC001212145371 1035925736 /nfs/dbraw/zinc/92/57/36/1035925736.db2.gz QYMUMVOWDAHLAY-KRWDZBQOSA-N 2 1 330.476 4.028 20 0 EIADMP C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000502258112 1036013991 /nfs/dbraw/zinc/01/39/91/1036013991.db2.gz QYEBPULHCLQPJZ-RVDAZCDBSA-N 2 1 329.532 4.064 20 0 EIADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000502258112 1036014016 /nfs/dbraw/zinc/01/40/16/1036014016.db2.gz QYEBPULHCLQPJZ-RVDAZCDBSA-N 2 1 329.532 4.064 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000502420481 1036205240 /nfs/dbraw/zinc/20/52/40/1036205240.db2.gz YNLNPXISQLMMLZ-QESAQDPVSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cnn(C2CCCC2)c1 ZINC000502429101 1036210096 /nfs/dbraw/zinc/21/00/96/1036210096.db2.gz GMOXSSKWADZOJA-MRXNPFEDSA-N 2 1 330.520 4.056 20 0 EIADMP CCSCC[C@@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000572036353 1036396765 /nfs/dbraw/zinc/39/67/65/1036396765.db2.gz NNTAFJVOTZBNSP-IEBWSBKVSA-N 2 1 332.557 4.305 20 0 EIADMP CCSCC[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000572036353 1036396791 /nfs/dbraw/zinc/39/67/91/1036396791.db2.gz NNTAFJVOTZBNSP-IEBWSBKVSA-N 2 1 332.557 4.305 20 0 EIADMP CCSCC[C@@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000572036354 1036397266 /nfs/dbraw/zinc/39/72/66/1036397266.db2.gz NNTAFJVOTZBNSP-MJGOQNOKSA-N 2 1 332.557 4.305 20 0 EIADMP CCSCC[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000572036354 1036397280 /nfs/dbraw/zinc/39/72/80/1036397280.db2.gz NNTAFJVOTZBNSP-MJGOQNOKSA-N 2 1 332.557 4.305 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000502694926 1036508565 /nfs/dbraw/zinc/50/85/65/1036508565.db2.gz ULOHSPLLUSPAPW-INIZCTEOSA-N 2 1 349.881 4.471 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000502694926 1036508577 /nfs/dbraw/zinc/50/85/77/1036508577.db2.gz ULOHSPLLUSPAPW-INIZCTEOSA-N 2 1 349.881 4.471 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000502699176 1036516945 /nfs/dbraw/zinc/51/69/45/1036516945.db2.gz XMMPUJWYZLAFAR-COPCDDAFSA-N 2 1 344.543 4.356 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[C@@H]1c1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486479364 1036726790 /nfs/dbraw/zinc/72/67/90/1036726790.db2.gz VFVYEWZFCSNSIK-OUFMZXHOSA-N 2 1 334.507 4.290 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@H]2C[C@@H](C)O[C@@H](C)C2)CC1)CC(C)C ZINC001168414258 1036824455 /nfs/dbraw/zinc/82/44/55/1036824455.db2.gz OIBUIVHLAVAVAJ-KXTWHKPSSA-N 2 1 338.580 4.270 20 0 EIADMP FC1(F)CCC(C[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000503043881 1036884007 /nfs/dbraw/zinc/88/40/07/1036884007.db2.gz AUSUJBAESDVYOR-XUVXKRRUSA-N 2 1 348.481 4.312 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@H]2CCC23CCOCC3)cc1 ZINC000669698638 1037014616 /nfs/dbraw/zinc/01/46/16/1037014616.db2.gz VPQYIEAEZUJZCL-RXVVDRJESA-N 2 1 342.527 4.110 20 0 EIADMP CCC[N@H+](CC1CCCCC1)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000603823009 1037023838 /nfs/dbraw/zinc/02/38/38/1037023838.db2.gz FOOIMXUGULNZKW-UHFFFAOYSA-N 2 1 344.547 4.355 20 0 EIADMP CCC[N@@H+](CC1CCCCC1)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000603823009 1037023859 /nfs/dbraw/zinc/02/38/59/1037023859.db2.gz FOOIMXUGULNZKW-UHFFFAOYSA-N 2 1 344.547 4.355 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cccc(OC(F)(F)F)c2)C1 ZINC000590301378 1037036833 /nfs/dbraw/zinc/03/68/33/1037036833.db2.gz CLJYQADKTALOFP-HNNXBMFYSA-N 2 1 344.421 4.187 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CCO1 ZINC000272009903 1037080387 /nfs/dbraw/zinc/08/03/87/1037080387.db2.gz LSVVMQGFIRVGFL-BDKRGJGYSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CCO1 ZINC000272009903 1037080411 /nfs/dbraw/zinc/08/04/11/1037080411.db2.gz LSVVMQGFIRVGFL-BDKRGJGYSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2c(Cl)ccc3cccnc32)CC1 ZINC000590786266 1037167896 /nfs/dbraw/zinc/16/78/96/1037167896.db2.gz LTBAIQAGGRSTOR-UHFFFAOYSA-N 2 1 345.918 4.440 20 0 EIADMP Cc1cc(C)cc(OCCC[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1 ZINC000590819067 1037183479 /nfs/dbraw/zinc/18/34/79/1037183479.db2.gz YADLPBQBNGTYDT-UHFFFAOYSA-N 2 1 332.532 4.125 20 0 EIADMP FC(F)Sc1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000272760399 1037286015 /nfs/dbraw/zinc/28/60/15/1037286015.db2.gz PGDRLFWMPPBTNU-UHFFFAOYSA-N 2 1 326.456 4.108 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CS1 ZINC000488443204 1037585073 /nfs/dbraw/zinc/58/50/73/1037585073.db2.gz GBHCYMLENCFRKE-LAQRGFTBSA-N 2 1 338.586 4.251 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CS1 ZINC000488443204 1037585089 /nfs/dbraw/zinc/58/50/89/1037585089.db2.gz GBHCYMLENCFRKE-LAQRGFTBSA-N 2 1 338.586 4.251 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CS[C@H](C(C)(C)C)C2)cc1F ZINC000488434019 1037592829 /nfs/dbraw/zinc/59/28/29/1037592829.db2.gz IITDCFVMKQOGRM-QAPCUYQASA-N 2 1 347.503 4.330 20 0 EIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CS1 ZINC000488434581 1037593566 /nfs/dbraw/zinc/59/35/66/1037593566.db2.gz JEAZSXIEQXQFOE-ZCNNSNEGSA-N 2 1 346.584 4.061 20 0 EIADMP C/C(=C\c1ccccc1)C[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000488459046 1037600519 /nfs/dbraw/zinc/60/05/19/1037600519.db2.gz NCNAKZCMSKCHLL-VVMUCNELSA-N 2 1 334.507 4.244 20 0 EIADMP Cc1cc(C)c(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)c(C)c1 ZINC000488571534 1037669296 /nfs/dbraw/zinc/66/92/96/1037669296.db2.gz STTYPOQFVNSGBI-JOCHJYFZSA-N 2 1 336.523 4.266 20 0 EIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H]2CCc3ccccc3C2)CC1 ZINC000573965418 1037796449 /nfs/dbraw/zinc/79/64/49/1037796449.db2.gz VCXFEIMBSRIZLL-GOSISDBHSA-N 2 1 336.479 4.038 20 0 EIADMP CCN(CC)[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)c1ccsc1 ZINC000422868783 1037856298 /nfs/dbraw/zinc/85/62/98/1037856298.db2.gz WAUGUVVCDYFZMO-IYWMVGAKSA-N 2 1 349.588 4.031 20 0 EIADMP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000422871101 1037858693 /nfs/dbraw/zinc/85/86/93/1037858693.db2.gz ZTNKZTZETRYJIZ-ZFWWWQNUSA-N 2 1 341.480 4.034 20 0 EIADMP Clc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000422937841 1037875556 /nfs/dbraw/zinc/87/55/56/1037875556.db2.gz CUYJBJOIXGCIRF-YSIASYRMSA-N 2 1 326.871 4.410 20 0 EIADMP CC[N@@H+](Cc1ccc(-c2ccccc2OC)cc1)[C@H]1CCC[NH2+]CC1 ZINC000414712454 1037910722 /nfs/dbraw/zinc/91/07/22/1037910722.db2.gz IXUMQCMFGMCKFO-FQEVSTJZSA-N 2 1 338.495 4.326 20 0 EIADMP Fc1ccc(CCCC[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1F ZINC000423045288 1037926697 /nfs/dbraw/zinc/92/66/97/1037926697.db2.gz BXLISVLCYHSWJM-WIYYLYMNSA-N 2 1 344.449 4.370 20 0 EIADMP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423093425 1037954253 /nfs/dbraw/zinc/95/42/53/1037954253.db2.gz HKTDJSRNZAWWBY-GALXQHASSA-N 2 1 328.887 4.134 20 0 EIADMP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]C1CC(c2ccc(F)c(Cl)c2)C1 ZINC000423094865 1037954464 /nfs/dbraw/zinc/95/44/64/1037954464.db2.gz CXCWWUBUCLDGQJ-UHYDZXOVSA-N 2 1 346.877 4.273 20 0 EIADMP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)c1 ZINC000423103033 1037963961 /nfs/dbraw/zinc/96/39/61/1037963961.db2.gz XJCLKYUGIRMILD-OTNPHJDUSA-N 2 1 342.433 4.294 20 0 EIADMP Clc1cccc([C@H]2CC[C@@H]([NH2+]CCC[NH2+]Cc3cccnc3)C2)c1 ZINC000423191779 1038044985 /nfs/dbraw/zinc/04/49/85/1038044985.db2.gz TYPBVVVFUXXWPC-AZUAARDMSA-N 2 1 343.902 4.141 20 0 EIADMP [NH3+]C[C@H]([NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C1CC1 ZINC000423284209 1038093136 /nfs/dbraw/zinc/09/31/36/1038093136.db2.gz WQEHQIBQDKDWQT-ZBFHGGJFSA-N 2 1 347.915 4.168 20 0 EIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423331019 1038144583 /nfs/dbraw/zinc/14/45/83/1038144583.db2.gz UNUBPZSXZYJCON-BMIGLBTASA-N 2 1 335.904 4.160 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000423385005 1038193927 /nfs/dbraw/zinc/19/39/27/1038193927.db2.gz QTDRODSTLWSJGN-IPYPFGDCSA-N 2 1 334.410 4.232 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1csc(-c2ccccc2)n1 ZINC000423391693 1038199238 /nfs/dbraw/zinc/19/92/38/1038199238.db2.gz POQSKGVADZRXDB-AWEZNQCLSA-N 2 1 335.476 4.264 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)cc1 ZINC000423437738 1038235323 /nfs/dbraw/zinc/23/53/23/1038235323.db2.gz GOCPZMUADDDYCY-INIZCTEOSA-N 2 1 346.478 4.390 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)cc1 ZINC000423437739 1038236462 /nfs/dbraw/zinc/23/64/62/1038236462.db2.gz GOCPZMUADDDYCY-MRXNPFEDSA-N 2 1 346.478 4.390 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)o1 ZINC000423476150 1038249113 /nfs/dbraw/zinc/24/91/13/1038249113.db2.gz QTBNNGXPVXAHLY-SIXWZSSISA-N 2 1 330.447 4.025 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423512029 1038270860 /nfs/dbraw/zinc/27/08/60/1038270860.db2.gz UFQIKIJLTMIGEE-VGSWGCGISA-N 3 1 348.494 4.312 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)CC[N@H+]1C ZINC000608061541 1038442421 /nfs/dbraw/zinc/44/24/21/1038442421.db2.gz JLQCDGZVCNUQEF-WIYYLYMNSA-N 2 1 347.506 4.262 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC[N@H+]1C ZINC000608061500 1038442785 /nfs/dbraw/zinc/44/27/85/1038442785.db2.gz WIQARCLZVWEGLI-KDOFPFPSSA-N 2 1 346.421 4.329 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](Cc2ccncc2)c2cccs2)C1 ZINC000424311946 1038797422 /nfs/dbraw/zinc/79/74/22/1038797422.db2.gz LNZKKMFZBSLTNU-MOPGFXCFSA-N 2 1 343.540 4.137 20 0 EIADMP COc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c(C)c1 ZINC000539062448 1038807765 /nfs/dbraw/zinc/80/77/65/1038807765.db2.gz YYHSKXHOXIWKKN-XMSQKQJNSA-N 2 1 338.495 4.004 20 0 EIADMP COc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c(C)c1 ZINC000539062446 1038808251 /nfs/dbraw/zinc/80/82/51/1038808251.db2.gz YYHSKXHOXIWKKN-GCJKJVERSA-N 2 1 338.495 4.004 20 0 EIADMP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H]3CCCC[C@H]3[NH3+])s2)cc1 ZINC000424380633 1038839017 /nfs/dbraw/zinc/83/90/17/1038839017.db2.gz XHIRJFHRBSGOFB-JCURWCKSSA-N 2 1 345.512 4.048 20 0 EIADMP CC(C)(C[NH2+]Cc1cnc(-c2ccccc2)s1)C[NH+]1CCCC1 ZINC000480928165 1038877105 /nfs/dbraw/zinc/87/71/05/1038877105.db2.gz BKOOTVMKJWEGAY-UHFFFAOYSA-N 2 1 329.513 4.022 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1ccccc1F)C1CCCC1 ZINC000539218454 1038888096 /nfs/dbraw/zinc/88/80/96/1038888096.db2.gz USLBIANKHZDXGM-MGPUTAFESA-N 2 1 329.463 4.488 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000462104071 1038908536 /nfs/dbraw/zinc/90/85/36/1038908536.db2.gz JONLIIFIIAHOBE-OIBXWCBGSA-N 2 1 336.523 4.303 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)CC[N@H+]1C ZINC000462104071 1038908547 /nfs/dbraw/zinc/90/85/47/1038908547.db2.gz JONLIIFIIAHOBE-OIBXWCBGSA-N 2 1 336.523 4.303 20 0 EIADMP FC(F)(F)CC[NH2+][C@@H]1CCCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000552042738 1039061262 /nfs/dbraw/zinc/06/12/62/1039061262.db2.gz ZPCDSZWSWVOHKW-FGTMMUONSA-N 2 1 340.433 4.219 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)[C@@H]2CCC[C@@H]21 ZINC000552057360 1039076668 /nfs/dbraw/zinc/07/66/68/1039076668.db2.gz QDNPBNQPRRABEN-WDSOQIARSA-N 2 1 328.431 4.048 20 0 EIADMP CSc1ccccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000481187266 1039090056 /nfs/dbraw/zinc/09/00/56/1039090056.db2.gz ZAKFLJTZFYBXGZ-YLJYHZDGSA-N 2 1 340.536 4.409 20 0 EIADMP COC1CCC([N@H+](C)CC(C)(C)C[NH+](C)Cc2ccccc2)CC1 ZINC000537630215 1039172490 /nfs/dbraw/zinc/17/24/90/1039172490.db2.gz MNXRXOAUDAKZPG-UHFFFAOYSA-N 2 1 332.532 4.034 20 0 EIADMP COC1CCC([N@@H+](C)CC(C)(C)C[NH+](C)Cc2ccccc2)CC1 ZINC000537630215 1039172508 /nfs/dbraw/zinc/17/25/08/1039172508.db2.gz MNXRXOAUDAKZPG-UHFFFAOYSA-N 2 1 332.532 4.034 20 0 EIADMP COC1CCC([NH+](C)CC(C)(C)C[N@H+](C)Cc2ccccc2)CC1 ZINC000537630215 1039172546 /nfs/dbraw/zinc/17/25/46/1039172546.db2.gz MNXRXOAUDAKZPG-UHFFFAOYSA-N 2 1 332.532 4.034 20 0 EIADMP COC1CCC([NH+](C)CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC000537630215 1039172573 /nfs/dbraw/zinc/17/25/73/1039172573.db2.gz MNXRXOAUDAKZPG-UHFFFAOYSA-N 2 1 332.532 4.034 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000120708634 1039210405 /nfs/dbraw/zinc/21/04/05/1039210405.db2.gz CCOSFDMZSMRWSZ-ZDUSSCGKSA-N 2 1 330.394 4.110 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccccc1OC(F)F ZINC000477917853 1039229367 /nfs/dbraw/zinc/22/93/67/1039229367.db2.gz UQQDHJSUPSPBJT-AWEZNQCLSA-N 2 1 326.431 4.061 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2OC(F)F)C1 ZINC000481296916 1039235698 /nfs/dbraw/zinc/23/56/98/1039235698.db2.gz BDIMYOLMVBQDEG-LSDHHAIUSA-N 2 1 348.437 4.434 20 0 EIADMP CCOCCC1(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000090722734 1039293780 /nfs/dbraw/zinc/29/37/80/1039293780.db2.gz JXQONRXWLNAKNA-MRXNPFEDSA-N 2 1 327.472 4.038 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cccc(OC(F)(F)F)c1 ZINC000481433659 1039423332 /nfs/dbraw/zinc/42/33/32/1039423332.db2.gz JCMWVDOEQIIZAJ-CYBMUJFWSA-N 2 1 342.405 4.253 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)CCOc2c(Cl)cccc2Cl)CC1 ZINC000514009583 1039458577 /nfs/dbraw/zinc/45/85/77/1039458577.db2.gz INLYCMASCBXSDZ-UHFFFAOYSA-N 2 1 345.314 4.177 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCOc2c(Cl)cccc2Cl)CC1 ZINC000514009583 1039458623 /nfs/dbraw/zinc/45/86/23/1039458623.db2.gz INLYCMASCBXSDZ-UHFFFAOYSA-N 2 1 345.314 4.177 20 0 EIADMP C[N@H+](C[C@H]1CCCC(F)(F)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000514074979 1039556832 /nfs/dbraw/zinc/55/68/32/1039556832.db2.gz XQQVDCGHCXAUBF-SFHVURJKSA-N 2 1 336.470 4.408 20 0 EIADMP C[N@@H+](C[C@H]1CCCC(F)(F)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000514074979 1039556854 /nfs/dbraw/zinc/55/68/54/1039556854.db2.gz XQQVDCGHCXAUBF-SFHVURJKSA-N 2 1 336.470 4.408 20 0 EIADMP CCC[N@@H+](Cc1cccs1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000093417542 1039684877 /nfs/dbraw/zinc/68/48/77/1039684877.db2.gz XNBAKHXJKAHVBT-UHFFFAOYSA-N 2 1 344.528 4.036 20 0 EIADMP CCC[N@H+](Cc1cccs1)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000093417542 1039684922 /nfs/dbraw/zinc/68/49/22/1039684922.db2.gz XNBAKHXJKAHVBT-UHFFFAOYSA-N 2 1 344.528 4.036 20 0 EIADMP CCC[N@@H+](Cc1cccs1)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000093417542 1039684954 /nfs/dbraw/zinc/68/49/54/1039684954.db2.gz XNBAKHXJKAHVBT-UHFFFAOYSA-N 2 1 344.528 4.036 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CCc2csc(C)n2)CC1)CC(C)C ZINC000552641720 1039725807 /nfs/dbraw/zinc/72/58/07/1039725807.db2.gz YRNUZDIDLTZOHB-UHFFFAOYSA-N 2 1 337.577 4.074 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)C(c1ccccc1)c1ccccc1 ZINC000122851689 1039798365 /nfs/dbraw/zinc/79/83/65/1039798365.db2.gz QYVVJOQPVXEYNF-GOSISDBHSA-N 2 1 334.507 4.423 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCc2ccccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000505465511 1039803758 /nfs/dbraw/zinc/80/37/58/1039803758.db2.gz VRNJWMOSSZGMJE-VLCRHTCISA-N 2 1 334.507 4.217 20 0 EIADMP COc1ccc2ccccc2c1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000537647606 1039805969 /nfs/dbraw/zinc/80/59/69/1039805969.db2.gz UUJYJCPSXSKQEU-GOSISDBHSA-N 2 1 338.495 4.156 20 0 EIADMP C[C@@H](c1ccc(F)cc1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434689073 1039812706 /nfs/dbraw/zinc/81/27/06/1039812706.db2.gz SSOSIFOSHRPMHL-HNNXBMFYSA-N 2 1 327.447 4.299 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000430115486 1039851999 /nfs/dbraw/zinc/85/19/99/1039851999.db2.gz BFGYMFMUZONHCK-VHUCWBOISA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000430115486 1039852002 /nfs/dbraw/zinc/85/20/02/1039852002.db2.gz BFGYMFMUZONHCK-VHUCWBOISA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000430115486 1039852003 /nfs/dbraw/zinc/85/20/03/1039852003.db2.gz BFGYMFMUZONHCK-VHUCWBOISA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000430115486 1039852004 /nfs/dbraw/zinc/85/20/04/1039852004.db2.gz BFGYMFMUZONHCK-VHUCWBOISA-N 2 1 338.417 4.136 20 0 EIADMP CN1CC[C@@H]([NH2+]Cc2ccccc2OC(F)F)C[C@H]1c1ccccc1 ZINC000550990265 1039855620 /nfs/dbraw/zinc/85/56/20/1039855620.db2.gz FZBNQKFQXNIYJC-MSOLQXFVSA-N 2 1 346.421 4.213 20 0 EIADMP C[C@H](COc1cccc(F)c1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000551008626 1039860818 /nfs/dbraw/zinc/86/08/18/1039860818.db2.gz YLIHBXHXVGQXAU-OZOXKJRCSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](COc1cccc(F)c1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000551008626 1039860820 /nfs/dbraw/zinc/86/08/20/1039860820.db2.gz YLIHBXHXVGQXAU-OZOXKJRCSA-N 2 1 342.458 4.018 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000534955300 1039868185 /nfs/dbraw/zinc/86/81/85/1039868185.db2.gz OQRYNTMQTRULEF-INIZCTEOSA-N 2 1 340.496 4.071 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000534955300 1039868186 /nfs/dbraw/zinc/86/81/86/1039868186.db2.gz OQRYNTMQTRULEF-INIZCTEOSA-N 2 1 340.496 4.071 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc(F)cc3)CC2)C[C@H]1c1ccccc1 ZINC000551006694 1039869280 /nfs/dbraw/zinc/86/92/80/1039869280.db2.gz IISIIFPBGRWMBW-RTWAWAEBSA-N 2 1 338.470 4.282 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(c3ccc(F)cc3)CC2)C[C@H]1c1ccccc1 ZINC000551006694 1039869284 /nfs/dbraw/zinc/86/92/84/1039869284.db2.gz IISIIFPBGRWMBW-RTWAWAEBSA-N 2 1 338.470 4.282 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)Oc1ccc(F)cc1 ZINC000551051662 1039923211 /nfs/dbraw/zinc/92/32/11/1039923211.db2.gz PTKPCQOFSCGTSC-LKUPVBHCSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)Oc1ccc(F)cc1 ZINC000551051662 1039923232 /nfs/dbraw/zinc/92/32/32/1039923232.db2.gz PTKPCQOFSCGTSC-LKUPVBHCSA-N 2 1 342.458 4.018 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2nc3ccccc3n2CC)CC1 ZINC000535067177 1039933846 /nfs/dbraw/zinc/93/38/46/1039933846.db2.gz KMVGDTGKVOBGAU-UHFFFAOYSA-N 2 1 342.531 4.000 20 0 EIADMP CCC(CC)[C@H](CC[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)OC ZINC000551087464 1039971919 /nfs/dbraw/zinc/97/19/19/1039971919.db2.gz RPWICWWETKKLHR-ACRUOGEOSA-N 2 1 332.532 4.253 20 0 EIADMP CCC(CC)[C@H](CC[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)OC ZINC000551087464 1039971951 /nfs/dbraw/zinc/97/19/51/1039971951.db2.gz RPWICWWETKKLHR-ACRUOGEOSA-N 2 1 332.532 4.253 20 0 EIADMP C[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1ccccc1 ZINC000482219344 1040077334 /nfs/dbraw/zinc/07/73/34/1040077334.db2.gz BHCAFWLQTMUHAY-HXUWFJFHSA-N 2 1 336.523 4.162 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)[C@]1(C)CCCO1 ZINC000551268552 1040132167 /nfs/dbraw/zinc/13/21/67/1040132167.db2.gz XYHOSQDLBSAECN-LQWHRVPQSA-N 2 1 330.516 4.108 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)Cc3ccc(C)nc3C)C2)s1 ZINC000514734037 1040197017 /nfs/dbraw/zinc/19/70/17/1040197017.db2.gz XZHHUNJNBAZMDY-GOSISDBHSA-N 2 1 343.540 4.022 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)Cc3ccc(C)nc3C)C2)s1 ZINC000514734037 1040197024 /nfs/dbraw/zinc/19/70/24/1040197024.db2.gz XZHHUNJNBAZMDY-GOSISDBHSA-N 2 1 343.540 4.022 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)Cc3ccc(C)nc3C)C2)s1 ZINC000514734037 1040197033 /nfs/dbraw/zinc/19/70/33/1040197033.db2.gz XZHHUNJNBAZMDY-GOSISDBHSA-N 2 1 343.540 4.022 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)Cc3ccc(C)nc3C)C2)s1 ZINC000514734037 1040197042 /nfs/dbraw/zinc/19/70/42/1040197042.db2.gz XZHHUNJNBAZMDY-GOSISDBHSA-N 2 1 343.540 4.022 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)o1 ZINC000482448900 1040258720 /nfs/dbraw/zinc/25/87/20/1040258720.db2.gz GQIXKWCNAKXNBD-MJGOQNOKSA-N 2 1 326.484 4.057 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)o1 ZINC000482448900 1040258739 /nfs/dbraw/zinc/25/87/39/1040258739.db2.gz GQIXKWCNAKXNBD-MJGOQNOKSA-N 2 1 326.484 4.057 20 0 EIADMP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482455387 1040267263 /nfs/dbraw/zinc/26/72/63/1040267263.db2.gz YMTMZFLTWBKIGT-OFNKIYASSA-N 2 1 334.507 4.137 20 0 EIADMP Cc1ccc(O[C@H](C)C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000565670190 1040295078 /nfs/dbraw/zinc/29/50/78/1040295078.db2.gz JFEHZXADLMEUNC-UZKOGDIHSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1ccc(O[C@H](C)C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000565670190 1040295094 /nfs/dbraw/zinc/29/50/94/1040295094.db2.gz JFEHZXADLMEUNC-UZKOGDIHSA-N 2 1 338.495 4.187 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000479461030 1040370350 /nfs/dbraw/zinc/37/03/50/1040370350.db2.gz AQMLGMKUMBHULA-WIYYLYMNSA-N 2 1 341.474 4.030 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000479461030 1040370368 /nfs/dbraw/zinc/37/03/68/1040370368.db2.gz AQMLGMKUMBHULA-WIYYLYMNSA-N 2 1 341.474 4.030 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccccc1Sc1ccccc1 ZINC000482644973 1040405406 /nfs/dbraw/zinc/40/54/06/1040405406.db2.gz VIZZZKYHZZISFR-VQIMIIECSA-N 2 1 326.509 4.268 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccccc1Sc1ccccc1 ZINC000482644973 1040405426 /nfs/dbraw/zinc/40/54/26/1040405426.db2.gz VIZZZKYHZZISFR-VQIMIIECSA-N 2 1 326.509 4.268 20 0 EIADMP C[C@H]([NH2+]C1CC(N2CCCCC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000479527245 1040424044 /nfs/dbraw/zinc/42/40/44/1040424044.db2.gz NFWMCNIJZRHGCD-JEYLPNPQSA-N 2 1 342.405 4.253 20 0 EIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000479527245 1040424053 /nfs/dbraw/zinc/42/40/53/1040424053.db2.gz NFWMCNIJZRHGCD-JEYLPNPQSA-N 2 1 342.405 4.253 20 0 EIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(Br)c1 ZINC000479514897 1040431429 /nfs/dbraw/zinc/43/14/29/1040431429.db2.gz XKYCNXFSNVMOSE-IGEOTXOUSA-N 2 1 337.305 4.117 20 0 EIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](CCCc4ccncc4)CC[C@H]32)cc1 ZINC000462314228 1040474014 /nfs/dbraw/zinc/47/40/14/1040474014.db2.gz JBUAKLCMTLYAFJ-XZOQPEGZSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](CCCc4ccncc4)CC[C@H]32)cc1 ZINC000462314228 1040474025 /nfs/dbraw/zinc/47/40/25/1040474025.db2.gz JBUAKLCMTLYAFJ-XZOQPEGZSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](CCCc4ccncc4)CC[C@H]32)cc1 ZINC000462314228 1040474035 /nfs/dbraw/zinc/47/40/35/1040474035.db2.gz JBUAKLCMTLYAFJ-XZOQPEGZSA-N 2 1 349.522 4.001 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCc4ccc(Cl)cc43)CC2)[nH+]c1 ZINC000479579003 1040488536 /nfs/dbraw/zinc/48/85/36/1040488536.db2.gz MTHXNZMOVUCKOK-LJQANCHMSA-N 2 1 341.886 4.289 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(-c2ccc(F)cc2)s1 ZINC000539507852 1040499825 /nfs/dbraw/zinc/49/98/25/1040499825.db2.gz QMANIGYGNLUUIW-CQSZACIVSA-N 2 1 330.472 4.467 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CCCc2ccncc2)CC1)CC(C)C ZINC000462349385 1040507065 /nfs/dbraw/zinc/50/70/65/1040507065.db2.gz SALNKYFEBSHKSD-UHFFFAOYSA-N 2 1 331.548 4.094 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(F)c1F ZINC000539546538 1040534185 /nfs/dbraw/zinc/53/41/85/1040534185.db2.gz QXHPFYWFPKHXKL-WMZOPIPTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc(F)c1F ZINC000539546538 1040534197 /nfs/dbraw/zinc/53/41/97/1040534197.db2.gz QXHPFYWFPKHXKL-WMZOPIPTSA-N 2 1 344.449 4.180 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cccc(C)c2C)[C@H](C)C1 ZINC000483124220 1040720366 /nfs/dbraw/zinc/72/03/66/1040720366.db2.gz GJCOTELRKQFGFP-QFUCXCTJSA-N 2 1 332.532 4.091 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(C)c2C)[C@H](C)C1 ZINC000483124218 1040720565 /nfs/dbraw/zinc/72/05/65/1040720565.db2.gz GJCOTELRKQFGFP-LMNJBCLMSA-N 2 1 332.532 4.091 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccc(F)cn1 ZINC000491282258 1040752806 /nfs/dbraw/zinc/75/28/06/1040752806.db2.gz DWNDGNDPCWAHJC-HXUWFJFHSA-N 2 1 341.474 4.448 20 0 EIADMP C[N@@H+](Cc1ccnn1-c1cc[nH+]cc1)[C@H]1CCC[C@H]1c1ccccc1 ZINC000668235280 1040819956 /nfs/dbraw/zinc/81/99/56/1040819956.db2.gz HRDSXDUIDXKPBP-SFTDATJTSA-N 2 1 332.451 4.035 20 0 EIADMP CCC[N@H+](C[C@@H]1CC=CCC1)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000539829594 1040824647 /nfs/dbraw/zinc/82/46/47/1040824647.db2.gz OLKQOUKTIUWNSK-LJQANCHMSA-N 2 1 342.531 4.131 20 0 EIADMP CCC[N@@H+](C[C@@H]1CC=CCC1)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000539829594 1040824653 /nfs/dbraw/zinc/82/46/53/1040824653.db2.gz OLKQOUKTIUWNSK-LJQANCHMSA-N 2 1 342.531 4.131 20 0 EIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000539836092 1040831855 /nfs/dbraw/zinc/83/18/55/1040831855.db2.gz REOWYFZJTNBEKD-GOSISDBHSA-N 2 1 346.906 4.036 20 0 EIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000539836092 1040831857 /nfs/dbraw/zinc/83/18/57/1040831857.db2.gz REOWYFZJTNBEKD-GOSISDBHSA-N 2 1 346.906 4.036 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000539836092 1040831861 /nfs/dbraw/zinc/83/18/61/1040831861.db2.gz REOWYFZJTNBEKD-GOSISDBHSA-N 2 1 346.906 4.036 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000539836092 1040831871 /nfs/dbraw/zinc/83/18/71/1040831871.db2.gz REOWYFZJTNBEKD-GOSISDBHSA-N 2 1 346.906 4.036 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccccc2F)C2CCOCC2)C1 ZINC000903090960 1040899581 /nfs/dbraw/zinc/89/95/81/1040899581.db2.gz KAKOUIHRIQXDMR-LAUBAEHRSA-N 2 1 348.506 4.003 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@H](C)[N@@H+]2CCC[C@H](C)C2)C1 ZINC000467341011 1040901695 /nfs/dbraw/zinc/90/16/95/1040901695.db2.gz BJNMISQDZKNWBF-FFGOWVMKSA-N 2 1 329.532 4.126 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@H](C)[N@H+]2CCC[C@H](C)C2)C1 ZINC000467341011 1040901714 /nfs/dbraw/zinc/90/17/14/1040901714.db2.gz BJNMISQDZKNWBF-FFGOWVMKSA-N 2 1 329.532 4.126 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)C1CC(F)(F)C1 ZINC000898519774 1040974494 /nfs/dbraw/zinc/97/44/94/1040974494.db2.gz RBKNZMMVEHXVCZ-ZNWBIBPKSA-N 2 1 348.481 4.311 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)c1ccccn1 ZINC000898523031 1040978085 /nfs/dbraw/zinc/97/80/85/1040978085.db2.gz XLSSUQWYBOFJTM-FYZZASKESA-N 2 1 335.495 4.033 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000379740221 1040991328 /nfs/dbraw/zinc/99/13/28/1040991328.db2.gz HWPIKSPXGYGELJ-NQIIRXRSSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(SCC(F)F)cc1 ZINC000483735973 1040991775 /nfs/dbraw/zinc/99/17/75/1040991775.db2.gz XOWGQNLGAYOVEB-YDHLFZDLSA-N 2 1 328.472 4.177 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(SCC(F)F)cc1 ZINC000483735973 1040991801 /nfs/dbraw/zinc/99/18/01/1040991801.db2.gz XOWGQNLGAYOVEB-YDHLFZDLSA-N 2 1 328.472 4.177 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CCN1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000425503117 1041016134 /nfs/dbraw/zinc/01/61/34/1041016134.db2.gz INJYSRSJDPJFIH-QGZVFWFLSA-N 2 1 347.572 4.076 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000425503117 1041016171 /nfs/dbraw/zinc/01/61/71/1041016171.db2.gz INJYSRSJDPJFIH-QGZVFWFLSA-N 2 1 347.572 4.076 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Sc2ccc(F)cc2)cc1 ZINC000538097059 1041045069 /nfs/dbraw/zinc/04/50/69/1041045069.db2.gz OHMYDKFSQMEMBG-YWZLYKJASA-N 2 1 344.499 4.407 20 0 EIADMP C[N@H+]1CCC[C@H](CNc2cc[nH+]c3ccccc23)[C@H]1c1cccs1 ZINC000462880167 1041061803 /nfs/dbraw/zinc/06/18/03/1041061803.db2.gz AYCYIJGZNYDHIW-QRWLVFNGSA-N 2 1 337.492 4.213 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@H](C)C1 ZINC000436317365 1041086913 /nfs/dbraw/zinc/08/69/13/1041086913.db2.gz UZEUBPKAFHZRKB-UWIFEVILSA-N 2 1 340.433 4.271 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000540150155 1041199320 /nfs/dbraw/zinc/19/93/20/1041199320.db2.gz CBIUQHJIFFEVLH-CVEARBPZSA-N 2 1 340.458 4.307 20 0 EIADMP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000540168898 1041211572 /nfs/dbraw/zinc/21/15/72/1041211572.db2.gz OGPHYEDRTBKTFI-KBPBESRZSA-N 2 1 335.879 4.231 20 0 EIADMP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000540168904 1041211936 /nfs/dbraw/zinc/21/19/36/1041211936.db2.gz OGPHYEDRTBKTFI-ZIAGYGMSSA-N 2 1 335.879 4.231 20 0 EIADMP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+]2C)cc1 ZINC000538259735 1041220866 /nfs/dbraw/zinc/22/08/66/1041220866.db2.gz NEMQVUHNXZRIPY-YLJYHZDGSA-N 2 1 338.495 4.497 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)c1c(F)cccc1Cl ZINC000540188951 1041230511 /nfs/dbraw/zinc/23/05/11/1041230511.db2.gz MXWPAJHLSJZFEN-WWGRRREGSA-N 2 1 326.887 4.075 20 0 EIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000538406156 1041302045 /nfs/dbraw/zinc/30/20/45/1041302045.db2.gz REOVHNPVSRTUFC-SFHVURJKSA-N 2 1 336.479 4.178 20 0 EIADMP CC[C@H](Cc1ccccc1)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463114264 1041340224 /nfs/dbraw/zinc/34/02/24/1041340224.db2.gz DYVMILLDKJIQRV-JOCHJYFZSA-N 2 1 336.523 4.304 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)Oc1ccccc1 ZINC000463117279 1041358447 /nfs/dbraw/zinc/35/84/47/1041358447.db2.gz GRKOXHYCYUAQKA-SBHAEUEKSA-N 2 1 338.495 4.097 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)Oc1ccccc1 ZINC000463117279 1041358454 /nfs/dbraw/zinc/35/84/54/1041358454.db2.gz GRKOXHYCYUAQKA-SBHAEUEKSA-N 2 1 338.495 4.097 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463159993 1041377541 /nfs/dbraw/zinc/37/75/41/1041377541.db2.gz IHEGZSXNECBPDX-GMAHTHKFSA-N 2 1 349.522 4.424 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCC[C@@H]1Oc1ccccc1C ZINC000484635017 1041380127 /nfs/dbraw/zinc/38/01/27/1041380127.db2.gz HZMYEPHQCJGKFY-FPOVZHCZSA-N 2 1 341.499 4.260 20 0 EIADMP COc1cc([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+]2C)ccc1OC1CCCC1 ZINC000540352022 1041391214 /nfs/dbraw/zinc/39/12/14/1041391214.db2.gz KZDFSQHVDZVDHQ-WMZOPIPTSA-N 2 1 346.515 4.152 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)ccc1F ZINC000463194647 1041410340 /nfs/dbraw/zinc/41/03/40/1041410340.db2.gz VVMFOPRRRRWGJI-GOSISDBHSA-N 2 1 340.486 4.492 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)CC[N@@H+]1Cc1ccccc1 ZINC000463205211 1041420118 /nfs/dbraw/zinc/42/01/18/1041420118.db2.gz LUZZSRDFVNUKQF-JWXLPAKVSA-N 2 1 346.518 4.215 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)CC[N@H+]1Cc1ccccc1 ZINC000463205211 1041420124 /nfs/dbraw/zinc/42/01/24/1041420124.db2.gz LUZZSRDFVNUKQF-JWXLPAKVSA-N 2 1 346.518 4.215 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000463207403 1041420254 /nfs/dbraw/zinc/42/02/54/1041420254.db2.gz SQVYGBXETXBYRB-NQIIRXRSSA-N 2 1 338.495 4.146 20 0 EIADMP CC(C)[NH+](CCCN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000463208586 1041420432 /nfs/dbraw/zinc/42/04/32/1041420432.db2.gz XOVOXKNCPMLHOB-IFMALSPDSA-N 2 1 345.575 4.138 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000287312956 1041421357 /nfs/dbraw/zinc/42/13/57/1041421357.db2.gz LIMKKRDSAWGCDW-BQFCYCMXSA-N 2 1 325.456 4.007 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000287312956 1041421366 /nfs/dbraw/zinc/42/13/66/1041421366.db2.gz LIMKKRDSAWGCDW-BQFCYCMXSA-N 2 1 325.456 4.007 20 0 EIADMP COc1cc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1OC ZINC000480611634 1041422442 /nfs/dbraw/zinc/42/24/42/1041422442.db2.gz OPJGOJUXXAZOIY-SJLPKXTDSA-N 2 1 348.531 4.175 20 0 EIADMP COc1cc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1OC ZINC000480615272 1041425325 /nfs/dbraw/zinc/42/53/25/1041425325.db2.gz RJIVUKVWIWPNBP-QZTJIDSGSA-N 2 1 348.531 4.317 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904337677 1041431364 /nfs/dbraw/zinc/43/13/64/1041431364.db2.gz DQJXSNHXMJNNQU-YQQAZPJKSA-N 2 1 329.513 4.157 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OCC(C)C)c(OC)c2)CC1 ZINC000540406456 1041436910 /nfs/dbraw/zinc/43/69/10/1041436910.db2.gz AZSUQUWPZBELAP-KRWDZBQOSA-N 2 1 348.531 4.255 20 0 EIADMP CC(C)(C)OCCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000554843882 1041443532 /nfs/dbraw/zinc/44/35/32/1041443532.db2.gz QTVLKKSMTPGDGV-FQEVSTJZSA-N 2 1 346.559 4.472 20 0 EIADMP CC(C)(C)OCCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000554843882 1041443541 /nfs/dbraw/zinc/44/35/41/1041443541.db2.gz QTVLKKSMTPGDGV-FQEVSTJZSA-N 2 1 346.559 4.472 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1N(C)C ZINC000480634114 1041446774 /nfs/dbraw/zinc/44/67/74/1041446774.db2.gz ZMQNUJHQHXWMSA-SJORKVTESA-N 2 1 335.511 4.054 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Br)cc2C)C[C@H]1C ZINC000538718056 1041487174 /nfs/dbraw/zinc/48/71/74/1041487174.db2.gz RUEVPYXSJWBQJQ-RHSMWYFYSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Br)cc2C)C[C@H]1C ZINC000538718056 1041487177 /nfs/dbraw/zinc/48/71/77/1041487177.db2.gz RUEVPYXSJWBQJQ-RHSMWYFYSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Br)cc2C)C[C@H]1C ZINC000538718056 1041487182 /nfs/dbraw/zinc/48/71/82/1041487182.db2.gz RUEVPYXSJWBQJQ-RHSMWYFYSA-N 2 1 339.321 4.062 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463290710 1041490069 /nfs/dbraw/zinc/49/00/69/1041490069.db2.gz UCUIYQRKXLVBKS-GBAJDQEWSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463290710 1041490073 /nfs/dbraw/zinc/49/00/73/1041490073.db2.gz UCUIYQRKXLVBKS-GBAJDQEWSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc(C2CC2)s1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000538704663 1041495450 /nfs/dbraw/zinc/49/54/50/1041495450.db2.gz VTZKZYYHOUOBFC-CRAIPNDOSA-N 2 1 341.524 4.021 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc(C2CC2)s1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000538704663 1041495456 /nfs/dbraw/zinc/49/54/56/1041495456.db2.gz VTZKZYYHOUOBFC-CRAIPNDOSA-N 2 1 341.524 4.021 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1c(F)cccc1F ZINC000402035876 1041514356 /nfs/dbraw/zinc/51/43/56/1041514356.db2.gz CYEQTXKRDYQTRO-KKSFZXQISA-N 2 1 344.449 4.008 20 0 EIADMP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000540708396 1041607362 /nfs/dbraw/zinc/60/73/62/1041607362.db2.gz WMIAPMCCSXQCHM-LGYWMIHWSA-N 2 1 330.516 4.182 20 0 EIADMP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000540708396 1041607365 /nfs/dbraw/zinc/60/73/65/1041607365.db2.gz WMIAPMCCSXQCHM-LGYWMIHWSA-N 2 1 330.516 4.182 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)[C@@H](C)C1 ZINC000437073874 1041625245 /nfs/dbraw/zinc/62/52/45/1041625245.db2.gz HOMIJMQEDIWFMD-WMLDXEAASA-N 2 1 340.433 4.057 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000437083239 1041629552 /nfs/dbraw/zinc/62/95/52/1041629552.db2.gz OOTMJGSTEMRRPP-KRWDZBQOSA-N 2 1 328.422 4.218 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]C[C@@H]3CCCCS3)CC23CC3)cc1 ZINC000516768834 1041746177 /nfs/dbraw/zinc/74/61/77/1041746177.db2.gz ACYRYYNFDMBVDW-MOPGFXCFSA-N 2 1 330.541 4.059 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]C[C@@H]3CCCCS3)CC23CC3)cc1 ZINC000516768834 1041746183 /nfs/dbraw/zinc/74/61/83/1041746183.db2.gz ACYRYYNFDMBVDW-MOPGFXCFSA-N 2 1 330.541 4.059 20 0 EIADMP Fc1ccccc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000516969843 1041825541 /nfs/dbraw/zinc/82/55/41/1041825541.db2.gz KKYQUFODOBGIIY-FQEVSTJZSA-N 2 1 338.470 4.155 20 0 EIADMP Fc1ccccc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000516969843 1041825544 /nfs/dbraw/zinc/82/55/44/1041825544.db2.gz KKYQUFODOBGIIY-FQEVSTJZSA-N 2 1 338.470 4.155 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cccc(OC(F)(F)F)c1 ZINC000517536465 1042069616 /nfs/dbraw/zinc/06/96/16/1042069616.db2.gz LZWZECPZWIHGDB-OAHLLOKOSA-N 2 1 344.421 4.329 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2cccc(F)c2)s1 ZINC000517574222 1042079513 /nfs/dbraw/zinc/07/95/13/1042079513.db2.gz KMMOKBOFRCEIMX-CQSZACIVSA-N 2 1 343.471 4.485 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CC[C@@H](Cc4ccccc4)C3)CC2)[nH+]c1 ZINC000438187460 1042081990 /nfs/dbraw/zinc/08/19/90/1042081990.db2.gz JAPIAAHJECBWBK-UNMCSNQZSA-N 2 1 349.522 4.360 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CC[C@H](Cc4ccccc4)C3)CC2)[nH+]1 ZINC000438193663 1042084072 /nfs/dbraw/zinc/08/40/72/1042084072.db2.gz UJHTUQOQLPUSAH-IRLDBZIGSA-N 2 1 349.522 4.360 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CC[C@@H](Cc4ccccc4)C3)CC2)[nH+]1 ZINC000438193664 1042084329 /nfs/dbraw/zinc/08/43/29/1042084329.db2.gz UJHTUQOQLPUSAH-RBBKRZOGSA-N 2 1 349.522 4.360 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000464782618 1042162101 /nfs/dbraw/zinc/16/21/01/1042162101.db2.gz YTFUOVJONGUGBC-CABCVRRESA-N 2 1 328.422 4.430 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000464782618 1042162103 /nfs/dbraw/zinc/16/21/03/1042162103.db2.gz YTFUOVJONGUGBC-CABCVRRESA-N 2 1 328.422 4.430 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC000426063597 1042239621 /nfs/dbraw/zinc/23/96/21/1042239621.db2.gz PPOGMKDSJBBIFP-RKVPGOIHSA-N 2 1 336.470 4.095 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(CC)cc3)o2)C1 ZINC000465014012 1042280986 /nfs/dbraw/zinc/28/09/86/1042280986.db2.gz SPBDKLJJZLWORC-GOSISDBHSA-N 2 1 326.484 4.331 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(CC)cc3)o2)C1 ZINC000465014012 1042280991 /nfs/dbraw/zinc/28/09/91/1042280991.db2.gz SPBDKLJJZLWORC-GOSISDBHSA-N 2 1 326.484 4.331 20 0 EIADMP Cc1ccc(C)c(C[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000518273253 1042447083 /nfs/dbraw/zinc/44/70/83/1042447083.db2.gz PNDAATKDBFGOER-GOSISDBHSA-N 2 1 328.525 4.367 20 0 EIADMP Cc1ccc(C)c(C[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000518273253 1042447093 /nfs/dbraw/zinc/44/70/93/1042447093.db2.gz PNDAATKDBFGOER-GOSISDBHSA-N 2 1 328.525 4.367 20 0 EIADMP C[C@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492427282 1042648719 /nfs/dbraw/zinc/64/87/19/1042648719.db2.gz YRWKSXRUOHNWSJ-KIZRIRGWSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccccc2OC(F)(F)F)C1 ZINC000518765545 1042675580 /nfs/dbraw/zinc/67/55/80/1042675580.db2.gz LFNANLHZTACJHK-HNNXBMFYSA-N 2 1 344.421 4.187 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+]Cc1csc(Br)c1 ZINC000518779421 1042682736 /nfs/dbraw/zinc/68/27/36/1042682736.db2.gz PJAUXBRHXVTLCI-UHFFFAOYSA-N 2 1 333.339 4.112 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000506659296 1042752292 /nfs/dbraw/zinc/75/22/92/1042752292.db2.gz CAKUNFFWUKHOAM-UHFFFAOYSA-N 2 1 338.495 4.182 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000506659296 1042752296 /nfs/dbraw/zinc/75/22/96/1042752296.db2.gz CAKUNFFWUKHOAM-UHFFFAOYSA-N 2 1 338.495 4.182 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1F ZINC000310093551 1042827887 /nfs/dbraw/zinc/82/78/87/1042827887.db2.gz SWFBCCOMKFVDSG-RDJZCZTQSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)ccc1F ZINC000310093551 1042827890 /nfs/dbraw/zinc/82/78/90/1042827890.db2.gz SWFBCCOMKFVDSG-RDJZCZTQSA-N 2 1 330.422 4.138 20 0 EIADMP COc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC000177213988 1042830502 /nfs/dbraw/zinc/83/05/02/1042830502.db2.gz PNYGZQWSARBTTG-KRWDZBQOSA-N 2 1 326.484 4.386 20 0 EIADMP C[NH+]1CCC([NH2+]Cc2ccccc2COc2ccccc2Cl)CC1 ZINC000177373655 1042836863 /nfs/dbraw/zinc/83/68/63/1042836863.db2.gz FHAGDONFHAJRJJ-UHFFFAOYSA-N 2 1 344.886 4.103 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310537054 1042839686 /nfs/dbraw/zinc/83/96/86/1042839686.db2.gz RNGFZEDVUMOLHA-QKLQHJQFSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000310591413 1042841090 /nfs/dbraw/zinc/84/10/90/1042841090.db2.gz OPYBISDIEXOZAY-LVCYWYKZSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000310591413 1042841092 /nfs/dbraw/zinc/84/10/92/1042841092.db2.gz OPYBISDIEXOZAY-LVCYWYKZSA-N 2 1 338.495 4.399 20 0 EIADMP CCC[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1ccc(C)cc1 ZINC000542466573 1042911319 /nfs/dbraw/zinc/91/13/19/1042911319.db2.gz WHMUJETWDIOCOL-UHFFFAOYSA-N 2 1 334.467 4.296 20 0 EIADMP COc1ccccc1C[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168006338 1043000784 /nfs/dbraw/zinc/00/07/84/1043000784.db2.gz NIDUDXQMYVTUSJ-QZTJIDSGSA-N 2 1 338.495 4.226 20 0 EIADMP C[C@@H]1CC([NH2+]Cc2cc(F)cc(F)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168007757 1043023882 /nfs/dbraw/zinc/02/38/82/1043023882.db2.gz UJTWBFCUJKDXST-HZPDHXFCSA-N 2 1 344.449 4.496 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)c(F)c(F)c1 ZINC000183190778 1043039242 /nfs/dbraw/zinc/03/92/42/1043039242.db2.gz LYKCUHYJZVJLPS-MELADBBJSA-N 2 1 340.433 4.408 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)c(F)c(F)c1 ZINC000183190778 1043039248 /nfs/dbraw/zinc/03/92/48/1043039248.db2.gz LYKCUHYJZVJLPS-MELADBBJSA-N 2 1 340.433 4.408 20 0 EIADMP Cc1ccc([C@H]([NH2+]CC2([NH+]3CCCC3)CCOCC2)C2CCC2)cc1 ZINC000427713419 1043172469 /nfs/dbraw/zinc/17/24/69/1043172469.db2.gz GZBBOEUFRJMQKO-OAQYLSRUSA-N 2 1 342.527 4.071 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc2cnccc2o1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000657965814 1043223063 /nfs/dbraw/zinc/22/30/63/1043223063.db2.gz BOBQZHSXLJZENT-ZIFCJYIRSA-N 2 1 349.478 4.389 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cnc3ccccc3c2)c1 ZINC000727469236 1043228437 /nfs/dbraw/zinc/22/84/37/1043228437.db2.gz ZMHXPNUXQMESNG-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP c1ccc(C(CC[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000165941998 1043263318 /nfs/dbraw/zinc/26/33/18/1043263318.db2.gz KVWMXYLAHDLPIP-FCHUYYIVSA-N 2 1 334.507 4.425 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)C1 ZINC000665252178 1043285191 /nfs/dbraw/zinc/28/51/91/1043285191.db2.gz JFHHIFQACFFRQY-CIAFKFPVSA-N 2 1 349.522 4.152 20 0 EIADMP COc1cccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000166714863 1043307915 /nfs/dbraw/zinc/30/79/15/1043307915.db2.gz QRQZWRHCYRVCIM-NHCUHLMSSA-N 2 1 336.479 4.079 20 0 EIADMP CCc1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)cn1 ZINC000347878003 1043312410 /nfs/dbraw/zinc/31/24/10/1043312410.db2.gz LTORKPBIYZGJPH-UHFFFAOYSA-N 2 1 349.522 4.132 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3cccnc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012548 1043439882 /nfs/dbraw/zinc/43/98/82/1043439882.db2.gz BWXRMZUZGKPNTO-GMQQQROESA-N 2 1 349.522 4.490 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3cccnc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168012548 1043439883 /nfs/dbraw/zinc/43/98/83/1043439883.db2.gz BWXRMZUZGKPNTO-GMQQQROESA-N 2 1 349.522 4.490 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2[C@H]2CCOC2)c1 ZINC000474029117 1043442378 /nfs/dbraw/zinc/44/23/78/1043442378.db2.gz LEEKHBHTUFICGT-BHDDXSALSA-N 2 1 344.543 4.212 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2[C@H]2CCOC2)c1 ZINC000474029119 1043442423 /nfs/dbraw/zinc/44/24/23/1043442423.db2.gz LEEKHBHTUFICGT-FDFHNCONSA-N 2 1 344.543 4.212 20 0 EIADMP C[C@@H](CC[NH+](C)C)[NH2+]Cc1ccc(Oc2cc(F)cc(F)c2)cc1 ZINC000520965530 1043465406 /nfs/dbraw/zinc/46/54/06/1043465406.db2.gz GBYVBHHQBDWOLS-AWEZNQCLSA-N 2 1 334.410 4.187 20 0 EIADMP Nc1ccc2c(c1)CC[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000665272160 1043477996 /nfs/dbraw/zinc/47/79/96/1043477996.db2.gz ZPMPOKKSJQOYJG-CUDBPUKSSA-N 2 1 347.506 4.041 20 0 EIADMP Cc1cscc1C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000494465826 1043500489 /nfs/dbraw/zinc/50/04/89/1043500489.db2.gz NYCQACMNNREOKP-YSIASYRMSA-N 2 1 326.509 4.057 20 0 EIADMP C(=C\C[N@H+]1CCC[C@H]1c1ccccn1)\C[NH+]1CCC[C@@H]1c1ccccn1 ZINC000674371429 1043646273 /nfs/dbraw/zinc/64/62/73/1043646273.db2.gz QRCNTDULJDXPFL-HENPEBFISA-N 2 1 348.494 4.007 20 0 EIADMP C(=C\C[N@@H+]1CCC[C@@H]1c1ccccn1)\C[NH+]1CCC[C@H]1c1ccccn1 ZINC000674371429 1043646286 /nfs/dbraw/zinc/64/62/86/1043646286.db2.gz QRCNTDULJDXPFL-HENPEBFISA-N 2 1 348.494 4.007 20 0 EIADMP C(=C\C[N@H+]1CCC[C@@H]1c1ccccn1)\C[NH+]1CCC[C@H]1c1ccccn1 ZINC000674371429 1043646296 /nfs/dbraw/zinc/64/62/96/1043646296.db2.gz QRCNTDULJDXPFL-HENPEBFISA-N 2 1 348.494 4.007 20 0 EIADMP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000474033792 1043692290 /nfs/dbraw/zinc/69/22/90/1043692290.db2.gz LUTFVOUQTQHRJI-UZLBHIALSA-N 2 1 330.516 4.128 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]CC[C@H](C)[NH+]3CCCCC3)oc21 ZINC000542486728 1043721992 /nfs/dbraw/zinc/72/19/92/1043721992.db2.gz LIVBICOCDLPYNU-JKSUJKDBSA-N 2 1 330.472 4.357 20 0 EIADMP Cc1cccc(NC[C@H]2CC[N@H+](C[C@@H]3CCC4(CCCCC4)O3)C2)[nH+]1 ZINC000190973093 1043757068 /nfs/dbraw/zinc/75/70/68/1043757068.db2.gz KFZDXKRMGIGMTG-MOPGFXCFSA-N 2 1 343.515 4.006 20 0 EIADMP Cc1cccc(NC[C@H]2CC[N@@H+](C[C@@H]3CCC4(CCCCC4)O3)C2)[nH+]1 ZINC000190973093 1043757082 /nfs/dbraw/zinc/75/70/82/1043757082.db2.gz KFZDXKRMGIGMTG-MOPGFXCFSA-N 2 1 343.515 4.006 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442643120 1043792791 /nfs/dbraw/zinc/79/27/91/1043792791.db2.gz GKRLKHAVODXWFK-CRAIPNDOSA-N 2 1 340.433 4.415 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCc2ccccc21 ZINC000682076067 1043802832 /nfs/dbraw/zinc/80/28/32/1043802832.db2.gz JPVHBZXIFBBPNS-JOCHJYFZSA-N 2 1 335.495 4.307 20 0 EIADMP CCCC[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)CC1 ZINC000731678015 1043814935 /nfs/dbraw/zinc/81/49/35/1043814935.db2.gz FDNNKBNAPWGFMZ-UHFFFAOYSA-N 2 1 330.516 4.144 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H]2CCSc3ccc(OC)cc32)CC1 ZINC000191505231 1043822927 /nfs/dbraw/zinc/82/29/27/1043822927.db2.gz IPJNIFMEHBQREQ-SFHVURJKSA-N 2 1 334.529 4.086 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442773378 1043830511 /nfs/dbraw/zinc/83/05/11/1043830511.db2.gz CLULFFYLKZQREO-DOTOQJQBSA-N 2 1 337.389 4.136 20 0 EIADMP Cc1ccc(C)c(OC2CC[NH+](CCC[NH+]3CCCCC3)CC2)c1 ZINC000195632439 1044152593 /nfs/dbraw/zinc/15/25/93/1044152593.db2.gz SGXXNFOHOWWQEJ-UHFFFAOYSA-N 2 1 330.516 4.023 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)cc1 ZINC000658268384 1044205536 /nfs/dbraw/zinc/20/55/36/1044205536.db2.gz MUVNPIXAMVAGPP-HNNXBMFYSA-N 2 1 349.482 4.033 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2cc(Br)cs2)CC1 ZINC000193963573 1044221329 /nfs/dbraw/zinc/22/13/29/1044221329.db2.gz OJIFBJPGHWSRAS-GFCCVEGCSA-N 2 1 345.350 4.282 20 0 EIADMP Cc1ccccc1[C@H]([NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)C1CCCC1 ZINC000658296202 1044268033 /nfs/dbraw/zinc/26/80/33/1044268033.db2.gz RAJJTKBUXWJVEW-RBBKRZOGSA-N 2 1 342.527 4.069 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000443413488 1044269468 /nfs/dbraw/zinc/26/94/68/1044269468.db2.gz MAUWNPDHZIVPBC-UHFFFAOYSA-N 2 1 328.422 4.318 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319483 1044306142 /nfs/dbraw/zinc/30/61/42/1044306142.db2.gz CHDFHURGPJGCHJ-GHTZIAJQSA-N 2 1 335.495 4.035 20 0 EIADMP Cc1cc(F)cc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001143590548 1044316010 /nfs/dbraw/zinc/31/60/10/1044316010.db2.gz YLYFNTXADQRBBC-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)cc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001143590548 1044316023 /nfs/dbraw/zinc/31/60/23/1044316023.db2.gz YLYFNTXADQRBBC-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001143590548 1044316033 /nfs/dbraw/zinc/31/60/33/1044316033.db2.gz YLYFNTXADQRBBC-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001143590548 1044316046 /nfs/dbraw/zinc/31/60/46/1044316046.db2.gz YLYFNTXADQRBBC-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP COCC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000347930247 1044330840 /nfs/dbraw/zinc/33/08/40/1044330840.db2.gz KOMGPTOIUAIAAY-QFUCXCTJSA-N 2 1 330.516 4.007 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@](C)(O)CCC(C)C)cc1 ZINC000348035233 1044368368 /nfs/dbraw/zinc/36/83/68/1044368368.db2.gz DDJCSKIUEKJMJN-OXQOHEQNSA-N 2 1 329.488 4.019 20 0 EIADMP Cc1cccc2c1OCC[C@H]2[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000474087307 1044434081 /nfs/dbraw/zinc/43/40/81/1044434081.db2.gz FJVONOHHJIQSFL-HBGVWJBISA-N 2 1 342.527 4.451 20 0 EIADMP C[NH+]1CCC([NH2+][C@H](Cc2ccccc2Cl)c2cccs2)CC1 ZINC000494876495 1044464446 /nfs/dbraw/zinc/46/44/46/1044464446.db2.gz HKLDQRWKEBQGGS-QGZVFWFLSA-N 2 1 334.916 4.369 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000443583894 1044494427 /nfs/dbraw/zinc/49/44/27/1044494427.db2.gz QXWJOEDWPLRKMM-GKCIPKSASA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000443583894 1044494434 /nfs/dbraw/zinc/49/44/34/1044494434.db2.gz QXWJOEDWPLRKMM-GKCIPKSASA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000443583894 1044494440 /nfs/dbraw/zinc/49/44/40/1044494440.db2.gz QXWJOEDWPLRKMM-GKCIPKSASA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000443583894 1044494445 /nfs/dbraw/zinc/49/44/45/1044494445.db2.gz QXWJOEDWPLRKMM-GKCIPKSASA-N 2 1 330.903 4.276 20 0 EIADMP C(=C\c1ccncc1)\C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000494963874 1044558743 /nfs/dbraw/zinc/55/87/43/1044558743.db2.gz KGHHNCICSNLYRS-IZPOICSHSA-N 2 1 347.506 4.083 20 0 EIADMP C(=C\c1ccncc1)\C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000494963874 1044558766 /nfs/dbraw/zinc/55/87/66/1044558766.db2.gz KGHHNCICSNLYRS-IZPOICSHSA-N 2 1 347.506 4.083 20 0 EIADMP C(=C\c1ccncc1)\C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000494963874 1044558781 /nfs/dbraw/zinc/55/87/81/1044558781.db2.gz KGHHNCICSNLYRS-IZPOICSHSA-N 2 1 347.506 4.083 20 0 EIADMP C(=C\c1ccncc1)\C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000494963874 1044558797 /nfs/dbraw/zinc/55/87/97/1044558797.db2.gz KGHHNCICSNLYRS-IZPOICSHSA-N 2 1 347.506 4.083 20 0 EIADMP C[C@@H]1C[C@@H](N2CC[C@H]([NH3+])c3ccccc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168023162 1044561798 /nfs/dbraw/zinc/56/17/98/1044561798.db2.gz VMYSCORWSVEKNN-TWWGPRNNSA-N 2 1 349.522 4.338 20 0 EIADMP CC(C)[C@H](O)[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000657744026 1044564253 /nfs/dbraw/zinc/56/42/53/1044564253.db2.gz CSRMBIHSQYFTGT-VXKWHMMOSA-N 2 1 344.543 4.131 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2C)C1 ZINC000443644184 1044598298 /nfs/dbraw/zinc/59/82/98/1044598298.db2.gz UGHNSSSAVHEWRQ-OAHLLOKOSA-N 2 1 328.422 4.178 20 0 EIADMP CCOc1c(Cl)cccc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000495080009 1044649221 /nfs/dbraw/zinc/64/92/21/1044649221.db2.gz PWFIWODBIMPFDD-UHFFFAOYSA-N 2 1 336.907 4.047 20 0 EIADMP c1cc2cc[nH+]cc2c(NCc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000676323879 1044710270 /nfs/dbraw/zinc/71/02/70/1044710270.db2.gz CKOJLIWFXHFSDO-UHFFFAOYSA-N 2 1 347.462 4.322 20 0 EIADMP Cc1nc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c(C)s1 ZINC000676491356 1044757357 /nfs/dbraw/zinc/75/73/57/1044757357.db2.gz ZUZMNYABHOKERP-CQSZACIVSA-N 2 1 331.529 4.451 20 0 EIADMP Cc1nc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c(C)s1 ZINC000676491356 1044757379 /nfs/dbraw/zinc/75/73/79/1044757379.db2.gz ZUZMNYABHOKERP-CQSZACIVSA-N 2 1 331.529 4.451 20 0 EIADMP C[C@@H]1C[C@@H](n2cnc3cccc(C[NH3+])c32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168030732 1044805229 /nfs/dbraw/zinc/80/52/29/1044805229.db2.gz WZWCNBLAHDZBBJ-XEMDLRDOSA-N 2 1 348.494 4.109 20 0 EIADMP Clc1ccccc1C[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000390725242 1044892017 /nfs/dbraw/zinc/89/20/17/1044892017.db2.gz QRZMJEIUHCNCNG-GOSISDBHSA-N 2 1 328.887 4.342 20 0 EIADMP Clc1ccccc1C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000390725242 1044892025 /nfs/dbraw/zinc/89/20/25/1044892025.db2.gz QRZMJEIUHCNCNG-GOSISDBHSA-N 2 1 328.887 4.342 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000429005191 1044993443 /nfs/dbraw/zinc/99/34/43/1044993443.db2.gz RLYVDGAKMISMQS-JOCHJYFZSA-N 2 1 338.495 4.155 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH+]1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000429005191 1044993449 /nfs/dbraw/zinc/99/34/49/1044993449.db2.gz RLYVDGAKMISMQS-JOCHJYFZSA-N 2 1 338.495 4.155 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000429005191 1044993456 /nfs/dbraw/zinc/99/34/56/1044993456.db2.gz RLYVDGAKMISMQS-JOCHJYFZSA-N 2 1 338.495 4.155 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)ccc1SC(F)F ZINC000766165394 1045004660 /nfs/dbraw/zinc/00/46/60/1045004660.db2.gz HMMUKYUBGFFJEA-MBNYWOFBSA-N 2 1 344.471 4.143 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1SC(F)F ZINC000766165394 1045004674 /nfs/dbraw/zinc/00/46/74/1045004674.db2.gz HMMUKYUBGFFJEA-MBNYWOFBSA-N 2 1 344.471 4.143 20 0 EIADMP C[C@H]1C[C@H](N[C@H]2CCCc3cccnc32)CC[N@H+]1Cc1ccccc1 ZINC000922885033 1045055119 /nfs/dbraw/zinc/05/51/19/1045055119.db2.gz YYKBVMLTVVTKRZ-WMQCIHAUSA-N 2 1 335.495 4.102 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@H]2CCCc3cccnc32)CCN1Cc1ccccc1 ZINC000922885033 1045055134 /nfs/dbraw/zinc/05/51/34/1045055134.db2.gz YYKBVMLTVVTKRZ-WMQCIHAUSA-N 2 1 335.495 4.102 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(C(F)F)nc1 ZINC000657898075 1045059510 /nfs/dbraw/zinc/05/95/10/1045059510.db2.gz LXAYYGGSNRWSLT-AWEZNQCLSA-N 2 1 337.458 4.467 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1Cc2cccc(Cl)c2C1 ZINC001168741225 1045230086 /nfs/dbraw/zinc/23/00/86/1045230086.db2.gz XLFIOEUITOUGAD-KSZLIROESA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@H]1Cc2cccc(Cl)c2C1 ZINC001168741225 1045230093 /nfs/dbraw/zinc/23/00/93/1045230093.db2.gz XLFIOEUITOUGAD-KSZLIROESA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@H]1Cc2cccc(Cl)c2C1 ZINC001168741225 1045230097 /nfs/dbraw/zinc/23/00/97/1045230097.db2.gz XLFIOEUITOUGAD-KSZLIROESA-N 2 1 332.919 4.146 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000237401383 1045384265 /nfs/dbraw/zinc/38/42/65/1045384265.db2.gz MTHLKHJOKDSYHK-HNNXBMFYSA-N 2 1 325.481 4.346 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2cccc(F)c2C)o1 ZINC000237410117 1045384274 /nfs/dbraw/zinc/38/42/74/1045384274.db2.gz LLSYQKAWFNQAMJ-AWEZNQCLSA-N 2 1 341.430 4.325 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000237585618 1045389056 /nfs/dbraw/zinc/38/90/56/1045389056.db2.gz XPISOIAQQLMUHX-GOSISDBHSA-N 2 1 349.478 4.196 20 0 EIADMP C[C@@H](CC[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000237565936 1045389100 /nfs/dbraw/zinc/38/91/00/1045389100.db2.gz REHDFNYQZCUUTD-RBBKRZOGSA-N 2 1 336.523 4.334 20 0 EIADMP Cc1cc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cnc1Cl ZINC000768301966 1045780340 /nfs/dbraw/zinc/78/03/40/1045780340.db2.gz FUJFDRCDEPIKGX-UHFFFAOYSA-N 2 1 335.923 4.131 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([NH2+]Cc3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170158386 1045799631 /nfs/dbraw/zinc/79/96/31/1045799631.db2.gz OFLGZXBIVBNDAO-RDTXWAMCSA-N 2 1 340.433 4.448 20 0 EIADMP C[C@H]1CC[C@H]([NH+]2CCC([NH2+]Cc3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170158384 1045800768 /nfs/dbraw/zinc/80/07/68/1045800768.db2.gz OFLGZXBIVBNDAO-KSSFIOAISA-N 2 1 340.433 4.448 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1ccc2c(c1)COC(C)(C)O2)C1CCCCC1 ZINC000768670627 1045829980 /nfs/dbraw/zinc/82/99/80/1045829980.db2.gz XBAPTFPPWDRJPM-UHFFFAOYSA-N 2 1 346.515 4.076 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1ccc2c(c1)COC(C)(C)O2)C1CCCCC1 ZINC000768670627 1045829978 /nfs/dbraw/zinc/82/99/78/1045829978.db2.gz XBAPTFPPWDRJPM-UHFFFAOYSA-N 2 1 346.515 4.076 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CC(C(F)F)C1 ZINC000768693145 1045830759 /nfs/dbraw/zinc/83/07/59/1045830759.db2.gz WYGZTKFZZJXFBP-UHFFFAOYSA-N 2 1 334.410 4.045 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCCOc4ccccc43)C2)cc1 ZINC000249157425 1045894061 /nfs/dbraw/zinc/89/40/61/1045894061.db2.gz XKYCQGHQBXWCFM-CTNGQTDRSA-N 2 1 336.479 4.012 20 0 EIADMP CCc1ccccc1C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170205350 1045925270 /nfs/dbraw/zinc/92/52/70/1045925270.db2.gz KRXUEXMWGBFESP-HSZRJFAPSA-N 2 1 334.507 4.347 20 0 EIADMP CCc1ccccc1C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001170205350 1045925288 /nfs/dbraw/zinc/92/52/88/1045925288.db2.gz KRXUEXMWGBFESP-HSZRJFAPSA-N 2 1 334.507 4.347 20 0 EIADMP CCc1ccccc1C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001170205350 1045925303 /nfs/dbraw/zinc/92/53/03/1045925303.db2.gz KRXUEXMWGBFESP-HSZRJFAPSA-N 2 1 334.507 4.347 20 0 EIADMP CC[C@@H]1C[C@H]([N@@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170194963 1045934252 /nfs/dbraw/zinc/93/42/52/1045934252.db2.gz PHMNLCQJQTZKDF-XRXFAXGQSA-N 2 1 330.516 4.025 20 0 EIADMP CC[C@@H]1C[C@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000509454722 1045945035 /nfs/dbraw/zinc/94/50/35/1045945035.db2.gz OKVHKSGRKNUCFY-NJDAHSKKSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@@H]1C[C@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000509454722 1045945052 /nfs/dbraw/zinc/94/50/52/1045945052.db2.gz OKVHKSGRKNUCFY-NJDAHSKKSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCCCCOc2ccc(Cl)cc2)CC[N@H+]1C ZINC000769418057 1045954742 /nfs/dbraw/zinc/95/47/42/1045954742.db2.gz TXKYLQFKIWMIBN-AEFFLSMTSA-N 2 1 338.923 4.352 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(OC)cc2F)c1 ZINC000123901965 1046203083 /nfs/dbraw/zinc/20/30/83/1046203083.db2.gz HZKKXXDFZBQNAB-OAHLLOKOSA-N 2 1 330.447 4.137 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cnc(Cl)c(C)c2)CC1)CC1CC1 ZINC000770590751 1046232490 /nfs/dbraw/zinc/23/24/90/1046232490.db2.gz BQPLDBQGBQOTBY-UHFFFAOYSA-N 2 1 349.950 4.377 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)Cc1cccs1 ZINC000508692941 1046324567 /nfs/dbraw/zinc/32/45/67/1046324567.db2.gz XMTQOQCIZQMNIP-CMKODMSKSA-N 2 1 342.552 4.427 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000508695466 1046325729 /nfs/dbraw/zinc/32/57/29/1046325729.db2.gz PWCCCAMCYOWFHY-BENYOCTQSA-N 2 1 342.527 4.187 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000508695466 1046325744 /nfs/dbraw/zinc/32/57/44/1046325744.db2.gz PWCCCAMCYOWFHY-BENYOCTQSA-N 2 1 342.527 4.187 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000125826946 1046353053 /nfs/dbraw/zinc/35/30/53/1046353053.db2.gz UOBHUIYPOZZHSX-GJZGRUSLSA-N 2 1 326.431 4.059 20 0 EIADMP C[C@@H]([NH2+]CC1(c2ccccc2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710701 1046359313 /nfs/dbraw/zinc/35/93/13/1046359313.db2.gz NRFRVNSJNRLIAS-CTNGQTDRSA-N 2 1 334.507 4.218 20 0 EIADMP C[C@@H]([NH2+]CCc1cccc(F)c1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710053 1046366076 /nfs/dbraw/zinc/36/60/76/1046366076.db2.gz KVEZBTYQWLFUND-VQIMIIECSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]([NH2+]CCc1ccc(Cl)s1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508718466 1046375863 /nfs/dbraw/zinc/37/58/63/1046375863.db2.gz IZAOAWBQCPDPEG-RDJZCZTQSA-N 2 1 348.943 4.444 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000125950925 1046384900 /nfs/dbraw/zinc/38/49/00/1046384900.db2.gz TYVSRVJZVBKSAF-LSDHHAIUSA-N 2 1 326.431 4.059 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)cc1 ZINC000126876243 1046577449 /nfs/dbraw/zinc/57/74/49/1046577449.db2.gz BGHQYWRUORUJCS-IAGOWNOFSA-N 2 1 344.524 4.320 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)cc1 ZINC000126876243 1046577472 /nfs/dbraw/zinc/57/74/72/1046577472.db2.gz BGHQYWRUORUJCS-IAGOWNOFSA-N 2 1 344.524 4.320 20 0 EIADMP c1csc([C@@H](Cc2ccccc2)[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC000459404963 1046605423 /nfs/dbraw/zinc/60/54/23/1046605423.db2.gz AKNOCQKMDPUQNW-LJQANCHMSA-N 2 1 326.509 4.248 20 0 EIADMP C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000459397836 1046615719 /nfs/dbraw/zinc/61/57/19/1046615719.db2.gz KIRRKBHOXJBHNB-GFCCVEGCSA-N 2 1 327.299 4.141 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccccc3F)o2)[C@H](C)C1 ZINC000536659053 1046621910 /nfs/dbraw/zinc/62/19/10/1046621910.db2.gz AQNSURGEIHJDTB-DNVCBOLYSA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)[C@H](C)C1 ZINC000536659053 1046621924 /nfs/dbraw/zinc/62/19/24/1046621924.db2.gz AQNSURGEIHJDTB-DNVCBOLYSA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)[C@H](C)C1 ZINC000536659053 1046621933 /nfs/dbraw/zinc/62/19/33/1046621933.db2.gz AQNSURGEIHJDTB-DNVCBOLYSA-N 2 1 330.447 4.248 20 0 EIADMP CCCOc1c(CN(C)[C@@H]2CC[N@@H+](CC)C[C@@H]2C)cccc1OCC ZINC000536662516 1046627987 /nfs/dbraw/zinc/62/79/87/1046627987.db2.gz HKVDGMJRQYYLMW-PKOBYXMFSA-N 2 1 348.531 4.036 20 0 EIADMP CCCOc1c(CN(C)[C@H]2CC[N@@H+](CC)C[C@H]2C)cccc1OCC ZINC000536662515 1046628530 /nfs/dbraw/zinc/62/85/30/1046628530.db2.gz HKVDGMJRQYYLMW-MJGOQNOKSA-N 2 1 348.531 4.036 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]CC3(c4ccccc4)CC3)CC2)cc1 ZINC000127215607 1046630935 /nfs/dbraw/zinc/63/09/35/1046630935.db2.gz DBISJQVCDHSMGV-UHFFFAOYSA-N 2 1 334.507 4.015 20 0 EIADMP Cc1[nH+]ccn1CCC[NH+](Cc1cccs1)Cc1cccs1 ZINC000127275522 1046642415 /nfs/dbraw/zinc/64/24/15/1046642415.db2.gz MJKGDQXLRDJDEM-UHFFFAOYSA-N 2 1 331.510 4.407 20 0 EIADMP C[C@@H](c1ccc2c(c1)CCC2)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000459417059 1046644084 /nfs/dbraw/zinc/64/40/84/1046644084.db2.gz ROSRLGQQWDKYFY-RTFZILSDSA-N 2 1 349.522 4.256 20 0 EIADMP C[N@H+](Cc1cccc2cc[nH]c21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536677259 1046665325 /nfs/dbraw/zinc/66/53/25/1046665325.db2.gz GSABXYYCRSFLLN-IBGZPJMESA-N 2 1 333.479 4.122 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCSc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379633850 1046732340 /nfs/dbraw/zinc/73/23/40/1046732340.db2.gz URYGALTTXQCGGD-AZUAARDMSA-N 2 1 340.536 4.421 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCSc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379633850 1046732354 /nfs/dbraw/zinc/73/23/54/1046732354.db2.gz URYGALTTXQCGGD-AZUAARDMSA-N 2 1 340.536 4.421 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3O)CC[N@@H+]1Cc1ccccc1 ZINC000379652753 1046747341 /nfs/dbraw/zinc/74/73/41/1046747341.db2.gz XWHZUOBYBCVFGC-MMOPVJDHSA-N 2 1 336.479 4.022 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3O)CC[N@H+]1Cc1ccccc1 ZINC000379652753 1046747354 /nfs/dbraw/zinc/74/73/54/1046747354.db2.gz XWHZUOBYBCVFGC-MMOPVJDHSA-N 2 1 336.479 4.022 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000536834363 1046810781 /nfs/dbraw/zinc/81/07/81/1046810781.db2.gz USIHMEZJQBFJAG-COXVUDFISA-N 2 1 328.422 4.475 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000536834363 1046810783 /nfs/dbraw/zinc/81/07/83/1046810783.db2.gz USIHMEZJQBFJAG-COXVUDFISA-N 2 1 328.422 4.475 20 0 EIADMP Cc1ccc([C@@H]2CCC[C@H]2[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000536855977 1046825775 /nfs/dbraw/zinc/82/57/75/1046825775.db2.gz CVIQTDCLMNLHJN-YUVXSKOASA-N 2 1 344.543 4.110 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC(C)(C)c1c(Cl)cccc1Cl ZINC000536865828 1046831219 /nfs/dbraw/zinc/83/12/19/1046831219.db2.gz XXYXFRFIGLYFAS-WFASDCNBSA-N 2 1 329.315 4.201 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cccc(Cl)c1Cl ZINC000536866227 1046832339 /nfs/dbraw/zinc/83/23/39/1046832339.db2.gz ZOOVLWCKDDHJDQ-NWDGAFQWSA-N 2 1 326.271 4.485 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)[C@H](C)c1nc2ccccc2s1 ZINC000459728931 1046865269 /nfs/dbraw/zinc/86/52/69/1046865269.db2.gz CWEUNKCBHXIVIJ-JYJNAYRXSA-N 2 1 331.529 4.110 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000459730176 1046867296 /nfs/dbraw/zinc/86/72/96/1046867296.db2.gz LNWYHFCAVKASNX-JXYHXMIBSA-N 2 1 338.470 4.182 20 0 EIADMP CCCc1ccc([C@H]([NH2+]CC2([NH+](C)C)CCOCC2)C(C)C)cc1 ZINC000537000210 1046891084 /nfs/dbraw/zinc/89/10/84/1046891084.db2.gz TWVCLDGGADIVMC-HXUWFJFHSA-N 2 1 332.532 4.037 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccc(OCC2CC2)c(F)c1 ZINC000537123103 1046952130 /nfs/dbraw/zinc/95/21/30/1046952130.db2.gz CMRWDMLZFHNVEX-YJBOKZPZSA-N 2 1 334.479 4.140 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(OCC2CC2)c(F)c1 ZINC000537123103 1046952149 /nfs/dbraw/zinc/95/21/49/1046952149.db2.gz CMRWDMLZFHNVEX-YJBOKZPZSA-N 2 1 334.479 4.140 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000788435785 1047185710 /nfs/dbraw/zinc/18/57/10/1047185710.db2.gz LVLIVIDZBURXKK-UHFFFAOYSA-N 2 1 344.446 4.359 20 0 EIADMP C[NH+]1CCC(C[N@@H+](Cc2ccccc2C(F)(F)F)C2CC2)CC1 ZINC000788479268 1047197307 /nfs/dbraw/zinc/19/73/07/1047197307.db2.gz PPOWVIYOHGHFRO-UHFFFAOYSA-N 2 1 326.406 4.012 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1cc[nH]c(=O)c1 ZINC000788530257 1047227020 /nfs/dbraw/zinc/22/70/20/1047227020.db2.gz WQMDQLIXXPNGJY-IRXDYDNUSA-N 2 1 339.483 4.012 20 0 EIADMP CCc1ccc([C@H](O)C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000789363098 1047409668 /nfs/dbraw/zinc/40/96/68/1047409668.db2.gz RZLCJOKAFNLNHH-OPAMFIHVSA-N 2 1 349.478 4.127 20 0 EIADMP CCc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000789363095 1047409708 /nfs/dbraw/zinc/40/97/08/1047409708.db2.gz RZLCJOKAFNLNHH-AOMKIAJQSA-N 2 1 349.478 4.127 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCn2ccc3ccccc32)C[C@@H]1c1ccccc1 ZINC000556052947 1047417487 /nfs/dbraw/zinc/41/74/87/1047417487.db2.gz LDMKZOXMQAOAJW-FYYLOGMGSA-N 2 1 347.506 4.457 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCn2ccc3ccccc32)C[C@@H]1c1ccccc1 ZINC000556052947 1047417491 /nfs/dbraw/zinc/41/74/91/1047417491.db2.gz LDMKZOXMQAOAJW-FYYLOGMGSA-N 2 1 347.506 4.457 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(c3ccccc3C(F)(F)F)CC2)C1 ZINC001170119647 1047472500 /nfs/dbraw/zinc/47/25/00/1047472500.db2.gz ZJEBULXZCJTYRV-KGLIPLIRSA-N 2 1 326.406 4.144 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1F ZINC000556119577 1047473508 /nfs/dbraw/zinc/47/35/08/1047473508.db2.gz AMKZVECWNUIPEJ-LNLFQRSKSA-N 2 1 341.474 4.172 20 0 EIADMP FC(F)(F)Sc1ccccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000898281723 1047608741 /nfs/dbraw/zinc/60/87/41/1047608741.db2.gz PCSYIWSHVAUGNL-UONOGXRCSA-N 2 1 330.419 4.015 20 0 EIADMP FC(F)(F)Sc1ccccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000898281723 1047608751 /nfs/dbraw/zinc/60/87/51/1047608751.db2.gz PCSYIWSHVAUGNL-UONOGXRCSA-N 2 1 330.419 4.015 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H](c3ccncc3)C3CC3)CC[N@@H+]2C2CC2)cc1 ZINC000898317067 1047621962 /nfs/dbraw/zinc/62/19/62/1047621962.db2.gz FUYRCXNUYSHMDT-AKIFATBCSA-N 2 1 347.506 4.490 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H](c3ccncc3)C3CC3)CC[N@H+]2C2CC2)cc1 ZINC000898317067 1047621967 /nfs/dbraw/zinc/62/19/67/1047621967.db2.gz FUYRCXNUYSHMDT-AKIFATBCSA-N 2 1 347.506 4.490 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665020 1047809980 /nfs/dbraw/zinc/80/99/80/1047809980.db2.gz CMRGHDSDGSEBPD-FYINFDKHSA-N 2 1 344.449 4.493 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665020 1047809982 /nfs/dbraw/zinc/80/99/82/1047809982.db2.gz CMRGHDSDGSEBPD-FYINFDKHSA-N 2 1 344.449 4.493 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)C1CCCC1 ZINC000550678077 1047813440 /nfs/dbraw/zinc/81/34/40/1047813440.db2.gz AERKODVVUKPUPF-FDFHNCONSA-N 2 1 344.543 4.397 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)C1CCCC1 ZINC000550678077 1047813442 /nfs/dbraw/zinc/81/34/42/1047813442.db2.gz AERKODVVUKPUPF-FDFHNCONSA-N 2 1 344.543 4.397 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)C1CCCC1 ZINC000550678078 1047813643 /nfs/dbraw/zinc/81/36/43/1047813643.db2.gz AERKODVVUKPUPF-YPAWHYETSA-N 2 1 344.543 4.397 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)C1CCCC1 ZINC000550678078 1047813645 /nfs/dbraw/zinc/81/36/45/1047813645.db2.gz AERKODVVUKPUPF-YPAWHYETSA-N 2 1 344.543 4.397 20 0 EIADMP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000556590216 1047830750 /nfs/dbraw/zinc/83/07/50/1047830750.db2.gz TWXKLECJMUBYKM-GMQQQROESA-N 2 1 344.543 4.289 20 0 EIADMP C[C@H](Nc1ccc2c(c1)[nH+]cn2[C@H]1CCC[NH2+]CC1)c1cccc(N)c1 ZINC001170733630 1047890117 /nfs/dbraw/zinc/89/01/17/1047890117.db2.gz JRIMJDRFOOCKSB-KXBFYZLASA-N 2 1 349.482 4.106 20 0 EIADMP 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 1047915081 /nfs/dbraw/zinc/91/50/81/1047915081.db2.gz AODVUVOTIVNVBX-PCYWVCGRSA-N 2 1 342.527 4.202 20 0 EIADMP C[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000824775077 1047934391 /nfs/dbraw/zinc/93/43/91/1047934391.db2.gz YFVHBNRDGSHPJV-UAGQMJEPSA-N 2 1 341.326 4.071 20 0 EIADMP CC1(C)[C@@H]2C[C@@H]([NH2+][C@@H]3CC[N@H+](Cc4ccccc4)CC3(C)C)C[C@@H]21 ZINC001170738865 1047969903 /nfs/dbraw/zinc/96/99/03/1047969903.db2.gz PUMGACMYGWQSJW-YSTOQKLRSA-N 2 1 326.528 4.311 20 0 EIADMP CC1(C)[C@@H]2C[C@@H]([NH2+][C@@H]3CC[N@@H+](Cc4ccccc4)CC3(C)C)C[C@@H]21 ZINC001170738865 1047969938 /nfs/dbraw/zinc/96/99/38/1047969938.db2.gz PUMGACMYGWQSJW-YSTOQKLRSA-N 2 1 326.528 4.311 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@H]2CCC[C@H]21 ZINC000556886249 1048107264 /nfs/dbraw/zinc/10/72/64/1048107264.db2.gz KDZMNKMJCSMBSV-ZIFCJYIRSA-N 2 1 347.572 4.196 20 0 EIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170764036 1048161473 /nfs/dbraw/zinc/16/14/73/1048161473.db2.gz FNRPZNUJFGOFCX-ACDBMABISA-N 2 1 330.491 4.157 20 0 EIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170764036 1048161482 /nfs/dbraw/zinc/16/14/82/1048161482.db2.gz FNRPZNUJFGOFCX-ACDBMABISA-N 2 1 330.491 4.157 20 0 EIADMP Cc1c(F)cc(F)cc1C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001143768107 1048189496 /nfs/dbraw/zinc/18/94/96/1048189496.db2.gz YXISBFZNJMVLQG-SFHVURJKSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1c(F)cc(F)cc1C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001143768107 1048189500 /nfs/dbraw/zinc/18/95/00/1048189500.db2.gz YXISBFZNJMVLQG-SFHVURJKSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1c(F)cc(F)cc1C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001143768107 1048189509 /nfs/dbraw/zinc/18/95/09/1048189509.db2.gz YXISBFZNJMVLQG-SFHVURJKSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1c(F)cc(F)cc1C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001143768107 1048189524 /nfs/dbraw/zinc/18/95/24/1048189524.db2.gz YXISBFZNJMVLQG-SFHVURJKSA-N 2 1 344.449 4.227 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(Cl)ccc2C1 ZINC001171113682 1048249918 /nfs/dbraw/zinc/24/99/18/1048249918.db2.gz VAQRJGBVGCJNMK-UFYCRDLUSA-N 2 1 334.935 4.425 20 0 EIADMP C[C@H](CC[N@H+]1CCC[C@@]2(CC2(F)F)C1)[NH+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437254 1048335080 /nfs/dbraw/zinc/33/50/80/1048335080.db2.gz MTLKTALOLQNCTL-BZUAXINKSA-N 2 1 348.428 4.007 20 0 EIADMP C[C@H](CC[NH+]1CCC[C@@]2(CC2(F)F)C1)[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437254 1048335096 /nfs/dbraw/zinc/33/50/96/1048335096.db2.gz MTLKTALOLQNCTL-BZUAXINKSA-N 2 1 348.428 4.007 20 0 EIADMP C[C@H](CC[NH+]1CCC[C@@]2(CC2(F)F)C1)[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437254 1048335114 /nfs/dbraw/zinc/33/51/14/1048335114.db2.gz MTLKTALOLQNCTL-BZUAXINKSA-N 2 1 348.428 4.007 20 0 EIADMP FC1(F)C[C@]12CCC[NH+](CCCC[N@@H+]1CCC[C@]3(CC3(F)F)C1)C2 ZINC000844437046 1048335751 /nfs/dbraw/zinc/33/57/51/1048335751.db2.gz KUQCXMLMZFCPOB-HOTGVXAUSA-N 2 1 348.428 4.009 20 0 EIADMP FC1(F)C[C@@]12CCC[N@@H+](Cc1cccc(C[NH+]3CCCCC3)c1)C2 ZINC000844443973 1048342815 /nfs/dbraw/zinc/34/28/15/1048342815.db2.gz NHGWWBBKMQMKFS-LJQANCHMSA-N 2 1 334.454 4.294 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H]2CCc4ccccc4C2)C3)cc1 ZINC000499164508 1048371094 /nfs/dbraw/zinc/37/10/94/1048371094.db2.gz OFZVSRHICCXJAA-NEWJYFPISA-N 2 1 346.518 4.329 20 0 EIADMP COc1ccc2oc(C[N@@H+](C)Cc3ccc(C[NH+](C)C)cc3)cc2c1 ZINC000809738372 1048509682 /nfs/dbraw/zinc/50/96/82/1048509682.db2.gz WLLIVNVYUZASEM-UHFFFAOYSA-N 2 1 338.451 4.135 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc(-c3ccccn3)c2)cc1 ZINC000809738807 1048513051 /nfs/dbraw/zinc/51/30/51/1048513051.db2.gz KRHMQVMGKNEWNL-UHFFFAOYSA-N 2 1 345.490 4.442 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765048 1048524285 /nfs/dbraw/zinc/52/42/85/1048524285.db2.gz KSAVMGINNBJHAK-IUODEOHRSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765048 1048524298 /nfs/dbraw/zinc/52/42/98/1048524298.db2.gz KSAVMGINNBJHAK-IUODEOHRSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765048 1048524311 /nfs/dbraw/zinc/52/43/11/1048524311.db2.gz KSAVMGINNBJHAK-IUODEOHRSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765048 1048524316 /nfs/dbraw/zinc/52/43/16/1048524316.db2.gz KSAVMGINNBJHAK-IUODEOHRSA-N 2 1 332.435 4.071 20 0 EIADMP CCc1cccc(C[NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)c1 ZINC001144322904 1048589883 /nfs/dbraw/zinc/58/98/83/1048589883.db2.gz IABCBCWBUWGDOL-UHFFFAOYSA-N 2 1 338.495 4.330 20 0 EIADMP CCc1cccc(CN2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)c1 ZINC001144326721 1048599036 /nfs/dbraw/zinc/59/90/36/1048599036.db2.gz PJNYNXRDGYCXBJ-UHFFFAOYSA-N 2 1 340.486 4.485 20 0 EIADMP CCc1cccc(C[NH+]2CCC(N(C)Cc3ccc(F)cc3)CC2)c1 ZINC001144326721 1048599049 /nfs/dbraw/zinc/59/90/49/1048599049.db2.gz PJNYNXRDGYCXBJ-UHFFFAOYSA-N 2 1 340.486 4.485 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1ccc(Br)nc1)C(C)C ZINC000810221504 1048690211 /nfs/dbraw/zinc/69/02/11/1048690211.db2.gz QEWAUEPNNTYSOV-CQSZACIVSA-N 2 1 342.325 4.004 20 0 EIADMP Clc1cc2cccnc2c(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000075834316 1048800034 /nfs/dbraw/zinc/80/00/34/1048800034.db2.gz OCBJVKNBIRFATQ-INIZCTEOSA-N 2 1 343.902 4.196 20 0 EIADMP Clc1cc2cccnc2c(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000075834316 1048800036 /nfs/dbraw/zinc/80/00/36/1048800036.db2.gz OCBJVKNBIRFATQ-INIZCTEOSA-N 2 1 343.902 4.196 20 0 EIADMP ClC1(Cl)C[C@H]1CCC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000846101303 1048819859 /nfs/dbraw/zinc/81/98/59/1048819859.db2.gz AFYZXSKQDKNEBJ-MRXNPFEDSA-N 2 1 341.326 4.215 20 0 EIADMP ClC1(Cl)C[C@@H]1CCC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000846101301 1048820048 /nfs/dbraw/zinc/82/00/48/1048820048.db2.gz AFYZXSKQDKNEBJ-INIZCTEOSA-N 2 1 341.326 4.215 20 0 EIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(F)cc1 ZINC000846145985 1048833604 /nfs/dbraw/zinc/83/36/04/1048833604.db2.gz PVQGBJOBZLCCMP-NHCUHLMSSA-N 2 1 348.506 4.146 20 0 EIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3cscc3C(F)(F)F)C2)CC1 ZINC000811501492 1049117212 /nfs/dbraw/zinc/11/72/12/1049117212.db2.gz ZENLTQJPHWMRHZ-UHFFFAOYSA-N 2 1 332.435 4.075 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171357407 1049510269 /nfs/dbraw/zinc/51/02/69/1049510269.db2.gz LPYVXVOSVYTSFN-BHIYHBOVSA-N 2 1 348.481 4.337 20 0 EIADMP Oc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)CCC2 ZINC000812719603 1049548043 /nfs/dbraw/zinc/54/80/43/1049548043.db2.gz ZAQCTYWEXTUBMZ-QFIPXVFZSA-N 2 1 342.527 4.404 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)[C@H](C)C1 ZINC000081095566 1049624564 /nfs/dbraw/zinc/62/45/64/1049624564.db2.gz LMOVSLVEFVKZSF-RDTXWAMCSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c3cccnc23)[C@H](C)C1 ZINC000081095566 1049624571 /nfs/dbraw/zinc/62/45/71/1049624571.db2.gz LMOVSLVEFVKZSF-RDTXWAMCSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c3cccnc23)[C@H](C)C1 ZINC000081095566 1049624576 /nfs/dbraw/zinc/62/45/76/1049624576.db2.gz LMOVSLVEFVKZSF-RDTXWAMCSA-N 2 1 331.891 4.050 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000716629321 1049701174 /nfs/dbraw/zinc/70/11/74/1049701174.db2.gz YFYJBWDGYJSGDB-VJANTYMQSA-N 2 1 334.454 4.207 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@@H+](C)C[C@H]1CC[NH+](Cc3ccccc3)C1)C2 ZINC001171573515 1049760802 /nfs/dbraw/zinc/76/08/02/1049760802.db2.gz IYVKHQYLIGSPFI-GGAORHGYSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH+](C)C[C@H]1CC[N@H+](Cc3ccccc3)C1)C2 ZINC001171573515 1049760804 /nfs/dbraw/zinc/76/08/04/1049760804.db2.gz IYVKHQYLIGSPFI-GGAORHGYSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH+](C)C[C@H]1CC[N@@H+](Cc3ccccc3)C1)C2 ZINC001171573515 1049760809 /nfs/dbraw/zinc/76/08/09/1049760809.db2.gz IYVKHQYLIGSPFI-GGAORHGYSA-N 2 1 348.534 4.306 20 0 EIADMP Fc1cccc2c1C[C@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)CC2 ZINC001170993223 1049776752 /nfs/dbraw/zinc/77/67/52/1049776752.db2.gz ZBOWEEXDGGGZAF-LJQANCHMSA-N 2 1 342.502 4.023 20 0 EIADMP Fc1cccc2c1C[C@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)CC2 ZINC001170993223 1049776757 /nfs/dbraw/zinc/77/67/57/1049776757.db2.gz ZBOWEEXDGGGZAF-LJQANCHMSA-N 2 1 342.502 4.023 20 0 EIADMP Cc1ccccc1O[C@@H]1CC[N@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)C1 ZINC001171637380 1049779910 /nfs/dbraw/zinc/77/99/10/1049779910.db2.gz LSWMYUVGMZRBJE-GOSISDBHSA-N 2 1 330.516 4.100 20 0 EIADMP CC[N@@H+](CCc1ccc(OC)cc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171641936 1049779972 /nfs/dbraw/zinc/77/99/72/1049779972.db2.gz WQDMOBKACAYVCW-UHFFFAOYSA-N 2 1 332.532 4.211 20 0 EIADMP COc1ccc([C@@H]2CC[N@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)cc1 ZINC001171643385 1049780853 /nfs/dbraw/zinc/78/08/53/1049780853.db2.gz SFDQMQLJFYMXEY-QGZVFWFLSA-N 2 1 330.516 4.136 20 0 EIADMP Cc1ccc2c(CC[NH3+])cn([C@H]3C[C@@H](C)[N@H+](Cc4ccccc4)C3)c2c1 ZINC001171724861 1049785629 /nfs/dbraw/zinc/78/56/29/1049785629.db2.gz DBGBJUKWAUSABI-NQIIRXRSSA-N 2 1 347.506 4.286 20 0 EIADMP Cc1ccc2c(c1)c(CC[NH3+])cn2[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727767 1049785640 /nfs/dbraw/zinc/78/56/40/1049785640.db2.gz XPSVBZMJBISYAB-WIYYLYMNSA-N 2 1 347.506 4.286 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)[C@H]2Cc3cccc(F)c3C2)CC1 ZINC001171785514 1049803736 /nfs/dbraw/zinc/80/37/36/1049803736.db2.gz OMWCBMGDLCJGSA-UFYCRDLUSA-N 2 1 338.470 4.065 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)C ZINC000245652588 1049812662 /nfs/dbraw/zinc/81/26/62/1049812662.db2.gz CWXFAGRQCRRPFQ-YUMYIRISSA-N 2 1 344.543 4.223 20 0 EIADMP CC1(C)C[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171967060 1049827613 /nfs/dbraw/zinc/82/76/13/1049827613.db2.gz XFXZRKVNDUCNNF-MSOLQXFVSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cccc(O)c1 ZINC001171967889 1049827874 /nfs/dbraw/zinc/82/78/74/1049827874.db2.gz NXPATKNCGAOEEB-PXNSSMCTSA-N 2 1 338.495 4.486 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccc(O)c1 ZINC001171967889 1049827876 /nfs/dbraw/zinc/82/78/76/1049827876.db2.gz NXPATKNCGAOEEB-PXNSSMCTSA-N 2 1 338.495 4.486 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCc2ccsc2)CC[N@H+]1Cc1ccccc1 ZINC001171969141 1049833792 /nfs/dbraw/zinc/83/37/92/1049833792.db2.gz UBPOKTLIPPIYKJ-IBGZPJMESA-N 2 1 328.525 4.323 20 0 EIADMP CC1(C)C[C@H]([NH2+]C2(c3ccncc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171972013 1049834920 /nfs/dbraw/zinc/83/49/20/1049834920.db2.gz LMNIXGSDCCVALV-HXUWFJFHSA-N 2 1 335.495 4.104 20 0 EIADMP CC1(C)C[C@H]([NH2+]C2(c3ccncc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171972013 1049834924 /nfs/dbraw/zinc/83/49/24/1049834924.db2.gz LMNIXGSDCCVALV-HXUWFJFHSA-N 2 1 335.495 4.104 20 0 EIADMP CCCCOCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171973319 1049835956 /nfs/dbraw/zinc/83/59/56/1049835956.db2.gz XOFCXGQHVURNQG-FQEVSTJZSA-N 2 1 332.532 4.226 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2CCCc3ccncc32)CC[N@H+]1Cc1ccccc1 ZINC001171978817 1049839356 /nfs/dbraw/zinc/83/93/56/1049839356.db2.gz LXYKHVYJZMYIQL-IRLDBZIGSA-N 2 1 349.522 4.492 20 0 EIADMP COCCC1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171985186 1049839798 /nfs/dbraw/zinc/83/97/98/1049839798.db2.gz SSHXXVHXUKVEKV-NRFANRHFSA-N 2 1 344.543 4.178 20 0 EIADMP COC(C)(C)[C@H]1CCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987837 1049839943 /nfs/dbraw/zinc/83/99/43/1049839943.db2.gz KJTYTZZLFJIPIK-VQTJNVASSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@H]1CCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987837 1049839950 /nfs/dbraw/zinc/83/99/50/1049839950.db2.gz KJTYTZZLFJIPIK-VQTJNVASSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@H]1CCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987837 1049839953 /nfs/dbraw/zinc/83/99/53/1049839953.db2.gz KJTYTZZLFJIPIK-VQTJNVASSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@H]1CCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987837 1049839956 /nfs/dbraw/zinc/83/99/56/1049839956.db2.gz KJTYTZZLFJIPIK-VQTJNVASSA-N 2 1 344.543 4.319 20 0 EIADMP F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076902 1049844613 /nfs/dbraw/zinc/84/46/13/1049844613.db2.gz AWJNNIBMTYBDAG-QKKHWQHCSA-N 2 1 328.475 4.004 20 0 EIADMP F[C@H]1C[C@@H]2C[C@H]1C[N@H+]2[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076902 1049844616 /nfs/dbraw/zinc/84/46/16/1049844616.db2.gz AWJNNIBMTYBDAG-QKKHWQHCSA-N 2 1 328.475 4.004 20 0 EIADMP F[C@H]1C[C@@H]2C[C@H]1C[NH+]2[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076902 1049844619 /nfs/dbraw/zinc/84/46/19/1049844619.db2.gz AWJNNIBMTYBDAG-QKKHWQHCSA-N 2 1 328.475 4.004 20 0 EIADMP F[C@H]1C[C@@H]2C[C@H]1C[NH+]2[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076902 1049844629 /nfs/dbraw/zinc/84/46/29/1049844629.db2.gz AWJNNIBMTYBDAG-QKKHWQHCSA-N 2 1 328.475 4.004 20 0 EIADMP Cc1ccnc(CC[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172073440 1049845085 /nfs/dbraw/zinc/84/50/85/1049845085.db2.gz QYQZTXKQRYITSZ-NUNAXRQHSA-N 2 1 349.522 4.108 20 0 EIADMP FC1(F)CC2(C[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)C1 ZINC001172081027 1049846363 /nfs/dbraw/zinc/84/63/63/1049846363.db2.gz ZHKNPLOIFNYULR-REPLKXPHSA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)CC2(C[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4Cc3ccccc3)C2)C1 ZINC001172081027 1049846364 /nfs/dbraw/zinc/84/63/64/1049846364.db2.gz ZHKNPLOIFNYULR-REPLKXPHSA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172080354 1049846450 /nfs/dbraw/zinc/84/64/50/1049846450.db2.gz ULCWQNDYCAQYNX-REPLKXPHSA-N 2 1 334.454 4.303 20 0 EIADMP FC1(F)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172080354 1049846451 /nfs/dbraw/zinc/84/64/51/1049846451.db2.gz ULCWQNDYCAQYNX-REPLKXPHSA-N 2 1 334.454 4.303 20 0 EIADMP CO[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H](C)C1 ZINC001172089916 1049848443 /nfs/dbraw/zinc/84/84/43/1049848443.db2.gz SSJAVIZOBKQIMN-MIUGBVLSSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H](C)C1 ZINC001172089916 1049848444 /nfs/dbraw/zinc/84/84/44/1049848444.db2.gz SSJAVIZOBKQIMN-MIUGBVLSSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@H](C)C1 ZINC001172089916 1049848445 /nfs/dbraw/zinc/84/84/45/1049848445.db2.gz SSJAVIZOBKQIMN-MIUGBVLSSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@H](C)C1 ZINC001172089916 1049848450 /nfs/dbraw/zinc/84/84/50/1049848450.db2.gz SSJAVIZOBKQIMN-MIUGBVLSSA-N 2 1 342.527 4.071 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2(c4ccncc4)CC2)C3)cc1 ZINC001172066198 1049851090 /nfs/dbraw/zinc/85/10/90/1049851090.db2.gz UTLUNTCXXTUYCW-DKUWSORSSA-N 2 1 347.506 4.246 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2(c4ccncc4)CC2)C3)cc1 ZINC001172066198 1049851095 /nfs/dbraw/zinc/85/10/95/1049851095.db2.gz UTLUNTCXXTUYCW-DKUWSORSSA-N 2 1 347.506 4.246 20 0 EIADMP c1cc(CC[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cs1 ZINC001172064681 1049851571 /nfs/dbraw/zinc/85/15/71/1049851571.db2.gz IVKCNOYSJKXWHP-WKCHPHFGSA-N 2 1 340.536 4.466 20 0 EIADMP [NH3+]CCc1cccc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172065173 1049851889 /nfs/dbraw/zinc/85/18/89/1049851889.db2.gz IONNYFPKDPKCCU-WBDAEOGXSA-N 2 1 349.522 4.185 20 0 EIADMP Cc1ccnc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172070002 1049853130 /nfs/dbraw/zinc/85/31/30/1049853130.db2.gz ZOGCIJOAMZSMRR-MMVMTREESA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccnc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172070002 1049853133 /nfs/dbraw/zinc/85/31/33/1049853133.db2.gz ZOGCIJOAMZSMRR-MMVMTREESA-N 2 1 335.495 4.065 20 0 EIADMP C[C@@]1(CF)CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070207 1049853658 /nfs/dbraw/zinc/85/36/58/1049853658.db2.gz XRPCYOGEKCQSTN-BQJUDKOJSA-N 2 1 330.491 4.254 20 0 EIADMP C[C@@]1(CF)CC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070207 1049853661 /nfs/dbraw/zinc/85/36/61/1049853661.db2.gz XRPCYOGEKCQSTN-BQJUDKOJSA-N 2 1 330.491 4.254 20 0 EIADMP C[C@@]1(CF)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070207 1049853667 /nfs/dbraw/zinc/85/36/67/1049853667.db2.gz XRPCYOGEKCQSTN-BQJUDKOJSA-N 2 1 330.491 4.254 20 0 EIADMP C[C@@]1(CF)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070207 1049853670 /nfs/dbraw/zinc/85/36/70/1049853670.db2.gz XRPCYOGEKCQSTN-BQJUDKOJSA-N 2 1 330.491 4.254 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)C2 ZINC001172105746 1049856641 /nfs/dbraw/zinc/85/66/41/1049856641.db2.gz KARUCVQYMGEBFW-PHZGNYQRSA-N 2 1 346.824 4.464 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3ccc(Br)cc3)CC1)C2 ZINC001172104266 1049856701 /nfs/dbraw/zinc/85/67/01/1049856701.db2.gz BDWUUPZMRKMREG-BJWYYQGGSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3ccc(Br)cc3)CC1)C2 ZINC001172104266 1049856703 /nfs/dbraw/zinc/85/67/03/1049856703.db2.gz BDWUUPZMRKMREG-BJWYYQGGSA-N 2 1 349.316 4.043 20 0 EIADMP COc1cccc(CC2(C[NH2+][C@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CCC2)c1 ZINC001172110319 1049857199 /nfs/dbraw/zinc/85/71/99/1049857199.db2.gz JSKOEHNKVMEDOZ-ACDBMABISA-N 2 1 342.527 4.013 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](N[C@H](c1ccccc1)[C@@H]([NH3+])c1ccccc1)C2 ZINC001172119427 1049858040 /nfs/dbraw/zinc/85/80/40/1049858040.db2.gz ZQJMJDQJRVPUSB-USWKJHDZSA-N 2 1 349.522 4.033 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3ccc(C(F)(F)F)cc3)CC1)C2 ZINC001172119003 1049858143 /nfs/dbraw/zinc/85/81/43/1049858143.db2.gz USVQQUOBKOFQPG-OSYLJGHBSA-N 2 1 338.417 4.299 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3ccc(C(F)(F)F)cc3)CC1)C2 ZINC001172119003 1049858144 /nfs/dbraw/zinc/85/81/44/1049858144.db2.gz USVQQUOBKOFQPG-OSYLJGHBSA-N 2 1 338.417 4.299 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1ccccc1)c1ccc(O)cc1)C2 ZINC001172118786 1049858437 /nfs/dbraw/zinc/85/84/37/1049858437.db2.gz SVLXVBSWYRCODC-KEZQHZCBSA-N 2 1 336.479 4.087 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccc(O)cc1)C2 ZINC001172118784 1049858935 /nfs/dbraw/zinc/85/89/35/1049858935.db2.gz SVLXVBSWYRCODC-IIZPIQPGSA-N 2 1 336.479 4.087 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1ccccc1)c1ccc(O)cc1)C2 ZINC001172118787 1049859310 /nfs/dbraw/zinc/85/93/10/1049859310.db2.gz SVLXVBSWYRCODC-XAPVIXHLSA-N 2 1 336.479 4.087 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001172322108 1049878488 /nfs/dbraw/zinc/87/84/88/1049878488.db2.gz RUIJTUXHWIEHBU-SVFBPWRDSA-N 2 1 332.532 4.082 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338325 1049888190 /nfs/dbraw/zinc/88/81/90/1049888190.db2.gz YITITDVMSAJPDY-KOUHRCEDSA-N 2 1 332.532 4.352 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001172340456 1049889089 /nfs/dbraw/zinc/88/90/89/1049889089.db2.gz KBARCGNPTXHPAJ-OALUTQOASA-N 2 1 332.532 4.177 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001172352501 1049891907 /nfs/dbraw/zinc/89/19/07/1049891907.db2.gz RMBMFKDIESEKDC-OALUTQOASA-N 2 1 332.532 4.224 20 0 EIADMP CC(C)COCC[C@@H](C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001172471174 1049908424 /nfs/dbraw/zinc/90/84/24/1049908424.db2.gz QTCZLVHHCSFROQ-LJQANCHMSA-N 2 1 332.532 4.034 20 0 EIADMP CC(C)COCC[C@@H](C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172475349 1049908798 /nfs/dbraw/zinc/90/87/98/1049908798.db2.gz IMVNEBDQPIPAAC-HXUWFJFHSA-N 2 1 346.559 4.282 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172456910 1049916178 /nfs/dbraw/zinc/91/61/78/1049916178.db2.gz JLWADPOVWBJSBC-QKNQBKEWSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172456910 1049916185 /nfs/dbraw/zinc/91/61/85/1049916185.db2.gz JLWADPOVWBJSBC-QKNQBKEWSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)OCC[C@@H](C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172457146 1049916462 /nfs/dbraw/zinc/91/64/62/1049916462.db2.gz RUOOBXBXJNKAKP-LJQANCHMSA-N 2 1 332.532 4.034 20 0 EIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccc3ccc(-c4ccccc4)nc3c2)CC[C@@H]1F ZINC001206164548 1049918151 /nfs/dbraw/zinc/91/81/51/1049918151.db2.gz KJNRYCBRSYEWMW-PMACEKPBSA-N 2 1 349.453 4.163 20 0 EIADMP CC(C)COCC[C@@H](C)[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172467179 1049919142 /nfs/dbraw/zinc/91/91/42/1049919142.db2.gz IVMOEAGMUDMLMZ-HMXCVIKNSA-N 2 1 332.532 4.210 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+]([C@H]2CC[C@@H](c3ccccc3)C2)C2CCOCC2)CC1 ZINC001172556403 1049932514 /nfs/dbraw/zinc/93/25/14/1049932514.db2.gz LXLDGVHWGWNVML-VMBXEPDQSA-N 2 1 342.527 4.074 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC001172546726 1049946785 /nfs/dbraw/zinc/94/67/85/1049946785.db2.gz PHGFMRLCTISBTC-WWNPGLIZSA-N 2 1 334.507 4.434 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172577616 1049951129 /nfs/dbraw/zinc/95/11/29/1049951129.db2.gz VUUXLRPIAUPLKK-GFCCVEGCSA-N 2 1 330.850 4.013 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc2ccccc2n1 ZINC000246879392 1050004266 /nfs/dbraw/zinc/00/42/66/1050004266.db2.gz DXRAEQFAPDHHRN-QZTJIDSGSA-N 2 1 325.500 4.398 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1 ZINC000247330457 1050021494 /nfs/dbraw/zinc/02/14/94/1050021494.db2.gz MLCNDENILSQPLH-RIFZZMRRSA-N 2 1 344.524 4.490 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1 ZINC000247330457 1050021499 /nfs/dbraw/zinc/02/14/99/1050021499.db2.gz MLCNDENILSQPLH-RIFZZMRRSA-N 2 1 344.524 4.490 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@H](C)C1 ZINC000090046501 1050152694 /nfs/dbraw/zinc/15/26/94/1050152694.db2.gz AADPSAOILARXLX-NVXWUHKLSA-N 2 1 335.561 4.053 20 0 EIADMP C[NH+]1CCC2(CC[N@H+](C3CCC(Cc4ccccc4)CC3)C2)CC1 ZINC001172825055 1050164012 /nfs/dbraw/zinc/16/40/12/1050164012.db2.gz NVULSQMRZKAYAF-UHFFFAOYSA-N 2 1 326.528 4.206 20 0 EIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC001206297311 1050168761 /nfs/dbraw/zinc/16/87/61/1050168761.db2.gz XOEJTDQWTDNJOQ-QFIPXVFZSA-N 2 1 338.495 4.217 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH2+]C1(C)CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001172839783 1050177818 /nfs/dbraw/zinc/17/78/18/1050177818.db2.gz XBEPDGKTHFQTDK-QHCPKHFHSA-N 2 1 348.534 4.497 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCCC[C@H]34)cc2)c1 ZINC001177303100 1050180500 /nfs/dbraw/zinc/18/05/00/1050180500.db2.gz CARGDNOLROFULN-NHCUHLMSSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+]4CCCC[C@H]34)cc2)c1 ZINC001177303100 1050180506 /nfs/dbraw/zinc/18/05/06/1050180506.db2.gz CARGDNOLROFULN-NHCUHLMSSA-N 2 1 340.442 4.334 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2c(Cl)cccc2N(C)C)C1 ZINC001177299708 1050180763 /nfs/dbraw/zinc/18/07/63/1050180763.db2.gz ZTVCSEKEBQDAAK-INIZCTEOSA-N 2 1 337.939 4.008 20 0 EIADMP C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001172849775 1050187877 /nfs/dbraw/zinc/18/78/77/1050187877.db2.gz PNGUXNBKNGAPCJ-CABCVRRESA-N 2 1 326.887 4.251 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cccc3cccnc32)C1 ZINC000251600662 1050193430 /nfs/dbraw/zinc/19/34/30/1050193430.db2.gz BRTAYIONMNVZOM-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cccc3cccnc32)C1 ZINC000251600662 1050193435 /nfs/dbraw/zinc/19/34/35/1050193435.db2.gz BRTAYIONMNVZOM-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCC[C@](C[NH2+]C2CCC3(COC(C)(C)C3)CC2)([NH+](C)C)C1 ZINC001177441403 1050219412 /nfs/dbraw/zinc/21/94/12/1050219412.db2.gz ALTXUIWVQFKMDQ-CZOVOBHWSA-N 2 1 336.564 4.214 20 0 EIADMP C[C@H]1CCC[C@@](C[NH2+]C2CCC3(COC(C)(C)C3)CC2)([NH+](C)C)C1 ZINC001177441405 1050220247 /nfs/dbraw/zinc/22/02/47/1050220247.db2.gz ALTXUIWVQFKMDQ-QUWFBVPJSA-N 2 1 336.564 4.214 20 0 EIADMP CO[C@H]1CCC[C@@H]([N@@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928118 1050238831 /nfs/dbraw/zinc/23/88/31/1050238831.db2.gz IXZRQQUZHITUAG-NCYKPQTJSA-N 2 1 330.516 4.025 20 0 EIADMP [NH3+][C@@H]1CC[N@@H+](Cc2ccc(Oc3ccc(Cl)cc3)cc2)CC[C@H]1F ZINC001206187044 1050265691 /nfs/dbraw/zinc/26/56/91/1050265691.db2.gz SPPOBVFIHDKCNA-RTBURBONSA-N 2 1 348.849 4.394 20 0 EIADMP CC(C)(C)C[N@H+](C1CCC2(CCOCC2)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173044781 1050271076 /nfs/dbraw/zinc/27/10/76/1050271076.db2.gz WXESNGUOQORXMM-IYARVYRRSA-N 2 1 336.564 4.344 20 0 EIADMP Cc1cc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)ccc1Cl ZINC001177669167 1050273897 /nfs/dbraw/zinc/27/38/97/1050273897.db2.gz SAIKJPVKBMDQHD-HXUWFJFHSA-N 2 1 342.914 4.303 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@H](Oc3ccccc3C)C2)CC1 ZINC001173112171 1050309656 /nfs/dbraw/zinc/30/96/56/1050309656.db2.gz ROXHEIFSZURQTL-MHJFOBGBSA-N 2 1 330.516 4.101 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H]2c2cccc(OC)c2)CC1 ZINC001173114314 1050310967 /nfs/dbraw/zinc/31/09/67/1050310967.db2.gz GEELUYRMOCCQSE-GRERDSQWSA-N 2 1 330.516 4.485 20 0 EIADMP CNc1ccc(C)cc1C[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC001177875331 1050311326 /nfs/dbraw/zinc/31/13/26/1050311326.db2.gz JFRRQHVAJIZXNI-SFHVURJKSA-N 2 1 337.511 4.352 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001177855570 1050316739 /nfs/dbraw/zinc/31/67/39/1050316739.db2.gz ZDJAZJKCIAAODB-WOIUINJBSA-N 2 1 344.518 4.391 20 0 EIADMP COC1CC[NH+](C2(C[NH2+]C3CCC4(CCC4)CC3)CCCC2)CC1 ZINC001177894199 1050321473 /nfs/dbraw/zinc/32/14/73/1050321473.db2.gz QEGPJVXSOGOHJQ-UHFFFAOYSA-N 2 1 334.548 4.113 20 0 EIADMP CCc1ccc(C[C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC001173236937 1050393534 /nfs/dbraw/zinc/39/35/34/1050393534.db2.gz GEKTVFKHLODGKI-IBGZPJMESA-N 2 1 336.523 4.434 20 0 EIADMP CCc1ccc(C[C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001173237249 1050393649 /nfs/dbraw/zinc/39/36/49/1050393649.db2.gz GPIMETLQGHZWRZ-XXBNENTESA-N 2 1 336.523 4.292 20 0 EIADMP Cc1cc(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)cc(C)c1Br ZINC001206317869 1050394910 /nfs/dbraw/zinc/39/49/10/1050394910.db2.gz KCDWYSAQOAJKQL-QGZVFWFLSA-N 2 1 339.321 4.017 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC001178249776 1050409986 /nfs/dbraw/zinc/40/99/86/1050409986.db2.gz VBTNLSRYZNJREI-INIZCTEOSA-N 2 1 342.449 4.471 20 0 EIADMP CC(C)([NH3+])CC[NH2+]CCC(C)(C)[NH2+][C@H]1CCCC2(CCCCC2)C1 ZINC001173338639 1050428054 /nfs/dbraw/zinc/42/80/54/1050428054.db2.gz BODDESKZZWOBDK-SFHVURJKSA-N 3 1 337.596 4.355 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1(C)C ZINC001178430249 1050455474 /nfs/dbraw/zinc/45/54/74/1050455474.db2.gz CUOSDILMSHZBOU-AYWYSENESA-N 2 1 344.543 4.221 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1(C)C ZINC001178430249 1050455479 /nfs/dbraw/zinc/45/54/79/1050455479.db2.gz CUOSDILMSHZBOU-AYWYSENESA-N 2 1 344.543 4.221 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CCC[N@@H+](C)CC1 ZINC001173541799 1050474668 /nfs/dbraw/zinc/47/46/68/1050474668.db2.gz DAOQWMZFJIOVAQ-HIFRSBDPSA-N 2 1 329.315 4.388 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2cc(F)ccc2o1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001178457877 1050475527 /nfs/dbraw/zinc/47/55/27/1050475527.db2.gz FUPRIRFMPMCBMP-HUUCEWRRSA-N 2 1 330.447 4.315 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2cc(F)ccc2o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001178457877 1050475541 /nfs/dbraw/zinc/47/55/41/1050475541.db2.gz FUPRIRFMPMCBMP-HUUCEWRRSA-N 2 1 330.447 4.315 20 0 EIADMP C[N@@H+](CC1CC[NH+](C)CC1)C1CCC2(CCc3ccccc32)CC1 ZINC001173690408 1050543096 /nfs/dbraw/zinc/54/30/96/1050543096.db2.gz SHBYSDSLNQADDB-UHFFFAOYSA-N 2 1 326.528 4.087 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1nc2c(s1)CCCC2 ZINC000093398279 1050587298 /nfs/dbraw/zinc/58/72/98/1050587298.db2.gz KSBHPZQJGDIKMT-HOTGVXAUSA-N 2 1 335.561 4.185 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000093644485 1050647113 /nfs/dbraw/zinc/64/71/13/1050647113.db2.gz PHRNZPDSLIKRCC-XLIONFOSSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000093644485 1050647119 /nfs/dbraw/zinc/64/71/19/1050647119.db2.gz PHRNZPDSLIKRCC-XLIONFOSSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000093644485 1050647125 /nfs/dbraw/zinc/64/71/25/1050647125.db2.gz PHRNZPDSLIKRCC-XLIONFOSSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000093644485 1050647128 /nfs/dbraw/zinc/64/71/28/1050647128.db2.gz PHRNZPDSLIKRCC-XLIONFOSSA-N 2 1 338.495 4.277 20 0 EIADMP Clc1ccc(C[NH2+][C@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)o1 ZINC001179771854 1050766846 /nfs/dbraw/zinc/76/68/46/1050766846.db2.gz ONNNXMDUSDDZNF-SQNIBIBYSA-N 2 1 344.886 4.323 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c1 ZINC001179816794 1050785188 /nfs/dbraw/zinc/78/51/88/1050785188.db2.gz NTXGFHPXNHPHEP-HLAWJBBLSA-N 2 1 330.516 4.076 20 0 EIADMP CCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877781 1050815728 /nfs/dbraw/zinc/81/57/28/1050815728.db2.gz JQLRXLIWTXDPBN-FQEVSTJZSA-N 2 1 330.516 4.092 20 0 EIADMP CCCOc1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877781 1050815733 /nfs/dbraw/zinc/81/57/33/1050815733.db2.gz JQLRXLIWTXDPBN-FQEVSTJZSA-N 2 1 330.516 4.092 20 0 EIADMP C[C@@H]1Cc2cc(C[N@@H+]3CCC[C@H](C[NH+]4CCCC[C@H]4C)C3)ccc2O1 ZINC001180030180 1050857451 /nfs/dbraw/zinc/85/74/51/1050857451.db2.gz JPMBHSUROZMPTK-GGPKGHCWSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[N@H+]3CCC[C@H](C[NH+]4CCCC[C@H]4C)C3)ccc2O1 ZINC001180030180 1050857463 /nfs/dbraw/zinc/85/74/63/1050857463.db2.gz JPMBHSUROZMPTK-GGPKGHCWSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[NH+]3CCC[C@H](C[N@@H+]4CCCC[C@H]4C)C3)ccc2O1 ZINC001180030180 1050857467 /nfs/dbraw/zinc/85/74/67/1050857467.db2.gz JPMBHSUROZMPTK-GGPKGHCWSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[NH+]3CCC[C@H](C[N@H+]4CCCC[C@H]4C)C3)ccc2O1 ZINC001180030180 1050857471 /nfs/dbraw/zinc/85/74/71/1050857471.db2.gz JPMBHSUROZMPTK-GGPKGHCWSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCc2cccc(Cl)c2)C1 ZINC001180031079 1050860403 /nfs/dbraw/zinc/86/04/03/1050860403.db2.gz UNLDQOOUSDDBFI-HKUYNNGSSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCc2cccc(Cl)c2)C1 ZINC001180031079 1050860408 /nfs/dbraw/zinc/86/04/08/1050860408.db2.gz UNLDQOOUSDDBFI-HKUYNNGSSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCc2cccc(Cl)c2)C1 ZINC001180031079 1050860417 /nfs/dbraw/zinc/86/04/17/1050860417.db2.gz UNLDQOOUSDDBFI-HKUYNNGSSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCc2cccc(Cl)c2)C1 ZINC001180031079 1050860419 /nfs/dbraw/zinc/86/04/19/1050860419.db2.gz UNLDQOOUSDDBFI-HKUYNNGSSA-N 2 1 334.935 4.469 20 0 EIADMP Cc1cc(C)c(/C=C\C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1C ZINC001180082797 1050878861 /nfs/dbraw/zinc/87/88/61/1050878861.db2.gz SWBPQGADZJTFBC-QEVIJRNUSA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C\C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1C ZINC001180082797 1050878867 /nfs/dbraw/zinc/87/88/67/1050878867.db2.gz SWBPQGADZJTFBC-QEVIJRNUSA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C\C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1C ZINC001180082797 1050878874 /nfs/dbraw/zinc/87/88/74/1050878874.db2.gz SWBPQGADZJTFBC-QEVIJRNUSA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1C ZINC001180082797 1050878881 /nfs/dbraw/zinc/87/88/81/1050878881.db2.gz SWBPQGADZJTFBC-QEVIJRNUSA-N 2 1 326.528 4.289 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(OCC)cc2C)CC1 ZINC001180123511 1050892645 /nfs/dbraw/zinc/89/26/45/1050892645.db2.gz BGBZDPDPDFKXJV-UHFFFAOYSA-N 2 1 332.532 4.338 20 0 EIADMP CC[NH+](CC)CC1CC[NH+](Cc2cc(Cl)cc(Cl)c2N)CC1 ZINC001180125147 1050893237 /nfs/dbraw/zinc/89/32/37/1050893237.db2.gz SMUWVAOVFGVYKG-UHFFFAOYSA-N 2 1 344.330 4.129 20 0 EIADMP COc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)c2ccccc12 ZINC000620109491 1051026193 /nfs/dbraw/zinc/02/61/93/1051026193.db2.gz KHZHPTGZUARIME-GOSISDBHSA-N 2 1 340.511 4.450 20 0 EIADMP CCN(Cc1ccc(Cl)nc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076154974 1051116439 /nfs/dbraw/zinc/11/64/39/1051116439.db2.gz NXIQTPMSWCYOOB-IBGZPJMESA-N 2 1 343.902 4.079 20 0 EIADMP CC[N@@H+](Cc1ccc(Cl)nc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076154974 1051116446 /nfs/dbraw/zinc/11/64/46/1051116446.db2.gz NXIQTPMSWCYOOB-IBGZPJMESA-N 2 1 343.902 4.079 20 0 EIADMP CC[N@H+](Cc1ccc(Cl)nc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076154974 1051116457 /nfs/dbraw/zinc/11/64/57/1051116457.db2.gz NXIQTPMSWCYOOB-IBGZPJMESA-N 2 1 343.902 4.079 20 0 EIADMP CC(C)c1ccc(CC[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001181349098 1051215965 /nfs/dbraw/zinc/21/59/65/1051215965.db2.gz KMVCVSOXXRSHGM-QFIPXVFZSA-N 2 1 336.523 4.464 20 0 EIADMP CC[N@H+](CCC[NH+]1CCCC1)Cc1cc(OC)cc(C(F)(F)F)c1 ZINC001181506298 1051242363 /nfs/dbraw/zinc/24/23/63/1051242363.db2.gz PCPUQUBKNUUZDN-UHFFFAOYSA-N 2 1 344.421 4.022 20 0 EIADMP CC[N@@H+](CCC[NH+]1CCCC1)Cc1cc(OC)cc(C(F)(F)F)c1 ZINC001181506298 1051242367 /nfs/dbraw/zinc/24/23/67/1051242367.db2.gz PCPUQUBKNUUZDN-UHFFFAOYSA-N 2 1 344.421 4.022 20 0 EIADMP Cc1ccccc1[C@H](C)[N@H+](C)Cc1ccc(C[NH+]2CCOCC2)cc1 ZINC001175036598 1051327754 /nfs/dbraw/zinc/32/77/54/1051327754.db2.gz UDKZYHHTDVNKIM-IBGZPJMESA-N 2 1 338.495 4.020 20 0 EIADMP Cc1ccccc1[C@H](C)[N@@H+](C)Cc1ccc(C[NH+]2CCOCC2)cc1 ZINC001175036598 1051327768 /nfs/dbraw/zinc/32/77/68/1051327768.db2.gz UDKZYHHTDVNKIM-IBGZPJMESA-N 2 1 338.495 4.020 20 0 EIADMP C([C@@H]1CCC2(CCCCCC2)O1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001191098490 1051348753 /nfs/dbraw/zinc/34/87/53/1051348753.db2.gz CWLBBRDOYPZTJC-PMACEKPBSA-N 2 1 334.548 4.209 20 0 EIADMP C=Cc1ccc(CC[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001181945459 1051359016 /nfs/dbraw/zinc/35/90/16/1051359016.db2.gz MFCASKALIGYAED-AUSIDOKSSA-N 2 1 334.507 4.372 20 0 EIADMP CCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001191164592 1051372125 /nfs/dbraw/zinc/37/21/25/1051372125.db2.gz GXDZCEVPIBNRIG-LEWJYISDSA-N 2 1 344.543 4.308 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1cncs1 ZINC000268772175 1051391681 /nfs/dbraw/zinc/39/16/81/1051391681.db2.gz MAAHBGUBUBQXNZ-IXDOHACOSA-N 2 1 343.540 4.472 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cncs1 ZINC000268772175 1051391696 /nfs/dbraw/zinc/39/16/96/1051391696.db2.gz MAAHBGUBUBQXNZ-IXDOHACOSA-N 2 1 343.540 4.472 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](CCSc2cccc(Cl)c2)C1 ZINC001191255371 1051395908 /nfs/dbraw/zinc/39/59/08/1051395908.db2.gz DRGDFFHZPKHFQK-OAHLLOKOSA-N 2 1 326.937 4.096 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCSc2cccc(Cl)c2)C1 ZINC001191255371 1051395920 /nfs/dbraw/zinc/39/59/20/1051395920.db2.gz DRGDFFHZPKHFQK-OAHLLOKOSA-N 2 1 326.937 4.096 20 0 EIADMP CCC(CC)(CCO)C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000155356326 1051410246 /nfs/dbraw/zinc/41/02/46/1051410246.db2.gz RYIRXXZCVAXVBY-INIZCTEOSA-N 2 1 329.488 4.020 20 0 EIADMP CO[C@H](CC(C)C)C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191358533 1051428312 /nfs/dbraw/zinc/42/83/12/1051428312.db2.gz MMZBVIWRHYQDJR-YADHBBJMSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@H](CC(C)C)C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001191358533 1051428319 /nfs/dbraw/zinc/42/83/19/1051428319.db2.gz MMZBVIWRHYQDJR-YADHBBJMSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@H](CC(C)C)C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001191358533 1051428323 /nfs/dbraw/zinc/42/83/23/1051428323.db2.gz MMZBVIWRHYQDJR-YADHBBJMSA-N 2 1 344.543 4.036 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCOc3cccc(C(C)(C)C)c3)CC[C@@H]21 ZINC001191521354 1051471977 /nfs/dbraw/zinc/47/19/77/1051471977.db2.gz PYFYREOFWSGLPC-NQIIRXRSSA-N 2 1 344.543 4.169 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCOc3cccc(C(C)(C)C)c3)CC[C@@H]21 ZINC001191521354 1051471987 /nfs/dbraw/zinc/47/19/87/1051471987.db2.gz PYFYREOFWSGLPC-NQIIRXRSSA-N 2 1 344.543 4.169 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCOc3cccc(C(C)(C)C)c3)CC[C@@H]21 ZINC001191521354 1051472005 /nfs/dbraw/zinc/47/20/05/1051472005.db2.gz PYFYREOFWSGLPC-NQIIRXRSSA-N 2 1 344.543 4.169 20 0 EIADMP CCO[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]CCC1CCCCC1 ZINC001182423535 1051542994 /nfs/dbraw/zinc/54/29/94/1051542994.db2.gz FTLDOPRCQHMNPV-FGZHOGPDSA-N 2 1 344.543 4.084 20 0 EIADMP CCO[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]CCC1CCCCC1 ZINC001182423535 1051543009 /nfs/dbraw/zinc/54/30/09/1051543009.db2.gz FTLDOPRCQHMNPV-FGZHOGPDSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000774389755 1051588834 /nfs/dbraw/zinc/58/88/34/1051588834.db2.gz DYHOJMJCEGFJKI-NSHDSACASA-N 2 1 342.314 4.101 20 0 EIADMP CCc1nc(CC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cs1 ZINC000157101007 1051596885 /nfs/dbraw/zinc/59/68/85/1051596885.db2.gz BOGBBOKYEPJILH-CQSZACIVSA-N 2 1 340.496 4.093 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000157155302 1051604066 /nfs/dbraw/zinc/60/40/66/1051604066.db2.gz NXUUIZKGTLWBGX-INIZCTEOSA-N 2 1 329.488 4.500 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000775507539 1051648486 /nfs/dbraw/zinc/64/84/86/1051648486.db2.gz AFCGZGZPAULTTK-IEBWSBKVSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000775507539 1051648493 /nfs/dbraw/zinc/64/84/93/1051648493.db2.gz AFCGZGZPAULTTK-IEBWSBKVSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1cccc(C)c1OCCC[N@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001175601860 1051667470 /nfs/dbraw/zinc/66/74/70/1051667470.db2.gz VMIKGDUVRQBSOK-UHFFFAOYSA-N 2 1 346.559 4.372 20 0 EIADMP CCc1cccc(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)c1 ZINC001182683868 1051672608 /nfs/dbraw/zinc/67/26/08/1051672608.db2.gz HNIRKEHWZVVIRX-VABKMULXSA-N 2 1 334.507 4.392 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158121680 1051715810 /nfs/dbraw/zinc/71/58/10/1051715810.db2.gz ILBNBCXINLRJFN-HIFRSBDPSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000158121680 1051715820 /nfs/dbraw/zinc/71/58/20/1051715820.db2.gz ILBNBCXINLRJFN-HIFRSBDPSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@@H]3CCC[N@@H+](C)C3)cs2)cs1 ZINC000158172579 1051722008 /nfs/dbraw/zinc/72/20/08/1051722008.db2.gz QRAPHEGZORWBNI-OCCSQVGLSA-N 2 1 335.542 4.172 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CCCOC(C)(C)C)CC1)CC(C)C ZINC001192490638 1051745445 /nfs/dbraw/zinc/74/54/45/1051745445.db2.gz RNIFOIWSTACPHX-UHFFFAOYSA-N 2 1 326.569 4.272 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](CN(C)Cc3cncc(Cl)c3)C2)s1 ZINC000621291876 1051823266 /nfs/dbraw/zinc/82/32/66/1051823266.db2.gz FNWVRNMUROEPAY-OAHLLOKOSA-N 2 1 349.931 4.059 20 0 EIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc3cc(Br)ccc3c2)CC1 ZINC001205274274 1051863800 /nfs/dbraw/zinc/86/38/00/1051863800.db2.gz UPMQIGPKBUNHOA-SFHVURJKSA-N 2 1 347.300 4.306 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)CC1 ZINC000621766471 1051942233 /nfs/dbraw/zinc/94/22/33/1051942233.db2.gz UBJLYDVLNZTOEK-UHFFFAOYSA-N 2 1 326.406 4.159 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](CC)CC1)c1ccc2cc(OC)ccc2c1 ZINC000159288266 1051971275 /nfs/dbraw/zinc/97/12/75/1051971275.db2.gz VGFCCAMAYVTGNS-NRFANRHFSA-N 2 1 326.484 4.373 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000163526896 1051993705 /nfs/dbraw/zinc/99/37/05/1051993705.db2.gz PAEREVOONFGSMC-KRWDZBQOSA-N 2 1 339.483 4.108 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1ccc(OC(F)(F)F)cc1 ZINC000163522157 1051994136 /nfs/dbraw/zinc/99/41/36/1051994136.db2.gz MKZSIVKDXQNDJD-UHFFFAOYSA-N 2 1 341.377 4.002 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1ccc(OC(F)(F)F)cc1 ZINC000163522157 1051994149 /nfs/dbraw/zinc/99/41/49/1051994149.db2.gz MKZSIVKDXQNDJD-UHFFFAOYSA-N 2 1 341.377 4.002 20 0 EIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12 ZINC001184386272 1052001966 /nfs/dbraw/zinc/00/19/66/1052001966.db2.gz AMWFWTLGJPVKGC-OCYFJXFZSA-N 2 1 334.507 4.214 20 0 EIADMP C[C@H]1CCC[C@@H](C[N@@H+]2CCC[NH+](Cc3ccccc3)CCOCC2)C1 ZINC001176496108 1052076459 /nfs/dbraw/zinc/07/64/59/1052076459.db2.gz NXKQABOALMPCLF-RBBKRZOGSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@H]1CCC[C@@H](C[N@H+]2CCC[NH+](Cc3ccccc3)CCOCC2)C1 ZINC001176496108 1052076474 /nfs/dbraw/zinc/07/64/74/1052076474.db2.gz NXKQABOALMPCLF-RBBKRZOGSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@H]1CCC[C@@H](C[NH+]2CCC[N@H+](Cc3ccccc3)CCOCC2)C1 ZINC001176496108 1052076486 /nfs/dbraw/zinc/07/64/86/1052076486.db2.gz NXKQABOALMPCLF-RBBKRZOGSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@H]1CCC[C@@H](C[NH+]2CCC[N@@H+](Cc3ccccc3)CCOCC2)C1 ZINC001176496108 1052076505 /nfs/dbraw/zinc/07/65/05/1052076505.db2.gz NXKQABOALMPCLF-RBBKRZOGSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000167510981 1052120574 /nfs/dbraw/zinc/12/05/74/1052120574.db2.gz PEXOPKSNMZTDDZ-XFQAVAEZSA-N 2 1 348.494 4.048 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000174247639 1052563617 /nfs/dbraw/zinc/56/36/17/1052563617.db2.gz MNSIMTLEPHWHRR-UHFFFAOYSA-N 2 1 338.495 4.325 20 0 EIADMP COc1cc(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)ccc1Cl ZINC000623356753 1052631282 /nfs/dbraw/zinc/63/12/82/1052631282.db2.gz FLMPSYQYPSDHGE-UHFFFAOYSA-N 2 1 346.902 4.479 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1OC ZINC000177899420 1052693301 /nfs/dbraw/zinc/69/33/01/1052693301.db2.gz OKWRACFXKHFAJR-QGZVFWFLSA-N 2 1 348.531 4.398 20 0 EIADMP CO[C@H](C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccccc1 ZINC000178458215 1052706051 /nfs/dbraw/zinc/70/60/51/1052706051.db2.gz YHSQQJFIAILUPY-HRAATJIYSA-N 2 1 335.451 4.219 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H](C)Cn2cc[nH+]c2C)c2ccccc12 ZINC000178698627 1052711536 /nfs/dbraw/zinc/71/15/36/1052711536.db2.gz VSZYMPOIUZTXHU-HOTGVXAUSA-N 2 1 337.467 4.340 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cc(C)ccc1OC(F)F ZINC000178698335 1052711613 /nfs/dbraw/zinc/71/16/13/1052711613.db2.gz RTFNLQJAQWAKPP-KGLIPLIRSA-N 2 1 337.414 4.088 20 0 EIADMP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000623755267 1052779175 /nfs/dbraw/zinc/77/91/75/1052779175.db2.gz ABWLZIDAEWAULR-VCBZYWHSSA-N 2 1 343.902 4.415 20 0 EIADMP Clc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000623854707 1052826670 /nfs/dbraw/zinc/82/66/70/1052826670.db2.gz GTMFHKLIJHUEQA-LJQANCHMSA-N 2 1 343.902 4.415 20 0 EIADMP Cc1csc([C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)n1 ZINC000623924196 1052838816 /nfs/dbraw/zinc/83/88/16/1052838816.db2.gz VLRCZIRXESRYOW-JENIJYKNSA-N 2 1 343.540 4.403 20 0 EIADMP CC[C@@H](C)Oc1cc(C[NH2+]CCC[N@@H+]2CCCC[C@H]2C)ccc1OC ZINC000624019693 1052853578 /nfs/dbraw/zinc/85/35/78/1052853578.db2.gz YIUNLZNOUJRHFS-QZTJIDSGSA-N 2 1 348.531 4.227 20 0 EIADMP CC[C@@H](C)Oc1cc(C[NH2+]CCC[N@H+]2CCCC[C@H]2C)ccc1OC ZINC000624019693 1052853580 /nfs/dbraw/zinc/85/35/80/1052853580.db2.gz YIUNLZNOUJRHFS-QZTJIDSGSA-N 2 1 348.531 4.227 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]C[C@@H](C)Cn3cc[nH+]c3C)oc21 ZINC000181693043 1052893168 /nfs/dbraw/zinc/89/31/68/1052893168.db2.gz UHRAIYOBJFDPCZ-CABCVRRESA-N 2 1 341.455 4.323 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCC[C@@H]2CCCCO2)cc1 ZINC000183989262 1052988907 /nfs/dbraw/zinc/98/89/07/1052988907.db2.gz RMUKVYZBMRWVBY-JXFKEZNVSA-N 2 1 327.472 4.181 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1OC(F)F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185667317 1053019907 /nfs/dbraw/zinc/01/99/07/1053019907.db2.gz TXDPUTOSPAVHRN-HOCLYGCPSA-N 2 1 338.442 4.031 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1OC(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185667317 1053019911 /nfs/dbraw/zinc/01/99/11/1053019911.db2.gz TXDPUTOSPAVHRN-HOCLYGCPSA-N 2 1 338.442 4.031 20 0 EIADMP C[C@H]([NH2+]CCSc1ccc(F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185706586 1053021005 /nfs/dbraw/zinc/02/10/05/1053021005.db2.gz DKESLWHYHAKWCM-JKSUJKDBSA-N 2 1 336.520 4.160 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000381131100 1053054546 /nfs/dbraw/zinc/05/45/46/1053054546.db2.gz KHCIPDQMARXAJU-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@@H]([NH2+]C1CC(c2ccccc2)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381292741 1053063457 /nfs/dbraw/zinc/06/34/57/1053063457.db2.gz XSUKPMYVVGHJHO-BVRQVQABSA-N 2 1 334.507 4.433 20 0 EIADMP c1ccc(CC2CC[NH+](CCC[N@H+]3CCC[C@H](C4CC4)C3)CC2)cc1 ZINC001194806912 1053108159 /nfs/dbraw/zinc/10/81/59/1053108159.db2.gz NWYZQTHOQDFEJR-QHCPKHFHSA-N 2 1 340.555 4.453 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc2ccccc2[nH]1 ZINC000775628275 1053220231 /nfs/dbraw/zinc/22/02/31/1053220231.db2.gz QSTOMFVCZAVHFI-QUCCMNQESA-N 2 1 347.506 4.383 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000339070113 1053320692 /nfs/dbraw/zinc/32/06/92/1053320692.db2.gz WPWCKUPRTRSTIP-IIZPIQPGSA-N 2 1 344.543 4.112 20 0 EIADMP COc1ccc(CC[C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000764963356 1053397844 /nfs/dbraw/zinc/39/78/44/1053397844.db2.gz NRHJYGAQVXGWIT-MOPGFXCFSA-N 2 1 332.532 4.261 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cnn(-c2ccccc2)c1 ZINC000764965134 1053402349 /nfs/dbraw/zinc/40/23/49/1053402349.db2.gz URPKBSGTXBHZTN-MOPGFXCFSA-N 2 1 340.515 4.178 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)cc2)cs1 ZINC000339072185 1053476566 /nfs/dbraw/zinc/47/65/66/1053476566.db2.gz UQOGSYJIWKPCHE-JVPBZIDWSA-N 2 1 341.524 4.396 20 0 EIADMP Fc1cccc2cc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)cnc12 ZINC000865480515 1053520345 /nfs/dbraw/zinc/52/03/45/1053520345.db2.gz ONDVJNOBBASEGZ-UHFFFAOYSA-N 2 1 341.474 4.261 20 0 EIADMP C[C@H]([NH2+]Cc1cnc2c(F)cccc2c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000865523485 1053534206 /nfs/dbraw/zinc/53/42/06/1053534206.db2.gz CFQLRQRFCUOGFV-YJBOKZPZSA-N 2 1 341.474 4.117 20 0 EIADMP C[C@]1(C[NH2+]Cc2ccc(C(F)F)nc2)CC[N@H+](Cc2ccccc2)C1 ZINC000865555380 1053546675 /nfs/dbraw/zinc/54/66/75/1053546675.db2.gz YTCVZXHBBBPMKZ-HXUWFJFHSA-N 2 1 345.437 4.021 20 0 EIADMP C[C@]1(C[NH2+]Cc2ccc(C(F)F)nc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000865555380 1053546683 /nfs/dbraw/zinc/54/66/83/1053546683.db2.gz YTCVZXHBBBPMKZ-HXUWFJFHSA-N 2 1 345.437 4.021 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]CC[C@H]3CCCS3)CC23CC3)cc1 ZINC000865725616 1053578437 /nfs/dbraw/zinc/57/84/37/1053578437.db2.gz NCPJRROVXDZHGU-RTBURBONSA-N 2 1 330.541 4.059 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]CC[C@H]3CCCS3)CC23CC3)cc1 ZINC000865725616 1053578456 /nfs/dbraw/zinc/57/84/56/1053578456.db2.gz NCPJRROVXDZHGU-RTBURBONSA-N 2 1 330.541 4.059 20 0 EIADMP Fc1ccccc1C1CC([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000386065341 1053578870 /nfs/dbraw/zinc/57/88/70/1053578870.db2.gz FGECBNQUSKWFAQ-XEVCZEQESA-N 2 1 338.470 4.183 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1c(Cl)n[nH]c1C1CC1 ZINC000921526415 1053585042 /nfs/dbraw/zinc/58/50/42/1053585042.db2.gz DPSRZTJMWAESMN-UHFFFAOYSA-N 2 1 346.906 4.071 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1c(Cl)n[nH]c1C1CC1 ZINC000921526415 1053585056 /nfs/dbraw/zinc/58/50/56/1053585056.db2.gz DPSRZTJMWAESMN-UHFFFAOYSA-N 2 1 346.906 4.071 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]CCCCc1cccc(C(F)(F)F)c1 ZINC000338954210 1053624849 /nfs/dbraw/zinc/62/48/49/1053624849.db2.gz JXSOTNBBTXFLJU-UHFFFAOYSA-N 2 1 339.405 4.213 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)c(C)o1 ZINC000120945761 1053650196 /nfs/dbraw/zinc/65/01/96/1053650196.db2.gz XUWSXIPTBNBLLA-UHFFFAOYSA-N 2 1 338.451 4.411 20 0 EIADMP Fc1cccc2c1SCC[C@@H]2[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000853239142 1053656298 /nfs/dbraw/zinc/65/62/98/1053656298.db2.gz ATHQDANHRUPJMJ-YJBOKZPZSA-N 2 1 334.504 4.074 20 0 EIADMP Fc1cccc2c1SCC[C@@H]2[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000853239142 1053656299 /nfs/dbraw/zinc/65/62/99/1053656299.db2.gz ATHQDANHRUPJMJ-YJBOKZPZSA-N 2 1 334.504 4.074 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866372467 1053708157 /nfs/dbraw/zinc/70/81/57/1053708157.db2.gz GXFDBBBDCSNYRZ-IFMALSPDSA-N 2 1 337.511 4.077 20 0 EIADMP CCC1([NH+]2CCCC2)CC[NH+](C[C@H]2CC[C@@H](c3ccccc3)O2)CC1 ZINC001196727899 1053732777 /nfs/dbraw/zinc/73/27/77/1053732777.db2.gz OBCNSIVWICNIAK-RTWAWAEBSA-N 2 1 342.527 4.247 20 0 EIADMP Cc1ccccc1OCCC[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001196936795 1053808233 /nfs/dbraw/zinc/80/82/33/1053808233.db2.gz URXHYNOHPVLKGT-OAQYLSRUSA-N 2 1 344.543 4.350 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2c(Cl)n[nH]c2C2CC2)c1 ZINC000921551887 1053845918 /nfs/dbraw/zinc/84/59/18/1053845918.db2.gz RAPXKRIGGQCGEI-UHFFFAOYSA-N 2 1 346.906 4.072 20 0 EIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1cccc(F)c1OC(F)F ZINC001197284817 1053875857 /nfs/dbraw/zinc/87/58/57/1053875857.db2.gz MHNLPZHYIINFKN-UHFFFAOYSA-N 2 1 344.421 4.125 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+]Cc1cc(F)cc(C(F)(F)F)c1 ZINC001198890964 1054302084 /nfs/dbraw/zinc/30/20/84/1054302084.db2.gz MGZRITVJGPGTIT-UHFFFAOYSA-N 2 1 334.401 4.446 20 0 EIADMP CC[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000872032511 1054350317 /nfs/dbraw/zinc/35/03/17/1054350317.db2.gz VICIDGYXKIORFS-ZWKOTPCHSA-N 2 1 342.449 4.262 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CCOC3(CCCC3)C2)CC1 ZINC000872036359 1054354129 /nfs/dbraw/zinc/35/41/29/1054354129.db2.gz UJUJHQLUUILIJO-NQIIRXRSSA-N 2 1 342.527 4.293 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(OC(F)F)c(F)c1 ZINC001199336158 1054394176 /nfs/dbraw/zinc/39/41/76/1054394176.db2.gz IDTFXUFRASPOAM-AWEZNQCLSA-N 2 1 344.421 4.171 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)CC1(C)C ZINC000858123187 1054421472 /nfs/dbraw/zinc/42/14/72/1054421472.db2.gz YXFWCBHVROGJPD-HNNXBMFYSA-N 2 1 326.406 4.157 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)CC1(C)C ZINC000858123187 1054421480 /nfs/dbraw/zinc/42/14/80/1054421480.db2.gz YXFWCBHVROGJPD-HNNXBMFYSA-N 2 1 326.406 4.157 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1c[nH]c2c1cccc2F ZINC001137059308 1054442820 /nfs/dbraw/zinc/44/28/20/1054442820.db2.gz WGYKMZXCPJAWTJ-IRXDYDNUSA-N 2 1 329.463 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1c[nH]c2c1cccc2F ZINC001137059308 1054442821 /nfs/dbraw/zinc/44/28/21/1054442821.db2.gz WGYKMZXCPJAWTJ-IRXDYDNUSA-N 2 1 329.463 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1c[nH]c2c1cccc2F ZINC001137059308 1054442822 /nfs/dbraw/zinc/44/28/22/1054442822.db2.gz WGYKMZXCPJAWTJ-IRXDYDNUSA-N 2 1 329.463 4.146 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000873200357 1054509539 /nfs/dbraw/zinc/50/95/39/1054509539.db2.gz FECIIOLMBDAHBR-LBPRGKRZSA-N 2 1 343.521 4.197 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000873200357 1054509559 /nfs/dbraw/zinc/50/95/59/1054509559.db2.gz FECIIOLMBDAHBR-LBPRGKRZSA-N 2 1 343.521 4.197 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+]Cc2nc3ccccc3o2)C[N@H+]1Cc1ccccc1 ZINC001201492512 1054818842 /nfs/dbraw/zinc/81/88/42/1054818842.db2.gz QHDZOIDOAGCAKO-HKUYNNGSSA-N 2 1 349.478 4.218 20 0 EIADMP CCC[C@@H](C)C[NH+]1CCC2(CCC[N@H+]2Cc2c(C)noc2C)CC1 ZINC001201542837 1054836588 /nfs/dbraw/zinc/83/65/88/1054836588.db2.gz MBKIDMCAEUYYGY-MRXNPFEDSA-N 2 1 333.520 4.158 20 0 EIADMP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201549385 1054839310 /nfs/dbraw/zinc/83/93/10/1054839310.db2.gz AWHIVGAWEUMRSI-MMKMLUHNSA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201549385 1054839312 /nfs/dbraw/zinc/83/93/12/1054839312.db2.gz AWHIVGAWEUMRSI-MMKMLUHNSA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201549385 1054839313 /nfs/dbraw/zinc/83/93/13/1054839313.db2.gz AWHIVGAWEUMRSI-MMKMLUHNSA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201549385 1054839316 /nfs/dbraw/zinc/83/93/16/1054839316.db2.gz AWHIVGAWEUMRSI-MMKMLUHNSA-N 2 1 329.532 4.050 20 0 EIADMP COc1ccc(C)cc1CN[C@@H](Cn1ccnc1)c1ccc(C)cc1C ZINC001201600807 1054861587 /nfs/dbraw/zinc/86/15/87/1054861587.db2.gz ODLITZXYILMBHY-NRFANRHFSA-N 2 1 349.478 4.348 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201609242 1054863927 /nfs/dbraw/zinc/86/39/27/1054863927.db2.gz FEKULCPALOKNJL-DHIUTWEWSA-N 2 1 334.507 4.073 20 0 EIADMP c1ccc(CC[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201609242 1054863928 /nfs/dbraw/zinc/86/39/28/1054863928.db2.gz FEKULCPALOKNJL-DHIUTWEWSA-N 2 1 334.507 4.073 20 0 EIADMP c1ccc(CC[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201609242 1054863929 /nfs/dbraw/zinc/86/39/29/1054863929.db2.gz FEKULCPALOKNJL-DHIUTWEWSA-N 2 1 334.507 4.073 20 0 EIADMP c1ccc(CCC[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201681701 1054874130 /nfs/dbraw/zinc/87/41/30/1054874130.db2.gz CIZQLBIMNVMSIZ-BJKOFHAPSA-N 2 1 348.534 4.463 20 0 EIADMP c1ccc(CCC[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201681701 1054874134 /nfs/dbraw/zinc/87/41/34/1054874134.db2.gz CIZQLBIMNVMSIZ-BJKOFHAPSA-N 2 1 348.534 4.463 20 0 EIADMP c1ccc(CCC[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201681701 1054874139 /nfs/dbraw/zinc/87/41/39/1054874139.db2.gz CIZQLBIMNVMSIZ-BJKOFHAPSA-N 2 1 348.534 4.463 20 0 EIADMP CSCCC[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3cccs3)[C@H]2C1 ZINC001201680826 1054874305 /nfs/dbraw/zinc/87/43/05/1054874305.db2.gz ODLXIDZCYDFOOY-SZMVWBNQSA-N 2 1 338.586 4.034 20 0 EIADMP CSCCC[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201680826 1054874313 /nfs/dbraw/zinc/87/43/13/1054874313.db2.gz ODLXIDZCYDFOOY-SZMVWBNQSA-N 2 1 338.586 4.034 20 0 EIADMP CSCCC[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201680826 1054874317 /nfs/dbraw/zinc/87/43/17/1054874317.db2.gz ODLXIDZCYDFOOY-SZMVWBNQSA-N 2 1 338.586 4.034 20 0 EIADMP C[C@H]([NH2+]C/C=C\c1cccc(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001201705172 1054882202 /nfs/dbraw/zinc/88/22/02/1054882202.db2.gz XGJFNCNFSCXVHX-NSSQAQOMSA-N 2 1 338.470 4.339 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(-c2cccnc2)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001201946717 1054962611 /nfs/dbraw/zinc/96/26/11/1054962611.db2.gz KTXXNFWZQKJBLR-AVRDEDQJSA-N 2 1 349.522 4.491 20 0 EIADMP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3nc(Cl)cs3)cc2)C1 ZINC000876931344 1054984737 /nfs/dbraw/zinc/98/47/37/1054984737.db2.gz LVWDAGGKKHBPPI-AWEZNQCLSA-N 2 1 349.931 4.318 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3nc(Cl)cs3)cc2)C1 ZINC000876931344 1054984748 /nfs/dbraw/zinc/98/47/48/1054984748.db2.gz LVWDAGGKKHBPPI-AWEZNQCLSA-N 2 1 349.931 4.318 20 0 EIADMP Cc1c(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)ccnc1F ZINC000862251172 1055033518 /nfs/dbraw/zinc/03/35/18/1055033518.db2.gz WUAJQRXHWSJKNB-MRXNPFEDSA-N 2 1 333.495 4.006 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(NC[C@@]3(C)CCCS3)cc2)CC1 ZINC000862261606 1055040208 /nfs/dbraw/zinc/04/02/08/1055040208.db2.gz BEHREGPDXTTXQB-HXUWFJFHSA-N 2 1 347.572 4.162 20 0 EIADMP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000877495658 1055065860 /nfs/dbraw/zinc/06/58/60/1055065860.db2.gz GQOIFDCLTZLKMR-XAEMIUIASA-N 2 1 344.480 4.096 20 0 EIADMP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000877495657 1055066615 /nfs/dbraw/zinc/06/66/15/1055066615.db2.gz GQOIFDCLTZLKMR-UQNRQAKVSA-N 2 1 344.480 4.096 20 0 EIADMP Clc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)nc1 ZINC000776255409 1055089443 /nfs/dbraw/zinc/08/94/43/1055089443.db2.gz WLRXEAXRPXUTCI-UHFFFAOYSA-N 2 1 329.875 4.011 20 0 EIADMP C[C@@]1(C[NH2+]C/C=C/c2ccc(F)cc2)CC[N@@H+](Cc2ccccc2)C1 ZINC001202221002 1055093031 /nfs/dbraw/zinc/09/30/31/1055093031.db2.gz XUTUWIFFHNUYMW-PABBZOGXSA-N 2 1 338.470 4.341 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(C)c(Cl)n2)cc1 ZINC000878368366 1055275307 /nfs/dbraw/zinc/27/53/07/1055275307.db2.gz BEIWPECIMOXPST-CQSZACIVSA-N 2 1 340.858 4.388 20 0 EIADMP C[C@H](Cc1ccccn1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000655834518 1055702363 /nfs/dbraw/zinc/70/23/63/1055702363.db2.gz PHQMRUPKEOVFJT-RLLPEYFOSA-N 2 1 349.522 4.045 20 0 EIADMP COC1CCC(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000542693390 1055834706 /nfs/dbraw/zinc/83/47/06/1055834706.db2.gz WSSPDYOANWSNKT-JJZDCNPZSA-N 2 1 344.543 4.224 20 0 EIADMP COC1CCC(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000542693390 1055834708 /nfs/dbraw/zinc/83/47/08/1055834708.db2.gz WSSPDYOANWSNKT-JJZDCNPZSA-N 2 1 344.543 4.224 20 0 EIADMP C[NH+](C)CC[C@@H]([NH2+][C@H]1Cc2cccc(Cl)c2C1)c1ccccc1 ZINC001168684233 1056719830 /nfs/dbraw/zinc/71/98/30/1056719830.db2.gz HPCXNSUFWIYTPN-FXAWDEMLSA-N 2 1 328.887 4.090 20 0 EIADMP Brc1ccc(C2([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCC2)cc1 ZINC000180439622 1058612335 /nfs/dbraw/zinc/61/23/35/1058612335.db2.gz ZEUIZNQQZUQMGP-DLBZAZTESA-N 2 1 349.316 4.045 20 0 EIADMP COc1ccc(Cl)cc1C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000742691867 1058724706 /nfs/dbraw/zinc/72/47/06/1058724706.db2.gz UMOJIFZJOMRZGL-UHFFFAOYSA-N 2 1 346.902 4.479 20 0 EIADMP FC(F)(F)Sc1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000742717864 1058757437 /nfs/dbraw/zinc/75/74/37/1058757437.db2.gz OMZNQTMYGVBBNP-UHFFFAOYSA-N 2 1 344.446 4.405 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc3cnccc32)CC1 ZINC000183057043 1059905564 /nfs/dbraw/zinc/90/55/64/1059905564.db2.gz RWHQZKKDCUXQHT-UHFFFAOYSA-N 2 1 325.500 4.179 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000746048243 1059985863 /nfs/dbraw/zinc/98/58/63/1059985863.db2.gz ZIRNYBVCPACIEA-UTKZUKDTSA-N 2 1 344.543 4.278 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379638601 1060137001 /nfs/dbraw/zinc/13/70/01/1060137001.db2.gz UQWCRVDEWZETOB-GHTZIAJQSA-N 2 1 338.495 4.146 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379638601 1060137027 /nfs/dbraw/zinc/13/70/27/1060137027.db2.gz UQWCRVDEWZETOB-GHTZIAJQSA-N 2 1 338.495 4.146 20 0 EIADMP C[C@@H](CC[NH2+]Cc1ccc2cnccc2c1)[N@@H+](C)Cc1ccccc1 ZINC000379641188 1060141901 /nfs/dbraw/zinc/14/19/01/1060141901.db2.gz CVVAESXBXDFIRZ-SFHVURJKSA-N 2 1 333.479 4.235 20 0 EIADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1cc(F)cc(F)c1 ZINC001168991194 1060584993 /nfs/dbraw/zinc/58/49/93/1060584993.db2.gz BBYMRWLMASCFDN-HZPDHXFCSA-N 2 1 344.449 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)Cc1cccc(C(F)(F)F)c1)C2 ZINC001169117086 1060647246 /nfs/dbraw/zinc/64/72/46/1060647246.db2.gz VQNPHJXISQCSPG-BJWYYQGGSA-N 2 1 340.433 4.241 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4C)cc2)cc1 ZINC001169107463 1060657969 /nfs/dbraw/zinc/65/79/69/1060657969.db2.gz HJXNNMLGTVNXAC-WKCHPHFGSA-N 2 1 336.479 4.077 20 0 EIADMP 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 1060666559 /nfs/dbraw/zinc/66/65/59/1060666559.db2.gz VSUPYEFXNMBVGX-DZJNRPSUSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CC[C@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147651 1060666561 /nfs/dbraw/zinc/66/65/61/1060666561.db2.gz VSUPYEFXNMBVGX-DZJNRPSUSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CC[C@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147651 1060666566 /nfs/dbraw/zinc/66/65/66/1060666566.db2.gz VSUPYEFXNMBVGX-DZJNRPSUSA-N 2 1 338.417 4.120 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](n1cc(C3CC[NH2+]CC3)c3c1cccc3F)C2 ZINC001169154749 1060670940 /nfs/dbraw/zinc/67/09/40/1060670940.db2.gz UDYQRYKLEYSFEY-FVQHAEBGSA-N 2 1 341.474 4.045 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](n1cc(C3CC[NH2+]CC3)c3cccc(F)c31)C2 ZINC001169155159 1060671206 /nfs/dbraw/zinc/67/12/06/1060671206.db2.gz YTWVTIBMNRDQBY-FVQHAEBGSA-N 2 1 341.474 4.045 20 0 EIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169154947 1060671696 /nfs/dbraw/zinc/67/16/96/1060671696.db2.gz VBBSRQTUACIPOC-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP CC[NH+](Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169154947 1060671699 /nfs/dbraw/zinc/67/16/99/1060671699.db2.gz VBBSRQTUACIPOC-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP CC[NH+](Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169154947 1060671706 /nfs/dbraw/zinc/67/17/06/1060671706.db2.gz VBBSRQTUACIPOC-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP COc1ccc2c(c1)c(CC[NH3+])c(C)n2-c1cccc(C2=[NH+]CCC2)c1 ZINC001169178903 1060687653 /nfs/dbraw/zinc/68/76/53/1060687653.db2.gz DKZFZPMROWWFQI-UHFFFAOYSA-N 2 1 347.462 4.032 20 0 EIADMP FC1(F)CCC[C@@H](Nc2ccc3c(c2)[nH+]cn3[C@@H]2CCC[NH2+]CC2)C1 ZINC001169213867 1060694640 /nfs/dbraw/zinc/69/46/40/1060694640.db2.gz QCMQDAODUHYJMS-HZPDHXFCSA-N 2 1 348.441 4.341 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2cccc(NC(=O)OC(C)(C)C)c2)CC1 ZINC001169222073 1060700418 /nfs/dbraw/zinc/70/04/18/1060700418.db2.gz ZTAHAAGMIHEMOV-OAHLLOKOSA-N 2 1 347.503 4.169 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(c3ccccc3F)CCC(F)(F)CC2)CC1 ZINC001169241359 1060717182 /nfs/dbraw/zinc/71/71/82/1060717182.db2.gz WKJIECRCFSHLMP-UHFFFAOYSA-N 2 1 340.433 4.304 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ccc([C@@H]2CC[N@H+](C)C2)cc1 ZINC001169690537 1060903165 /nfs/dbraw/zinc/90/31/65/1060903165.db2.gz WSWYFEDAXUMUDI-WIYYLYMNSA-N 2 1 335.495 4.346 20 0 EIADMP COc1cc(N2CCCC[C@@H]2CC[NH+]2CCCC2)[nH+]c2ccccc21 ZINC001165046896 721973503 /nfs/dbraw/zinc/97/35/03/721973503.db2.gz CMFLUUFCJUFKMC-QGZVFWFLSA-N 2 1 339.483 4.088 20 0 EIADMP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3ccc4ccccc4n3)CC2)C1 ZINC000532205409 1032075273 /nfs/dbraw/zinc/07/52/73/1032075273.db2.gz SFMXWUSOJOLCMB-LAUBAEHRSA-N 2 1 337.511 4.368 20 0 EIADMP CC(C)=CCOc1ccc(CC[C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000532225968 1032103160 /nfs/dbraw/zinc/10/31/60/1032103160.db2.gz GIPOACTXIFXJGR-CTNGQTDRSA-N 2 1 344.543 4.284 20 0 EIADMP CCCOc1ccccc1[C@H](CC(C)C)[NH2+]CCc1c[nH+]cn1C ZINC000459381067 1032234812 /nfs/dbraw/zinc/23/48/12/1032234812.db2.gz CDZPGHLLVWPKFH-IBGZPJMESA-N 2 1 329.488 4.128 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000194238656 1032246815 /nfs/dbraw/zinc/24/68/15/1032246815.db2.gz UEYMUGYDVCOMGT-UHFFFAOYSA-N 2 1 348.494 4.207 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000194238656 1032246831 /nfs/dbraw/zinc/24/68/31/1032246831.db2.gz UEYMUGYDVCOMGT-UHFFFAOYSA-N 2 1 348.494 4.207 20 0 EIADMP CC[N@@H+](Cc1sc(C)nc1C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174486109 1032402881 /nfs/dbraw/zinc/40/28/81/1032402881.db2.gz JWINSDGBCLRPIW-LJQANCHMSA-N 2 1 343.540 4.104 20 0 EIADMP CC[N@H+](Cc1sc(C)nc1C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174486109 1032402887 /nfs/dbraw/zinc/40/28/87/1032402887.db2.gz JWINSDGBCLRPIW-LJQANCHMSA-N 2 1 343.540 4.104 20 0 EIADMP CC[NH+](Cc1sc(C)nc1C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174486109 1032402894 /nfs/dbraw/zinc/40/28/94/1032402894.db2.gz JWINSDGBCLRPIW-LJQANCHMSA-N 2 1 343.540 4.104 20 0 EIADMP CC[NH+](Cc1sc(C)nc1C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174486109 1032402902 /nfs/dbraw/zinc/40/29/02/1032402902.db2.gz JWINSDGBCLRPIW-LJQANCHMSA-N 2 1 343.540 4.104 20 0 EIADMP CN(Cc1ccoc1)Cc1cc(C[N@H+](C)Cc2ccoc2)ccc1F ZINC000450291404 1032404118 /nfs/dbraw/zinc/40/41/18/1032404118.db2.gz VDMJTTLPRGDVQT-UHFFFAOYSA-N 2 1 342.414 4.276 20 0 EIADMP CN(Cc1ccoc1)Cc1cc(C[N@@H+](C)Cc2ccoc2)ccc1F ZINC000450291404 1032404128 /nfs/dbraw/zinc/40/41/28/1032404128.db2.gz VDMJTTLPRGDVQT-UHFFFAOYSA-N 2 1 342.414 4.276 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529543736 1032434227 /nfs/dbraw/zinc/43/42/27/1032434227.db2.gz NDWNDUSWBSNAGA-BQFCYCMXSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CC(F)(F)C1 ZINC000529543575 1032434697 /nfs/dbraw/zinc/43/46/97/1032434697.db2.gz BHJSBXRGCIBYFW-AQXGTKIOSA-N 2 1 334.454 4.205 20 0 EIADMP C[C@H](c1ccc(C[NH+](C)C[C@H]2CCC[N@H+](C)C2)cc1)C(F)(F)F ZINC000450431108 1032494640 /nfs/dbraw/zinc/49/46/40/1032494640.db2.gz XPOJINKSSNXVRP-ZBFHGGJFSA-N 2 1 328.422 4.126 20 0 EIADMP C[C@H](c1ccc(C[NH+](C)C[C@H]2CCC[N@@H+](C)C2)cc1)C(F)(F)F ZINC000450431108 1032494647 /nfs/dbraw/zinc/49/46/47/1032494647.db2.gz XPOJINKSSNXVRP-ZBFHGGJFSA-N 2 1 328.422 4.126 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccsc3)CC2)cs1 ZINC000178092780 1032519577 /nfs/dbraw/zinc/51/95/77/1032519577.db2.gz BQHOPXBPDKPFQP-CQSZACIVSA-N 2 1 349.569 4.330 20 0 EIADMP CC(C)C1CCC([NH+]2CCN(C[C@H]3CCCC[N@H+]3C(C)C)CC2)CC1 ZINC000450485713 1032527790 /nfs/dbraw/zinc/52/77/90/1032527790.db2.gz KAPCNXWYAVYFAG-LZBANZJXSA-N 2 1 349.607 4.082 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000178706661 1032544251 /nfs/dbraw/zinc/54/42/51/1032544251.db2.gz ZBLQDNLEHAOINM-LSDHHAIUSA-N 2 1 340.496 4.302 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccc(Cl)nc2)cc1F ZINC000179112625 1032554624 /nfs/dbraw/zinc/55/46/24/1032554624.db2.gz OBJXLBBCMGUEIC-GFCCVEGCSA-N 2 1 344.821 4.219 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000430153503 1018881264 /nfs/dbraw/zinc/88/12/64/1018881264.db2.gz YKIUTYASICHIHX-BXBOZWQASA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH+]1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000430153503 1018881266 /nfs/dbraw/zinc/88/12/66/1018881266.db2.gz YKIUTYASICHIHX-BXBOZWQASA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000430153503 1018881267 /nfs/dbraw/zinc/88/12/67/1018881267.db2.gz YKIUTYASICHIHX-BXBOZWQASA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000430153503 1018881271 /nfs/dbraw/zinc/88/12/71/1018881271.db2.gz YKIUTYASICHIHX-BXBOZWQASA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000430153506 1018881515 /nfs/dbraw/zinc/88/15/15/1018881515.db2.gz YKIUTYASICHIHX-SPQRHKFCSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH+]1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000430153506 1018881519 /nfs/dbraw/zinc/88/15/19/1018881519.db2.gz YKIUTYASICHIHX-SPQRHKFCSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000430153506 1018881523 /nfs/dbraw/zinc/88/15/23/1018881523.db2.gz YKIUTYASICHIHX-SPQRHKFCSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000430153506 1018881526 /nfs/dbraw/zinc/88/15/26/1018881526.db2.gz YKIUTYASICHIHX-SPQRHKFCSA-N 2 1 338.417 4.136 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)c(C)c2c1 ZINC000643545898 1018892804 /nfs/dbraw/zinc/89/28/04/1018892804.db2.gz FDTBVDSAEFNJQP-HUUCEWRRSA-N 2 1 328.456 4.075 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCCO2 ZINC000643545988 1018898286 /nfs/dbraw/zinc/89/82/86/1018898286.db2.gz GTQXRXWZMPNLSA-PBHICJAKSA-N 2 1 334.891 4.126 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000432788453 1032805625 /nfs/dbraw/zinc/80/56/25/1032805625.db2.gz LCDFVUCJKUSJIN-AWEZNQCLSA-N 2 1 334.410 4.141 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000432788453 1032805627 /nfs/dbraw/zinc/80/56/27/1032805627.db2.gz LCDFVUCJKUSJIN-AWEZNQCLSA-N 2 1 334.410 4.141 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH+]2CC[C@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001208608398 1019447246 /nfs/dbraw/zinc/44/72/46/1019447246.db2.gz IQAJPTODASRYOP-KGLIPLIRSA-N 2 1 327.299 4.125 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH+]2CC[C@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001208608398 1019447256 /nfs/dbraw/zinc/44/72/56/1019447256.db2.gz IQAJPTODASRYOP-KGLIPLIRSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@@H](C[N@@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001208608398 1019447262 /nfs/dbraw/zinc/44/72/62/1019447262.db2.gz IQAJPTODASRYOP-KGLIPLIRSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@@H](C[N@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001208608398 1019447270 /nfs/dbraw/zinc/44/72/70/1019447270.db2.gz IQAJPTODASRYOP-KGLIPLIRSA-N 2 1 327.299 4.125 20 0 EIADMP Cc1nccn1CCCC[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000179394884 1019721349 /nfs/dbraw/zinc/72/13/49/1019721349.db2.gz AIIMQGKZFPEJHO-UHFFFAOYSA-N 2 1 326.271 4.411 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000179394884 1019721381 /nfs/dbraw/zinc/72/13/81/1019721381.db2.gz AIIMQGKZFPEJHO-UHFFFAOYSA-N 2 1 326.271 4.411 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Br)cc1 ZINC000037140847 1019855776 /nfs/dbraw/zinc/85/57/76/1019855776.db2.gz ZJMCDIXNCVEBPJ-KRWDZBQOSA-N 2 1 337.305 4.117 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(CSC(F)F)o1 ZINC000120620042 1019897856 /nfs/dbraw/zinc/89/78/56/1019897856.db2.gz CGAZTZKONSVHGM-CQSZACIVSA-N 2 1 346.487 4.480 20 0 EIADMP C[C@@H]1CC(C[N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)C[C@@H](C)O1 ZINC001209390761 1020244456 /nfs/dbraw/zinc/24/44/56/1020244456.db2.gz NBRQFKHBKRMXKK-RTBURBONSA-N 2 1 344.543 4.034 20 0 EIADMP Cc1cc([C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)sc1Br ZINC000510199094 1020433818 /nfs/dbraw/zinc/43/38/18/1020433818.db2.gz LSSVAMJMCXMVMR-NSHDSACASA-N 2 1 333.339 4.057 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000398153886 1020505863 /nfs/dbraw/zinc/50/58/63/1020505863.db2.gz QCFBOHSOHMNLFQ-AULURCSPSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000398153886 1020505884 /nfs/dbraw/zinc/50/58/84/1020505884.db2.gz QCFBOHSOHMNLFQ-AULURCSPSA-N 2 1 334.507 4.433 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000398172917 1020515433 /nfs/dbraw/zinc/51/54/33/1020515433.db2.gz IGWVBDGHPDVTFL-FGSXEWAUSA-N 2 1 338.495 4.256 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398187932 1020532182 /nfs/dbraw/zinc/53/21/82/1020532182.db2.gz LVOYFKRDSBKHFI-SVMVAKDDSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398187932 1020532195 /nfs/dbraw/zinc/53/21/95/1020532195.db2.gz LVOYFKRDSBKHFI-SVMVAKDDSA-N 2 1 340.486 4.257 20 0 EIADMP CC[C@H]([NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)[C@@H]1CCCCO1 ZINC000655850449 1021013188 /nfs/dbraw/zinc/01/31/88/1021013188.db2.gz VKMOHPZIUZDGNB-YSSFQJQWSA-N 2 1 327.472 4.179 20 0 EIADMP C[C@@H](NCc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccncc1F ZINC000340469443 1021073340 /nfs/dbraw/zinc/07/33/40/1021073340.db2.gz JRMTVAAEYVEIHA-DLBZAZTESA-N 2 1 341.474 4.303 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccncc1F ZINC000340469443 1021073346 /nfs/dbraw/zinc/07/33/46/1021073346.db2.gz JRMTVAAEYVEIHA-DLBZAZTESA-N 2 1 341.474 4.303 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccncc1F ZINC000340469443 1021073349 /nfs/dbraw/zinc/07/33/49/1021073349.db2.gz JRMTVAAEYVEIHA-DLBZAZTESA-N 2 1 341.474 4.303 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCCc3ccc(O)cc32)C1 ZINC000340471529 1021079305 /nfs/dbraw/zinc/07/93/05/1021079305.db2.gz XWTNGHHCUSWIKV-FVJLSDCUSA-N 2 1 330.516 4.117 20 0 EIADMP C([C@@H]1CCC[N@@H+](CC2([C@H]3CCCCO3)CCC2)C1)[NH+]1CCCCCC1 ZINC001167326740 1021130018 /nfs/dbraw/zinc/13/00/18/1021130018.db2.gz PZNQJMKXBZEGJD-LEWJYISDSA-N 2 1 348.575 4.314 20 0 EIADMP COc1cc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)ccc1OCC(C)C ZINC000892509666 1021309816 /nfs/dbraw/zinc/30/98/16/1021309816.db2.gz AEHSIOMRCUGANN-UXDRXVOSSA-N 2 1 346.515 4.006 20 0 EIADMP Cc1ccncc1CCC[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000584496445 1021330902 /nfs/dbraw/zinc/33/09/02/1021330902.db2.gz DSVRDBQJQDJYCU-FQEVSTJZSA-N 2 1 343.559 4.299 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1N(C)Cc1ccc(-c2ccccc2)cc1F ZINC000580059979 1021586236 /nfs/dbraw/zinc/58/62/36/1021586236.db2.gz JSXSFOISMNNZTG-HRAATJIYSA-N 2 1 326.459 4.265 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCO3)c1 ZINC000177977868 1021837434 /nfs/dbraw/zinc/83/74/34/1021837434.db2.gz VIYSAWJWQVKZMK-QGZVFWFLSA-N 2 1 338.495 4.313 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc3ccccc3[nH]2)[C@@H]1c1cccs1 ZINC000683930267 1021998759 /nfs/dbraw/zinc/99/87/59/1021998759.db2.gz YITXFXZDCDRIGH-OXJNMPFZSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cc3ccccc3[nH]2)[C@@H]1c1cccs1 ZINC000683930267 1021998775 /nfs/dbraw/zinc/99/87/75/1021998775.db2.gz YITXFXZDCDRIGH-OXJNMPFZSA-N 2 1 339.508 4.402 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000414170135 1022020892 /nfs/dbraw/zinc/02/08/92/1022020892.db2.gz BRWLMMLYWXWXTK-LSDHHAIUSA-N 2 1 342.499 4.426 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000236808808 1022169493 /nfs/dbraw/zinc/16/94/93/1022169493.db2.gz LDAIZSBXTCCVEG-HNNXBMFYSA-N 2 1 332.875 4.422 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000236808808 1022169505 /nfs/dbraw/zinc/16/95/05/1022169505.db2.gz LDAIZSBXTCCVEG-HNNXBMFYSA-N 2 1 332.875 4.422 20 0 EIADMP COc1ccsc1[C@H](C)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000471593617 1022199778 /nfs/dbraw/zinc/19/97/78/1022199778.db2.gz MJBLPSVVUAWZAB-XYJFISCASA-N 2 1 344.524 4.318 20 0 EIADMP COc1ccsc1[C@H](C)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000471593617 1022199785 /nfs/dbraw/zinc/19/97/85/1022199785.db2.gz MJBLPSVVUAWZAB-XYJFISCASA-N 2 1 344.524 4.318 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCOCC1 ZINC000549037997 1022204101 /nfs/dbraw/zinc/20/41/01/1022204101.db2.gz ZBQWMHLBFXJFPM-SFTDATJTSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCOCC1 ZINC000549037997 1022204107 /nfs/dbraw/zinc/20/41/07/1022204107.db2.gz ZBQWMHLBFXJFPM-SFTDATJTSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)C[C@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000580579098 1022226921 /nfs/dbraw/zinc/22/69/21/1022226921.db2.gz WXOBWQBZFPIJNY-NZSAHSFTSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)C[C@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000580579098 1022226937 /nfs/dbraw/zinc/22/69/37/1022226937.db2.gz WXOBWQBZFPIJNY-NZSAHSFTSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)C[C@H]2CCC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000580579098 1022226965 /nfs/dbraw/zinc/22/69/65/1022226965.db2.gz WXOBWQBZFPIJNY-NZSAHSFTSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)C[C@H]2CCC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000580579098 1022226998 /nfs/dbraw/zinc/22/69/98/1022226998.db2.gz WXOBWQBZFPIJNY-NZSAHSFTSA-N 2 1 336.470 4.407 20 0 EIADMP C[N@H+]1CCCC[C@@H](C[NH2+]C(CCC(F)(F)F)CCC(F)(F)F)C1 ZINC000926754622 1022279663 /nfs/dbraw/zinc/27/96/63/1022279663.db2.gz PUCXLWZOUPOOIN-LBPRGKRZSA-N 2 1 348.375 4.362 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cnc(-c4cccs4)s3)C2)CC1 ZINC000580636680 1022331574 /nfs/dbraw/zinc/33/15/74/1022331574.db2.gz ZNZWOZQUOSBSNF-OAHLLOKOSA-N 2 1 347.553 4.035 20 0 EIADMP C[C@@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)CC(F)(F)F ZINC000414280991 1022386303 /nfs/dbraw/zinc/38/63/03/1022386303.db2.gz MBPFLAKRYLFDAN-CQSZACIVSA-N 2 1 346.412 4.011 20 0 EIADMP C[C@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)CC(F)(F)F ZINC000414280990 1022387272 /nfs/dbraw/zinc/38/72/72/1022387272.db2.gz MBPFLAKRYLFDAN-AWEZNQCLSA-N 2 1 346.412 4.011 20 0 EIADMP CCOc1ccccc1C1=CCN(CC[C@@H]2CCCC[N@H+]2C)CC1 ZINC000472591796 1022630653 /nfs/dbraw/zinc/63/06/53/1022630653.db2.gz YQLXOWQJPCZVPG-IBGZPJMESA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccccc1C1=CC[N@H+](CC[C@@H]2CCCC[NH+]2C)CC1 ZINC000472591796 1022630692 /nfs/dbraw/zinc/63/06/92/1022630692.db2.gz YQLXOWQJPCZVPG-IBGZPJMESA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccccc1C1=CC[N@@H+](CC[C@@H]2CCCC[NH+]2C)CC1 ZINC000472591796 1022630711 /nfs/dbraw/zinc/63/07/11/1022630711.db2.gz YQLXOWQJPCZVPG-IBGZPJMESA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccccc1C1=CC[NH+](CC[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000472591796 1022630743 /nfs/dbraw/zinc/63/07/43/1022630743.db2.gz YQLXOWQJPCZVPG-IBGZPJMESA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccccc1C1=CC[NH+](CC[C@@H]2CCCC[N@H+]2C)CC1 ZINC000472591796 1022630766 /nfs/dbraw/zinc/63/07/66/1022630766.db2.gz YQLXOWQJPCZVPG-IBGZPJMESA-N 2 1 328.500 4.049 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000414341050 1022634575 /nfs/dbraw/zinc/63/45/75/1022634575.db2.gz UVOJFHIYIOSJRB-NQIIRXRSSA-N 2 1 337.511 4.002 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000414341050 1022634593 /nfs/dbraw/zinc/63/45/93/1022634593.db2.gz UVOJFHIYIOSJRB-NQIIRXRSSA-N 2 1 337.511 4.002 20 0 EIADMP CC(C)(C)c1csc(C2CC[NH+](CCC[NH+]3CCCC3)CC2)n1 ZINC000378315151 1022682888 /nfs/dbraw/zinc/68/28/88/1022682888.db2.gz PHLGASDGQYLVPU-UHFFFAOYSA-N 2 1 335.561 4.106 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1C ZINC000580945758 1022733782 /nfs/dbraw/zinc/73/37/82/1022733782.db2.gz ZVIQVSWXRBGARS-FXAWDEMLSA-N 2 1 344.524 4.238 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ccc1C ZINC000580945758 1022733811 /nfs/dbraw/zinc/73/38/11/1022733811.db2.gz ZVIQVSWXRBGARS-FXAWDEMLSA-N 2 1 344.524 4.238 20 0 EIADMP Cc1cc2cc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)ccc2[nH]1 ZINC000581026079 1022802492 /nfs/dbraw/zinc/80/24/92/1022802492.db2.gz QHKURDSJSCTSON-IFMALSPDSA-N 2 1 333.479 4.401 20 0 EIADMP Cc1cc2cc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H](c4ccccc4)C3)ccc2[nH]1 ZINC000581026079 1022802496 /nfs/dbraw/zinc/80/24/96/1022802496.db2.gz QHKURDSJSCTSON-IFMALSPDSA-N 2 1 333.479 4.401 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1)c1ccc(Cl)nc1 ZINC000378513142 1022853045 /nfs/dbraw/zinc/85/30/45/1022853045.db2.gz AGOMEDHCRQTWOU-FNHZYXHNSA-N 2 1 329.875 4.079 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2c[nH]nc2-c2ccccc2)c1 ZINC000065976566 1022874245 /nfs/dbraw/zinc/87/42/45/1022874245.db2.gz JPGMODMBVBRUSZ-UHFFFAOYSA-N 2 1 348.494 4.207 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1cncc(F)c1 ZINC000156191754 1023135548 /nfs/dbraw/zinc/13/55/48/1023135548.db2.gz ILVWQLCTZKDODH-IRXDYDNUSA-N 2 1 341.474 4.446 20 0 EIADMP C[N@@H+](CCCOc1ccc(C(C)(C)C)cc1)C[C@@H]1CCC[NH+](C)C1 ZINC000605421259 1023269090 /nfs/dbraw/zinc/26/90/90/1023269090.db2.gz WVTBJLWGTAWXJN-GOSISDBHSA-N 2 1 332.532 4.027 20 0 EIADMP C[NH+](CCCOc1ccc(C(C)(C)C)cc1)C[C@@H]1CCC[N@H+](C)C1 ZINC000605421259 1023269098 /nfs/dbraw/zinc/26/90/98/1023269098.db2.gz WVTBJLWGTAWXJN-GOSISDBHSA-N 2 1 332.532 4.027 20 0 EIADMP C[NH+](CCCOc1ccc(C(C)(C)C)cc1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000605421259 1023269103 /nfs/dbraw/zinc/26/91/03/1023269103.db2.gz WVTBJLWGTAWXJN-GOSISDBHSA-N 2 1 332.532 4.027 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000123822932 1023274470 /nfs/dbraw/zinc/27/44/70/1023274470.db2.gz CKZPOBHJYMDAET-UHFFFAOYSA-N 2 1 346.906 4.036 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000123822932 1023274479 /nfs/dbraw/zinc/27/44/79/1023274479.db2.gz CKZPOBHJYMDAET-UHFFFAOYSA-N 2 1 346.906 4.036 20 0 EIADMP Cc1ncncc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000581558629 1023361590 /nfs/dbraw/zinc/36/15/90/1023361590.db2.gz VVWOPFYSNCOKKZ-KRWDZBQOSA-N 2 1 338.499 4.012 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](Cc2ccccc2)c2ccc(OC)cc2)CC1 ZINC000581577624 1023380134 /nfs/dbraw/zinc/38/01/34/1023380134.db2.gz NGMZFHGXLGWLRU-JOCHJYFZSA-N 2 1 338.495 4.053 20 0 EIADMP COc1cccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1Cl ZINC000660256991 1023392826 /nfs/dbraw/zinc/39/28/26/1023392826.db2.gz PJCOXNNWJCHXKI-GOEBONIOSA-N 2 1 336.907 4.091 20 0 EIADMP COc1cccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1Cl ZINC000660256991 1023392836 /nfs/dbraw/zinc/39/28/36/1023392836.db2.gz PJCOXNNWJCHXKI-GOEBONIOSA-N 2 1 336.907 4.091 20 0 EIADMP COc1cccc(SCC[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000660257464 1023396526 /nfs/dbraw/zinc/39/65/26/1023396526.db2.gz TZZSCRKNKKBFNG-IRXDYDNUSA-N 2 1 348.556 4.030 20 0 EIADMP C[N@@H+]1CCC[C@@]2(CCN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)C2)C1 ZINC000549195743 1023454888 /nfs/dbraw/zinc/45/48/88/1023454888.db2.gz BCZJIACCEHXUGW-GOSISDBHSA-N 2 1 349.400 4.176 20 0 EIADMP C[N@H+]1CCC[C@@]2(CCN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)C2)C1 ZINC000549195743 1023454893 /nfs/dbraw/zinc/45/48/93/1023454893.db2.gz BCZJIACCEHXUGW-GOSISDBHSA-N 2 1 349.400 4.176 20 0 EIADMP C[C@]1(C[NH2+]Cc2cccc3cc[nH]c32)CC[N@@H+](Cc2ccccc2)C1 ZINC000310970410 1023495284 /nfs/dbraw/zinc/49/52/84/1023495284.db2.gz DERVVDQDYSFKTG-JOCHJYFZSA-N 2 1 333.479 4.170 20 0 EIADMP FC1(F)CC[C@@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000564958697 1023531237 /nfs/dbraw/zinc/53/12/37/1023531237.db2.gz JJCVEJLPBFZFRX-MSOLQXFVSA-N 2 1 334.454 4.209 20 0 EIADMP FC1(F)CC[C@@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000564958697 1023531243 /nfs/dbraw/zinc/53/12/43/1023531243.db2.gz JJCVEJLPBFZFRX-MSOLQXFVSA-N 2 1 334.454 4.209 20 0 EIADMP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)C1 ZINC000684369839 1023539979 /nfs/dbraw/zinc/53/99/79/1023539979.db2.gz BYKOLPKQRJCXQU-DZFGPLHGSA-N 2 1 330.516 4.108 20 0 EIADMP CC[NH+](CC)Cc1cc(NCCC[N@H+]2CCCC[C@H]2C)ccc1OC ZINC001167754258 1023635709 /nfs/dbraw/zinc/63/57/09/1023635709.db2.gz QBYHBCZDTDKEAF-GOSISDBHSA-N 2 1 347.547 4.213 20 0 EIADMP Cc1cccc(CCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)n1 ZINC000582122045 1023687644 /nfs/dbraw/zinc/68/76/44/1023687644.db2.gz XEINLRPSJYHVSO-QFIPXVFZSA-N 2 1 349.522 4.109 20 0 EIADMP Cc1cccc(CCC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)n1 ZINC000582122045 1023687655 /nfs/dbraw/zinc/68/76/55/1023687655.db2.gz XEINLRPSJYHVSO-QFIPXVFZSA-N 2 1 349.522 4.109 20 0 EIADMP C[C@H]1C[N@@H+](C[C@H](C[NH+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483563 1023740134 /nfs/dbraw/zinc/74/01/34/1023740134.db2.gz XGHBKCQKOSKYBZ-MZKRTTBSSA-N 2 1 336.523 4.490 20 0 EIADMP C[C@H]1C[NH+](C[C@H](C[N@H+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483563 1023740141 /nfs/dbraw/zinc/74/01/41/1023740141.db2.gz XGHBKCQKOSKYBZ-MZKRTTBSSA-N 2 1 336.523 4.490 20 0 EIADMP C[C@H]1C[NH+](C[C@H](C[N@@H+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483563 1023740148 /nfs/dbraw/zinc/74/01/48/1023740148.db2.gz XGHBKCQKOSKYBZ-MZKRTTBSSA-N 2 1 336.523 4.490 20 0 EIADMP C[C@@H]1C[NH+](C[C@@H](C[N@@H+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483566 1023740458 /nfs/dbraw/zinc/74/04/58/1023740458.db2.gz XGHBKCQKOSKYBZ-TXTKFYIRSA-N 2 1 336.523 4.490 20 0 EIADMP Fc1c(Cl)cc(Cl)cc1C[NH+]1CCC2(CCC[NH2+]C2)CC1 ZINC001222461260 1023779219 /nfs/dbraw/zinc/77/92/19/1023779219.db2.gz PUVHSEMMKWAQSI-UHFFFAOYSA-N 2 1 331.262 4.098 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@H](Cc1ccc(Cl)cc1)c1ccccc1 ZINC000471756984 1023801829 /nfs/dbraw/zinc/80/18/29/1023801829.db2.gz GETJXUIJMXWACH-HXUWFJFHSA-N 2 1 339.870 4.190 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000500426884 1023822331 /nfs/dbraw/zinc/82/23/31/1023822331.db2.gz HEAJOVMDEXPFDW-DYXWJJEUSA-N 2 1 329.532 4.065 20 0 EIADMP Cc1ccc2ncc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)cc2c1 ZINC000662729624 1023973518 /nfs/dbraw/zinc/97/35/18/1023973518.db2.gz CWMOXWHAGKMTOZ-UHFFFAOYSA-N 2 1 325.500 4.095 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)CCCOc2ccc(Cl)c(C)c2)C1 ZINC000510653329 1024175381 /nfs/dbraw/zinc/17/53/81/1024175381.db2.gz RERWBZBBXGVHGA-SJORKVTESA-N 2 1 338.923 4.127 20 0 EIADMP FC(F)(F)c1ccc2c(c1)[nH+]ccc2N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000549526915 1024199938 /nfs/dbraw/zinc/19/99/38/1024199938.db2.gz YRTSSKBBSPYKKJ-AWEZNQCLSA-N 2 1 349.400 4.176 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510699560 1024250276 /nfs/dbraw/zinc/25/02/76/1024250276.db2.gz BZSMHBUQTFDQRG-WBVHZDCISA-N 2 1 342.449 4.348 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341696903 1024338625 /nfs/dbraw/zinc/33/86/25/1024338625.db2.gz MFSOCVSTZVBHIR-YJBOKZPZSA-N 2 1 336.907 4.264 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341696903 1024338634 /nfs/dbraw/zinc/33/86/34/1024338634.db2.gz MFSOCVSTZVBHIR-YJBOKZPZSA-N 2 1 336.907 4.264 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000510737091 1024378681 /nfs/dbraw/zinc/37/86/81/1024378681.db2.gz RVTIFRMEUHRMFC-JKIFEVAISA-N 2 1 328.422 4.099 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000510737091 1024378686 /nfs/dbraw/zinc/37/86/86/1024378686.db2.gz RVTIFRMEUHRMFC-JKIFEVAISA-N 2 1 328.422 4.099 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(F)c(Cl)c1Cl ZINC000432243782 1024733125 /nfs/dbraw/zinc/73/31/25/1024733125.db2.gz YCDRRSRPYQELGW-UHFFFAOYSA-N 2 1 330.234 4.207 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000548482336 1024826215 /nfs/dbraw/zinc/82/62/15/1024826215.db2.gz GDXCIRCCZXLUCZ-DSKINZAPSA-N 2 1 340.511 4.409 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582002538 1024836354 /nfs/dbraw/zinc/83/63/54/1024836354.db2.gz QSPRFYPJLPMWFP-ICSRJNTNSA-N 2 1 338.495 4.388 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582002538 1024836358 /nfs/dbraw/zinc/83/63/58/1024836358.db2.gz QSPRFYPJLPMWFP-ICSRJNTNSA-N 2 1 338.495 4.388 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCC[C@@H]1c1ccc(OC(C)C)cc1 ZINC000510961554 1024867467 /nfs/dbraw/zinc/86/74/67/1024867467.db2.gz MKNKJIIIRYAPEW-NHCUHLMSSA-N 2 1 341.499 4.295 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cccc2c1CC[NH2+]C2 ZINC000662258840 1025009986 /nfs/dbraw/zinc/00/99/86/1025009986.db2.gz LYZCMDMAHPJDCM-CQSZACIVSA-N 2 1 337.492 4.135 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cccc2c1CC[NH2+]C2 ZINC000662258840 1025010003 /nfs/dbraw/zinc/01/00/03/1025010003.db2.gz LYZCMDMAHPJDCM-CQSZACIVSA-N 2 1 337.492 4.135 20 0 EIADMP c1nc(-c2ccccc2)sc1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663347127 1025142941 /nfs/dbraw/zinc/14/29/41/1025142941.db2.gz ZKSSDFXNXDCWIW-QGZVFWFLSA-N 2 1 341.524 4.022 20 0 EIADMP c1nc(-c2ccccc2)sc1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663347127 1025142951 /nfs/dbraw/zinc/14/29/51/1025142951.db2.gz ZKSSDFXNXDCWIW-QGZVFWFLSA-N 2 1 341.524 4.022 20 0 EIADMP COc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)ccc1SC ZINC000663466983 1025401492 /nfs/dbraw/zinc/40/14/92/1025401492.db2.gz CIPIPSTWEQQFFB-RDJZCZTQSA-N 2 1 348.556 4.190 20 0 EIADMP COc1cccc2cc([C@H](C)NC[C@@H]3CCC[N@@H+](CC4CC4)C3)oc21 ZINC000663467545 1025409427 /nfs/dbraw/zinc/40/94/27/1025409427.db2.gz GOGKQEJZHYMFEI-RDJZCZTQSA-N 2 1 342.483 4.214 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)oc21 ZINC000663467545 1025409431 /nfs/dbraw/zinc/40/94/31/1025409431.db2.gz GOGKQEJZHYMFEI-RDJZCZTQSA-N 2 1 342.483 4.214 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)oc21 ZINC000663467545 1025409440 /nfs/dbraw/zinc/40/94/40/1025409440.db2.gz GOGKQEJZHYMFEI-RDJZCZTQSA-N 2 1 342.483 4.214 20 0 EIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+]CCCn1cc[nH+]c1C ZINC000342249977 1025616642 /nfs/dbraw/zinc/61/66/42/1025616642.db2.gz XRBJYRIJUUMGDE-IBGZPJMESA-N 2 1 329.488 4.357 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC001167833351 1025784132 /nfs/dbraw/zinc/78/41/32/1025784132.db2.gz APSSOASVHKWFRF-IRLDBZIGSA-N 2 1 345.575 4.093 20 0 EIADMP CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]CCn1cc[nH+]c1C ZINC000342318645 1025845095 /nfs/dbraw/zinc/84/50/95/1025845095.db2.gz FDKPAACXIQYMDI-LJQANCHMSA-N 2 1 329.488 4.357 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3ccc4ncccc4c3)CC2)n2c1CCCC2 ZINC000278947449 1025858475 /nfs/dbraw/zinc/85/84/75/1025858475.db2.gz VEBKWAVHDUEKIG-UHFFFAOYSA-N 2 1 346.478 4.147 20 0 EIADMP COCc1csc(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC000657308310 1025862436 /nfs/dbraw/zinc/86/24/36/1025862436.db2.gz QADGKIPMVNSQTI-UHFFFAOYSA-N 2 1 332.513 4.025 20 0 EIADMP Clc1cccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c1 ZINC001167967581 1025869678 /nfs/dbraw/zinc/86/96/78/1025869678.db2.gz HOUJHGQTZDAEQT-YQQQUEKLSA-N 2 1 330.903 4.324 20 0 EIADMP Clc1cccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)c1 ZINC001167967581 1025869687 /nfs/dbraw/zinc/86/96/87/1025869687.db2.gz HOUJHGQTZDAEQT-YQQQUEKLSA-N 2 1 330.903 4.324 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)cc1 ZINC000511052775 1025885406 /nfs/dbraw/zinc/88/54/06/1025885406.db2.gz ZHMBATLGOFEXQA-OXJNMPFZSA-N 2 1 347.462 4.225 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1cnn(C)c1 ZINC000157653585 1025904320 /nfs/dbraw/zinc/90/43/20/1025904320.db2.gz WXIFTLYPYRJPKO-LAUBAEHRSA-N 2 1 340.515 4.035 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000431333251 1025910417 /nfs/dbraw/zinc/91/04/17/1025910417.db2.gz MWJLVVBLPPQEQJ-UWJYYQICSA-N 2 1 342.527 4.099 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cccc(OC(F)F)c1 ZINC000319783453 1025923047 /nfs/dbraw/zinc/92/30/47/1025923047.db2.gz GVGYZWIQMXHPNC-CABCVRRESA-N 2 1 326.431 4.203 20 0 EIADMP CCOc1ccccc1C1=CC[N@H+](CCCCn2cc[nH+]c2C)CC1 ZINC000119605058 1025941283 /nfs/dbraw/zinc/94/12/83/1025941283.db2.gz IAIQMIOLBAWDRU-UHFFFAOYSA-N 2 1 339.483 4.160 20 0 EIADMP CCOc1ccccc1C1=CC[N@@H+](CCCCn2cc[nH+]c2C)CC1 ZINC000119605058 1025941314 /nfs/dbraw/zinc/94/13/14/1025941314.db2.gz IAIQMIOLBAWDRU-UHFFFAOYSA-N 2 1 339.483 4.160 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CCCO1 ZINC000432433115 1025971718 /nfs/dbraw/zinc/97/17/18/1025971718.db2.gz ZORANQBABCGQMQ-LAUBAEHRSA-N 2 1 348.506 4.148 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2COc3c(C)cccc3C2)cc1 ZINC000582032707 1025997270 /nfs/dbraw/zinc/99/72/70/1025997270.db2.gz VQMNPBUJEPHDGB-JXFKEZNVSA-N 2 1 347.462 4.143 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000431350094 1026113932 /nfs/dbraw/zinc/11/39/32/1026113932.db2.gz NMLCYCFWEFKRIB-NUJGCVRESA-N 2 1 334.891 4.079 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000431350094 1026113955 /nfs/dbraw/zinc/11/39/55/1026113955.db2.gz NMLCYCFWEFKRIB-NUJGCVRESA-N 2 1 334.891 4.079 20 0 EIADMP COCc1csc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)c1 ZINC000657332570 1026143362 /nfs/dbraw/zinc/14/33/62/1026143362.db2.gz JECCWGWXCHPPLG-UHFFFAOYSA-N 2 1 332.513 4.025 20 0 EIADMP [NH3+]CCCCCCCCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167974222 1026186152 /nfs/dbraw/zinc/18/61/52/1026186152.db2.gz ROLPZWMBMXOBRX-FRIKZZABSA-N 3 1 349.607 4.451 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3cccc4cc[nH]c43)C2)CC1 ZINC000512164659 1026194016 /nfs/dbraw/zinc/19/40/16/1026194016.db2.gz DBUNJRVFSADZPT-SFHVURJKSA-N 2 1 325.500 4.112 20 0 EIADMP Cc1nc(-c2cc([C@H](C)[NH2+]CC3=CC[N@@H+](C)CC3)cs2)cs1 ZINC000344291994 1026220020 /nfs/dbraw/zinc/22/00/20/1026220020.db2.gz NLUHAWMUNJNWLH-LBPRGKRZSA-N 2 1 333.526 4.093 20 0 EIADMP COCCCC[N@H+]1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664836025 1026306264 /nfs/dbraw/zinc/30/62/64/1026306264.db2.gz IJXJNOVMCUGQTR-NRFANRHFSA-N 2 1 344.543 4.036 20 0 EIADMP Fc1cc(F)c2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)CCC2 ZINC001167981777 1026368202 /nfs/dbraw/zinc/36/82/02/1026368202.db2.gz JQDDEAPOSTWEQS-KVSYXXJQSA-N 2 1 346.465 4.337 20 0 EIADMP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000279499972 1026461508 /nfs/dbraw/zinc/46/15/08/1026461508.db2.gz MNBSVWZKAPDWHM-IGGJEDBVSA-N 2 1 330.516 4.005 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c(C)nn(C(C)(C)C)c2C)CC1 ZINC000506883988 1026487556 /nfs/dbraw/zinc/48/75/56/1026487556.db2.gz IXVLECYSWQCHHO-UHFFFAOYSA-N 2 1 348.579 4.199 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657430657 1026644597 /nfs/dbraw/zinc/64/45/97/1026644597.db2.gz ULRYCYSNZXYOSA-NVXWUHKLSA-N 2 1 346.490 4.110 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000657430657 1026644601 /nfs/dbraw/zinc/64/46/01/1026644601.db2.gz ULRYCYSNZXYOSA-NVXWUHKLSA-N 2 1 346.490 4.110 20 0 EIADMP CC[C@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)c1ccccc1 ZINC000112547316 1026676177 /nfs/dbraw/zinc/67/61/77/1026676177.db2.gz RDQKWNMAQRNMLI-FQEVSTJZSA-N 2 1 341.499 4.244 20 0 EIADMP Fc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1-c1cccs1 ZINC000391397339 1026752287 /nfs/dbraw/zinc/75/22/87/1026752287.db2.gz NGACIKXWBJKFLW-HZPDHXFCSA-N 2 1 330.472 4.271 20 0 EIADMP C[C@H](CNc1cc[nH+]c2cc(F)ccc12)[N@H+]1CCc2sccc2C1 ZINC000500461718 1026773369 /nfs/dbraw/zinc/77/33/69/1026773369.db2.gz XQSOXTHJGRRBGR-CYBMUJFWSA-N 2 1 341.455 4.294 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000507506130 1026819308 /nfs/dbraw/zinc/81/93/08/1026819308.db2.gz FGDOEMJZILTWKW-LQWHRVPQSA-N 2 1 337.511 4.348 20 0 EIADMP CCSCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC000507531758 1026829272 /nfs/dbraw/zinc/82/92/72/1026829272.db2.gz RKMVCTMSPFKVBF-MTFMMBMASA-N 2 1 332.557 4.018 20 0 EIADMP FC(F)(F)c1ccc(Cl)c(CN[C@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000370988519 1026832805 /nfs/dbraw/zinc/83/28/05/1026832805.db2.gz QZGHZZNQGMKOFO-KBPBESRZSA-N 2 1 332.797 4.075 20 0 EIADMP Cc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3csc(C)n3)CC2)c(C)o1 ZINC000375721550 1026865347 /nfs/dbraw/zinc/86/53/47/1026865347.db2.gz WDWJRIVBPHLUMH-AWEZNQCLSA-N 2 1 347.528 4.224 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@H]3CCCc4cccnc43)C2)c1 ZINC000684956483 1026890460 /nfs/dbraw/zinc/89/04/60/1026890460.db2.gz ZWYUICVBXZSXPD-LPHOPBHVSA-N 2 1 341.524 4.022 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3CCCc4cccnc43)C2)c1 ZINC000684956483 1026890461 /nfs/dbraw/zinc/89/04/61/1026890461.db2.gz ZWYUICVBXZSXPD-LPHOPBHVSA-N 2 1 341.524 4.022 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3cccnc32)[C@H]1c1cccs1 ZINC000684956333 1026890825 /nfs/dbraw/zinc/89/08/25/1026890825.db2.gz APVZKIAFQUYGPK-HLIPFELVSA-N 2 1 341.524 4.193 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3cccnc32)[C@H]1c1cccs1 ZINC000684956333 1026890828 /nfs/dbraw/zinc/89/08/28/1026890828.db2.gz APVZKIAFQUYGPK-HLIPFELVSA-N 2 1 341.524 4.193 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCOc2ccc(Cl)cc21 ZINC000164592379 1026967439 /nfs/dbraw/zinc/96/74/39/1026967439.db2.gz BPDGBFFVIAJMQU-QGZVFWFLSA-N 2 1 333.863 4.129 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CC2([NH+](C)C)CCCCC2)cc1OC ZINC000474484561 1027120051 /nfs/dbraw/zinc/12/00/51/1027120051.db2.gz KUTGCCJCHFPODC-SJORKVTESA-N 2 1 348.531 4.050 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)s2)cc1C ZINC000655717124 1027219186 /nfs/dbraw/zinc/21/91/86/1027219186.db2.gz VFLOFFGMZJDQPE-MRXNPFEDSA-N 2 1 341.524 4.001 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)s2)cc1C ZINC000655717124 1027219199 /nfs/dbraw/zinc/21/91/99/1027219199.db2.gz VFLOFFGMZJDQPE-MRXNPFEDSA-N 2 1 341.524 4.001 20 0 EIADMP Cc1cc2c(cn1)[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C1)CC2 ZINC001168037449 1027254289 /nfs/dbraw/zinc/25/42/89/1027254289.db2.gz YNXQNUNCCVXXKE-OXHIVJRSSA-N 2 1 349.522 4.409 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CC[N@H+](C)C2CCCCC2)cc1OC ZINC000474629209 1027336308 /nfs/dbraw/zinc/33/63/08/1027336308.db2.gz CSVUBWNXCXJIII-SJORKVTESA-N 2 1 348.531 4.050 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CC[N@@H+](C)C2CCCCC2)cc1OC ZINC000474629209 1027336319 /nfs/dbraw/zinc/33/63/19/1027336319.db2.gz CSVUBWNXCXJIII-SJORKVTESA-N 2 1 348.531 4.050 20 0 EIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000342863923 1027342050 /nfs/dbraw/zinc/34/20/50/1027342050.db2.gz KNJZVTPQGRUJAK-UHFFFAOYSA-N 2 1 340.446 4.082 20 0 EIADMP CN1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c2ccccc21 ZINC000453348353 1027417739 /nfs/dbraw/zinc/41/77/39/1027417739.db2.gz GCYYCWMHUNINKH-UNWVZKJWSA-N 2 1 349.522 4.383 20 0 EIADMP CN1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c2ccccc21 ZINC000453348353 1027417743 /nfs/dbraw/zinc/41/77/43/1027417743.db2.gz GCYYCWMHUNINKH-UNWVZKJWSA-N 2 1 349.522 4.383 20 0 EIADMP Cc1ccc(C)c(OCCC[N@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c1 ZINC000441399028 1027520693 /nfs/dbraw/zinc/52/06/93/1027520693.db2.gz UEJKRHDGQKEZTK-PZJWPPBQSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441399028 1027520706 /nfs/dbraw/zinc/52/07/06/1027520706.db2.gz UEJKRHDGQKEZTK-PZJWPPBQSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441399028 1027520718 /nfs/dbraw/zinc/52/07/18/1027520718.db2.gz UEJKRHDGQKEZTK-PZJWPPBQSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441399028 1027520729 /nfs/dbraw/zinc/52/07/29/1027520729.db2.gz UEJKRHDGQKEZTK-PZJWPPBQSA-N 2 1 342.527 4.021 20 0 EIADMP Clc1cccc(OCCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441403223 1027541573 /nfs/dbraw/zinc/54/15/73/1027541573.db2.gz CERSPABZYFZHIX-JXFKEZNVSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441403223 1027541586 /nfs/dbraw/zinc/54/15/86/1027541586.db2.gz CERSPABZYFZHIX-JXFKEZNVSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441403223 1027541598 /nfs/dbraw/zinc/54/15/98/1027541598.db2.gz CERSPABZYFZHIX-JXFKEZNVSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000441403223 1027541608 /nfs/dbraw/zinc/54/16/08/1027541608.db2.gz CERSPABZYFZHIX-JXFKEZNVSA-N 2 1 348.918 4.058 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000152458086 1027612645 /nfs/dbraw/zinc/61/26/45/1027612645.db2.gz BUMVDAZIDIQCHM-NWDGAFQWSA-N 2 1 344.833 4.076 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000152458086 1027612668 /nfs/dbraw/zinc/61/26/68/1027612668.db2.gz BUMVDAZIDIQCHM-NWDGAFQWSA-N 2 1 344.833 4.076 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)C1CCSCC1 ZINC000474879488 1027711950 /nfs/dbraw/zinc/71/19/50/1027711950.db2.gz QSEBCSBXVSYDQW-BJLQDIEVSA-N 2 1 346.584 4.408 20 0 EIADMP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000657706269 1027761312 /nfs/dbraw/zinc/76/13/12/1027761312.db2.gz KYOPEPAYXVVQLE-OLZOCXBDSA-N 2 1 346.359 4.256 20 0 EIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995700 1027797866 /nfs/dbraw/zinc/79/78/66/1027797866.db2.gz OKIOBKOBZDXGBS-APZTZJSISA-N 2 1 328.475 4.368 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccsc4)cc3)CC[C@H]21 ZINC001167648116 1027843321 /nfs/dbraw/zinc/84/33/21/1027843321.db2.gz RIYKVYBVUJUIQP-AZUAARDMSA-N 2 1 326.509 4.331 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(-c4ccsc4)cc3)CC[C@H]21 ZINC001167648116 1027843322 /nfs/dbraw/zinc/84/33/22/1027843322.db2.gz RIYKVYBVUJUIQP-AZUAARDMSA-N 2 1 326.509 4.331 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4ccsc4)cc3)CC[C@H]21 ZINC001167648116 1027843325 /nfs/dbraw/zinc/84/33/25/1027843325.db2.gz RIYKVYBVUJUIQP-AZUAARDMSA-N 2 1 326.509 4.331 20 0 EIADMP Cc1nccn1-c1ccc(CN[C@H](C)c2ccccc2F)cc1F ZINC000153683769 1027872247 /nfs/dbraw/zinc/87/22/47/1027872247.db2.gz JARDMPQMJCAEBW-CYBMUJFWSA-N 2 1 327.378 4.310 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(C(F)(F)F)cn2)CC1 ZINC000583039830 1027878878 /nfs/dbraw/zinc/87/88/78/1027878878.db2.gz SGTGVJSFRSOOIC-UHFFFAOYSA-N 2 1 343.437 4.044 20 0 EIADMP C[C@H](c1ccccn1)[N@@H+](C)CCCCC[NH+](C)[C@@H](C)c1ccccn1 ZINC000091702933 1027899836 /nfs/dbraw/zinc/89/98/36/1027899836.db2.gz ZQYBDWGAHIUQIV-KDURUIRLSA-N 2 1 340.515 4.333 20 0 EIADMP C[C@H](c1ccccn1)[NH+](C)CCCCC[N@H+](C)[C@@H](C)c1ccccn1 ZINC000091702933 1027899838 /nfs/dbraw/zinc/89/98/38/1027899838.db2.gz ZQYBDWGAHIUQIV-KDURUIRLSA-N 2 1 340.515 4.333 20 0 EIADMP C[C@H](c1ccccn1)[NH+](C)CCCCC[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000091702933 1027899842 /nfs/dbraw/zinc/89/98/42/1027899842.db2.gz ZQYBDWGAHIUQIV-KDURUIRLSA-N 2 1 340.515 4.333 20 0 EIADMP c1ccc2c(c1)cccc2OCC[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000523452281 1028105733 /nfs/dbraw/zinc/10/57/33/1028105733.db2.gz HOQUMLOSRGCCQA-HXUWFJFHSA-N 2 1 338.495 4.169 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)Cc1cccs1 ZINC000583194605 1028217463 /nfs/dbraw/zinc/21/74/63/1028217463.db2.gz LUOJUAJMOQDQJI-ILZDJORESA-N 2 1 328.525 4.352 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)Cc1cccs1 ZINC000583194605 1028217477 /nfs/dbraw/zinc/21/74/77/1028217477.db2.gz LUOJUAJMOQDQJI-ILZDJORESA-N 2 1 328.525 4.352 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCOCc2ccccc2)CC1 ZINC001167658442 1028221303 /nfs/dbraw/zinc/22/13/03/1028221303.db2.gz HHLNWLBGEJYKFL-HXUWFJFHSA-N 2 1 344.543 4.180 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)Cc1csc2ccccc12 ZINC000346138107 1028274419 /nfs/dbraw/zinc/27/44/19/1028274419.db2.gz RPSJEAREZVHKNX-UHFFFAOYSA-N 2 1 348.475 4.422 20 0 EIADMP Fc1cccc(C[N@@H+](Cc2cc(-n3ccnc3)cs2)C2CC2)c1 ZINC000346162657 1028295108 /nfs/dbraw/zinc/29/51/08/1028295108.db2.gz ZSNQBGGEOGSNPT-UHFFFAOYSA-N 2 1 327.428 4.238 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1ccc(C)c(C)c1)C1CC1 ZINC000346204204 1028329383 /nfs/dbraw/zinc/32/93/83/1028329383.db2.gz PKXKWKNMKQAAMC-UHFFFAOYSA-N 2 1 346.478 4.357 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3cc(F)c(OC)cc32)c1 ZINC000281088740 1028372004 /nfs/dbraw/zinc/37/20/04/1028372004.db2.gz AGCFFFBCBCPGFW-HXUWFJFHSA-N 2 1 342.458 4.063 20 0 EIADMP CCc1ccc([C@H](CC)[NH2+]Cc2ccc(-n3cc[nH+]c3C)nc2)cc1 ZINC000126381898 1028600579 /nfs/dbraw/zinc/60/05/79/1028600579.db2.gz SZMDFGSMYVPFGE-FQEVSTJZSA-N 2 1 334.467 4.379 20 0 EIADMP Cc1cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c2ccccc2n1 ZINC000524081076 1028631207 /nfs/dbraw/zinc/63/12/07/1028631207.db2.gz KHAFNZXMOVQFEK-UHFFFAOYSA-N 2 1 325.500 4.095 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)Cc1cccc(C(F)(F)F)c1 ZINC000281603243 1028802178 /nfs/dbraw/zinc/80/21/78/1028802178.db2.gz MHJLOHPDKMOOPV-CQSZACIVSA-N 2 1 339.405 4.211 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)cc1OC ZINC000324383740 1028862278 /nfs/dbraw/zinc/86/22/78/1028862278.db2.gz OBRHTLOKODYVEE-INIZCTEOSA-N 2 1 334.504 4.009 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1OC ZINC000324383740 1028862280 /nfs/dbraw/zinc/86/22/80/1028862280.db2.gz OBRHTLOKODYVEE-INIZCTEOSA-N 2 1 334.504 4.009 20 0 EIADMP CC(C)O[C@H](C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000428325951 1028883991 /nfs/dbraw/zinc/88/39/91/1028883991.db2.gz OMVAWMLDOVTIHS-RCZSKKKRSA-N 2 1 344.543 4.395 20 0 EIADMP CC(C)C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000647302036 1028991267 /nfs/dbraw/zinc/99/12/67/1028991267.db2.gz PKUBGQGLNVZYJC-IFMALSPDSA-N 2 1 337.511 4.281 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(Br)cc1 ZINC000157421673 1029069132 /nfs/dbraw/zinc/06/91/32/1029069132.db2.gz LXWMPXBOUSZSKG-ZTFRIQLXSA-N 2 1 331.257 4.245 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cccc(Oc2ccccc2)c1 ZINC000524619258 1029122093 /nfs/dbraw/zinc/12/20/93/1029122093.db2.gz PYBAOJWWBPWZCH-QGZVFWFLSA-N 2 1 335.451 4.410 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000469980252 1029206619 /nfs/dbraw/zinc/20/66/19/1029206619.db2.gz DVHXQSPCKUADKV-JKSUJKDBSA-N 2 1 329.513 4.111 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCSCc2cccc3ccccc32)CC[N@H+]1C ZINC000151159421 1029217543 /nfs/dbraw/zinc/21/75/43/1029217543.db2.gz QMXJVMOVDKUQIQ-APWZRJJASA-N 2 1 328.525 4.145 20 0 EIADMP CCc1ncc(C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)s1 ZINC000536141233 1029254083 /nfs/dbraw/zinc/25/40/83/1029254083.db2.gz PPXXLBPDSCCPSA-UHFFFAOYSA-N 2 1 335.561 4.040 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)CCS2 ZINC000343470731 1029316700 /nfs/dbraw/zinc/31/67/00/1029316700.db2.gz XRXOUYKVQUUTCJ-QAPCUYQASA-N 2 1 334.529 4.086 20 0 EIADMP Cc1onc(-c2ccccc2)c1C[N@@H+]1CC[C@@H](Oc2cc[nH+]cc2C)C1 ZINC001141992344 1029336835 /nfs/dbraw/zinc/33/68/35/1029336835.db2.gz LRKGSWCXMXZRPB-GOSISDBHSA-N 2 1 349.434 4.007 20 0 EIADMP Cc1onc(-c2ccccc2)c1C[N@H+]1CC[C@@H](Oc2cc[nH+]cc2C)C1 ZINC001141992344 1029336852 /nfs/dbraw/zinc/33/68/52/1029336852.db2.gz LRKGSWCXMXZRPB-GOSISDBHSA-N 2 1 349.434 4.007 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[N@H+]2C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168057923 1029355810 /nfs/dbraw/zinc/35/58/10/1029355810.db2.gz OPOKHMVJPAKWFO-UWTAYAECSA-N 2 1 342.527 4.070 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[N@@H+]2C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168057923 1029355828 /nfs/dbraw/zinc/35/58/28/1029355828.db2.gz OPOKHMVJPAKWFO-UWTAYAECSA-N 2 1 342.527 4.070 20 0 EIADMP COCCC1(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCCCC1 ZINC000475269209 1029478043 /nfs/dbraw/zinc/47/80/43/1029478043.db2.gz MSANAWAJAARJPF-NRFANRHFSA-N 2 1 344.543 4.085 20 0 EIADMP C[C@@H](CCc1ccc(F)cc1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475270422 1029487305 /nfs/dbraw/zinc/48/73/05/1029487305.db2.gz SEXAYVRXHQITJI-RXVVDRJESA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000655710803 1029571035 /nfs/dbraw/zinc/57/10/35/1029571035.db2.gz FSTUBCMALRSBBL-RNINOARNSA-N 2 1 330.541 4.056 20 0 EIADMP C[C@H]([NH2+]CCCN(C)Cc1ccccc1)c1ccc(C(F)F)nc1 ZINC000657823250 1029577810 /nfs/dbraw/zinc/57/78/10/1029577810.db2.gz COFPYGBUVYHAFN-HNNXBMFYSA-N 2 1 333.426 4.192 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1ccc(C(F)F)nc1 ZINC000657823250 1029577817 /nfs/dbraw/zinc/57/78/17/1029577817.db2.gz COFPYGBUVYHAFN-HNNXBMFYSA-N 2 1 333.426 4.192 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccc(C(F)F)nc1 ZINC000657823250 1029577825 /nfs/dbraw/zinc/57/78/25/1029577825.db2.gz COFPYGBUVYHAFN-HNNXBMFYSA-N 2 1 333.426 4.192 20 0 EIADMP Cc1ccc([C@@H]([NH2+]CCCC[N@H+]2CCC[C@@H]2CO)C2CCCC2)cc1 ZINC000446820468 1029588720 /nfs/dbraw/zinc/58/87/20/1029588720.db2.gz CWETZLZQBMBPDW-YADHBBJMSA-N 2 1 344.543 4.053 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)cc1 ZINC000584140662 1029640637 /nfs/dbraw/zinc/64/06/37/1029640637.db2.gz SBADXBSZNSHYNR-UWJYYQICSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)cc1 ZINC000584140662 1029640641 /nfs/dbraw/zinc/64/06/41/1029640641.db2.gz SBADXBSZNSHYNR-UWJYYQICSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000584140662 1029640644 /nfs/dbraw/zinc/64/06/44/1029640644.db2.gz SBADXBSZNSHYNR-UWJYYQICSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000584140662 1029640647 /nfs/dbraw/zinc/64/06/47/1029640647.db2.gz SBADXBSZNSHYNR-UWJYYQICSA-N 2 1 338.495 4.134 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2csc(-c3csc(C)n3)c2)CC1 ZINC000159290739 1029685324 /nfs/dbraw/zinc/68/53/24/1029685324.db2.gz MQEWOGNGLKIFCM-LBPRGKRZSA-N 2 1 335.542 4.315 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(C(F)F)nc1 ZINC000657838548 1029721925 /nfs/dbraw/zinc/72/19/25/1029721925.db2.gz VOJBHEFZJPIAHQ-LSDHHAIUSA-N 2 1 325.447 4.324 20 0 EIADMP Cc1cc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c2cc(F)ccc2[nH+]1 ZINC000301793063 1029809361 /nfs/dbraw/zinc/80/93/61/1029809361.db2.gz RQKBFVPMNMBWAL-MGPUTAFESA-N 2 1 339.458 4.135 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2COc3ccc(C)cc32)cc1 ZINC000090452398 1029860851 /nfs/dbraw/zinc/86/08/51/1029860851.db2.gz CFPQSIQHAQRLES-YWZLYKJASA-N 2 1 333.435 4.273 20 0 EIADMP C[N@H+]1CC[C@@H](C[NH2+]Cc2ccc3occc3c2)[C@@H]1c1cccs1 ZINC000375751891 1029865138 /nfs/dbraw/zinc/86/51/38/1029865138.db2.gz YBYZZMBGUXNQDJ-QFBILLFUSA-N 2 1 326.465 4.277 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](c2cccnc2)C(C)C)cc1F ZINC000091307389 1029883546 /nfs/dbraw/zinc/88/35/46/1029883546.db2.gz JGABHJHQRIDHOE-FQEVSTJZSA-N 2 1 338.430 4.202 20 0 EIADMP CC(C)c1nn(-c2ccccc2)cc1C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000092071305 1029899380 /nfs/dbraw/zinc/89/93/80/1029899380.db2.gz GLXJQNKNNCDEJH-QGZVFWFLSA-N 2 1 349.482 4.098 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccccc1OC(F)(F)F ZINC000121427688 1030110290 /nfs/dbraw/zinc/11/02/90/1030110290.db2.gz WHQMFAJUNWWGBN-STQMWFEESA-N 2 1 341.377 4.077 20 0 EIADMP C[N@H+](Cc1nccs1)[C@@H]1CC12CC[NH+](CCC1=CCCCC1)CC2 ZINC000450940265 1030120345 /nfs/dbraw/zinc/12/03/45/1030120345.db2.gz QZAZGHWNUZMAJM-GOSISDBHSA-N 2 1 345.556 4.320 20 0 EIADMP C[N@@H+](Cc1nccs1)[C@@H]1CC12CC[NH+](CCC1=CCCCC1)CC2 ZINC000450940265 1030120360 /nfs/dbraw/zinc/12/03/60/1030120360.db2.gz QZAZGHWNUZMAJM-GOSISDBHSA-N 2 1 345.556 4.320 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C(F)F ZINC000657879101 1030164098 /nfs/dbraw/zinc/16/40/98/1030164098.db2.gz JOCHOVNGLQUEEO-MIGBEJBISA-N 2 1 336.470 4.451 20 0 EIADMP C[C@H](CC(F)(F)F)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447601977 1030218843 /nfs/dbraw/zinc/21/88/43/1030218843.db2.gz RBPKUHFFCRJILV-MXASKKJJSA-N 2 1 326.406 4.113 20 0 EIADMP Clc1ccc2c(c1)CC[C@H]2[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000530217930 1030224197 /nfs/dbraw/zinc/22/41/97/1030224197.db2.gz CUYJBJOIXGCIRF-DFQSSKMNSA-N 2 1 326.871 4.410 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657887331 1030225696 /nfs/dbraw/zinc/22/56/96/1030225696.db2.gz GZSZUFGMQRCRIN-NTZNESFSSA-N 2 1 345.712 4.236 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657887331 1030225714 /nfs/dbraw/zinc/22/57/14/1030225714.db2.gz GZSZUFGMQRCRIN-NTZNESFSSA-N 2 1 345.712 4.236 20 0 EIADMP Clc1ccc(/C=C/C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000526056938 1030252424 /nfs/dbraw/zinc/25/24/24/1030252424.db2.gz RWZBQOISOJWSHK-MBEDVLMFSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C/C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000526056938 1030252447 /nfs/dbraw/zinc/25/24/47/1030252447.db2.gz RWZBQOISOJWSHK-MBEDVLMFSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C/C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000526056938 1030252469 /nfs/dbraw/zinc/25/24/69/1030252469.db2.gz RWZBQOISOJWSHK-MBEDVLMFSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C/C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000526056938 1030252490 /nfs/dbraw/zinc/25/24/90/1030252490.db2.gz RWZBQOISOJWSHK-MBEDVLMFSA-N 2 1 330.903 4.302 20 0 EIADMP CCc1ccc(-c2ccc(C[N@H+]3CC[C@@H](c4nccn4C)C3)o2)cc1 ZINC000685463265 1030344458 /nfs/dbraw/zinc/34/44/58/1030344458.db2.gz NCEAJZXDRDQHBE-GOSISDBHSA-N 2 1 335.451 4.232 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)C2CCSCC2)cc1 ZINC000187290860 1030353084 /nfs/dbraw/zinc/35/30/84/1030353084.db2.gz AFGRMYUCRKCMQS-LSDHHAIUSA-N 2 1 329.513 4.363 20 0 EIADMP Cc1ccc(N2CCC([NH2+]Cc3ccc4nc(C)ccc4c3)CC2)[nH+]c1 ZINC000189358804 1030462099 /nfs/dbraw/zinc/46/20/99/1030462099.db2.gz XKQHNHAKEDYQHV-UHFFFAOYSA-N 2 1 346.478 4.005 20 0 EIADMP C[C@H](CCSc1ccccc1)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000431607620 1030474771 /nfs/dbraw/zinc/47/47/71/1030474771.db2.gz IIYDPFJVKASULJ-IEBWSBKVSA-N 2 1 332.557 4.221 20 0 EIADMP C[C@H](CCSc1ccccc1)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000431607620 1030474788 /nfs/dbraw/zinc/47/47/88/1030474788.db2.gz IIYDPFJVKASULJ-IEBWSBKVSA-N 2 1 332.557 4.221 20 0 EIADMP C[C@H](CCSc1ccccc1)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000431607620 1030474809 /nfs/dbraw/zinc/47/48/09/1030474809.db2.gz IIYDPFJVKASULJ-IEBWSBKVSA-N 2 1 332.557 4.221 20 0 EIADMP Cc1c([C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cnn1C(C)(C)C ZINC000191238444 1030610548 /nfs/dbraw/zinc/61/05/48/1030610548.db2.gz OJLGNRGDBBXALL-INIZCTEOSA-N 2 1 346.563 4.252 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCOc2ccc3ccccc3c2)C[C@@H]1C ZINC000530662942 1030619331 /nfs/dbraw/zinc/61/93/31/1030619331.db2.gz RXDWRDXVDHATOU-FXAWDEMLSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCOc2ccc3ccccc3c2)C[C@@H]1C ZINC000530662942 1030619336 /nfs/dbraw/zinc/61/93/36/1030619336.db2.gz RXDWRDXVDHATOU-FXAWDEMLSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCOc2ccc3ccccc3c2)C[C@@H]1C ZINC000530662942 1030619348 /nfs/dbraw/zinc/61/93/48/1030619348.db2.gz RXDWRDXVDHATOU-FXAWDEMLSA-N 2 1 326.484 4.023 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000530667404 1030623534 /nfs/dbraw/zinc/62/35/34/1030623534.db2.gz FBFSYDDUSNYGRV-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000530667404 1030623546 /nfs/dbraw/zinc/62/35/46/1030623546.db2.gz FBFSYDDUSNYGRV-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000530667404 1030623565 /nfs/dbraw/zinc/62/35/65/1030623565.db2.gz FBFSYDDUSNYGRV-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000530667404 1030623576 /nfs/dbraw/zinc/62/35/76/1030623576.db2.gz FBFSYDDUSNYGRV-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2ccccc2n1 ZINC000398109842 1030703400 /nfs/dbraw/zinc/70/34/00/1030703400.db2.gz CPLUTDVYPDDFOV-GCJKJVERSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(C(F)F)nc1 ZINC000657969666 1030705921 /nfs/dbraw/zinc/70/59/21/1030705921.db2.gz SXQAHJCPXGNHDC-DZKIICNBSA-N 2 1 337.458 4.323 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000398141015 1030712252 /nfs/dbraw/zinc/71/22/52/1030712252.db2.gz MKDMZWFOSIQGRI-LAUBAEHRSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000398141015 1030712272 /nfs/dbraw/zinc/71/22/72/1030712272.db2.gz MKDMZWFOSIQGRI-LAUBAEHRSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000398133010 1030712511 /nfs/dbraw/zinc/71/25/11/1030712511.db2.gz KDLIBUYHNUNNGB-UTKZUKDTSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000398179850 1030728950 /nfs/dbraw/zinc/72/89/50/1030728950.db2.gz WUURNDQBGOEJMI-DYESRHJHSA-N 2 1 333.479 4.168 20 0 EIADMP Cc1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc(C)c1O ZINC000398182641 1030733162 /nfs/dbraw/zinc/73/31/62/1030733162.db2.gz KKMMTTGOQHOVJI-RXVVDRJESA-N 2 1 338.495 4.009 20 0 EIADMP CCC(CC)(C[NH2+][C@H]1CCC12CCOCC2)[NH2+][C@@H](C)c1ccccc1 ZINC000548859477 1030820893 /nfs/dbraw/zinc/82/08/93/1030820893.db2.gz JOBALWFAWQKZAL-ICSRJNTNSA-N 2 1 344.543 4.445 20 0 EIADMP Brc1ccc(/C=C/CC[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000527741683 1030838280 /nfs/dbraw/zinc/83/82/80/1030838280.db2.gz AEKFDMYGDLWECB-PESVTJQDSA-N 2 1 349.316 4.069 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](c2cccc(C)c2)C(C)C)cn1 ZINC000527849624 1030891249 /nfs/dbraw/zinc/89/12/49/1030891249.db2.gz MOJQYVNBJSIQHK-OAQYLSRUSA-N 2 1 334.467 4.371 20 0 EIADMP Oc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CC2 ZINC000658240092 1030898306 /nfs/dbraw/zinc/89/83/06/1030898306.db2.gz XSYQYZFFSBKZDS-SRYPRDQNSA-N 2 1 348.490 4.165 20 0 EIADMP Oc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3Cc1ccccc1)CC2 ZINC000658240092 1030898308 /nfs/dbraw/zinc/89/83/08/1030898308.db2.gz XSYQYZFFSBKZDS-SRYPRDQNSA-N 2 1 348.490 4.165 20 0 EIADMP C[C@@H](NC[C@H]1CC[N@@H+]1C1CCCCC1)c1cnc2ccsc2c1 ZINC000527949017 1030962999 /nfs/dbraw/zinc/96/29/99/1030962999.db2.gz NQICBPAWJMESSN-RHSMWYFYSA-N 2 1 329.513 4.354 20 0 EIADMP C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527964479 1031007828 /nfs/dbraw/zinc/00/78/28/1031007828.db2.gz KSCRHKLTRJXPFS-AVCGJXAMSA-N 2 1 349.522 4.423 20 0 EIADMP C[C@@H](O)[C@@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1ccccc1 ZINC000658355921 1031025569 /nfs/dbraw/zinc/02/55/69/1031025569.db2.gz IQKQUUZYOVBTMP-YLJYHZDGSA-N 2 1 346.559 4.377 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)C1CCOCC1 ZINC000532459776 1031106433 /nfs/dbraw/zinc/10/64/33/1031106433.db2.gz IVSHHGSSUUXKFV-PGRDOPGGSA-N 2 1 344.543 4.213 20 0 EIADMP COc1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1C ZINC000532469189 1031148510 /nfs/dbraw/zinc/14/85/10/1031148510.db2.gz MPCNBZGDBIKGNO-WIYYLYMNSA-N 2 1 338.495 4.004 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)sc1C ZINC000892471115 1031173532 /nfs/dbraw/zinc/17/35/32/1031173532.db2.gz ZPYWNVNVRSQOFN-UHFFFAOYSA-N 2 1 329.513 4.036 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc3ncccc3c2)C[C@@H]1c1ccccc1 ZINC000340377429 1031211359 /nfs/dbraw/zinc/21/13/59/1031211359.db2.gz ISHIMDVOQBLPKL-IFMALSPDSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc3ncccc3c2)C[C@@H]1c1ccccc1 ZINC000340377429 1031211383 /nfs/dbraw/zinc/21/13/83/1031211383.db2.gz ISHIMDVOQBLPKL-IFMALSPDSA-N 2 1 331.463 4.160 20 0 EIADMP COc1cccc2c(C[N@H+]3CCC[C@@H]3Cn3ccnc3C)cccc12 ZINC000449037698 1031377087 /nfs/dbraw/zinc/37/70/87/1031377087.db2.gz OFSQHTHBNDTQTR-GOSISDBHSA-N 2 1 335.451 4.018 20 0 EIADMP COc1cccc2c(C[N@@H+]3CCC[C@@H]3Cn3cc[nH+]c3C)cccc12 ZINC000449037698 1031377103 /nfs/dbraw/zinc/37/71/03/1031377103.db2.gz OFSQHTHBNDTQTR-GOSISDBHSA-N 2 1 335.451 4.018 20 0 EIADMP COc1cccc2c(C[N@H+]3CCC[C@@H]3Cn3cc[nH+]c3C)cccc12 ZINC000449037698 1031377114 /nfs/dbraw/zinc/37/71/14/1031377114.db2.gz OFSQHTHBNDTQTR-GOSISDBHSA-N 2 1 335.451 4.018 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2cc3cccnc3o2)C1 ZINC000449081956 1031437745 /nfs/dbraw/zinc/43/77/45/1031437745.db2.gz JEHKNPJIMDAVFH-KRWDZBQOSA-N 2 1 349.478 4.350 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccccc23)CC[N@@H+]1Cc1ccccc1 ZINC000531677776 1031470533 /nfs/dbraw/zinc/47/05/33/1031470533.db2.gz ZTALYEMLJCXDEL-RXVVDRJESA-N 2 1 347.506 4.353 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccccc23)CC[N@H+]1Cc1ccccc1 ZINC000531677776 1031470541 /nfs/dbraw/zinc/47/05/41/1031470541.db2.gz ZTALYEMLJCXDEL-RXVVDRJESA-N 2 1 347.506 4.353 20 0 EIADMP COc1cc(F)cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1 ZINC000449159596 1031488032 /nfs/dbraw/zinc/48/80/32/1031488032.db2.gz HPGBTQXJUOGYQK-BEFAXECRSA-N 2 1 348.487 4.069 20 0 EIADMP COc1cc(F)cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000449159596 1031488043 /nfs/dbraw/zinc/48/80/43/1031488043.db2.gz HPGBTQXJUOGYQK-BEFAXECRSA-N 2 1 348.487 4.069 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(C)(C)c1cccc(C(F)(F)F)c1 ZINC000531710572 1031497249 /nfs/dbraw/zinc/49/72/49/1031497249.db2.gz ZCYGXQBPVUCTLM-CPUCHLNUSA-N 2 1 342.449 4.301 20 0 EIADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1cc2cccnc2o1 ZINC000449181025 1031520468 /nfs/dbraw/zinc/52/04/68/1031520468.db2.gz DNPPQZXYNJKPDE-IAGOWNOFSA-N 2 1 349.478 4.074 20 0 EIADMP COCC1CCC([NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000449216233 1031548801 /nfs/dbraw/zinc/54/88/01/1031548801.db2.gz QQJAFAMENNRVIF-DWOCFRCJSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+]Cc2cc3cccnc3o2)C[N@H+]1Cc1ccccc1 ZINC000449217116 1031551596 /nfs/dbraw/zinc/55/15/96/1031551596.db2.gz WZNDHCAMSUOETM-HKUYNNGSSA-N 2 1 349.478 4.218 20 0 EIADMP COCC1CCC([NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000449338107 1031655958 /nfs/dbraw/zinc/65/59/58/1031655958.db2.gz RNKCRZBIFMILQM-ATKRNPRHSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2ccccn2)CC[N@@H+]1Cc1ccccc1 ZINC000449399226 1031705542 /nfs/dbraw/zinc/70/55/42/1031705542.db2.gz YTJBVJYGUFZZGF-ICSRJNTNSA-N 2 1 337.511 4.002 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2ccccn2)CC[N@H+]1Cc1ccccc1 ZINC000449399226 1031705557 /nfs/dbraw/zinc/70/55/57/1031705557.db2.gz YTJBVJYGUFZZGF-ICSRJNTNSA-N 2 1 337.511 4.002 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccc(F)cc1F ZINC000128168153 1031728049 /nfs/dbraw/zinc/72/80/49/1031728049.db2.gz IRSZJUYDIZKJCI-IBGZPJMESA-N 2 1 345.437 4.378 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCO[C@H](C(C)C)C2)cc1 ZINC000449494198 1031804115 /nfs/dbraw/zinc/80/41/15/1031804115.db2.gz MYYCQYRZLNEFBW-CDXJDZJCSA-N 2 1 341.499 4.283 20 0 EIADMP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000449559854 1031846918 /nfs/dbraw/zinc/84/69/18/1031846918.db2.gz CXMRKXCMXSQNML-DXJOGWAWSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@@H+](C)C[C@H]1C)c1c(Cl)cccc1Cl ZINC000531963658 1031883613 /nfs/dbraw/zinc/88/36/13/1031883613.db2.gz LNNLFEFSMYYNES-BRXULGCHSA-N 2 1 329.315 4.415 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]CCn1cc[nH+]c1C ZINC000531964510 1031885275 /nfs/dbraw/zinc/88/52/75/1031885275.db2.gz WJSCWXDEGAPHOO-SFHVURJKSA-N 2 1 325.481 4.135 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000531970874 1031902993 /nfs/dbraw/zinc/90/29/93/1031902993.db2.gz ZDINZSKSVGJXEE-MELADBBJSA-N 2 1 345.314 4.081 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000531972414 1031910477 /nfs/dbraw/zinc/91/04/77/1031910477.db2.gz RIVLNIKSUXKXEW-UTKZUKDTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(F)cc1Br ZINC000453399782 1031934602 /nfs/dbraw/zinc/93/46/02/1031934602.db2.gz LJTFZCLXEUWCLE-LBPRGKRZSA-N 2 1 343.284 4.113 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453417577 1031950957 /nfs/dbraw/zinc/95/09/57/1031950957.db2.gz XVEGFGIYBKHQFZ-CABCVRRESA-N 2 1 331.529 4.252 20 0 EIADMP CCCc1ncc(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)o1 ZINC000453392579 1031958187 /nfs/dbraw/zinc/95/81/87/1031958187.db2.gz QZCUAJAZAPKAIF-UHFFFAOYSA-N 2 1 341.499 4.160 20 0 EIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453393312 1031961388 /nfs/dbraw/zinc/96/13/88/1031961388.db2.gz FYFHRPJKTLUNNH-FQEVSTJZSA-N 2 1 325.500 4.318 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000532046990 1031997697 /nfs/dbraw/zinc/99/76/97/1031997697.db2.gz YLECONRYLDKCPB-QGZVFWFLSA-N 2 1 349.478 4.293 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1 ZINC000237337866 1032018116 /nfs/dbraw/zinc/01/81/16/1032018116.db2.gz HCAYUFYNUGFFAB-QGZVFWFLSA-N 2 1 349.478 4.293 20 0 EIADMP C[C@H]([NH2+]CCc1c(F)cccc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000544424364 1032053542 /nfs/dbraw/zinc/05/35/42/1032053542.db2.gz LGDLBJZRLUBRJV-GJZGRUSLSA-N 2 1 338.898 4.264 20 0 EIADMP CSCCCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000512633896 1033569680 /nfs/dbraw/zinc/56/96/80/1033569680.db2.gz AWGPDSDOTGQSFS-SLFFLAALSA-N 2 1 332.557 4.020 20 0 EIADMP Cc1cc(OCC[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)ccc1C(C)C ZINC000513128812 1034604662 /nfs/dbraw/zinc/60/46/62/1034604662.db2.gz SUFTXTGLRFNHLD-DFNIBXOVSA-N 2 1 330.516 4.054 20 0 EIADMP Cc1cc(OCC[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)ccc1C(C)C ZINC000513128812 1034604666 /nfs/dbraw/zinc/60/46/66/1034604666.db2.gz SUFTXTGLRFNHLD-DFNIBXOVSA-N 2 1 330.516 4.054 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(CNc2cc(C)[nH+]c3ccccc23)cn1 ZINC000052510473 1034607479 /nfs/dbraw/zinc/60/74/79/1034607479.db2.gz SWSYADVPPBFLRH-UHFFFAOYSA-N 2 1 329.407 4.044 20 0 EIADMP 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 1034710217 /nfs/dbraw/zinc/71/02/17/1034710217.db2.gz GVMRSHOMCRAQES-NGDUPAHQSA-N 2 1 330.541 4.079 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+]([C@H]3C[C@H]4C[C@H]4C3)C[C@H]21 ZINC001167934136 1034710239 /nfs/dbraw/zinc/71/02/39/1034710239.db2.gz GVMRSHOMCRAQES-NGDUPAHQSA-N 2 1 330.541 4.079 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+]([C@H]3C[C@H]4C[C@H]4C3)C[C@H]21 ZINC001167934136 1034710254 /nfs/dbraw/zinc/71/02/54/1034710254.db2.gz GVMRSHOMCRAQES-NGDUPAHQSA-N 2 1 330.541 4.079 20 0 EIADMP Cc1ccc(C[N@H+]2CCCC3(CC[NH+]([C@@H]4C[C@H]5C[C@H]5C4)CC3)C2)cc1 ZINC001167941590 1034809438 /nfs/dbraw/zinc/80/94/38/1034809438.db2.gz QKTNVACZNILHEQ-KOUNCHBCSA-N 2 1 338.539 4.472 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CCc4c3cccc4O)CC2)C1 ZINC000513204288 1034834800 /nfs/dbraw/zinc/83/48/00/1034834800.db2.gz PPRWTDXVBFBIID-MDYRTPRTSA-N 2 1 328.500 4.012 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H](c3cnn(C)c3)C(C)(C)C)CC2)C1 ZINC000513326332 1034879666 /nfs/dbraw/zinc/87/96/66/1034879666.db2.gz PECDWYSAFXXOHW-NSISKUIASA-N 2 1 346.563 4.140 20 0 EIADMP C[N@H+](Cc1cccc2cc[nH]c21)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513496934 1034987187 /nfs/dbraw/zinc/98/71/87/1034987187.db2.gz NPFNLHMPUKGGEG-UHFFFAOYSA-N 2 1 333.479 4.264 20 0 EIADMP C[N@@H+](Cc1cccc2cc[nH]c21)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513496934 1034987192 /nfs/dbraw/zinc/98/71/92/1034987192.db2.gz NPFNLHMPUKGGEG-UHFFFAOYSA-N 2 1 333.479 4.264 20 0 EIADMP COc1cccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000513510914 1035005831 /nfs/dbraw/zinc/00/58/31/1035005831.db2.gz GNHOOBOTGVCYPJ-NQIIRXRSSA-N 2 1 338.495 4.086 20 0 EIADMP COCc1ccccc1/C=C(/C)C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000509927397 1035011496 /nfs/dbraw/zinc/01/14/96/1035011496.db2.gz PEMNIHHGUWXXOG-GCFJHJGGSA-N 2 1 344.543 4.338 20 0 EIADMP CCc1nc(C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cs1 ZINC000513546756 1035028777 /nfs/dbraw/zinc/02/87/77/1035028777.db2.gz ZPSJVNKCPWTJRS-WMZOPIPTSA-N 2 1 343.540 4.096 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)[C@@H]2CCC[C@@H]21 ZINC000513712193 1035425727 /nfs/dbraw/zinc/42/57/27/1035425727.db2.gz AJPCAEFOAIROLQ-BZSNNMDCSA-N 2 1 340.433 4.100 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000501380183 1035430228 /nfs/dbraw/zinc/43/02/28/1035430228.db2.gz CUIZLRKKNOWIDT-IPJDOKCGSA-N 2 1 338.417 4.183 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501384133 1035435882 /nfs/dbraw/zinc/43/58/82/1035435882.db2.gz WRWVEMQVKNAFDD-RCLSDMTESA-N 2 1 329.532 4.065 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000501425136 1035443423 /nfs/dbraw/zinc/44/34/23/1035443423.db2.gz OAWPEBGNPJYANS-WMGCDEKXSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000501425136 1035443432 /nfs/dbraw/zinc/44/34/32/1035443432.db2.gz OAWPEBGNPJYANS-WMGCDEKXSA-N 2 1 338.417 4.325 20 0 EIADMP c1cc(CCC[N@@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cs1 ZINC000420301652 1035503439 /nfs/dbraw/zinc/50/34/39/1035503439.db2.gz ARBIWFLXENFELI-SFHVURJKSA-N 2 1 346.565 4.387 20 0 EIADMP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000420307236 1035504176 /nfs/dbraw/zinc/50/41/76/1035504176.db2.gz BILYTKVVPVAZCR-FXAWDEMLSA-N 2 1 340.515 4.144 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420327454 1035531161 /nfs/dbraw/zinc/53/11/61/1035531161.db2.gz LDPLGFBKDPYTHZ-VNQPRFMTSA-N 2 1 326.406 4.088 20 0 EIADMP c1sc(C2CCCCC2)nc1C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000420332632 1035533926 /nfs/dbraw/zinc/53/39/26/1035533926.db2.gz GQLAVDBCOGZGLC-SFHVURJKSA-N 2 1 333.545 4.155 20 0 EIADMP CSCC1(CC[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000595067415 1035551315 /nfs/dbraw/zinc/55/13/15/1035551315.db2.gz ILNPRTXKAGURLZ-HKUYNNGSSA-N 2 1 332.557 4.020 20 0 EIADMP C[N@@H+](Cc1ccc(F)c(-c2cccs2)c1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000470010037 1035555053 /nfs/dbraw/zinc/55/50/53/1035555053.db2.gz VZDZTJIXOWZWMB-XYPWUTKMSA-N 2 1 330.472 4.269 20 0 EIADMP C[C@H](C[N@H+]1CCC[C@H]([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501951050 1035754513 /nfs/dbraw/zinc/75/45/13/1035754513.db2.gz OBQYKHKYSRXORP-PBHICJAKSA-N 2 1 328.422 4.225 20 0 EIADMP CC(C)[NH2+]CCCC[C@H]([NH3+])c1nc(-c2ccc(C(C)(C)C)cc2)no1 ZINC001212145419 1035924976 /nfs/dbraw/zinc/92/49/76/1035924976.db2.gz TZMNKRHZRPJMAN-KRWDZBQOSA-N 2 1 344.503 4.202 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090594 1035942308 /nfs/dbraw/zinc/94/23/08/1035942308.db2.gz GHUSSRTXJLVXLT-KSSFIOAISA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090594 1035942320 /nfs/dbraw/zinc/94/23/20/1035942320.db2.gz GHUSSRTXJLVXLT-KSSFIOAISA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090594 1035942330 /nfs/dbraw/zinc/94/23/30/1035942330.db2.gz GHUSSRTXJLVXLT-KSSFIOAISA-N 2 1 332.488 4.326 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090594 1035942336 /nfs/dbraw/zinc/94/23/36/1035942336.db2.gz GHUSSRTXJLVXLT-KSSFIOAISA-N 2 1 332.488 4.326 20 0 EIADMP FC(F)Oc1ccc2ccccc2c1C[NH2+]CCC[NH+]1CCCCC1 ZINC000588258035 1036330245 /nfs/dbraw/zinc/33/02/45/1036330245.db2.gz ULVOQCJYECGBAF-UHFFFAOYSA-N 2 1 348.437 4.407 20 0 EIADMP Clc1cccc(OCCC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000572047912 1036400634 /nfs/dbraw/zinc/40/06/34/1036400634.db2.gz ZVNZEUMLWDELKA-GOSISDBHSA-N 2 1 336.907 4.059 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000502725584 1036587764 /nfs/dbraw/zinc/58/77/64/1036587764.db2.gz XUVKLZSTDGHCGE-XQBPLPMBSA-N 2 1 344.543 4.213 20 0 EIADMP Clc1ccc(O[C@H]2CCC[N@@H+](C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC001168387286 1036678172 /nfs/dbraw/zinc/67/81/72/1036678172.db2.gz BUFDHBPKDKPAAK-FQEVSTJZSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(O[C@H]2CCC[N@H+](C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC001168387286 1036678194 /nfs/dbraw/zinc/67/81/94/1036678194.db2.gz BUFDHBPKDKPAAK-FQEVSTJZSA-N 2 1 348.918 4.058 20 0 EIADMP COC1([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCC1 ZINC000421829856 1036788130 /nfs/dbraw/zinc/78/81/30/1036788130.db2.gz JALFRUNWCQLYIF-LBFURVHYSA-N 2 1 342.527 4.119 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2[nH]nc3ccccc32)C1 ZINC000589641075 1036857356 /nfs/dbraw/zinc/85/73/56/1036857356.db2.gz DCXROIPUOQRBNE-KRWDZBQOSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1[nH]nc2ccccc21 ZINC000589641373 1036857836 /nfs/dbraw/zinc/85/78/36/1036857836.db2.gz JBKFLTDUTOWVOI-QGZVFWFLSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2cnc(-c3ccccc3)s2)C1 ZINC000589641443 1036858286 /nfs/dbraw/zinc/85/82/86/1036858286.db2.gz KTSGHUKOUBKDIA-IAGOWNOFSA-N 2 1 343.540 4.268 20 0 EIADMP CN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000589837987 1036880230 /nfs/dbraw/zinc/88/02/30/1036880230.db2.gz OEAWLNDITAQATE-YADHBBJMSA-N 2 1 335.495 4.171 20 0 EIADMP CN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC000589837987 1036880232 /nfs/dbraw/zinc/88/02/32/1036880232.db2.gz OEAWLNDITAQATE-YADHBBJMSA-N 2 1 335.495 4.171 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@](C)(CCc2ccccc2)C1 ZINC000503079008 1036894967 /nfs/dbraw/zinc/89/49/67/1036894967.db2.gz CHZKSPVKWSPWJW-NRFANRHFSA-N 2 1 325.500 4.317 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@](C)(CCc2ccccc2)C1 ZINC000503079008 1036894972 /nfs/dbraw/zinc/89/49/72/1036894972.db2.gz CHZKSPVKWSPWJW-NRFANRHFSA-N 2 1 325.500 4.317 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2CCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000503078749 1036895422 /nfs/dbraw/zinc/89/54/22/1036895422.db2.gz SINVKFPAGNXCFU-LPHOPBHVSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2CCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000503078749 1036895423 /nfs/dbraw/zinc/89/54/23/1036895423.db2.gz SINVKFPAGNXCFU-LPHOPBHVSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C/C=C\c2ccncc2)C1 ZINC000486935524 1036907971 /nfs/dbraw/zinc/90/79/71/1036907971.db2.gz JKOJRLHJEKUGPQ-OCTSTCLRSA-N 2 1 335.495 4.117 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]C[C@H]2CCSC2)C1 ZINC000486982921 1036935600 /nfs/dbraw/zinc/93/56/00/1036935600.db2.gz VJVFQPOHCWERLG-FGTMMUONSA-N 2 1 332.557 4.007 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271812514 1037022063 /nfs/dbraw/zinc/02/20/63/1037022063.db2.gz BAYILPDKMBTMGX-CYBMUJFWSA-N 2 1 345.487 4.170 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+][C@H](C)CC3CCCCC3)sc2C1 ZINC000487166891 1037024687 /nfs/dbraw/zinc/02/46/87/1037024687.db2.gz XZAKKPKCYJLZKO-OAHLLOKOSA-N 2 1 335.561 4.358 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+][C@H](C)CC3CCCCC3)sc2C1 ZINC000487166891 1037024702 /nfs/dbraw/zinc/02/47/02/1037024702.db2.gz XZAKKPKCYJLZKO-OAHLLOKOSA-N 2 1 335.561 4.358 20 0 EIADMP Cc1oc(-c2ccsc2)nc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000590786136 1037165339 /nfs/dbraw/zinc/16/53/39/1037165339.db2.gz BKERSVKGMIBVBD-UHFFFAOYSA-N 2 1 347.528 4.264 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2csc(C3CCCC3)n2)CC1 ZINC000590786427 1037165885 /nfs/dbraw/zinc/16/58/85/1037165885.db2.gz WWFFCUFLSPSAFG-UHFFFAOYSA-N 2 1 335.561 4.353 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2csc(C3CCCC3)n2)CC1 ZINC000590786427 1037165900 /nfs/dbraw/zinc/16/59/00/1037165900.db2.gz WWFFCUFLSPSAFG-UHFFFAOYSA-N 2 1 335.561 4.353 20 0 EIADMP C[C@@H](N[C@@H](C)c1cccnc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272355886 1037168518 /nfs/dbraw/zinc/16/85/18/1037168518.db2.gz RJMMXOBPDPJWQW-SOLBZPMBSA-N 2 1 343.902 4.296 20 0 EIADMP Cc1csc([C@H](C)C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000273470320 1037474344 /nfs/dbraw/zinc/47/43/44/1037474344.db2.gz RXDDCUHYKATPNV-MDZRGWNJSA-N 2 1 343.540 4.055 20 0 EIADMP CC[N@@H+](Cc1cnc(CC(C)C)s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000573486927 1037566234 /nfs/dbraw/zinc/56/62/34/1037566234.db2.gz ATERJIAALWFRGP-UHFFFAOYSA-N 2 1 345.556 4.425 20 0 EIADMP COc1c(C)cnc(CN2CCC([N@@H+](C)CCCC(C)C)CC2)c1C ZINC000573526518 1037574715 /nfs/dbraw/zinc/57/47/15/1037574715.db2.gz IYMWYSHWRAPOOT-UHFFFAOYSA-N 2 1 347.547 4.039 20 0 EIADMP COc1c(C)c[nH+]c(CN2CCC([N@H+](C)CCCC(C)C)CC2)c1C ZINC000573526518 1037574726 /nfs/dbraw/zinc/57/47/26/1037574726.db2.gz IYMWYSHWRAPOOT-UHFFFAOYSA-N 2 1 347.547 4.039 20 0 EIADMP COc1c(C)c[nH+]c(CN2CCC([N@@H+](C)CCCC(C)C)CC2)c1C ZINC000573526518 1037574730 /nfs/dbraw/zinc/57/47/30/1037574730.db2.gz IYMWYSHWRAPOOT-UHFFFAOYSA-N 2 1 347.547 4.039 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CCN(CCc2cc(Cl)ccc2Cl)C1 ZINC000488469421 1037617064 /nfs/dbraw/zinc/61/70/64/1037617064.db2.gz ZJDCQLKPMPRJKZ-HNNXBMFYSA-N 2 1 341.326 4.200 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414648191 1037657229 /nfs/dbraw/zinc/65/72/29/1037657229.db2.gz AQVRMXLVQMCQKX-WCRBZPEASA-N 2 1 336.479 4.077 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414648191 1037657240 /nfs/dbraw/zinc/65/72/40/1037657240.db2.gz AQVRMXLVQMCQKX-WCRBZPEASA-N 2 1 336.479 4.077 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000513787594 1037714229 /nfs/dbraw/zinc/71/42/29/1037714229.db2.gz BLMGIIJUIBCZBP-GGPKGHCWSA-N 2 1 340.511 4.430 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000513787594 1037714246 /nfs/dbraw/zinc/71/42/46/1037714246.db2.gz BLMGIIJUIBCZBP-GGPKGHCWSA-N 2 1 340.511 4.430 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000513787594 1037714264 /nfs/dbraw/zinc/71/42/64/1037714264.db2.gz BLMGIIJUIBCZBP-GGPKGHCWSA-N 2 1 340.511 4.430 20 0 EIADMP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]C1CCN([C@H](C)c2ccccc2)CC1 ZINC000422740253 1037821416 /nfs/dbraw/zinc/82/14/16/1037821416.db2.gz BJZHZMNFODVQQN-WOIUINJBSA-N 2 1 343.559 4.112 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]Cc3ccc(-c4ccncc4)cc3)CC[NH2+]2)cc1 ZINC000422773190 1037830596 /nfs/dbraw/zinc/83/05/96/1037830596.db2.gz TXUVACJESDDCPT-GOTSBHOMSA-N 2 1 343.474 4.332 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)ccc1OC(C)C ZINC000422814210 1037839593 /nfs/dbraw/zinc/83/95/93/1037839593.db2.gz UAWJSBIDCOMBTA-ZOCIIQOWSA-N 2 1 340.467 4.278 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CN[C@H]3C[C@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866968 1037848928 /nfs/dbraw/zinc/84/89/28/1037848928.db2.gz RGZOJHFOMMLFJE-VSDWSMLSSA-N 2 1 349.522 4.153 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3C[C@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866968 1037848930 /nfs/dbraw/zinc/84/89/30/1037848930.db2.gz RGZOJHFOMMLFJE-VSDWSMLSSA-N 3 1 349.522 4.153 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@H]3C[C@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866968 1037848935 /nfs/dbraw/zinc/84/89/35/1037848935.db2.gz RGZOJHFOMMLFJE-VSDWSMLSSA-N 3 1 349.522 4.153 20 0 EIADMP Fc1cccc([C@@H]([NH2+][C@H]2CCC[NH2+]CC2)c2cccc(Cl)c2)c1 ZINC000422873147 1037859455 /nfs/dbraw/zinc/85/94/55/1037859455.db2.gz KFUPLPUIQLXYQS-OALUTQOASA-N 2 1 332.850 4.300 20 0 EIADMP c1ccc(-c2cccc3c2OCC[C@H]3[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422957191 1037889809 /nfs/dbraw/zinc/88/98/09/1037889809.db2.gz SLCDOOVIPQBTTE-PGGWPXBNSA-N 2 1 334.463 4.050 20 0 EIADMP CCCc1cccc(C[N@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)c1 ZINC000414717960 1037976312 /nfs/dbraw/zinc/97/63/12/1037976312.db2.gz QJCGXYLXMHYBNG-QFIPXVFZSA-N 2 1 337.511 4.178 20 0 EIADMP CCCc1cccc(C[N@@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)c1 ZINC000414717960 1037976333 /nfs/dbraw/zinc/97/63/33/1037976333.db2.gz QJCGXYLXMHYBNG-QFIPXVFZSA-N 2 1 337.511 4.178 20 0 EIADMP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(-c2ccccc2)o1 ZINC000423179874 1038035506 /nfs/dbraw/zinc/03/55/06/1038035506.db2.gz ALSSQPZYISRGRQ-QGZVFWFLSA-N 2 1 335.451 4.172 20 0 EIADMP CSc1cccc([C@@H]([NH2+]CC[C@H](C)[NH3+])c2ccc(F)c(F)c2)c1 ZINC000423223654 1038064666 /nfs/dbraw/zinc/06/46/66/1038064666.db2.gz HARKXQRFMCBTMZ-KPZWWZAWSA-N 2 1 336.451 4.103 20 0 EIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+][C@@H](C[NH3+])C1CC1 ZINC000423268036 1038096356 /nfs/dbraw/zinc/09/63/56/1038096356.db2.gz DHFDXIINPPMPHN-BMIGLBTASA-N 2 1 335.904 4.160 20 0 EIADMP C[C@H](C[NH3+])[NH2+][C@@H](C)c1ccc(-c2ccccc2Br)s1 ZINC000423318765 1038115348 /nfs/dbraw/zinc/11/53/48/1038115348.db2.gz DQSSFZFKZMEXAJ-MNOVXSKESA-N 2 1 339.302 4.175 20 0 EIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C[C@@H]([NH3+])C1CC1 ZINC000423331036 1038150547 /nfs/dbraw/zinc/15/05/47/1038150547.db2.gz UNUBPZSXZYJCON-ZUZCIYMTSA-N 2 1 335.904 4.160 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423374382 1038153682 /nfs/dbraw/zinc/15/36/82/1038153682.db2.gz JVXIMSJXLCFBIW-VYDXJSESSA-N 2 1 328.431 4.409 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@H]3C1)CCCO2 ZINC000489630263 1038177896 /nfs/dbraw/zinc/17/78/96/1038177896.db2.gz LHSSCYAGOJDHFR-CMKODMSKSA-N 2 1 328.500 4.240 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CCCO2 ZINC000489630263 1038177925 /nfs/dbraw/zinc/17/79/25/1038177925.db2.gz LHSSCYAGOJDHFR-CMKODMSKSA-N 2 1 328.500 4.240 20 0 EIADMP COc1ccc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)cc1 ZINC000489659951 1038196342 /nfs/dbraw/zinc/19/63/42/1038196342.db2.gz QUEGCTGZMHRPRK-UHFFFAOYSA-N 2 1 338.495 4.039 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cccc3c2CCCN3)cc1 ZINC000423421614 1038208004 /nfs/dbraw/zinc/20/80/04/1038208004.db2.gz YDSKUUXWQSBTOE-MRXNPFEDSA-N 2 1 346.478 4.390 20 0 EIADMP COCc1cc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)ccc1OC ZINC000157884050 1038211281 /nfs/dbraw/zinc/21/12/81/1038211281.db2.gz JYKDDURBPKHUOP-ROUUACIJSA-N 2 1 348.531 4.147 20 0 EIADMP CO[C@H]1C[C@H]2C[C@@H]([NH2+]C3CC[NH+]([C@@H](C)c4ccccc4)CC3)C[C@H]2C1 ZINC000424315658 1038801036 /nfs/dbraw/zinc/80/10/36/1038801036.db2.gz PQXWKFPSWODNRB-DTTOWAHTSA-N 2 1 342.527 4.005 20 0 EIADMP c1ccc(CC[C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000480763298 1038804453 /nfs/dbraw/zinc/80/44/53/1038804453.db2.gz MJCOBARYOHFAJA-NFBKMPQASA-N 2 1 334.507 4.434 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccccc2OC(F)F)C1 ZINC000539045516 1038810225 /nfs/dbraw/zinc/81/02/25/1038810225.db2.gz BCKMFSDKLOMZMP-HOTGVXAUSA-N 2 1 340.458 4.307 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccccc2OC(F)F)C1 ZINC000539045516 1038810227 /nfs/dbraw/zinc/81/02/27/1038810227.db2.gz BCKMFSDKLOMZMP-HOTGVXAUSA-N 2 1 340.458 4.307 20 0 EIADMP CC(C)(C)c1coc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)n1 ZINC001168316374 1038820864 /nfs/dbraw/zinc/82/08/64/1038820864.db2.gz AWKIKHPGVWNOQY-UHFFFAOYSA-N 2 1 333.520 4.060 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@H]1Cc1ccccc1 ZINC000539088421 1038830736 /nfs/dbraw/zinc/83/07/36/1038830736.db2.gz SHKGEYDSSOOHOU-TWHAJKEOSA-N 2 1 334.507 4.118 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@H]1Cc1ccccc1 ZINC000539088421 1038830738 /nfs/dbraw/zinc/83/07/38/1038830738.db2.gz SHKGEYDSSOOHOU-TWHAJKEOSA-N 2 1 334.507 4.118 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@@H](C)C1 ZINC000539093783 1038834463 /nfs/dbraw/zinc/83/44/63/1038834463.db2.gz TWODIFIATSLHCX-RXVVDRJESA-N 2 1 338.495 4.052 20 0 EIADMP COc1ccc([C@H]([NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)C2CC2)cc1 ZINC000539215679 1038887077 /nfs/dbraw/zinc/88/70/77/1038887077.db2.gz BZBQSDINQUHZDR-DYESRHJHSA-N 2 1 330.516 4.104 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1Cc2ccccc2C1 ZINC000462112800 1038929065 /nfs/dbraw/zinc/92/90/65/1038929065.db2.gz TYTVONACLXFKJF-UHFFFAOYSA-N 2 1 346.474 4.169 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(Cl)ccc2OC(F)F)C1 ZINC000481017560 1038946103 /nfs/dbraw/zinc/94/61/03/1038946103.db2.gz CJLCLPALLKLFND-CHWSQXEVSA-N 2 1 346.849 4.324 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(Cl)ccc2OC(F)F)C1 ZINC000481017560 1038946142 /nfs/dbraw/zinc/94/61/42/1038946142.db2.gz CJLCLPALLKLFND-CHWSQXEVSA-N 2 1 346.849 4.324 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2oc3ccc(OC)cc3c2C)C1 ZINC000481019932 1038957243 /nfs/dbraw/zinc/95/72/43/1038957243.db2.gz GWVZSYGTDQAYPF-CVEARBPZSA-N 2 1 330.472 4.132 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2oc3ccc(OC)cc3c2C)C1 ZINC000481019932 1038957271 /nfs/dbraw/zinc/95/72/71/1038957271.db2.gz GWVZSYGTDQAYPF-CVEARBPZSA-N 2 1 330.472 4.132 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccccc2Br)C1 ZINC000481042583 1038975547 /nfs/dbraw/zinc/97/55/47/1038975547.db2.gz TUIWILSVCXFCBL-PBHICJAKSA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccccc2Br)C1 ZINC000481042583 1038975567 /nfs/dbraw/zinc/97/55/67/1038975567.db2.gz TUIWILSVCXFCBL-PBHICJAKSA-N 2 1 339.321 4.222 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccc3c[nH]nc32)CC1 ZINC000537622147 1038984517 /nfs/dbraw/zinc/98/45/17/1038984517.db2.gz PCKDETAKCLGPRW-KRWDZBQOSA-N 2 1 340.515 4.039 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@H]2c2ccc(OC)c(F)c2)C1 ZINC000481039921 1038988410 /nfs/dbraw/zinc/98/84/10/1038988410.db2.gz QINATYYIUFKGPW-IMFGXOCKSA-N 2 1 348.506 4.182 20 0 EIADMP c1ccc(CC(Cc2ccccc2)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000378931082 1039039961 /nfs/dbraw/zinc/03/99/61/1039039961.db2.gz YIYROVRNYOVJIR-FYYLOGMGSA-N 2 1 334.507 4.057 20 0 EIADMP FC(F)(F)CC[NH2+][C@@H]1CCCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000552042739 1039060125 /nfs/dbraw/zinc/06/01/25/1039060125.db2.gz ZPCDSZWSWVOHKW-KZNAEPCWSA-N 2 1 340.433 4.219 20 0 EIADMP COc1ccc(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000537629483 1039085673 /nfs/dbraw/zinc/08/56/73/1039085673.db2.gz IVOBBHDREQHQQH-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000537629483 1039085692 /nfs/dbraw/zinc/08/56/92/1039085692.db2.gz IVOBBHDREQHQQH-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000537629483 1039085713 /nfs/dbraw/zinc/08/57/13/1039085713.db2.gz IVOBBHDREQHQQH-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000537629483 1039085737 /nfs/dbraw/zinc/08/57/37/1039085737.db2.gz IVOBBHDREQHQQH-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP CCCOc1ccc(CN(C)[C@H]2CC[N@@H+](CC)[C@@H](C)C2)cc1OCC ZINC000552071106 1039096819 /nfs/dbraw/zinc/09/68/19/1039096819.db2.gz PTRQOOFOOMKJQX-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP CCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)cc1OCC ZINC000552071106 1039096840 /nfs/dbraw/zinc/09/68/40/1039096840.db2.gz PTRQOOFOOMKJQX-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP CCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)cc1OCC ZINC000552071106 1039096866 /nfs/dbraw/zinc/09/68/66/1039096866.db2.gz PTRQOOFOOMKJQX-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP Cc1cccnc1[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)C(C)C ZINC000120458352 1039114399 /nfs/dbraw/zinc/11/43/99/1039114399.db2.gz KAHFGFZKGXCMKB-HXUWFJFHSA-N 2 1 329.532 4.474 20 0 EIADMP CCc1ccc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)nc1 ZINC000555381654 1039136406 /nfs/dbraw/zinc/13/64/06/1039136406.db2.gz ZXMHOFFRAQESJA-GOSISDBHSA-N 2 1 329.532 4.121 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(Cl)c2F)CCCC1 ZINC000477861517 1039142701 /nfs/dbraw/zinc/14/27/01/1039142701.db2.gz NOAWQAHFHZGAKD-YOEHRIQHSA-N 2 1 338.898 4.221 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)s1 ZINC000090419089 1039225734 /nfs/dbraw/zinc/22/57/34/1039225734.db2.gz FXRVOJNZYUJRES-CHWSQXEVSA-N 2 1 326.469 4.357 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)cc1 ZINC000481318205 1039273289 /nfs/dbraw/zinc/27/32/89/1039273289.db2.gz ZYXGZTQYHKSHQM-GOSISDBHSA-N 2 1 338.495 4.319 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2COc3ccccc32)cc1 ZINC000090845039 1039309064 /nfs/dbraw/zinc/30/90/64/1039309064.db2.gz NZYHVNFHVORNQK-QYWGDWMGSA-N 2 1 347.462 4.396 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](CC)c2cccc(C)c2)[C@@H](C)C1 ZINC000552244528 1039311357 /nfs/dbraw/zinc/31/13/57/1039311357.db2.gz DEYJCPYKLAQTFD-TYPHKJRUSA-N 2 1 332.532 4.173 20 0 EIADMP C[N@@H+](CCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1)C1CCCCC1 ZINC000534351247 1039339806 /nfs/dbraw/zinc/33/98/06/1039339806.db2.gz TWLFGMAGANENQH-SIKLNZKXSA-N 2 1 344.543 4.399 20 0 EIADMP C[C@@H](CC(F)(F)F)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000552280653 1039356670 /nfs/dbraw/zinc/35/66/70/1039356670.db2.gz ORKYQNPLWOJHAU-OOHWJJMZSA-N 2 1 328.422 4.360 20 0 EIADMP CCCCc1noc([C@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)n1 ZINC000121780736 1039418177 /nfs/dbraw/zinc/41/81/77/1039418177.db2.gz RGNPZZRPBCRUMI-KRWDZBQOSA-N 2 1 348.535 4.061 20 0 EIADMP CC(C)(C)c1cnc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)o1 ZINC000121794619 1039491879 /nfs/dbraw/zinc/49/18/79/1039491879.db2.gz VBUSOJFXXRRWCO-UHFFFAOYSA-N 2 1 333.520 4.060 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000121892641 1039527459 /nfs/dbraw/zinc/52/74/59/1039527459.db2.gz MIZZYFSLPUJHNR-OXJNMPFZSA-N 2 1 328.500 4.098 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000552562148 1039641891 /nfs/dbraw/zinc/64/18/91/1039641891.db2.gz RMORPFGLGKJBEM-LMMKCTJWSA-N 2 1 328.525 4.322 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000552562148 1039641914 /nfs/dbraw/zinc/64/19/14/1039641914.db2.gz RMORPFGLGKJBEM-LMMKCTJWSA-N 2 1 328.525 4.322 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(Cl)c4cccnc34)C2)CC1 ZINC000555803551 1039656162 /nfs/dbraw/zinc/65/61/62/1039656162.db2.gz YUMNBEQYILGXJT-INIZCTEOSA-N 2 1 343.902 4.052 20 0 EIADMP Clc1cccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000434678371 1039796907 /nfs/dbraw/zinc/79/69/07/1039796907.db2.gz FZKWNYCUJSPUFR-UHFFFAOYSA-N 2 1 329.875 4.252 20 0 EIADMP CCc1ccccc1CC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434667122 1039801359 /nfs/dbraw/zinc/80/13/59/1039801359.db2.gz TZIICIPJRCPRGY-UHFFFAOYSA-N 2 1 337.511 4.204 20 0 EIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537649742 1039823887 /nfs/dbraw/zinc/82/38/87/1039823887.db2.gz ZJAOJFVFEIAFPU-KRWDZBQOSA-N 2 1 342.458 4.249 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537649742 1039823889 /nfs/dbraw/zinc/82/38/89/1039823889.db2.gz ZJAOJFVFEIAFPU-KRWDZBQOSA-N 2 1 342.458 4.249 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537649742 1039823893 /nfs/dbraw/zinc/82/38/93/1039823893.db2.gz ZJAOJFVFEIAFPU-KRWDZBQOSA-N 2 1 342.458 4.249 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537649742 1039823894 /nfs/dbraw/zinc/82/38/94/1039823894.db2.gz ZJAOJFVFEIAFPU-KRWDZBQOSA-N 2 1 342.458 4.249 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000434745521 1039856596 /nfs/dbraw/zinc/85/65/96/1039856596.db2.gz KOPJSYMMZFBULC-LIVBEALHSA-N 2 1 345.437 4.046 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCSc2ccccc2)C[C@H]1c1ccccc1 ZINC000550999047 1039862165 /nfs/dbraw/zinc/86/21/65/1039862165.db2.gz GZWIYUXCJVPHDP-QUCCMNQESA-N 2 1 326.509 4.204 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCSc2ccccc2)C[C@H]1c1ccccc1 ZINC000550999047 1039862168 /nfs/dbraw/zinc/86/21/68/1039862168.db2.gz GZWIYUXCJVPHDP-QUCCMNQESA-N 2 1 326.509 4.204 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCSc2ccccc2)C[C@H]1c1ccccc1 ZINC000550999046 1039862838 /nfs/dbraw/zinc/86/28/38/1039862838.db2.gz GZWIYUXCJVPHDP-ICSRJNTNSA-N 2 1 326.509 4.204 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCSc2ccccc2)C[C@H]1c1ccccc1 ZINC000550999046 1039862845 /nfs/dbraw/zinc/86/28/45/1039862845.db2.gz GZWIYUXCJVPHDP-ICSRJNTNSA-N 2 1 326.509 4.204 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000469251731 1039875875 /nfs/dbraw/zinc/87/58/75/1039875875.db2.gz KWGLWAKFXCLDFO-LSDHHAIUSA-N 2 1 331.529 4.418 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc3ccccc3n2)C[C@@H]1c1ccccc1 ZINC000551029282 1039886278 /nfs/dbraw/zinc/88/62/78/1039886278.db2.gz CBIANMYTINVFEZ-FYYLOGMGSA-N 2 1 345.490 4.202 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc3ccccc3n2)C[C@@H]1c1ccccc1 ZINC000551029282 1039886284 /nfs/dbraw/zinc/88/62/84/1039886284.db2.gz CBIANMYTINVFEZ-FYYLOGMGSA-N 2 1 345.490 4.202 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2cccc3cccnc32)C[C@H]1c1ccccc1 ZINC000556050201 1039889504 /nfs/dbraw/zinc/88/95/04/1039889504.db2.gz DCGZXGVXCLYKFW-VXKWHMMOSA-N 2 1 345.490 4.202 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2cccc3cccnc32)C[C@H]1c1ccccc1 ZINC000556050201 1039889505 /nfs/dbraw/zinc/88/95/05/1039889505.db2.gz DCGZXGVXCLYKFW-VXKWHMMOSA-N 2 1 345.490 4.202 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1ccccc1OCc1ccccc1 ZINC000481956886 1039910969 /nfs/dbraw/zinc/91/09/69/1039910969.db2.gz DZPZXAXJNDIZSH-QZTJIDSGSA-N 2 1 326.484 4.256 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)Oc1ccc(F)cc1 ZINC000551051661 1039922092 /nfs/dbraw/zinc/92/20/92/1039922092.db2.gz PTKPCQOFSCGTSC-BSIFCXSSSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)Oc1ccc(F)cc1 ZINC000551051661 1039922110 /nfs/dbraw/zinc/92/21/10/1039922110.db2.gz PTKPCQOFSCGTSC-BSIFCXSSSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)Oc1ccc(F)cc1 ZINC000551051663 1039925276 /nfs/dbraw/zinc/92/52/76/1039925276.db2.gz PTKPCQOFSCGTSC-OZOXKJRCSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)Oc1ccc(F)cc1 ZINC000551051663 1039925304 /nfs/dbraw/zinc/92/53/04/1039925304.db2.gz PTKPCQOFSCGTSC-OZOXKJRCSA-N 2 1 342.458 4.018 20 0 EIADMP Cc1cc(C[NH+](C)C)cc(N[C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551147672 1040006879 /nfs/dbraw/zinc/00/68/79/1040006879.db2.gz HNIDGWRGKPLORZ-RBBKRZOGSA-N 2 1 337.511 4.304 20 0 EIADMP Fc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000482117242 1040017644 /nfs/dbraw/zinc/01/76/44/1040017644.db2.gz CFYYPEDEADZPKH-FOIQADDNSA-N 2 1 344.499 4.376 20 0 EIADMP Fc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000482117242 1040017652 /nfs/dbraw/zinc/01/76/52/1040017652.db2.gz CFYYPEDEADZPKH-FOIQADDNSA-N 2 1 344.499 4.376 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(-c2ccccc2F)s1 ZINC000482111319 1040022082 /nfs/dbraw/zinc/02/20/82/1040022082.db2.gz AXTJLTQKYUCRGQ-CYBMUJFWSA-N 2 1 329.444 4.410 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000482122546 1040033483 /nfs/dbraw/zinc/03/34/83/1040033483.db2.gz NYCYNOCAXFQFIF-ZDUSSCGKSA-N 2 1 329.444 4.410 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000666969025 1040053677 /nfs/dbraw/zinc/05/36/77/1040053677.db2.gz XZLNFBAPAXKCSU-FUHWJXTLSA-N 2 1 333.545 4.155 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000666969025 1040053695 /nfs/dbraw/zinc/05/36/95/1040053695.db2.gz XZLNFBAPAXKCSU-FUHWJXTLSA-N 2 1 333.545 4.155 20 0 EIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000514625817 1040063900 /nfs/dbraw/zinc/06/39/00/1040063900.db2.gz KWUSSBHAPYUPOU-AWEZNQCLSA-N 2 1 334.410 4.045 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000514625817 1040063915 /nfs/dbraw/zinc/06/39/15/1040063915.db2.gz KWUSSBHAPYUPOU-AWEZNQCLSA-N 2 1 334.410 4.045 20 0 EIADMP C[N@H+]1CC[C@@]2(CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)C2)C1 ZINC000430135327 1040121350 /nfs/dbraw/zinc/12/13/50/1040121350.db2.gz SWGKBQVAHAFYBJ-XMMPIXPASA-N 2 1 348.534 4.116 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@H+](CC(Cc3ccccc3)Cc3ccccc3)C2)C1 ZINC000430135327 1040121355 /nfs/dbraw/zinc/12/13/55/1040121355.db2.gz SWGKBQVAHAFYBJ-XMMPIXPASA-N 2 1 348.534 4.116 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@@H+](CC(Cc3ccccc3)Cc3ccccc3)C2)C1 ZINC000430135327 1040121361 /nfs/dbraw/zinc/12/13/61/1040121361.db2.gz SWGKBQVAHAFYBJ-XMMPIXPASA-N 2 1 348.534 4.116 20 0 EIADMP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccccc4F)s3)C2)C1 ZINC000430137894 1040124675 /nfs/dbraw/zinc/12/46/75/1040124675.db2.gz ZTTWMPSVJKFLQZ-IBGZPJMESA-N 2 1 330.472 4.082 20 0 EIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccccc4F)s3)C2)C1 ZINC000430137894 1040124687 /nfs/dbraw/zinc/12/46/87/1040124687.db2.gz ZTTWMPSVJKFLQZ-IBGZPJMESA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(-c4ccccc4F)s3)C2)C1 ZINC000430137894 1040124695 /nfs/dbraw/zinc/12/46/95/1040124695.db2.gz ZTTWMPSVJKFLQZ-IBGZPJMESA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(-c4ccccc4F)s3)C2)C1 ZINC000430137894 1040124718 /nfs/dbraw/zinc/12/47/18/1040124718.db2.gz ZTTWMPSVJKFLQZ-IBGZPJMESA-N 2 1 330.472 4.082 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(C)c(O)c(C)c1 ZINC000514758673 1040210283 /nfs/dbraw/zinc/21/02/83/1040210283.db2.gz PXEKTABDDNCNLE-UHFFFAOYSA-N 2 1 326.484 4.093 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000514812797 1040255873 /nfs/dbraw/zinc/25/58/73/1040255873.db2.gz UEQQHFQKQQGNJF-MJSCBBHESA-N 2 1 340.433 4.430 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+][C@@H](Cc3ccccc3)C3CC3)C2)cc1 ZINC000482452128 1040262778 /nfs/dbraw/zinc/26/27/78/1040262778.db2.gz ABHIMGHYFMWALQ-UPVQGACJSA-N 2 1 348.534 4.162 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000479447865 1040377805 /nfs/dbraw/zinc/37/78/05/1040377805.db2.gz DRMJOMMKMZWRPQ-PMJAUZGISA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000479466319 1040391542 /nfs/dbraw/zinc/39/15/42/1040391542.db2.gz RNJJXZYXLKYOIR-CDMIOBSGSA-N 2 1 338.470 4.171 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2Sc2ccccc2)CC[N@@H+]1C ZINC000482639579 1040401928 /nfs/dbraw/zinc/40/19/28/1040401928.db2.gz DRJZPEZXEKOMTC-FUHWJXTLSA-N 2 1 326.509 4.410 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2Sc2ccccc2)CC[N@H+]1C ZINC000482639579 1040401938 /nfs/dbraw/zinc/40/19/38/1040401938.db2.gz DRJZPEZXEKOMTC-FUHWJXTLSA-N 2 1 326.509 4.410 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccccc1F ZINC000479561978 1040472868 /nfs/dbraw/zinc/47/28/68/1040472868.db2.gz WIVNWVIFVDGKTB-AVRDEDQJSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccccc1F ZINC000479561978 1040472879 /nfs/dbraw/zinc/47/28/79/1040472879.db2.gz WIVNWVIFVDGKTB-AVRDEDQJSA-N 2 1 340.486 4.259 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(C(C)(C)C)cc1 ZINC000551779385 1040584172 /nfs/dbraw/zinc/58/41/72/1040584172.db2.gz VGXNVHJAVIBENY-OAQYLSRUSA-N 2 1 346.559 4.118 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(C(C)(C)C)cc1 ZINC000551779384 1040585324 /nfs/dbraw/zinc/58/53/24/1040585324.db2.gz VGXNVHJAVIBENY-NRFANRHFSA-N 2 1 346.559 4.118 20 0 EIADMP C[N@H+](Cc1cnc(-c2ccc(Cl)cc2)s1)CC1CC[NH+](C)CC1 ZINC000551804784 1040599010 /nfs/dbraw/zinc/59/90/10/1040599010.db2.gz HMEKZEYGEVNLGT-UHFFFAOYSA-N 2 1 349.931 4.237 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)CCC(C)(C)C)CC2)oc1C ZINC000551789384 1040603850 /nfs/dbraw/zinc/60/38/50/1040603850.db2.gz NEWSAGRHZJXABW-HNNXBMFYSA-N 2 1 335.536 4.308 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)cc1 ZINC000668172371 1040605672 /nfs/dbraw/zinc/60/56/72/1040605672.db2.gz MCQRXBFJLKWDCD-RTBURBONSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000668172371 1040605677 /nfs/dbraw/zinc/60/56/77/1040605677.db2.gz MCQRXBFJLKWDCD-RTBURBONSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000668172371 1040605688 /nfs/dbraw/zinc/60/56/88/1040605688.db2.gz MCQRXBFJLKWDCD-RTBURBONSA-N 2 1 341.524 4.035 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000568169702 1040636916 /nfs/dbraw/zinc/63/69/16/1040636916.db2.gz REPVCXRAYFDBKP-UHFFFAOYSA-N 2 1 333.426 4.076 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000568169702 1040636923 /nfs/dbraw/zinc/63/69/23/1040636923.db2.gz REPVCXRAYFDBKP-UHFFFAOYSA-N 2 1 333.426 4.076 20 0 EIADMP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[NH+](C)C)CCC3)cc1 ZINC000479876996 1040740213 /nfs/dbraw/zinc/74/02/13/1040740213.db2.gz WGTJGBRDBCCXLY-INIZCTEOSA-N 2 1 329.513 4.037 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(F)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000539816873 1040809900 /nfs/dbraw/zinc/80/99/00/1040809900.db2.gz BKSUWNBVUFUJND-MLGOLLRUSA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(F)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000539816873 1040809902 /nfs/dbraw/zinc/80/99/02/1040809902.db2.gz BKSUWNBVUFUJND-MLGOLLRUSA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(F)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000539816873 1040809904 /nfs/dbraw/zinc/80/99/04/1040809904.db2.gz BKSUWNBVUFUJND-MLGOLLRUSA-N 2 1 332.385 4.007 20 0 EIADMP CC[C@@H](c1ccc(F)cc1)[N@@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1 ZINC000436048985 1040840185 /nfs/dbraw/zinc/84/01/85/1040840185.db2.gz GOIZLPAJQPLRCT-YJBOKZPZSA-N 2 1 347.503 4.153 20 0 EIADMP CC[C@@H](c1ccc(F)cc1)[N@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1 ZINC000436048985 1040840189 /nfs/dbraw/zinc/84/01/89/1040840189.db2.gz GOIZLPAJQPLRCT-YJBOKZPZSA-N 2 1 347.503 4.153 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000539851073 1040843010 /nfs/dbraw/zinc/84/30/10/1040843010.db2.gz KMFPVIIXLFCGIG-IBGZPJMESA-N 2 1 330.516 4.172 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000539851073 1040843014 /nfs/dbraw/zinc/84/30/14/1040843014.db2.gz KMFPVIIXLFCGIG-IBGZPJMESA-N 2 1 330.516 4.172 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccncc2Cl)CC1)CC1CC1 ZINC000537847756 1040851318 /nfs/dbraw/zinc/85/13/18/1040851318.db2.gz TZHKNNWPZXEKDJ-UHFFFAOYSA-N 2 1 335.923 4.069 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccccc2OCc2ccccc2)CC1 ZINC000480022766 1040859779 /nfs/dbraw/zinc/85/97/79/1040859779.db2.gz POCWWIWUOSVGPB-GOSISDBHSA-N 2 1 338.495 4.401 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2ccccc2OCc2ccccc2)CC1 ZINC000480022767 1040860787 /nfs/dbraw/zinc/86/07/87/1040860787.db2.gz POCWWIWUOSVGPB-SFHVURJKSA-N 2 1 338.495 4.401 20 0 EIADMP CCC[C@H]([NH2+][C@@H]1CC[N@@H+](CCCOCC)C[C@H]1C)c1ccccc1 ZINC000480034155 1040870017 /nfs/dbraw/zinc/87/00/17/1040870017.db2.gz JJSHPFSSAUJFHH-NRSPTQNISA-N 2 1 332.532 4.254 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCSc3ccccc3Cl)CC[C@@H]21 ZINC000483504620 1040877227 /nfs/dbraw/zinc/87/72/27/1040877227.db2.gz RVVJURMMKKTPKA-WBVHZDCISA-N 2 1 338.948 4.238 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)[C@@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000480033443 1040877892 /nfs/dbraw/zinc/87/78/92/1040877892.db2.gz GBJVOFGSTVGINV-QWHCGFSZSA-N 2 1 345.314 4.223 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)[C@@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000480033441 1040878638 /nfs/dbraw/zinc/87/86/38/1040878638.db2.gz GBJVOFGSTVGINV-CHWSQXEVSA-N 2 1 345.314 4.223 20 0 EIADMP CC[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000537940134 1040905536 /nfs/dbraw/zinc/90/55/36/1040905536.db2.gz VNUXUOXSFYICHU-UZKOGDIHSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H](CC[NH2+][C@@H](C)c1ccc2c(c1)COC2)[N@@H+](C)Cc1ccccc1 ZINC000483672074 1040959906 /nfs/dbraw/zinc/95/99/06/1040959906.db2.gz PPUYZLPVPHLNLJ-MSOLQXFVSA-N 2 1 338.495 4.278 20 0 EIADMP Fc1cccc(Cl)c1[C@@H]1C[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903186879 1040960060 /nfs/dbraw/zinc/96/00/60/1040960060.db2.gz WBIJDFWOASCYRY-IYHLECPCSA-N 2 1 334.866 4.082 20 0 EIADMP C=Cc1ccc(CC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000462811381 1040959935 /nfs/dbraw/zinc/95/99/35/1040959935.db2.gz FLXRTYRNHRZOEF-UHFFFAOYSA-N 2 1 334.507 4.169 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC000537967959 1040973480 /nfs/dbraw/zinc/97/34/80/1040973480.db2.gz JBVNGAMMIQMOEF-XWDORNJCSA-N 2 1 325.500 4.390 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000483725995 1040977031 /nfs/dbraw/zinc/97/70/31/1040977031.db2.gz IZQQMJQWVLASAP-KCQAQPDRSA-N 2 1 346.462 4.474 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000483725995 1040977054 /nfs/dbraw/zinc/97/70/54/1040977054.db2.gz IZQQMJQWVLASAP-KCQAQPDRSA-N 2 1 346.462 4.474 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)c1ccccn1 ZINC000898523033 1040978013 /nfs/dbraw/zinc/97/80/13/1040978013.db2.gz XLSSUQWYBOFJTM-PBASOCQRSA-N 2 1 335.495 4.033 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000483734612 1040987413 /nfs/dbraw/zinc/98/74/13/1040987413.db2.gz WERCEWPDBOMWPZ-FVQBIDKESA-N 2 1 326.937 4.283 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000483734612 1040987442 /nfs/dbraw/zinc/98/74/42/1040987442.db2.gz WERCEWPDBOMWPZ-FVQBIDKESA-N 2 1 326.937 4.283 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CC[C@H](Cc2ccc(C(C)C)cc2)C1 ZINC000460972396 1041078240 /nfs/dbraw/zinc/07/82/40/1041078240.db2.gz XQSMCTBNUBTSAF-HXUWFJFHSA-N 2 1 325.500 4.270 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC[C@H](Cc2ccc(C(C)C)cc2)C1 ZINC000460972396 1041078259 /nfs/dbraw/zinc/07/82/59/1041078259.db2.gz XQSMCTBNUBTSAF-HXUWFJFHSA-N 2 1 325.500 4.270 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000480208928 1041082531 /nfs/dbraw/zinc/08/25/31/1041082531.db2.gz LDRZBTVZHNGRJS-KNQAVFIVSA-N 2 1 334.507 4.218 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)CCCC(F)(F)F)CC2)[nH+]1 ZINC000480227679 1041098970 /nfs/dbraw/zinc/09/89/70/1041098970.db2.gz IYIARDOEESPBMP-CYBMUJFWSA-N 2 1 329.410 4.070 20 0 EIADMP CC[C@H]([NH2+]CC(CC)(CC)[NH2+][C@H](C)c1ccccc1)[C@@H]1CCOC1 ZINC000484142480 1041132846 /nfs/dbraw/zinc/13/28/46/1041132846.db2.gz SESCZWGQHPUZDX-RLLQIKCJSA-N 2 1 332.532 4.301 20 0 EIADMP CC[C@H]([NH2+]CC(CC)(CC)[NH2+][C@@H](C)c1ccccc1)[C@@H]1CCOC1 ZINC000484142481 1041134654 /nfs/dbraw/zinc/13/46/54/1041134654.db2.gz SESCZWGQHPUZDX-SXLOBPIMSA-N 2 1 332.532 4.301 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(Oc3ccc(F)cc3)cc2)CC[N@H+]1C ZINC000540140577 1041159537 /nfs/dbraw/zinc/15/95/37/1041159537.db2.gz PCYQAEVBTZYWLR-APWZRJJASA-N 2 1 342.458 4.233 20 0 EIADMP Cc1ccc(SC2(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H](C)C3)CCCC2)cc1 ZINC000484287870 1041197143 /nfs/dbraw/zinc/19/71/43/1041197143.db2.gz CYHWAVGHHIMLBB-ZWKOTPCHSA-N 2 1 332.557 4.472 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2cccnc2)C2CC2)CC1 ZINC000540151492 1041199610 /nfs/dbraw/zinc/19/96/10/1041199610.db2.gz QAGIFJWOQSSAST-CZAAIQMYSA-N 2 1 327.516 4.165 20 0 EIADMP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000540168900 1041212769 /nfs/dbraw/zinc/21/27/69/1041212769.db2.gz OGPHYEDRTBKTFI-KGLIPLIRSA-N 2 1 335.879 4.231 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2cccc3F)c1 ZINC000540172617 1041216223 /nfs/dbraw/zinc/21/62/23/1041216223.db2.gz PNJHRZVJFBXPCX-NRFANRHFSA-N 2 1 326.459 4.443 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@H](c2ccccc2)C(C)C)[C@@H](C)C1 ZINC000480331501 1041217163 /nfs/dbraw/zinc/21/71/63/1041217163.db2.gz HBIHUOZWCJGSGI-BVSLBCMMSA-N 2 1 346.559 4.153 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)[C@@H](C)C1 ZINC000667666260 1041238583 /nfs/dbraw/zinc/23/85/83/1041238583.db2.gz HJKDVEFSROVGCN-HNAYVOBHSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3scnc3C)cc2)[C@@H](C)C1 ZINC000667666260 1041238599 /nfs/dbraw/zinc/23/85/99/1041238599.db2.gz HJKDVEFSROVGCN-HNAYVOBHSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(-c3scnc3C)cc2)[C@@H](C)C1 ZINC000667666260 1041238612 /nfs/dbraw/zinc/23/86/12/1041238612.db2.gz HJKDVEFSROVGCN-HNAYVOBHSA-N 2 1 343.540 4.281 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@@H]3CCC[C@H]([NH+](C)C)C3)c(C)c2c1 ZINC000484470381 1041246530 /nfs/dbraw/zinc/24/65/30/1041246530.db2.gz SUOIRRBGUYCXMX-XHSDSOJGSA-N 2 1 330.472 4.273 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H](C)Oc2ccccc2)cc1 ZINC000540183719 1041247432 /nfs/dbraw/zinc/24/74/32/1041247432.db2.gz SWAUZAVGCZOJRE-DLBZAZTESA-N 2 1 335.451 4.299 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000667667648 1041253146 /nfs/dbraw/zinc/25/31/46/1041253146.db2.gz SEFBPYKHSRADQA-KBXCAEBGSA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000667667648 1041253156 /nfs/dbraw/zinc/25/31/56/1041253156.db2.gz SEFBPYKHSRADQA-KBXCAEBGSA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000667667648 1041253163 /nfs/dbraw/zinc/25/31/63/1041253163.db2.gz SEFBPYKHSRADQA-KBXCAEBGSA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000667667648 1041253171 /nfs/dbraw/zinc/25/31/71/1041253171.db2.gz SEFBPYKHSRADQA-KBXCAEBGSA-N 2 1 329.513 4.033 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667672894 1041284234 /nfs/dbraw/zinc/28/42/34/1041284234.db2.gz KEZUMQQXEMFNFK-SFHVURJKSA-N 2 1 343.540 4.282 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667672894 1041284247 /nfs/dbraw/zinc/28/42/47/1041284247.db2.gz KEZUMQQXEMFNFK-SFHVURJKSA-N 2 1 343.540 4.282 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)cc1 ZINC000463084700 1041333220 /nfs/dbraw/zinc/33/32/20/1041333220.db2.gz JWXQZLBUXGSBBT-SFHVURJKSA-N 2 1 340.486 4.492 20 0 EIADMP C[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccc(F)cc1 ZINC000463118444 1041356548 /nfs/dbraw/zinc/35/65/48/1041356548.db2.gz XLSBYQGYEGWHBV-GOSISDBHSA-N 2 1 340.486 4.226 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)C(F)(F)F ZINC000554722031 1041364860 /nfs/dbraw/zinc/36/48/60/1041364860.db2.gz DJVVFMKVCLMZRO-GVDBMIGSSA-N 2 1 340.433 4.075 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463146462 1041369347 /nfs/dbraw/zinc/36/93/47/1041369347.db2.gz BVMHKLPJZOLJGL-GCJKJVERSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463146462 1041369354 /nfs/dbraw/zinc/36/93/54/1041369354.db2.gz BVMHKLPJZOLJGL-GCJKJVERSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2ccccc2n1 ZINC000480601912 1041415707 /nfs/dbraw/zinc/41/57/07/1041415707.db2.gz OMGXDUFGIPQFLD-KSZLIROESA-N 2 1 325.500 4.253 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2ccccc2n1 ZINC000480601912 1041415711 /nfs/dbraw/zinc/41/57/11/1041415711.db2.gz OMGXDUFGIPQFLD-KSZLIROESA-N 2 1 325.500 4.253 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccc(OC(F)F)c1 ZINC000480622504 1041437688 /nfs/dbraw/zinc/43/76/88/1041437688.db2.gz YNWFIJDBFSTDKB-JKSUJKDBSA-N 2 1 340.458 4.451 20 0 EIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463252282 1041463911 /nfs/dbraw/zinc/46/39/11/1041463911.db2.gz KHKSJSOOMDPWEF-INIZCTEOSA-N 2 1 342.449 4.404 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cnc(-c4ccsc4)s3)C2)CC1 ZINC000554879293 1041476517 /nfs/dbraw/zinc/47/65/17/1041476517.db2.gz QAXRWIXRIZJOJK-OAHLLOKOSA-N 2 1 347.553 4.035 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC000195133246 1041485327 /nfs/dbraw/zinc/48/53/27/1041485327.db2.gz KOGIPFUHFQOKQY-SJLPKXTDSA-N 2 1 342.458 4.007 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000195138235 1041486975 /nfs/dbraw/zinc/48/69/75/1041486975.db2.gz NYQSPSIALCMJEX-SJLPKXTDSA-N 2 1 342.458 4.007 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000195138235 1041486979 /nfs/dbraw/zinc/48/69/79/1041486979.db2.gz NYQSPSIALCMJEX-SJLPKXTDSA-N 2 1 342.458 4.007 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000195135365 1041487203 /nfs/dbraw/zinc/48/72/03/1041487203.db2.gz VLLZXWUJLQVAST-NVXWUHKLSA-N 2 1 330.422 4.138 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463289560 1041487965 /nfs/dbraw/zinc/48/79/65/1041487965.db2.gz QEXRHVADPOCVGX-IEBWSBKVSA-N 2 1 328.525 4.242 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463289560 1041487970 /nfs/dbraw/zinc/48/79/70/1041487970.db2.gz QEXRHVADPOCVGX-IEBWSBKVSA-N 2 1 328.525 4.242 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000538750070 1041522842 /nfs/dbraw/zinc/52/28/42/1041522842.db2.gz YGKOHAHQQPBYNM-INIZCTEOSA-N 2 1 330.447 4.168 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000538750070 1041522853 /nfs/dbraw/zinc/52/28/53/1041522853.db2.gz YGKOHAHQQPBYNM-INIZCTEOSA-N 2 1 330.447 4.168 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000538750070 1041522866 /nfs/dbraw/zinc/52/28/66/1041522866.db2.gz YGKOHAHQQPBYNM-INIZCTEOSA-N 2 1 330.447 4.168 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000538750070 1041522873 /nfs/dbraw/zinc/52/28/73/1041522873.db2.gz YGKOHAHQQPBYNM-INIZCTEOSA-N 2 1 330.447 4.168 20 0 EIADMP c1ccc(CC[C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000461799870 1041592326 /nfs/dbraw/zinc/59/23/26/1041592326.db2.gz XEAKXVZMZKISIX-SGNDLWITSA-N 2 1 348.534 4.447 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000540915735 1041737534 /nfs/dbraw/zinc/73/75/34/1041737534.db2.gz LHCSUNFIYOXKKS-OXJNMPFZSA-N 2 1 328.887 4.361 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000540915735 1041737543 /nfs/dbraw/zinc/73/75/43/1041737543.db2.gz LHCSUNFIYOXKKS-OXJNMPFZSA-N 2 1 328.887 4.361 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000516932496 1041815107 /nfs/dbraw/zinc/81/51/07/1041815107.db2.gz RDAGSALKPOOJTC-AWEZNQCLSA-N 2 1 337.492 4.135 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000516932496 1041815112 /nfs/dbraw/zinc/81/51/12/1041815112.db2.gz RDAGSALKPOOJTC-AWEZNQCLSA-N 2 1 337.492 4.135 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]CC(Cc2ccccc2)Cc2ccccc2)C1 ZINC000517001603 1041838955 /nfs/dbraw/zinc/83/89/55/1041838955.db2.gz LBFGLZJWBZSMSM-JOCHJYFZSA-N 2 1 336.523 4.019 20 0 EIADMP Cn1ccnc1C[C@@H]1CCC[N@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000437791851 1041913740 /nfs/dbraw/zinc/91/37/40/1041913740.db2.gz HTYPVOCBVOQNKU-CZTZKLFOSA-N 2 1 337.511 4.185 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000425922591 1041942446 /nfs/dbraw/zinc/94/24/46/1041942446.db2.gz SPRBYFMUTZFZJA-HXUWFJFHSA-N 2 1 345.918 4.339 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000425922591 1041942447 /nfs/dbraw/zinc/94/24/47/1041942447.db2.gz SPRBYFMUTZFZJA-HXUWFJFHSA-N 2 1 345.918 4.339 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)ccc1F ZINC000301718697 1041982431 /nfs/dbraw/zinc/98/24/31/1041982431.db2.gz PUUCTDFKDFLOJC-MRXNPFEDSA-N 2 1 330.447 4.007 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438094685 1042042726 /nfs/dbraw/zinc/04/27/26/1042042726.db2.gz OBVLVGAIPKHDMW-KSEOMHKRSA-N 2 1 326.528 4.161 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438094685 1042042729 /nfs/dbraw/zinc/04/27/29/1042042729.db2.gz OBVLVGAIPKHDMW-KSEOMHKRSA-N 2 1 326.528 4.161 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438094685 1042042736 /nfs/dbraw/zinc/04/27/36/1042042736.db2.gz OBVLVGAIPKHDMW-KSEOMHKRSA-N 2 1 326.528 4.161 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)o2)C1 ZINC000517536480 1042070200 /nfs/dbraw/zinc/07/02/00/1042070200.db2.gz MZAXLDGXLMDOSM-OAHLLOKOSA-N 2 1 332.875 4.455 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)o2)C1 ZINC000517536480 1042070202 /nfs/dbraw/zinc/07/02/02/1042070202.db2.gz MZAXLDGXLMDOSM-OAHLLOKOSA-N 2 1 332.875 4.455 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CC[C@@H](Cc4ccccc4)C3)CC2)[nH+]1 ZINC000438193665 1042084760 /nfs/dbraw/zinc/08/47/60/1042084760.db2.gz UJHTUQOQLPUSAH-UNMCSNQZSA-N 2 1 349.522 4.360 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCCSc2ccccc2Cl)C1 ZINC000464774793 1042157467 /nfs/dbraw/zinc/15/74/67/1042157467.db2.gz IVXWGEAQVWFTLR-MRXNPFEDSA-N 2 1 340.964 4.486 20 0 EIADMP CSC[C@H]([NH2+]CCC[N@H+](C)C(C)C)c1ccc(C(F)(F)F)cc1 ZINC000541915236 1042171039 /nfs/dbraw/zinc/17/10/39/1042171039.db2.gz DIUVTUGVEWLHTR-INIZCTEOSA-N 2 1 348.478 4.429 20 0 EIADMP CSC[C@H]([NH2+]CCC[N@@H+](C)C(C)C)c1ccc(C(F)(F)F)cc1 ZINC000541915236 1042171044 /nfs/dbraw/zinc/17/10/44/1042171044.db2.gz DIUVTUGVEWLHTR-INIZCTEOSA-N 2 1 348.478 4.429 20 0 EIADMP C[C@H](c1ccc(F)cc1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464832149 1042189666 /nfs/dbraw/zinc/18/96/66/1042189666.db2.gz BVJFWQIOWBYLJM-IEBWSBKVSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@H](c1ccc(F)cc1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464832149 1042189667 /nfs/dbraw/zinc/18/96/67/1042189667.db2.gz BVJFWQIOWBYLJM-IEBWSBKVSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@H](c1ccc(F)cc1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464832149 1042189672 /nfs/dbraw/zinc/18/96/72/1042189672.db2.gz BVJFWQIOWBYLJM-IEBWSBKVSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@@H]1CCCC[C@H]1OCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464847132 1042195081 /nfs/dbraw/zinc/19/50/81/1042195081.db2.gz UTUIURPIHCXRCE-BAGYTPMASA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1CCCC[C@H]1OCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464847132 1042195084 /nfs/dbraw/zinc/19/50/84/1042195084.db2.gz UTUIURPIHCXRCE-BAGYTPMASA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1CCCC[C@H]1OCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464847132 1042195087 /nfs/dbraw/zinc/19/50/87/1042195087.db2.gz UTUIURPIHCXRCE-BAGYTPMASA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC[N@@H+]1C ZINC000426063895 1042247144 /nfs/dbraw/zinc/24/71/44/1042247144.db2.gz VTFZVTSWWVFMGN-YSGRDPCXSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC[N@H+]1C ZINC000426063895 1042247154 /nfs/dbraw/zinc/24/71/54/1042247154.db2.gz VTFZVTSWWVFMGN-YSGRDPCXSA-N 2 1 343.902 4.091 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000506343314 1042330239 /nfs/dbraw/zinc/33/02/39/1042330239.db2.gz RNTMXIIWYUGIAE-UHFFFAOYSA-N 2 1 332.385 4.149 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000506343314 1042330245 /nfs/dbraw/zinc/33/02/45/1042330245.db2.gz RNTMXIIWYUGIAE-UHFFFAOYSA-N 2 1 332.385 4.149 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCc2ccccc2F)CC1 ZINC000438835224 1042375581 /nfs/dbraw/zinc/37/55/81/1042375581.db2.gz VZFUMCGWCFZXIZ-UHFFFAOYSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@@H](Cc1ccsc1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000518156608 1042377338 /nfs/dbraw/zinc/37/73/38/1042377338.db2.gz BPTMXDQAOGIPLV-HNNXBMFYSA-N 2 1 329.513 4.092 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1cccc(O)c1 ZINC000638566661 1042422398 /nfs/dbraw/zinc/42/23/98/1042422398.db2.gz BYGBUJXJAAOTBN-XWFZLUIHSA-N 2 1 336.479 4.411 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1cccc(O)c1 ZINC000638566661 1042422402 /nfs/dbraw/zinc/42/24/02/1042422402.db2.gz BYGBUJXJAAOTBN-XWFZLUIHSA-N 2 1 336.479 4.411 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCOc2ccc(F)cc2)C1 ZINC000303603349 1042483851 /nfs/dbraw/zinc/48/38/51/1042483851.db2.gz NYEWPCQBRHPXPM-OALUTQOASA-N 2 1 348.506 4.181 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCOc2ccc(F)cc2)C1 ZINC000303603349 1042483855 /nfs/dbraw/zinc/48/38/55/1042483855.db2.gz NYEWPCQBRHPXPM-OALUTQOASA-N 2 1 348.506 4.181 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCOc2ccc(F)cc2)C1 ZINC000303603349 1042483862 /nfs/dbraw/zinc/48/38/62/1042483862.db2.gz NYEWPCQBRHPXPM-OALUTQOASA-N 2 1 348.506 4.181 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC[N@@H+]1C ZINC000439145996 1042519683 /nfs/dbraw/zinc/51/96/83/1042519683.db2.gz KQMAMDAXGJDFIX-IFUGULHKSA-N 2 1 343.334 4.034 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC[N@H+]1C ZINC000439145996 1042519684 /nfs/dbraw/zinc/51/96/84/1042519684.db2.gz KQMAMDAXGJDFIX-IFUGULHKSA-N 2 1 343.334 4.034 20 0 EIADMP CSc1ccc([C@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)cc1 ZINC000173440541 1042573422 /nfs/dbraw/zinc/57/34/22/1042573422.db2.gz LNBVRMMBCCRVFA-INIZCTEOSA-N 2 1 341.524 4.432 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000518793740 1042695945 /nfs/dbraw/zinc/69/59/45/1042695945.db2.gz ARLAMMNGYNLRBK-INIZCTEOSA-N 2 1 346.421 4.189 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000506647074 1042731276 /nfs/dbraw/zinc/73/12/76/1042731276.db2.gz TWTKOQZBNGEMLI-UHFFFAOYSA-N 2 1 338.495 4.182 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000506647074 1042731288 /nfs/dbraw/zinc/73/12/88/1042731288.db2.gz TWTKOQZBNGEMLI-UHFFFAOYSA-N 2 1 338.495 4.182 20 0 EIADMP c1ccc(CCC[N@H+]2CCCN(c3cc[nH+]c4ccccc43)CC2)cc1 ZINC000518899044 1042749891 /nfs/dbraw/zinc/74/98/91/1042749891.db2.gz PFHPRHCLVDNIMW-UHFFFAOYSA-N 2 1 345.490 4.380 20 0 EIADMP CCc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000309707879 1042819294 /nfs/dbraw/zinc/81/92/94/1042819294.db2.gz IMPNKUCFLQEITC-SJLPKXTDSA-N 2 1 328.525 4.311 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000309710698 1042819415 /nfs/dbraw/zinc/81/94/15/1042819415.db2.gz JESXOHUZMZRMCF-FUHWJXTLSA-N 2 1 328.525 4.483 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1F ZINC000310093552 1042827700 /nfs/dbraw/zinc/82/77/00/1042827700.db2.gz SWFBCCOMKFVDSG-WBVHZDCISA-N 2 1 330.422 4.138 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)ccc1F ZINC000310093552 1042827703 /nfs/dbraw/zinc/82/77/03/1042827703.db2.gz SWFBCCOMKFVDSG-WBVHZDCISA-N 2 1 330.422 4.138 20 0 EIADMP C[C@@H]([NH2+]CCSc1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310170868 1042830034 /nfs/dbraw/zinc/83/00/34/1042830034.db2.gz UAUPBAFOHWMDDW-UYAOXDASSA-N 2 1 340.536 4.279 20 0 EIADMP Cc1cc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC000310522231 1042839204 /nfs/dbraw/zinc/83/92/04/1042839204.db2.gz NVJWGIYVOVMALP-XLIONFOSSA-N 2 1 326.459 4.134 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1OC ZINC000310985596 1042849612 /nfs/dbraw/zinc/84/96/12/1042849612.db2.gz GTHDBFODEHWHDM-PZJWPPBQSA-N 2 1 338.495 4.258 20 0 EIADMP CC(C)Oc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310991161 1042849976 /nfs/dbraw/zinc/84/99/76/1042849976.db2.gz HTDJSTJXTMEJGQ-OAQYLSRUSA-N 2 1 338.495 4.086 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310998842 1042850080 /nfs/dbraw/zinc/85/00/80/1042850080.db2.gz UVEIKUHUHJNACO-UEXGIBASSA-N 2 1 338.495 4.256 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000311236761 1042855048 /nfs/dbraw/zinc/85/50/48/1042855048.db2.gz UILJTIOHHLKWFH-IEBWSBKVSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000311236761 1042855051 /nfs/dbraw/zinc/85/50/51/1042855051.db2.gz UILJTIOHHLKWFH-IEBWSBKVSA-N 2 1 341.474 4.174 20 0 EIADMP COC[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(Cl)cc1 ZINC000493884679 1042971280 /nfs/dbraw/zinc/97/12/80/1042971280.db2.gz ZNNQGCITJNPICD-APWZRJJASA-N 2 1 338.923 4.272 20 0 EIADMP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000493890810 1042972119 /nfs/dbraw/zinc/97/21/19/1042972119.db2.gz HMTGJMDJNPFGOK-GCJKJVERSA-N 2 1 340.511 4.393 20 0 EIADMP C[NH+](C)[C@H]1CCC[C@H]([NH2+]Cc2ccc(Br)c(Cl)c2)C1 ZINC000494081524 1043015024 /nfs/dbraw/zinc/01/50/24/1043015024.db2.gz ZBUMBUJLQYGBJZ-STQMWFEESA-N 2 1 345.712 4.065 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168007477 1043015033 /nfs/dbraw/zinc/01/50/33/1043015033.db2.gz SHPMFKFOBGFGKX-OPMZPASUSA-N 2 1 340.486 4.399 20 0 EIADMP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(OC)cc1 ZINC000183192887 1043039127 /nfs/dbraw/zinc/03/91/27/1043039127.db2.gz KIMIAYUJTQNZJD-BLIXFSHQSA-N 2 1 330.516 4.389 20 0 EIADMP C[C@@H](C[NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C[NH+](C)C ZINC000391884770 1043071183 /nfs/dbraw/zinc/07/11/83/1043071183.db2.gz PDRKXRJDEXFXNU-JTQLQIEISA-N 2 1 342.327 4.012 20 0 EIADMP C[C@H](c1ccncc1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000673857219 1043126873 /nfs/dbraw/zinc/12/68/73/1043126873.db2.gz LEVILVIRXOAPPI-KNQAVFIVSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccncc1)[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000673857219 1043126877 /nfs/dbraw/zinc/12/68/77/1043126877.db2.gz LEVILVIRXOAPPI-KNQAVFIVSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccncc1)[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000673857219 1043126881 /nfs/dbraw/zinc/12/68/81/1043126881.db2.gz LEVILVIRXOAPPI-KNQAVFIVSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccncc1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000673857219 1043126888 /nfs/dbraw/zinc/12/68/88/1043126888.db2.gz LEVILVIRXOAPPI-KNQAVFIVSA-N 2 1 335.495 4.131 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000338785107 1043272891 /nfs/dbraw/zinc/27/28/91/1043272891.db2.gz ADYSTIJFJYSLNK-SFHVURJKSA-N 2 1 349.316 4.068 20 0 EIADMP COc1ccccc1[C@H](C[NH2+]C1CC[NH+](C(C)(C)C)CC1)OC(C)C ZINC000186383712 1043273760 /nfs/dbraw/zinc/27/37/60/1043273760.db2.gz RHGSWNLVZBLGNQ-FQEVSTJZSA-N 2 1 348.531 4.014 20 0 EIADMP Fc1ccccc1[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166677633 1043307716 /nfs/dbraw/zinc/30/77/16/1043307716.db2.gz RDBCEPHTBGAHDP-JQVVWYNYSA-N 2 1 338.470 4.326 20 0 EIADMP Fc1ccccc1[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000166677633 1043307732 /nfs/dbraw/zinc/30/77/32/1043307732.db2.gz RDBCEPHTBGAHDP-JQVVWYNYSA-N 2 1 338.470 4.326 20 0 EIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccccc1 ZINC000674049650 1043349865 /nfs/dbraw/zinc/34/98/65/1043349865.db2.gz VROMDBPTQAQOFU-SFTDATJTSA-N 2 1 330.516 4.007 20 0 EIADMP CCCC[N@@H+](C)CCCN[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012145 1043416264 /nfs/dbraw/zinc/41/62/64/1043416264.db2.gz WWWWPYMMZRNMTK-VTYHHJSWSA-N 2 1 345.575 4.140 20 0 EIADMP CCCC[NH+](C)CCCN[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012145 1043416271 /nfs/dbraw/zinc/41/62/71/1043416271.db2.gz WWWWPYMMZRNMTK-VTYHHJSWSA-N 2 1 345.575 4.140 20 0 EIADMP CCCC[NH+](C)CCCN[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012145 1043416282 /nfs/dbraw/zinc/41/62/82/1043416282.db2.gz WWWWPYMMZRNMTK-VTYHHJSWSA-N 2 1 345.575 4.140 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCC34CCCC4)CC2)cs1 ZINC000189120803 1043438962 /nfs/dbraw/zinc/43/89/62/1043438962.db2.gz UXEQXQVFLNRSMA-SFHVURJKSA-N 2 1 347.572 4.230 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3F)s2)C1 ZINC000520943395 1043444686 /nfs/dbraw/zinc/44/46/86/1043444686.db2.gz AIFQFQQUGVCRPX-HNNXBMFYSA-N 2 1 332.488 4.376 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)cc1 ZINC000665269584 1043450923 /nfs/dbraw/zinc/45/09/23/1043450923.db2.gz IZPQQJKBKBMCLQ-QKKBWIMNSA-N 2 1 332.451 4.101 20 0 EIADMP Cc1nc2ccc(C[NH2+]CCCC[N@@H+]3CCCC[C@H]3C)cc2s1 ZINC000494385263 1043459546 /nfs/dbraw/zinc/45/95/46/1043459546.db2.gz LYODQEKDDHWVOT-OAHLLOKOSA-N 2 1 331.529 4.349 20 0 EIADMP CN(c1ccccc1C[N@@H+](C)C[C@@H]1CC=CCC1)C1CC[NH+](C)CC1 ZINC000542483084 1043478119 /nfs/dbraw/zinc/47/81/19/1043478119.db2.gz VFDJGZRXLWJLNQ-LJQANCHMSA-N 2 1 341.543 4.005 20 0 EIADMP CC[C@@H]1C[N@@H+](CCCCn2ccnc2C)CC[C@H]1c1ccccc1 ZINC000442394528 1043669702 /nfs/dbraw/zinc/66/97/02/1043669702.db2.gz SHOSLCGPXOTZGE-TZIWHRDSSA-N 2 1 325.500 4.487 20 0 EIADMP CC[C@@H]1C[N@H+](CCCCn2cc[nH+]c2C)CC[C@H]1c1ccccc1 ZINC000442394528 1043669706 /nfs/dbraw/zinc/66/97/06/1043669706.db2.gz SHOSLCGPXOTZGE-TZIWHRDSSA-N 2 1 325.500 4.487 20 0 EIADMP CC[C@@H]1C[N@@H+](CCCCn2cc[nH+]c2C)CC[C@H]1c1ccccc1 ZINC000442394528 1043669716 /nfs/dbraw/zinc/66/97/16/1043669716.db2.gz SHOSLCGPXOTZGE-TZIWHRDSSA-N 2 1 325.500 4.487 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(OCC3CC3)cc2)c1 ZINC000190955688 1043755434 /nfs/dbraw/zinc/75/54/34/1043755434.db2.gz ZDHVKRNQXHGNIY-UHFFFAOYSA-N 2 1 338.495 4.217 20 0 EIADMP COc1ccsc1C[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000521418605 1043759009 /nfs/dbraw/zinc/75/90/09/1043759009.db2.gz CBRJJKLPIPWNCO-SFHVURJKSA-N 2 1 344.524 4.149 20 0 EIADMP COc1ccsc1C[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000521418605 1043759027 /nfs/dbraw/zinc/75/90/27/1043759027.db2.gz CBRJJKLPIPWNCO-SFHVURJKSA-N 2 1 344.524 4.149 20 0 EIADMP COCCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000521477540 1043784469 /nfs/dbraw/zinc/78/44/69/1043784469.db2.gz RLFSCTLNDBHCCU-FDFHNCONSA-N 2 1 344.543 4.084 20 0 EIADMP C[NH+]1CCC([NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442645532 1043794752 /nfs/dbraw/zinc/79/47/52/1043794752.db2.gz IXBUTCUSLCDQMT-PBHICJAKSA-N 2 1 326.406 4.025 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000442779555 1043831605 /nfs/dbraw/zinc/83/16/05/1043831605.db2.gz JEARKIFSLQDKBG-MOIQIXESSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000442779555 1043831610 /nfs/dbraw/zinc/83/16/10/1043831610.db2.gz JEARKIFSLQDKBG-MOIQIXESSA-N 2 1 340.433 4.414 20 0 EIADMP CCCCOc1ccc(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1Cl ZINC000191632472 1043832804 /nfs/dbraw/zinc/83/28/04/1043832804.db2.gz SFSDQAODMFBFJI-IAGOWNOFSA-N 2 1 336.907 4.235 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1Cl ZINC000191632472 1043832809 /nfs/dbraw/zinc/83/28/09/1043832809.db2.gz SFSDQAODMFBFJI-IAGOWNOFSA-N 2 1 336.907 4.235 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1Cl ZINC000191632472 1043832818 /nfs/dbraw/zinc/83/28/18/1043832818.db2.gz SFSDQAODMFBFJI-IAGOWNOFSA-N 2 1 336.907 4.235 20 0 EIADMP Clc1csc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000193083159 1043997491 /nfs/dbraw/zinc/99/74/91/1043997491.db2.gz SYDAGSFTPDZDSG-INIZCTEOSA-N 2 1 334.916 4.056 20 0 EIADMP Cc1cc(C)c(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c(C)c1 ZINC000521818952 1044008887 /nfs/dbraw/zinc/00/88/87/1044008887.db2.gz ICQHGMGDLNDNQV-UHFFFAOYSA-N 2 1 336.523 4.409 20 0 EIADMP CCC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1ccsc1 ZINC000443100562 1044017846 /nfs/dbraw/zinc/01/78/46/1044017846.db2.gz ANOAWYZRERGNDK-HXUWFJFHSA-N 2 1 344.524 4.211 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2ccccc2n1 ZINC000195138737 1044026135 /nfs/dbraw/zinc/02/61/35/1044026135.db2.gz DQALDPSPLPZFMJ-QUCCMNQESA-N 2 1 345.490 4.408 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc2ccccc2n1 ZINC000195138737 1044026154 /nfs/dbraw/zinc/02/61/54/1044026154.db2.gz DQALDPSPLPZFMJ-QUCCMNQESA-N 2 1 345.490 4.408 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2ccc(F)cc2)s1 ZINC000521856324 1044029946 /nfs/dbraw/zinc/02/99/46/1044029946.db2.gz SMRFJGGXQWEIMN-AWEZNQCLSA-N 2 1 343.471 4.485 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2cc(Br)cs2)CC1 ZINC000193963558 1044221194 /nfs/dbraw/zinc/22/11/94/1044221194.db2.gz OJIFBJPGHWSRAS-LBPRGKRZSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000358343728 1044276263 /nfs/dbraw/zinc/27/62/63/1044276263.db2.gz UBLGSBIDTSWKHU-YJBOKZPZSA-N 2 1 336.520 4.320 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000358343728 1044276278 /nfs/dbraw/zinc/27/62/78/1044276278.db2.gz UBLGSBIDTSWKHU-YJBOKZPZSA-N 2 1 336.520 4.320 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cnc(-c3ccco3)s2)CC1 ZINC000194330018 1044286982 /nfs/dbraw/zinc/28/69/82/1044286982.db2.gz BRBCGBQUNLMLNY-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCC[C@H]([C@H]2CCOC2)C1)[N@@H+](C)Cc1ccccc1 ZINC000466343340 1044295407 /nfs/dbraw/zinc/29/54/07/1044295407.db2.gz JRCYCOVUKHXFGD-RYFAJOAYSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(O)cc1 ZINC001168017936 1044318579 /nfs/dbraw/zinc/31/85/79/1044318579.db2.gz YDQIVCCCRXXXNK-NYUBLWNDSA-N 2 1 338.495 4.484 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)C1CCC(F)(F)CC1 ZINC000474060491 1044324925 /nfs/dbraw/zinc/32/49/25/1044324925.db2.gz AGKCHTPJXIUPKN-INIZCTEOSA-N 2 1 336.470 4.238 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)C1CCC(F)(F)CC1 ZINC000474060491 1044324939 /nfs/dbraw/zinc/32/49/39/1044324939.db2.gz AGKCHTPJXIUPKN-INIZCTEOSA-N 2 1 336.470 4.238 20 0 EIADMP Cc1nc(C)c(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)s1 ZINC001168019133 1044338415 /nfs/dbraw/zinc/33/84/15/1044338415.db2.gz GRCVJAQLOIWPGX-GJZGRUSLSA-N 2 1 343.540 4.291 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C1CCC(F)(F)CC1 ZINC000474079417 1044357466 /nfs/dbraw/zinc/35/74/66/1044357466.db2.gz IXISZHDEECMEMO-ZOBUZTSGSA-N 2 1 328.491 4.443 20 0 EIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)Cc1ccccc1 ZINC000542518736 1044434633 /nfs/dbraw/zinc/43/46/33/1044434633.db2.gz VCUREJMJBCGNKE-UYAOXDASSA-N 2 1 342.552 4.429 20 0 EIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)Cc1ccccc1 ZINC000542518736 1044434660 /nfs/dbraw/zinc/43/46/60/1044434660.db2.gz VCUREJMJBCGNKE-UYAOXDASSA-N 2 1 342.552 4.429 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000675790078 1044500765 /nfs/dbraw/zinc/50/07/65/1044500765.db2.gz RCMADJNBHUDIDA-DYESRHJHSA-N 2 1 333.479 4.168 20 0 EIADMP CCOc1ccc([C@H](CC)N[C@H]2CC[N@H+](CC3CC3)C2)cc1OCC ZINC000675833490 1044521208 /nfs/dbraw/zinc/52/12/08/1044521208.db2.gz KRUMSXBYLNEQSN-OALUTQOASA-N 2 1 346.515 4.009 20 0 EIADMP CCOc1ccc([C@H](CC)N[C@H]2CC[N@@H+](CC3CC3)C2)cc1OCC ZINC000675833490 1044521224 /nfs/dbraw/zinc/52/12/24/1044521224.db2.gz KRUMSXBYLNEQSN-OALUTQOASA-N 2 1 346.515 4.009 20 0 EIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1cccs1 ZINC000675880286 1044552685 /nfs/dbraw/zinc/55/26/85/1044552685.db2.gz CUNAOOCJXCXTIH-ZWKOTPCHSA-N 2 1 336.545 4.068 20 0 EIADMP CC[NH+]1CCC([N@H+](C)CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000474118432 1044580548 /nfs/dbraw/zinc/58/05/48/1044580548.db2.gz NFGKURUWVCWWNV-UHFFFAOYSA-N 2 1 342.449 4.444 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000474118432 1044580562 /nfs/dbraw/zinc/58/05/62/1044580562.db2.gz NFGKURUWVCWWNV-UHFFFAOYSA-N 2 1 342.449 4.444 20 0 EIADMP C[C@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)C1CCSCC1 ZINC000250104781 1044673721 /nfs/dbraw/zinc/67/37/21/1044673721.db2.gz RXKYLTVZANMGKX-TWFHAPMSSA-N 2 1 346.584 4.264 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(F)(F)F)s2)C1 ZINC000428869842 1044785444 /nfs/dbraw/zinc/78/54/44/1044785444.db2.gz CPDUGDLWGAHTBI-CYBMUJFWSA-N 2 1 334.451 4.225 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(F)(F)F)s2)C1 ZINC000428869842 1044785466 /nfs/dbraw/zinc/78/54/66/1044785466.db2.gz CPDUGDLWGAHTBI-CYBMUJFWSA-N 2 1 334.451 4.225 20 0 EIADMP CC1(C[NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532369 1044800004 /nfs/dbraw/zinc/80/00/04/1044800004.db2.gz OAUAXHSXRHJXKP-WMZOPIPTSA-N 2 1 334.454 4.380 20 0 EIADMP CC1(C[NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532369 1044800010 /nfs/dbraw/zinc/80/00/10/1044800010.db2.gz OAUAXHSXRHJXKP-WMZOPIPTSA-N 2 1 334.454 4.380 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccncc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168032455 1044839313 /nfs/dbraw/zinc/83/93/13/1044839313.db2.gz GIVAUBMIBKHGGC-NNTZPNAXSA-N 2 1 349.522 4.490 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)[C@@H]1CCCOC1 ZINC000895663398 1044842170 /nfs/dbraw/zinc/84/21/70/1044842170.db2.gz KPSUGSYYLBWXJN-WKDRNLAYSA-N 2 1 342.527 4.149 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)[C@@H]1CCCOC1 ZINC000895663398 1044842173 /nfs/dbraw/zinc/84/21/73/1044842173.db2.gz KPSUGSYYLBWXJN-WKDRNLAYSA-N 2 1 342.527 4.149 20 0 EIADMP Fc1ccc2occ(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c2c1 ZINC001141852497 1044969752 /nfs/dbraw/zinc/96/97/52/1044969752.db2.gz GHUKMWTVFOQHOT-SFHVURJKSA-N 2 1 330.447 4.412 20 0 EIADMP Fc1ccc2occ(C[N@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c2c1 ZINC001141852497 1044969769 /nfs/dbraw/zinc/96/97/69/1044969769.db2.gz GHUKMWTVFOQHOT-SFHVURJKSA-N 2 1 330.447 4.412 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCSC3(CCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000922840724 1044985022 /nfs/dbraw/zinc/98/50/22/1044985022.db2.gz RJVWJYMFLONMBP-HOJAQTOUSA-N 2 1 344.568 4.447 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCSC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000922840724 1044985037 /nfs/dbraw/zinc/98/50/37/1044985037.db2.gz RJVWJYMFLONMBP-HOJAQTOUSA-N 2 1 344.568 4.447 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(C(F)F)nc1 ZINC000657898076 1045059932 /nfs/dbraw/zinc/05/99/32/1045059932.db2.gz LXAYYGGSNRWSLT-CQSZACIVSA-N 2 1 337.458 4.467 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@@H+](C)CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000923319178 1045060260 /nfs/dbraw/zinc/06/02/60/1045060260.db2.gz MJDPFPVTIYXRHX-WZYMTQMTSA-N 2 1 329.513 4.210 20 0 EIADMP CC(C)C[N@@H+](Cc1ccccc1N(C)C1CC[NH+](C)CC1)C(C)C ZINC000509407769 1045128386 /nfs/dbraw/zinc/12/83/86/1045128386.db2.gz MEAWWNGRAHIVDL-UHFFFAOYSA-N 2 1 331.548 4.083 20 0 EIADMP C[C@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC([C@H]2CCC[NH2+]CC2)CC1 ZINC000923508523 1045141473 /nfs/dbraw/zinc/14/14/73/1045141473.db2.gz WJUKUOYVHMPILF-CVEARBPZSA-N 2 1 333.520 4.135 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674007448 1045178548 /nfs/dbraw/zinc/17/85/48/1045178548.db2.gz JEVZLQNBDNXNOP-QGZVFWFLSA-N 2 1 342.449 4.302 20 0 EIADMP FC(F)C1(C[NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000671762706 1045185646 /nfs/dbraw/zinc/18/56/46/1045185646.db2.gz GYPRWQFEIDKXDS-IPMKNSEASA-N 2 1 348.481 4.312 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2scnc2C2CC2)[C@H]1c1cccs1 ZINC000487272404 1045223619 /nfs/dbraw/zinc/22/36/19/1045223619.db2.gz SCFNNOWRBPJRBO-KDOFPFPSSA-N 2 1 347.553 4.255 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2scnc2C2CC2)[C@H]1c1cccs1 ZINC000487272404 1045223627 /nfs/dbraw/zinc/22/36/27/1045223627.db2.gz SCFNNOWRBPJRBO-KDOFPFPSSA-N 2 1 347.553 4.255 20 0 EIADMP C[C@H](CC[NH2+]Cc1scnc1C1CC1)[N@H+](C)Cc1ccccc1 ZINC000487306719 1045225102 /nfs/dbraw/zinc/22/51/02/1045225102.db2.gz HPGSUWALRGYUPB-OAHLLOKOSA-N 2 1 329.513 4.021 20 0 EIADMP C[C@H](CC[NH2+]Cc1scnc1C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000487306719 1045225114 /nfs/dbraw/zinc/22/51/14/1045225114.db2.gz HPGSUWALRGYUPB-OAHLLOKOSA-N 2 1 329.513 4.021 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)c2ccc(F)cc2)CC1 ZINC000495652218 1045269903 /nfs/dbraw/zinc/26/99/03/1045269903.db2.gz BIGJTPVFBIGPDL-QGZVFWFLSA-N 2 1 326.459 4.449 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@H+]1C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000542567524 1045330934 /nfs/dbraw/zinc/33/09/34/1045330934.db2.gz ZTSCPPKJVFINIK-QLFBSQMISA-N 2 1 328.422 4.271 20 0 EIADMP Cl/C=C(/Cl)C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000762926571 1045416792 /nfs/dbraw/zinc/41/67/92/1045416792.db2.gz LENOOGVQPKXRCY-SFQUDFHCSA-N 2 1 339.310 4.294 20 0 EIADMP Cc1ccsc1C[N@H+]1Cc2ccccc2C2(CC[NH+](C)CC2)C1 ZINC001279165973 1045427332 /nfs/dbraw/zinc/42/73/32/1045427332.db2.gz KXSZFCODGHYGPD-UHFFFAOYSA-N 2 1 326.509 4.036 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(Br)c1 ZINC000322630204 1045491677 /nfs/dbraw/zinc/49/16/77/1045491677.db2.gz VIGBPICLMXOAND-NPYXIHBLSA-N 2 1 337.305 4.115 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc3cccnc32)CC1 ZINC000054337452 1045575265 /nfs/dbraw/zinc/57/52/65/1045575265.db2.gz AUYZLBYBSORLLQ-UHFFFAOYSA-N 2 1 325.500 4.179 20 0 EIADMP COc1ccccc1[C@H](C)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398142363 1045831472 /nfs/dbraw/zinc/83/14/72/1045831472.db2.gz MUDSXZGCDMZNTG-BBTUJRGHSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398142363 1045831474 /nfs/dbraw/zinc/83/14/74/1045831474.db2.gz MUDSXZGCDMZNTG-BBTUJRGHSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398142363 1045831475 /nfs/dbraw/zinc/83/14/75/1045831475.db2.gz MUDSXZGCDMZNTG-BBTUJRGHSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398142363 1045831476 /nfs/dbraw/zinc/83/14/76/1045831476.db2.gz MUDSXZGCDMZNTG-BBTUJRGHSA-N 2 1 338.495 4.256 20 0 EIADMP C[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1nc(-c2ccccc2)cs1 ZINC000246813586 1045831587 /nfs/dbraw/zinc/83/15/87/1045831587.db2.gz AVBIPIAMXGBBRG-UAGQMJEPSA-N 2 1 327.497 4.088 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2N2CCCCC2)CC1 ZINC000768925391 1045861888 /nfs/dbraw/zinc/86/18/88/1045861888.db2.gz CBMRIGYGICIDOP-UHFFFAOYSA-N 2 1 343.559 4.229 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@H]3CCCOc4ccccc43)C2)cc1 ZINC000249157426 1045893675 /nfs/dbraw/zinc/89/36/75/1045893675.db2.gz XKYCQGHQBXWCFM-FPOVZHCZSA-N 2 1 336.479 4.012 20 0 EIADMP CC[C@@H]1C[C@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)CCO1 ZINC001170176619 1045913130 /nfs/dbraw/zinc/91/31/30/1045913130.db2.gz AAEJAJVUHWWWJQ-XJSHKYLYSA-N 2 1 342.527 4.072 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000509454726 1045953013 /nfs/dbraw/zinc/95/30/13/1045953013.db2.gz OKVHKSGRKNUCFY-PWRODBHTSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000509454726 1045953031 /nfs/dbraw/zinc/95/30/31/1045953031.db2.gz OKVHKSGRKNUCFY-PWRODBHTSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(c2ccc(F)cc2)CC1 ZINC001170260373 1045958423 /nfs/dbraw/zinc/95/84/23/1045958423.db2.gz JHHTXZZSUNMJDC-OAHLLOKOSA-N 2 1 346.877 4.360 20 0 EIADMP C[C@@H](Cc1ccccc1Cl)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001170250350 1045973288 /nfs/dbraw/zinc/97/32/88/1045973288.db2.gz KPKKZEFUQFTTAJ-PKOBYXMFSA-N 2 1 342.914 4.383 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)CC1 ZINC000161655038 1046020649 /nfs/dbraw/zinc/02/06/49/1046020649.db2.gz BNWLNGMURBRLBX-ZDUSSCGKSA-N 2 1 330.394 4.110 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(F)c(Br)c2)CC1 ZINC000037236785 1046088946 /nfs/dbraw/zinc/08/89/46/1046088946.db2.gz XGOPJVRIVFXFJQ-LBPRGKRZSA-N 2 1 343.284 4.112 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCC[C@@H](CC(C)C)C2)cn1 ZINC000792922667 1046108980 /nfs/dbraw/zinc/10/89/80/1046108980.db2.gz QFESFQGRSSYWFI-HKUYNNGSSA-N 2 1 326.488 4.270 20 0 EIADMP C[NH+](C)CCCC1CC[NH+](Cc2csc(-c3cccs3)n2)CC1 ZINC000123453524 1046131802 /nfs/dbraw/zinc/13/18/02/1046131802.db2.gz YAHGNGPRPHPKBD-UHFFFAOYSA-N 2 1 349.569 4.425 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+](C)CC)c2)cc1 ZINC000124004295 1046212423 /nfs/dbraw/zinc/21/24/23/1046212423.db2.gz NYPNRKVQMARNHS-KRWDZBQOSA-N 2 1 326.484 4.388 20 0 EIADMP COc1ccc2oc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)cc2c1 ZINC000124552764 1046245493 /nfs/dbraw/zinc/24/54/93/1046245493.db2.gz UOPQWELNQFJNSJ-UHFFFAOYSA-N 2 1 342.483 4.186 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(Oc3cccnc3)c(C)c2)CC1 ZINC000125253818 1046295357 /nfs/dbraw/zinc/29/53/57/1046295357.db2.gz FLUMQMXLTVRWAO-UHFFFAOYSA-N 2 1 339.483 4.098 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(Oc3cccnc3)c(C)c2)CC1 ZINC000125253818 1046295375 /nfs/dbraw/zinc/29/53/75/1046295375.db2.gz FLUMQMXLTVRWAO-UHFFFAOYSA-N 2 1 339.483 4.098 20 0 EIADMP C[C@H](Nc1cccc(C[NH+](C)C)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508688661 1046321861 /nfs/dbraw/zinc/32/18/61/1046321861.db2.gz DLAGTOFQMIXOFR-RXVVDRJESA-N 2 1 337.511 4.071 20 0 EIADMP COc1cc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1C ZINC000508698032 1046328457 /nfs/dbraw/zinc/32/84/57/1046328457.db2.gz KSTQEXQRXZCKPL-NQIIRXRSSA-N 2 1 338.495 4.004 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@@H]1Cc1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508709193 1046359908 /nfs/dbraw/zinc/35/99/08/1046359908.db2.gz GMDXFVKHFKIQPO-OUFMZXHOSA-N 2 1 334.507 4.118 20 0 EIADMP C[C@@H]([NH2+]CCc1cc(F)ccc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710412 1046363564 /nfs/dbraw/zinc/36/35/64/1046363564.db2.gz MXRSPFQFWTUGES-APWZRJJASA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]([NH2+]CC1(c2ccccc2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710703 1046370251 /nfs/dbraw/zinc/37/02/51/1046370251.db2.gz NRFRVNSJNRLIAS-PZJWPPBQSA-N 2 1 334.507 4.218 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)C/C(C)=C\c2ccccc2COC)C[C@@H]1C ZINC000508719526 1046378025 /nfs/dbraw/zinc/37/80/25/1046378025.db2.gz NYAFEXDQTIJWHJ-JCXSTKQLSA-N 2 1 330.516 4.041 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C(C)=C\c2ccccc2COC)C[C@@H]1C ZINC000508719526 1046378044 /nfs/dbraw/zinc/37/80/44/1046378044.db2.gz NYAFEXDQTIJWHJ-JCXSTKQLSA-N 2 1 330.516 4.041 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C(C)=C\c2ccccc2COC)C[C@@H]1C ZINC000508719526 1046378065 /nfs/dbraw/zinc/37/80/65/1046378065.db2.gz NYAFEXDQTIJWHJ-JCXSTKQLSA-N 2 1 330.516 4.041 20 0 EIADMP COc1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c2ccccc12 ZINC000536652209 1046594183 /nfs/dbraw/zinc/59/41/83/1046594183.db2.gz OKVMRVAAZBHUBV-UHFFFAOYSA-N 2 1 340.511 4.401 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[N@@H+]1C ZINC000536660054 1046627139 /nfs/dbraw/zinc/62/71/39/1046627139.db2.gz VCRMDIHVFPCHCQ-WMLDXEAASA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[N@H+]1C ZINC000536660054 1046627150 /nfs/dbraw/zinc/62/71/50/1046627150.db2.gz VCRMDIHVFPCHCQ-WMLDXEAASA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[NH+]1C ZINC000536660054 1046627155 /nfs/dbraw/zinc/62/71/55/1046627155.db2.gz VCRMDIHVFPCHCQ-WMLDXEAASA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[NH+]1C ZINC000536660054 1046627167 /nfs/dbraw/zinc/62/71/67/1046627167.db2.gz VCRMDIHVFPCHCQ-WMLDXEAASA-N 2 1 332.488 4.469 20 0 EIADMP c1cc(OC2CCCCC2)ccc1C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000459410068 1046632740 /nfs/dbraw/zinc/63/27/40/1046632740.db2.gz NITTWTXLZIKXGO-UHFFFAOYSA-N 2 1 328.500 4.115 20 0 EIADMP C[C@@H](c1ccc2c(c1)CCC2)[N@@H+]1CC[C@H](C[NH+](C)Cc2cccnc2)C1 ZINC000459449012 1046676926 /nfs/dbraw/zinc/67/69/26/1046676926.db2.gz WXBOZTZIWBFDGI-AZUAARDMSA-N 2 1 349.522 4.085 20 0 EIADMP C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@H](C[NH+](C)Cc2cccnc2)C1 ZINC000459449012 1046676949 /nfs/dbraw/zinc/67/69/49/1046676949.db2.gz WXBOZTZIWBFDGI-AZUAARDMSA-N 2 1 349.522 4.085 20 0 EIADMP C[C@@H](c1ccc2c(c1)CCC2)[NH+]1CC[C@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000459449012 1046676956 /nfs/dbraw/zinc/67/69/56/1046676956.db2.gz WXBOZTZIWBFDGI-AZUAARDMSA-N 2 1 349.522 4.085 20 0 EIADMP C[C@@H](c1ccc2c(c1)CCC2)[NH+]1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000459449012 1046676958 /nfs/dbraw/zinc/67/69/58/1046676958.db2.gz WXBOZTZIWBFDGI-AZUAARDMSA-N 2 1 349.522 4.085 20 0 EIADMP c1ccc2c(c1)cccc2CSCC[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000459459572 1046699174 /nfs/dbraw/zinc/69/91/74/1046699174.db2.gz DVSWNAFHVZKGRG-UHFFFAOYSA-N 2 1 340.536 4.289 20 0 EIADMP C[C@@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)[C@@H]1CC1(C)C ZINC000785497563 1046701029 /nfs/dbraw/zinc/70/10/29/1046701029.db2.gz SHSFEMITMMVZQS-UZLBHIALSA-N 2 1 329.532 4.311 20 0 EIADMP C[C@@H]([NH2+]C1CC(C)(c2ccccc2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000459467897 1046703839 /nfs/dbraw/zinc/70/38/39/1046703839.db2.gz QQUSBCWKZZXLKD-ROFGYTOFSA-N 2 1 326.528 4.349 20 0 EIADMP Clc1ccc([C@@H](C[NH2+]C2CC[NH+](C3CC3)CC2)OCC2CC2)cc1 ZINC000459543285 1046766399 /nfs/dbraw/zinc/76/63/99/1046766399.db2.gz LJCQJKQQVLPRNI-HXUWFJFHSA-N 2 1 348.918 4.024 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000459730184 1046866839 /nfs/dbraw/zinc/86/68/39/1046866839.db2.gz LNWYHFCAVKASNX-UYKQMDHISA-N 2 1 338.470 4.182 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459796845 1046892895 /nfs/dbraw/zinc/89/28/95/1046892895.db2.gz WLKVQCLGSLPSTE-IRVMHKCDSA-N 2 1 338.442 4.013 20 0 EIADMP Cc1nc(F)ccc1C[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000787202678 1046949596 /nfs/dbraw/zinc/94/95/96/1046949596.db2.gz SKZDGJHTROITJB-MRXNPFEDSA-N 2 1 333.495 4.006 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](COc1ccccc1)c1ccccc1 ZINC000537116024 1046966706 /nfs/dbraw/zinc/96/67/06/1046966706.db2.gz DOGUHPFWWKSYNQ-JOCHJYFZSA-N 2 1 349.478 4.382 20 0 EIADMP COc1ccccc1C[N@H+](Cc1cccs1)CC1CC[NH+](C)CC1 ZINC000788473889 1047197363 /nfs/dbraw/zinc/19/73/63/1047197363.db2.gz LZSAVTVQIROWTE-UHFFFAOYSA-N 2 1 344.524 4.101 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000537406726 1047199450 /nfs/dbraw/zinc/19/94/50/1047199450.db2.gz IAAGTFBSTJYNCM-UVUJQTEASA-N 2 1 344.543 4.080 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1cc[nH]c(=O)c1 ZINC000788530231 1047229238 /nfs/dbraw/zinc/22/92/38/1047229238.db2.gz WQMDQLIXXPNGJY-IAGOWNOFSA-N 2 1 339.483 4.012 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000556052699 1047417345 /nfs/dbraw/zinc/41/73/45/1047417345.db2.gz KWODHMSWKAOPGL-VQTJNVASSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000556052699 1047417350 /nfs/dbraw/zinc/41/73/50/1047417350.db2.gz KWODHMSWKAOPGL-VQTJNVASSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000556052697 1047418054 /nfs/dbraw/zinc/41/80/54/1047418054.db2.gz KWODHMSWKAOPGL-UXHICEINSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000556052697 1047418063 /nfs/dbraw/zinc/41/80/63/1047418063.db2.gz KWODHMSWKAOPGL-UXHICEINSA-N 2 1 328.887 4.308 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556076013 1047433493 /nfs/dbraw/zinc/43/34/93/1047433493.db2.gz HUNBFIGTEPIXGK-RTWAWAEBSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556076013 1047433504 /nfs/dbraw/zinc/43/35/04/1047433504.db2.gz HUNBFIGTEPIXGK-RTWAWAEBSA-N 2 1 338.495 4.189 20 0 EIADMP CCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1F ZINC000556077752 1047434066 /nfs/dbraw/zinc/43/40/66/1047434066.db2.gz ZXROQWKXCYGVHG-AZUAARDMSA-N 2 1 342.458 4.150 20 0 EIADMP CCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1F ZINC000556077752 1047434076 /nfs/dbraw/zinc/43/40/76/1047434076.db2.gz ZXROQWKXCYGVHG-AZUAARDMSA-N 2 1 342.458 4.150 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)CC1 ZINC000129635450 1047452348 /nfs/dbraw/zinc/45/23/48/1047452348.db2.gz GHCSOOPSNOCAJG-IBGZPJMESA-N 2 1 328.500 4.287 20 0 EIADMP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000129671816 1047461598 /nfs/dbraw/zinc/46/15/98/1047461598.db2.gz VUDBNJSRIAWOFP-GFCCVEGCSA-N 2 1 327.299 4.141 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@H]2[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000129754318 1047500930 /nfs/dbraw/zinc/50/09/30/1047500930.db2.gz ZVDGAYLDCXNRIA-FXAWDEMLSA-N 2 1 340.511 4.287 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+](C)C2CCCCC2)CC[N@H+]1C ZINC000129862438 1047519170 /nfs/dbraw/zinc/51/91/70/1047519170.db2.gz RWYWXPRYSIXQFK-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862438 1047519181 /nfs/dbraw/zinc/51/91/81/1047519181.db2.gz RWYWXPRYSIXQFK-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862438 1047519187 /nfs/dbraw/zinc/51/91/87/1047519187.db2.gz RWYWXPRYSIXQFK-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCN1C ZINC000129862438 1047519197 /nfs/dbraw/zinc/51/91/97/1047519197.db2.gz RWYWXPRYSIXQFK-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCN1C ZINC000129862438 1047519206 /nfs/dbraw/zinc/51/92/06/1047519206.db2.gz RWYWXPRYSIXQFK-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@@H](NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000129862438 1047519214 /nfs/dbraw/zinc/51/92/14/1047519214.db2.gz RWYWXPRYSIXQFK-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@@H](NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@H+]1C ZINC000129862438 1047519222 /nfs/dbraw/zinc/51/92/22/1047519222.db2.gz RWYWXPRYSIXQFK-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@@H](NCc2ccccc2C[N@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862438 1047519231 /nfs/dbraw/zinc/51/92/31/1047519231.db2.gz RWYWXPRYSIXQFK-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@@H](NCc2ccccc2C[N@@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862438 1047519236 /nfs/dbraw/zinc/51/92/36/1047519236.db2.gz RWYWXPRYSIXQFK-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)[C@@H]1CCOC1 ZINC000129870453 1047521008 /nfs/dbraw/zinc/52/10/08/1047521008.db2.gz JVLZYAAJTGNTJR-IRLDBZIGSA-N 2 1 344.543 4.356 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2cc(F)c(F)c(F)c2)C[C@@H]1c1ccccc1 ZINC000556167965 1047525288 /nfs/dbraw/zinc/52/52/88/1047525288.db2.gz ZLJOYEUSEKNBJO-QFBILLFUSA-N 2 1 348.412 4.072 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2cc(F)c(F)c(F)c2)C[C@@H]1c1ccccc1 ZINC000556167965 1047525303 /nfs/dbraw/zinc/52/53/03/1047525303.db2.gz ZLJOYEUSEKNBJO-QFBILLFUSA-N 2 1 348.412 4.072 20 0 EIADMP CC[NH+](CC)CCC[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556407831 1047739912 /nfs/dbraw/zinc/73/99/12/1047739912.db2.gz OYZSABPYSJKSNA-UHFFFAOYSA-N 2 1 337.920 4.285 20 0 EIADMP Cc1ccc([C@H](O)C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)cc1 ZINC000763432488 1047746986 /nfs/dbraw/zinc/74/69/86/1047746986.db2.gz MBSRKARZGUVNEJ-SIKLNZKXSA-N 2 1 344.543 4.005 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCCOc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000550644326 1047798389 /nfs/dbraw/zinc/79/83/89/1047798389.db2.gz QXWFJWPGUVQKII-FPOVZHCZSA-N 2 1 342.458 4.020 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCOc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000550644326 1047798399 /nfs/dbraw/zinc/79/83/99/1047798399.db2.gz QXWFJWPGUVQKII-FPOVZHCZSA-N 2 1 342.458 4.020 20 0 EIADMP Cc1ccccc1C1(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000550642811 1047801181 /nfs/dbraw/zinc/80/11/81/1047801181.db2.gz UUDYDAFVFBNORL-UNMCSNQZSA-N 2 1 334.507 4.452 20 0 EIADMP Cc1ccccc1C1(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000550642811 1047801184 /nfs/dbraw/zinc/80/11/84/1047801184.db2.gz UUDYDAFVFBNORL-UNMCSNQZSA-N 2 1 334.507 4.452 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)[C@H](C)c1ccccc1C(F)(F)F ZINC000824988012 1048016416 /nfs/dbraw/zinc/01/64/16/1048016416.db2.gz GAFOGGJIRFEOCB-BLNMRFBMSA-N 2 1 340.433 4.412 20 0 EIADMP CC[NH+]1CCC([N@H+](C)[C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171082807 1048072788 /nfs/dbraw/zinc/07/27/88/1048072788.db2.gz NSHUMHYCFVREFU-INIZCTEOSA-N 2 1 341.326 4.267 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)[C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171082807 1048072805 /nfs/dbraw/zinc/07/28/05/1048072805.db2.gz NSHUMHYCFVREFU-INIZCTEOSA-N 2 1 341.326 4.267 20 0 EIADMP CCCC(C[NH3+])(CCC)[NH2+][C@H](C)Cc1ccc(Br)cc1 ZINC001246495518 1048175178 /nfs/dbraw/zinc/17/51/78/1048175178.db2.gz LDPYQJXVSMWSPT-CQSZACIVSA-N 2 1 341.337 4.267 20 0 EIADMP C[N@@H+](Cc1csc(Cc2ccc(Cl)cc2)n1)C1CCC([NH3+])CC1 ZINC000844221132 1048225172 /nfs/dbraw/zinc/22/51/72/1048225172.db2.gz WCSLEUFQCMXQGF-UHFFFAOYSA-N 2 1 349.931 4.089 20 0 EIADMP CCn1c2ccccc2nc1[C@H]1CCC[N@H+]1CCCCCCC[NH3+] ZINC000844221942 1048225889 /nfs/dbraw/zinc/22/58/89/1048225889.db2.gz OSHKXHSAYDNMMN-LJQANCHMSA-N 2 1 328.504 4.102 20 0 EIADMP CCCCCC[C@H](CC)n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001170592880 1048588546 /nfs/dbraw/zinc/58/85/46/1048588546.db2.gz NGOWBDHKRKLPOR-KRWDZBQOSA-N 2 1 334.552 4.291 20 0 EIADMP C[N@@H+](Cc1cccc2cc[nH]c21)C1CC[NH+](C2CCCCC2)CC1 ZINC001144721354 1048831823 /nfs/dbraw/zinc/83/18/23/1048831823.db2.gz IERNNLDJLFFDHG-UHFFFAOYSA-N 2 1 325.500 4.397 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000236810765 1048856009 /nfs/dbraw/zinc/85/60/09/1048856009.db2.gz GBKMJZGUVAWWKY-MRXNPFEDSA-N 2 1 330.447 4.216 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000236810765 1048856014 /nfs/dbraw/zinc/85/60/14/1048856014.db2.gz GBKMJZGUVAWWKY-MRXNPFEDSA-N 2 1 330.447 4.216 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cnc(C3CCC3)s2)CC1 ZINC000134173603 1048891973 /nfs/dbraw/zinc/89/19/73/1048891973.db2.gz KDOAIOZDGIHCHO-UHFFFAOYSA-N 2 1 335.561 4.355 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1csc(-c2ccccc2)n1 ZINC000817948196 1049064897 /nfs/dbraw/zinc/06/48/97/1049064897.db2.gz GCFTXEBQSAHTEL-HNNXBMFYSA-N 2 1 337.492 4.162 20 0 EIADMP COc1cc([C@@H](C)[NH2+][C@@H](C[NH3+])CC(C)C)ccc1SC(F)F ZINC000817958191 1049067566 /nfs/dbraw/zinc/06/75/66/1049067566.db2.gz INHRBFAXTGRZCA-DGCLKSJQSA-N 2 1 332.460 4.034 20 0 EIADMP CCCC[C@H](C[NH3+])[NH2+]C1CCC(O)(c2ccc(C(C)C)cc2)CC1 ZINC000817962376 1049070860 /nfs/dbraw/zinc/07/08/60/1049070860.db2.gz IUXWPCLJNVSTCR-NYLDSWQDSA-N 2 1 332.532 4.047 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cccc(Cl)c2C1 ZINC001170916749 1049215173 /nfs/dbraw/zinc/21/51/73/1049215173.db2.gz PEJQYIPSDZAWRY-BZSNNMDCSA-N 2 1 334.935 4.425 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C[C@H](O)c1ccccc1Cl ZINC000818960344 1049216182 /nfs/dbraw/zinc/21/61/82/1049216182.db2.gz BMWLACSRQNRNRY-FQEVSTJZSA-N 2 1 346.902 4.003 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)C[C@@H]1c1ccccc1 ZINC000517045143 1049374655 /nfs/dbraw/zinc/37/46/55/1049374655.db2.gz UQDGZIRZQCGVKR-ZHHKINOHSA-N 2 1 338.470 4.497 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)C[C@@H]1c1ccccc1 ZINC000517045143 1049374670 /nfs/dbraw/zinc/37/46/70/1049374670.db2.gz UQDGZIRZQCGVKR-ZHHKINOHSA-N 2 1 338.470 4.497 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1ccc2c(c1)OCCCO2)C(C)C ZINC000348093965 1049424757 /nfs/dbraw/zinc/42/47/57/1049424757.db2.gz VQDKIMUDKMMXEK-QGZVFWFLSA-N 2 1 334.504 4.007 20 0 EIADMP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1 ZINC000820836052 1049566299 /nfs/dbraw/zinc/56/62/99/1049566299.db2.gz IZFYUQIMOOCFGF-XMSQKQJNSA-N 2 1 337.511 4.132 20 0 EIADMP Fc1cc(F)c2c(c1)C[C@@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001171381932 1049575802 /nfs/dbraw/zinc/57/58/02/1049575802.db2.gz VZKRYRLXMKFBAI-OALUTQOASA-N 2 1 348.481 4.163 20 0 EIADMP Fc1cc(F)c2c(c1)C[C@@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001171381932 1049575815 /nfs/dbraw/zinc/57/58/15/1049575815.db2.gz VZKRYRLXMKFBAI-OALUTQOASA-N 2 1 348.481 4.163 20 0 EIADMP Fc1cccc2c1CC[C@@H](N1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001171421104 1049658959 /nfs/dbraw/zinc/65/89/59/1049658959.db2.gz CLHIRPOORNSGNI-LJQANCHMSA-N 2 1 342.502 4.023 20 0 EIADMP Fc1cccc2c1CC[C@@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001171421104 1049658972 /nfs/dbraw/zinc/65/89/72/1049658972.db2.gz CLHIRPOORNSGNI-LJQANCHMSA-N 2 1 342.502 4.023 20 0 EIADMP Fc1cccc2c1CC[C@@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001171421104 1049658988 /nfs/dbraw/zinc/65/89/88/1049658988.db2.gz CLHIRPOORNSGNI-LJQANCHMSA-N 2 1 342.502 4.023 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)C[C@H]1C)C2 ZINC001171563880 1049756062 /nfs/dbraw/zinc/75/60/62/1049756062.db2.gz OISKXLRSWMYDSS-WNOPAQSVSA-N 2 1 348.534 4.353 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)C[C@H]1C)C2 ZINC001171563880 1049756067 /nfs/dbraw/zinc/75/60/67/1049756067.db2.gz OISKXLRSWMYDSS-WNOPAQSVSA-N 2 1 348.534 4.353 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@@H](c2ccc(Cl)cn2)C2CC2)CC1(C)C ZINC001171630364 1049761611 /nfs/dbraw/zinc/76/16/11/1049761611.db2.gz OHZHVUSMVZOEAD-QGZVFWFLSA-N 2 1 335.923 4.427 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2cc(Br)cs2)CC1(C)C ZINC001171613775 1049765069 /nfs/dbraw/zinc/76/50/69/1049765069.db2.gz PVIXWMSQFIZETR-UHFFFAOYSA-N 2 1 345.350 4.252 20 0 EIADMP Cc1ccc(CC[C@@H](C)N(c2[nH+]cccc2C)C2CC[NH2+]CC2)cc1 ZINC001171682880 1049777011 /nfs/dbraw/zinc/77/70/11/1049777011.db2.gz XVDNOTNMHZEOHJ-LJQANCHMSA-N 2 1 337.511 4.278 20 0 EIADMP COc1cccc([C@@H]2CC[N@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)c1 ZINC001171641330 1049779019 /nfs/dbraw/zinc/77/90/19/1049779019.db2.gz OVMQNEQJSJFDNV-QGZVFWFLSA-N 2 1 330.516 4.136 20 0 EIADMP Cc1ccc2c(CC[NH3+])cn([C@@H]3C[C@@H](C)[N@H+](Cc4ccccc4)C3)c2c1 ZINC001171724863 1049784932 /nfs/dbraw/zinc/78/49/32/1049784932.db2.gz DBGBJUKWAUSABI-WIYYLYMNSA-N 2 1 347.506 4.286 20 0 EIADMP Cc1ccc2c(CC[NH3+])cn([C@H]3C[C@H](C)[N@H+](Cc4ccccc4)C3)c2c1 ZINC001171724862 1049785811 /nfs/dbraw/zinc/78/58/11/1049785811.db2.gz DBGBJUKWAUSABI-RXVVDRJESA-N 2 1 347.506 4.286 20 0 EIADMP C[NH2+]CCc1cn([C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171760335 1049792647 /nfs/dbraw/zinc/79/26/47/1049792647.db2.gz UDOQZCXTVGNIOX-RXVVDRJESA-N 2 1 347.506 4.239 20 0 EIADMP C[C@H]1C[C@@H](NC(=[NH2+])c2cccc3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC001171733924 1049799767 /nfs/dbraw/zinc/79/97/67/1049799767.db2.gz KEAHRFUYTXSYHN-FXAWDEMLSA-N 2 1 343.474 4.418 20 0 EIADMP C[C@H]1C[C@@H](NC(=[NH2+])c2cccc3ccccc32)C[N@H+]1Cc1ccccc1 ZINC001171733924 1049799775 /nfs/dbraw/zinc/79/97/75/1049799775.db2.gz KEAHRFUYTXSYHN-FXAWDEMLSA-N 2 1 343.474 4.418 20 0 EIADMP C[C@@]1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCS1 ZINC000245686788 1049825760 /nfs/dbraw/zinc/82/57/60/1049825760.db2.gz JQRNVYDRXVKTCH-HAGHYFMRSA-N 2 1 330.541 4.057 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCc2ccsc2)CC[N@H+]1Cc1ccccc1 ZINC001171969145 1049833516 /nfs/dbraw/zinc/83/35/16/1049833516.db2.gz UBPOKTLIPPIYKJ-LJQANCHMSA-N 2 1 328.525 4.323 20 0 EIADMP C[C@@H](CCCC(C)(C)O)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171972621 1049834361 /nfs/dbraw/zinc/83/43/61/1049834361.db2.gz RRDFWUDAAWBPHJ-ICSRJNTNSA-N 2 1 346.559 4.349 20 0 EIADMP CC1(C)C[C@@H](n2cnc3cccc(C[NH3+])c32)CC[N@H+]1Cc1ccccc1 ZINC001171973878 1049835801 /nfs/dbraw/zinc/83/58/01/1049835801.db2.gz AEEBRLCQZHCHPF-IBGZPJMESA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCOC2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001171977209 1049837633 /nfs/dbraw/zinc/83/76/33/1049837633.db2.gz YORZTVBXUWGHEV-HXUWFJFHSA-N 2 1 344.543 4.369 20 0 EIADMP Cc1ncsc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980611 1049838272 /nfs/dbraw/zinc/83/82/72/1049838272.db2.gz WAOHHXGTOQJFNN-GOSISDBHSA-N 2 1 343.540 4.027 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CC2Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001171979043 1049838644 /nfs/dbraw/zinc/83/86/44/1049838644.db2.gz KMTYVMWTXUZCDI-QHCPKHFHSA-N 2 1 348.534 4.434 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2CCCc3ncccc32)CC[N@H+]1Cc1ccccc1 ZINC001171982334 1049839045 /nfs/dbraw/zinc/83/90/45/1049839045.db2.gz HJOUFBCACLODOJ-DENIHFKCSA-N 2 1 349.522 4.492 20 0 EIADMP CCC[N@H+](C1CCOCC1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985809 1049840391 /nfs/dbraw/zinc/84/03/91/1049840391.db2.gz BVTHSKVYTNVKBI-OAQYLSRUSA-N 2 1 344.543 4.321 20 0 EIADMP CCC[N@@H+](C1CCOCC1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985809 1049840394 /nfs/dbraw/zinc/84/03/94/1049840394.db2.gz BVTHSKVYTNVKBI-OAQYLSRUSA-N 2 1 344.543 4.321 20 0 EIADMP CCC[NH+](C1CCOCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985809 1049840397 /nfs/dbraw/zinc/84/03/97/1049840397.db2.gz BVTHSKVYTNVKBI-OAQYLSRUSA-N 2 1 344.543 4.321 20 0 EIADMP CCC[NH+](C1CCOCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985809 1049840399 /nfs/dbraw/zinc/84/03/99/1049840399.db2.gz BVTHSKVYTNVKBI-OAQYLSRUSA-N 2 1 344.543 4.321 20 0 EIADMP C[N@@H+](CCc1ccncc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074723 1049844999 /nfs/dbraw/zinc/84/49/99/1049844999.db2.gz LHVISXUEMLNOIP-JKHIJQBDSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1ccncc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172074723 1049845006 /nfs/dbraw/zinc/84/50/06/1049845006.db2.gz LHVISXUEMLNOIP-JKHIJQBDSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1ccncc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172074723 1049845009 /nfs/dbraw/zinc/84/50/09/1049845009.db2.gz LHVISXUEMLNOIP-JKHIJQBDSA-N 2 1 349.522 4.142 20 0 EIADMP C[C@@H](Cc1cccs1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245770352 1049853010 /nfs/dbraw/zinc/85/30/10/1049853010.db2.gz XEBGOLFGCFCYGV-FFGOWVMKSA-N 2 1 340.536 4.464 20 0 EIADMP C[N@@H+](Cc1cccc(OC(F)(F)F)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172133274 1049855015 /nfs/dbraw/zinc/85/50/15/1049855015.db2.gz QWSRSCYICAQJPO-MUJYYYPQSA-N 2 1 342.405 4.032 20 0 EIADMP C[NH+](Cc1cccc(OC(F)(F)F)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172133274 1049855019 /nfs/dbraw/zinc/85/50/19/1049855019.db2.gz QWSRSCYICAQJPO-MUJYYYPQSA-N 2 1 342.405 4.032 20 0 EIADMP C[NH+](Cc1cccc(OC(F)(F)F)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172133274 1049855022 /nfs/dbraw/zinc/85/50/22/1049855022.db2.gz QWSRSCYICAQJPO-MUJYYYPQSA-N 2 1 342.405 4.032 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1ccc(Cl)c(Cl)c1)C2 ZINC001172103123 1049855637 /nfs/dbraw/zinc/85/56/37/1049855637.db2.gz SEEYHHSUAYRGKP-QDMKHBRRSA-N 2 1 327.299 4.141 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cnc(-c3cccs3)s2)[C@@H](C)C1 ZINC000245799480 1049856858 /nfs/dbraw/zinc/85/68/58/1049856858.db2.gz XOICAUXEWHXHJJ-ZFWWWQNUSA-N 2 1 335.542 4.034 20 0 EIADMP CN(Cc1ccc(Cl)cc1Cl)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172112776 1049857420 /nfs/dbraw/zinc/85/74/20/1049857420.db2.gz FESJTKFZHUUUBZ-ZSHCYNCHSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@H+](Cc1ccc(Cl)cc1Cl)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172112776 1049857422 /nfs/dbraw/zinc/85/74/22/1049857422.db2.gz FESJTKFZHUUUBZ-ZSHCYNCHSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)cc1Cl)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172112776 1049857429 /nfs/dbraw/zinc/85/74/29/1049857429.db2.gz FESJTKFZHUUUBZ-ZSHCYNCHSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1ccc(Cl)cc1Cl)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172112776 1049857431 /nfs/dbraw/zinc/85/74/31/1049857431.db2.gz FESJTKFZHUUUBZ-ZSHCYNCHSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1ccc(Cl)cc1Cl)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172112776 1049857435 /nfs/dbraw/zinc/85/74/35/1049857435.db2.gz FESJTKFZHUUUBZ-ZSHCYNCHSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](n1c3ccc(Cl)cc3c3c1CC[NH2+]C3)C2 ZINC001172120163 1049858481 /nfs/dbraw/zinc/85/84/81/1049858481.db2.gz DMCFADXUKJTXMD-MUJYYYPQSA-N 2 1 343.902 4.128 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(c3nc4ccccc4o3)CC1)C2 ZINC001172113989 1049859010 /nfs/dbraw/zinc/85/90/10/1049859010.db2.gz NHVOOIIOMKIPEM-BCDXTJNWSA-N 2 1 339.483 4.023 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(c3nc4ccccc4o3)CC1)C2 ZINC001172113989 1049859014 /nfs/dbraw/zinc/85/90/14/1049859014.db2.gz NHVOOIIOMKIPEM-BCDXTJNWSA-N 2 1 339.483 4.023 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccc1)C1CCSCC1)C2 ZINC001172123385 1049859053 /nfs/dbraw/zinc/85/90/53/1049859053.db2.gz CFDGTOLMNNUWNG-AERCQKQUSA-N 2 1 344.568 4.400 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccc1)C1CCSCC1)C2 ZINC001172123385 1049859055 /nfs/dbraw/zinc/85/90/55/1049859055.db2.gz CFDGTOLMNNUWNG-AERCQKQUSA-N 2 1 344.568 4.400 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+](Cc1ccccc1)C1CCSCC1)C2 ZINC001172123385 1049859060 /nfs/dbraw/zinc/85/90/60/1049859060.db2.gz CFDGTOLMNNUWNG-AERCQKQUSA-N 2 1 344.568 4.400 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+](Cc1ccccc1)C1CCSCC1)C2 ZINC001172123385 1049859064 /nfs/dbraw/zinc/85/90/64/1049859064.db2.gz CFDGTOLMNNUWNG-AERCQKQUSA-N 2 1 344.568 4.400 20 0 EIADMP C[N@@H+](Cc1ccccc1C(F)(F)F)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172124219 1049859783 /nfs/dbraw/zinc/85/97/83/1049859783.db2.gz JNXPDKIXEMJQLE-ZSHCYNCHSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1ccccc1C(F)(F)F)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172124219 1049859786 /nfs/dbraw/zinc/85/97/86/1049859786.db2.gz JNXPDKIXEMJQLE-ZSHCYNCHSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1ccccc1C(F)(F)F)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172124219 1049859788 /nfs/dbraw/zinc/85/97/88/1049859788.db2.gz JNXPDKIXEMJQLE-ZSHCYNCHSA-N 2 1 326.406 4.153 20 0 EIADMP c1ccc2c(c1)C[C@@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CS2 ZINC001172203694 1049863692 /nfs/dbraw/zinc/86/36/92/1049863692.db2.gz VDCHGTQUHDFXGG-RBUKOAKNSA-N 2 1 330.541 4.044 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CSc2ccccc2C1 ZINC001172206329 1049864783 /nfs/dbraw/zinc/86/47/83/1049864783.db2.gz ONPOOHUOZSJKIU-FHWLQOOXSA-N 2 1 330.541 4.042 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@@H]1CSc2ccccc2C1 ZINC001172206329 1049864784 /nfs/dbraw/zinc/86/47/84/1049864784.db2.gz ONPOOHUOZSJKIU-FHWLQOOXSA-N 2 1 330.541 4.042 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@@H]1CSc2ccccc2C1 ZINC001172206329 1049864787 /nfs/dbraw/zinc/86/47/87/1049864787.db2.gz ONPOOHUOZSJKIU-FHWLQOOXSA-N 2 1 330.541 4.042 20 0 EIADMP COCCC[NH+]1CCC([NH2+][C@H](CC2CCC2)c2ccccc2F)CC1 ZINC001172248481 1049871922 /nfs/dbraw/zinc/87/19/22/1049871922.db2.gz KATJZQZVAKKDON-OAQYLSRUSA-N 2 1 348.506 4.148 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2c(Cl)cccc2C1 ZINC001171031398 1049876118 /nfs/dbraw/zinc/87/61/18/1049876118.db2.gz WLVWRHLVJKGAMS-KZNAEPCWSA-N 2 1 334.935 4.425 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)C[C@H]1C ZINC001172381012 1049886021 /nfs/dbraw/zinc/88/60/21/1049886021.db2.gz ZSPZFTBVVNIWFL-SBHAEUEKSA-N 2 1 341.543 4.194 20 0 EIADMP CC[C@H](CC(C)C)[NH2+]C1CC[NH+](CCc2ccc(OC)cc2)CC1 ZINC001172394336 1049905612 /nfs/dbraw/zinc/90/56/12/1049905612.db2.gz RLOOQOPFPBOVFQ-LJQANCHMSA-N 2 1 332.532 4.116 20 0 EIADMP CC(C)COCC[C@@H](C)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C ZINC001172470548 1049909205 /nfs/dbraw/zinc/90/92/05/1049909205.db2.gz ZKHUCUVTMGGRGX-SJBKTWHCSA-N 2 1 346.559 4.185 20 0 EIADMP [NH3+]C1(c2cccnc2)CC[NH+]([C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172537404 1049943876 /nfs/dbraw/zinc/94/38/76/1049943876.db2.gz POYGGFPBSKIWPJ-CTNGQTDRSA-N 2 1 335.495 4.058 20 0 EIADMP [NH3+][C@H]1CC[N@H+](Cc2ccccc2Oc2cccc(Cl)c2)CC[C@@H]1F ZINC001206174475 1049970779 /nfs/dbraw/zinc/97/07/79/1049970779.db2.gz NFBYGAVVGAUBSW-ROUUACIJSA-N 2 1 348.849 4.394 20 0 EIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccccc2Oc2cccc(Cl)c2)CC[C@@H]1F ZINC001206174475 1049970786 /nfs/dbraw/zinc/97/07/86/1049970786.db2.gz NFBYGAVVGAUBSW-ROUUACIJSA-N 2 1 348.849 4.394 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H](C)c2nc3ccccc3s2)C1 ZINC000247000605 1050009357 /nfs/dbraw/zinc/00/93/57/1050009357.db2.gz KRQPFRGJNKNSJB-BZUAXINKSA-N 2 1 331.529 4.110 20 0 EIADMP CCOc1ccc([C@H](N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c2ccccc2)cc1 ZINC000247161675 1050016237 /nfs/dbraw/zinc/01/62/37/1050016237.db2.gz XUPHMEKJOBVXRJ-RBDMOPTHSA-N 2 1 338.495 4.247 20 0 EIADMP CCOc1ccc([C@H]([NH2+][C@H]2CCN(C)[C@@H](C)C2)c2ccccc2)cc1 ZINC000247161675 1050016243 /nfs/dbraw/zinc/01/62/43/1050016243.db2.gz XUPHMEKJOBVXRJ-RBDMOPTHSA-N 2 1 338.495 4.247 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccncc1 ZINC000247487642 1050025586 /nfs/dbraw/zinc/02/55/86/1050025586.db2.gz VJZAOXZMVVYRPW-CEXWTWQISA-N 2 1 337.511 4.410 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc1 ZINC000247983756 1050038849 /nfs/dbraw/zinc/03/88/49/1050038849.db2.gz IPPUPIQEFLIDHE-RIFZZMRRSA-N 2 1 344.524 4.490 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cc1 ZINC000247983756 1050038856 /nfs/dbraw/zinc/03/88/56/1050038856.db2.gz IPPUPIQEFLIDHE-RIFZZMRRSA-N 2 1 344.524 4.490 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000248198214 1050046313 /nfs/dbraw/zinc/04/63/13/1050046313.db2.gz XTWIDUMWLIBJAB-RZQQEMMASA-N 2 1 344.524 4.490 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000248198214 1050046318 /nfs/dbraw/zinc/04/63/18/1050046318.db2.gz XTWIDUMWLIBJAB-RZQQEMMASA-N 2 1 344.524 4.490 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cnn1C(C)(C)C ZINC000248707733 1050073474 /nfs/dbraw/zinc/07/34/74/1050073474.db2.gz PFQAEXCXOFXGEE-BQFCYCMXSA-N 2 1 346.563 4.250 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cnn1C(C)(C)C ZINC000248707733 1050073483 /nfs/dbraw/zinc/07/34/83/1050073483.db2.gz PFQAEXCXOFXGEE-BQFCYCMXSA-N 2 1 346.563 4.250 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)CCS2 ZINC000248893055 1050082786 /nfs/dbraw/zinc/08/27/86/1050082786.db2.gz ZGNYFVITIOGBBW-LPHOPBHVSA-N 2 1 348.556 4.190 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](C)c2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000249137883 1050093860 /nfs/dbraw/zinc/09/38/60/1050093860.db2.gz XENCLJLFTDPAAX-ZQIUZPCESA-N 2 1 328.422 4.129 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C2CC2)[C@@H]2CCCCO2)cc1 ZINC000655789074 1050097994 /nfs/dbraw/zinc/09/79/94/1050097994.db2.gz VFPXBBGCDBOYDC-JHVJFLLYSA-N 2 1 339.483 4.179 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001172824065 1050164604 /nfs/dbraw/zinc/16/46/04/1050164604.db2.gz PSJALJJCOITNKC-QHCPKHFHSA-N 2 1 334.507 4.107 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc3ncccc3c2)C1 ZINC001177290923 1050177296 /nfs/dbraw/zinc/17/72/96/1050177296.db2.gz ZNMWOQZJKSCOQE-HDICACEKSA-N 2 1 325.500 4.083 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1csc(Br)c1 ZINC001177299147 1050179873 /nfs/dbraw/zinc/17/98/73/1050179873.db2.gz LAFJZRFRBSIZTR-ZDUSSCGKSA-N 2 1 345.350 4.255 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2cc(F)cc(F)c2)C1 ZINC001177261383 1050183903 /nfs/dbraw/zinc/18/39/03/1050183903.db2.gz CFBITXDBCVKORT-INIZCTEOSA-N 2 1 344.449 4.487 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cnc3ccsc3c2)C1 ZINC000090585741 1050186532 /nfs/dbraw/zinc/18/65/32/1050186532.db2.gz ICLXUSJAOKYSIV-JKSUJKDBSA-N 2 1 331.529 4.315 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cnc3ccsc3c2)C1 ZINC000090585743 1050188021 /nfs/dbraw/zinc/18/80/21/1050188021.db2.gz ICLXUSJAOKYSIV-HOTGVXAUSA-N 2 1 331.529 4.315 20 0 EIADMP C[C@@H]1C[N@H+](Cc2cccc(C[NH2+]C3CCC4(CCC4)CC3)c2)CCO1 ZINC001177454825 1050213330 /nfs/dbraw/zinc/21/33/30/1050213330.db2.gz ZKTZCJIBIRXSFI-GOSISDBHSA-N 2 1 342.527 4.110 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH2+]C3CCC4(CCC4)CC3)c2)CCO1 ZINC001177454825 1050213345 /nfs/dbraw/zinc/21/33/45/1050213345.db2.gz ZKTZCJIBIRXSFI-GOSISDBHSA-N 2 1 342.527 4.110 20 0 EIADMP COc1ccc(CC[C@@H](C)[NH2+]CC(C)(C)[N@@H+]2CCC[C@H](C)C2)cc1 ZINC001177483486 1050224359 /nfs/dbraw/zinc/22/43/59/1050224359.db2.gz UIWLSEXDLPHBAY-ZWKOTPCHSA-N 2 1 332.532 4.116 20 0 EIADMP COc1ccc(CC[C@@H](C)[NH2+]CC(C)(C)[N@H+]2CCC[C@H](C)C2)cc1 ZINC001177483486 1050224369 /nfs/dbraw/zinc/22/43/69/1050224369.db2.gz UIWLSEXDLPHBAY-ZWKOTPCHSA-N 2 1 332.532 4.116 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+]CC(C)(C)[N@@H+]2CCC[C@H](C)C2)cc1 ZINC001177483485 1050224862 /nfs/dbraw/zinc/22/48/62/1050224862.db2.gz UIWLSEXDLPHBAY-ROUUACIJSA-N 2 1 332.532 4.116 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+]CC(C)(C)[N@H+]2CCC[C@H](C)C2)cc1 ZINC001177483485 1050224876 /nfs/dbraw/zinc/22/48/76/1050224876.db2.gz UIWLSEXDLPHBAY-ROUUACIJSA-N 2 1 332.532 4.116 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@@H](C)CC3)CC2)cs1 ZINC001177855426 1050316486 /nfs/dbraw/zinc/31/64/86/1050316486.db2.gz VTPXUUUDOZSMJC-SJLPKXTDSA-N 2 1 349.588 4.476 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)[C@@H]2CCc3ncsc3C2)CC1 ZINC001173125808 1050319733 /nfs/dbraw/zinc/31/97/33/1050319733.db2.gz HZYZFERAWHBGOJ-KZNAEPCWSA-N 2 1 347.572 4.153 20 0 EIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)ccc2C(F)(F)F)CC1 ZINC001206311257 1050335375 /nfs/dbraw/zinc/33/53/75/1050335375.db2.gz LHWMRYRKLHGIHB-OAHLLOKOSA-N 2 1 334.813 4.310 20 0 EIADMP CCC(CC)[N@@H+]1CC[C@H]([NH2+]C2CCC(Oc3ccccc3)CC2)C1 ZINC001173199122 1050342002 /nfs/dbraw/zinc/34/20/02/1050342002.db2.gz TYOMGWYONFFKLF-WBTXTPOCSA-N 2 1 330.516 4.229 20 0 EIADMP CCC(CC)[N@H+]1CC[C@H]([NH2+]C2CCC(Oc3ccccc3)CC2)C1 ZINC001173199122 1050342015 /nfs/dbraw/zinc/34/20/15/1050342015.db2.gz TYOMGWYONFFKLF-WBTXTPOCSA-N 2 1 330.516 4.229 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173198020 1050343163 /nfs/dbraw/zinc/34/31/63/1050343163.db2.gz PPVGTNDVSYBVKF-JCIQBNCYSA-N 2 1 342.527 4.359 20 0 EIADMP CC[NH+](CC)c1ccc(Nc2cccc(N3CC[NH+](C)CC3)c2)cc1 ZINC001212713812 1050353644 /nfs/dbraw/zinc/35/36/44/1050353644.db2.gz LHQZCUYNQIFVHO-UHFFFAOYSA-N 2 1 338.499 4.028 20 0 EIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2OC)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272786 1050391651 /nfs/dbraw/zinc/39/16/51/1050391651.db2.gz WWCPNVZHRMSPLC-AFYVEPGGSA-N 2 1 330.516 4.346 20 0 EIADMP CCc1sc(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)cc1Br ZINC001206317876 1050395873 /nfs/dbraw/zinc/39/58/73/1050395873.db2.gz KETJQLPRCNZLEE-HNNXBMFYSA-N 2 1 345.350 4.024 20 0 EIADMP Cc1cc(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)cc(C)c1Br ZINC001206317868 1050396112 /nfs/dbraw/zinc/39/61/12/1050396112.db2.gz KCDWYSAQOAJKQL-KRWDZBQOSA-N 2 1 339.321 4.017 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC001178249777 1050411016 /nfs/dbraw/zinc/41/10/16/1050411016.db2.gz VBTNLSRYZNJREI-MRXNPFEDSA-N 2 1 342.449 4.471 20 0 EIADMP COCc1c(C)cc(C)c(C[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c1C ZINC001178250007 1050411129 /nfs/dbraw/zinc/41/11/29/1050411129.db2.gz ZLHBRIWGYIOOQS-HXUWFJFHSA-N 2 1 346.559 4.216 20 0 EIADMP C[C@@H]1CCC[C@H](C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)[C@H]1C ZINC001178595462 1050504350 /nfs/dbraw/zinc/50/43/50/1050504350.db2.gz PNOOEISKIODRQO-WSTZPKSXSA-N 2 1 346.534 4.495 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+]C3CCc4ccccc4CC3)C2)cc1 ZINC001178609373 1050518335 /nfs/dbraw/zinc/51/83/35/1050518335.db2.gz GKFRPYXKHZZZBR-FQEVSTJZSA-N 2 1 334.507 4.046 20 0 EIADMP CC(C)(C[N@@H+]1CCCC[C@@](F)(CN)C1)Sc1ccc(Cl)cc1 ZINC001206337672 1050520474 /nfs/dbraw/zinc/52/04/74/1050520474.db2.gz VEAVUEQQAIAQRI-QGZVFWFLSA-N 2 1 344.927 4.364 20 0 EIADMP CC(C)(C[N@H+]1CCCC[C@@](F)(CN)C1)Sc1ccc(Cl)cc1 ZINC001206337672 1050520487 /nfs/dbraw/zinc/52/04/87/1050520487.db2.gz VEAVUEQQAIAQRI-QGZVFWFLSA-N 2 1 344.927 4.364 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000450740967 1050526227 /nfs/dbraw/zinc/52/62/27/1050526227.db2.gz XGNZIOTZYBGJIC-OGWHTMIXSA-N 2 1 336.470 4.168 20 0 EIADMP CC[N@@H+](C)C1CC[NH+](C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173690968 1050543573 /nfs/dbraw/zinc/54/35/73/1050543573.db2.gz CYIGRFBBGSTFFF-UHFFFAOYSA-N 2 1 326.528 4.229 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2coc(-c3ccccc3)n2)c1 ZINC000155538168 1050549547 /nfs/dbraw/zinc/54/95/47/1050549547.db2.gz UNKQVOKSYFVTAD-UHFFFAOYSA-N 2 1 349.478 4.473 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCC[C@H](C4CC4)C3)CC2)cc1 ZINC001178981324 1050592440 /nfs/dbraw/zinc/59/24/40/1050592440.db2.gz GPOVGKLGGTZGFR-SIKLNZKXSA-N 2 1 344.518 4.391 20 0 EIADMP COc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c2ccccc12 ZINC001179257490 1050662895 /nfs/dbraw/zinc/66/28/95/1050662895.db2.gz BJKKZJABILUQAG-SFHVURJKSA-N 2 1 338.495 4.060 20 0 EIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](CC4CCSCC4)CC[C@H]32)cc1 ZINC001179918358 1050833966 /nfs/dbraw/zinc/83/39/66/1050833966.db2.gz BOCCNQXXYRCCIC-LEWJYISDSA-N 2 1 344.568 4.116 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](CC4CCSCC4)CC[C@H]32)cc1 ZINC001179918358 1050833969 /nfs/dbraw/zinc/83/39/69/1050833969.db2.gz BOCCNQXXYRCCIC-LEWJYISDSA-N 2 1 344.568 4.116 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](CC4CCSCC4)CC[C@H]32)cc1 ZINC001179918358 1050833976 /nfs/dbraw/zinc/83/39/76/1050833976.db2.gz BOCCNQXXYRCCIC-LEWJYISDSA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030500 1050859374 /nfs/dbraw/zinc/85/93/74/1050859374.db2.gz NRDOSSHPRXNNBK-ICSRJNTNSA-N 2 1 342.527 4.098 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030500 1050859379 /nfs/dbraw/zinc/85/93/79/1050859379.db2.gz NRDOSSHPRXNNBK-ICSRJNTNSA-N 2 1 342.527 4.098 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030500 1050859383 /nfs/dbraw/zinc/85/93/83/1050859383.db2.gz NRDOSSHPRXNNBK-ICSRJNTNSA-N 2 1 342.527 4.098 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030500 1050859388 /nfs/dbraw/zinc/85/93/88/1050859388.db2.gz NRDOSSHPRXNNBK-ICSRJNTNSA-N 2 1 342.527 4.098 20 0 EIADMP CCc1cccc2cc(C[N@@H+]3CC[C@@H](C[NH+](C)CC4CC4)C3)oc21 ZINC001180083485 1050879464 /nfs/dbraw/zinc/87/94/64/1050879464.db2.gz ZTAPCGUMAAXABS-KRWDZBQOSA-N 2 1 326.484 4.159 20 0 EIADMP CCc1cccc2cc(C[N@H+]3CC[C@@H](C[NH+](C)CC4CC4)C3)oc21 ZINC001180083485 1050879466 /nfs/dbraw/zinc/87/94/66/1050879466.db2.gz ZTAPCGUMAAXABS-KRWDZBQOSA-N 2 1 326.484 4.159 20 0 EIADMP CCc1cccc2cc(C[NH+]3CC[C@@H](C[N@H+](C)CC4CC4)C3)oc21 ZINC001180083485 1050879474 /nfs/dbraw/zinc/87/94/74/1050879474.db2.gz ZTAPCGUMAAXABS-KRWDZBQOSA-N 2 1 326.484 4.159 20 0 EIADMP CCc1cccc2cc(C[NH+]3CC[C@@H](C[N@@H+](C)CC4CC4)C3)oc21 ZINC001180083485 1050879479 /nfs/dbraw/zinc/87/94/79/1050879479.db2.gz ZTAPCGUMAAXABS-KRWDZBQOSA-N 2 1 326.484 4.159 20 0 EIADMP C[NH+](C)CC(C)(C)C[NH2+]Cc1cccc(OCc2ccccc2F)c1 ZINC000619757510 1050884790 /nfs/dbraw/zinc/88/47/90/1050884790.db2.gz HSBLWPRUXMDOAM-UHFFFAOYSA-N 2 1 344.474 4.082 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[N@@H+](C)CCCn1ccnc1 ZINC000572563912 1050907382 /nfs/dbraw/zinc/90/73/82/1050907382.db2.gz REIMWMMKUOMKIA-NTCAYCPXSA-N 2 1 337.389 4.327 20 0 EIADMP Cc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCO[C@H](C)C3)c2)c1 ZINC000153501938 1051060083 /nfs/dbraw/zinc/06/00/83/1051060083.db2.gz RBPJYASZGUNPQP-MOPGFXCFSA-N 2 1 338.495 4.067 20 0 EIADMP Cc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCO[C@H](C)C3)c2)c1 ZINC000153501938 1051060096 /nfs/dbraw/zinc/06/00/96/1051060096.db2.gz RBPJYASZGUNPQP-MOPGFXCFSA-N 2 1 338.495 4.067 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000775367604 1051137865 /nfs/dbraw/zinc/13/78/65/1051137865.db2.gz XICNTHGZGRGTOR-KRWDZBQOSA-N 2 1 340.483 4.453 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000775367606 1051138973 /nfs/dbraw/zinc/13/89/73/1051138973.db2.gz XICNTHGZGRGTOR-QGZVFWFLSA-N 2 1 340.483 4.453 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccn1C(F)F ZINC001181153364 1051169569 /nfs/dbraw/zinc/16/95/69/1051169569.db2.gz CIWOSHVXTAKOQL-SFHVURJKSA-N 2 1 347.453 4.274 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccn1C(F)F ZINC001181153364 1051169573 /nfs/dbraw/zinc/16/95/73/1051169573.db2.gz CIWOSHVXTAKOQL-SFHVURJKSA-N 2 1 347.453 4.274 20 0 EIADMP CCC(CC)(C[NH2+][C@H](C)C1CCOCC1)[NH2+][C@H](C)c1ccccc1 ZINC000153896384 1051243980 /nfs/dbraw/zinc/24/39/80/1051243980.db2.gz XXUHAYGVUQGQQE-QZTJIDSGSA-N 2 1 332.532 4.301 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCCSC(C)(C)C)C2)CC1 ZINC001190652298 1051245434 /nfs/dbraw/zinc/24/54/34/1051245434.db2.gz YZIBBRWVEKEZMH-SFHVURJKSA-N 2 1 326.594 4.352 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(Cl)ccc1OCC ZINC001181514317 1051246272 /nfs/dbraw/zinc/24/62/72/1051246272.db2.gz FGMMAKKUAJKVQE-UHFFFAOYSA-N 2 1 349.906 4.410 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(Cl)ccc1OCC ZINC001181514317 1051246278 /nfs/dbraw/zinc/24/62/78/1051246278.db2.gz FGMMAKKUAJKVQE-UHFFFAOYSA-N 2 1 349.906 4.410 20 0 EIADMP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533889 1051247544 /nfs/dbraw/zinc/24/75/44/1051247544.db2.gz COTKAVGURZDTKZ-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533889 1051247557 /nfs/dbraw/zinc/24/75/57/1051247557.db2.gz COTKAVGURZDTKZ-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533889 1051247570 /nfs/dbraw/zinc/24/75/70/1051247570.db2.gz COTKAVGURZDTKZ-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533889 1051247580 /nfs/dbraw/zinc/24/75/80/1051247580.db2.gz COTKAVGURZDTKZ-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000163221426 1051250642 /nfs/dbraw/zinc/25/06/42/1051250642.db2.gz AXVUSPKFOGBSMF-KBPBESRZSA-N 2 1 328.472 4.036 20 0 EIADMP C([C@H]1CCCC12CCOCC2)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190827422 1051285279 /nfs/dbraw/zinc/28/52/79/1051285279.db2.gz PJTAUJRJEHNSQW-NHCUHLMSSA-N 2 1 348.575 4.171 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccc2c(c1)OCO2 ZINC000154845949 1051342314 /nfs/dbraw/zinc/34/23/14/1051342314.db2.gz WYHFSPUZYREFKQ-MRXNPFEDSA-N 2 1 340.467 4.106 20 0 EIADMP C([C@H]1CCC2(CCCCCC2)O1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001191098493 1051349353 /nfs/dbraw/zinc/34/93/53/1051349353.db2.gz CWLBBRDOYPZTJC-VQTJNVASSA-N 2 1 334.548 4.209 20 0 EIADMP CO[C@@H](C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)CC(C)C ZINC001182020672 1051383864 /nfs/dbraw/zinc/38/38/64/1051383864.db2.gz MCDUZBXUXMKYDG-LQCXBHPOSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H](CCc1ccccc1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191233032 1051404058 /nfs/dbraw/zinc/40/40/58/1051404058.db2.gz KEEDDUCXBREVGG-REWPJTCUSA-N 2 1 336.523 4.462 20 0 EIADMP C[C@@H](CCc1ccccc1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001191233032 1051404065 /nfs/dbraw/zinc/40/40/65/1051404065.db2.gz KEEDDUCXBREVGG-REWPJTCUSA-N 2 1 336.523 4.462 20 0 EIADMP C[C@@H](CCc1ccccc1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001191233032 1051404074 /nfs/dbraw/zinc/40/40/74/1051404074.db2.gz KEEDDUCXBREVGG-REWPJTCUSA-N 2 1 336.523 4.462 20 0 EIADMP C/C=C/COc1ccc(CC[C@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC001182248548 1051440164 /nfs/dbraw/zinc/44/01/64/1051440164.db2.gz ACTTZACVUAOEKS-PXODQFSGSA-N 2 1 344.543 4.284 20 0 EIADMP CC(C)CCOCC[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191359274 1051441517 /nfs/dbraw/zinc/44/15/17/1051441517.db2.gz SXKLWBYIMWZHRI-QFIPXVFZSA-N 2 1 344.543 4.037 20 0 EIADMP CC(C)CCOCC[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001191359274 1051441519 /nfs/dbraw/zinc/44/15/19/1051441519.db2.gz SXKLWBYIMWZHRI-QFIPXVFZSA-N 2 1 344.543 4.037 20 0 EIADMP CC(C)CCOCC[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001191359274 1051441524 /nfs/dbraw/zinc/44/15/24/1051441524.db2.gz SXKLWBYIMWZHRI-QFIPXVFZSA-N 2 1 344.543 4.037 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+]CCCCc2cccc(C(F)(F)F)c2)C1 ZINC001182251079 1051443554 /nfs/dbraw/zinc/44/35/54/1051443554.db2.gz LTJIVSLISCBGQP-KRWDZBQOSA-N 2 1 342.449 4.350 20 0 EIADMP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311188769 1051470016 /nfs/dbraw/zinc/47/00/16/1051470016.db2.gz DJWVWNJTRNVTPU-AZUAARDMSA-N 2 1 338.495 4.176 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCOc3cccc(C(C)(C)C)c3)CC[C@H]21 ZINC001191521359 1051471704 /nfs/dbraw/zinc/47/17/04/1051471704.db2.gz PYFYREOFWSGLPC-WIYYLYMNSA-N 2 1 344.543 4.169 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCOc3cccc(C(C)(C)C)c3)CC[C@H]21 ZINC001191521359 1051471710 /nfs/dbraw/zinc/47/17/10/1051471710.db2.gz PYFYREOFWSGLPC-WIYYLYMNSA-N 2 1 344.543 4.169 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCOc3cccc(C(C)(C)C)c3)CC[C@H]21 ZINC001191521359 1051471717 /nfs/dbraw/zinc/47/17/17/1051471717.db2.gz PYFYREOFWSGLPC-WIYYLYMNSA-N 2 1 344.543 4.169 20 0 EIADMP C[C@@H]1C[C@H](C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)C[C@H](C)O1 ZINC001191549589 1051485307 /nfs/dbraw/zinc/48/53/07/1051485307.db2.gz FANKXXQEBVUQQN-BNDYYXHWSA-N 2 1 336.564 4.167 20 0 EIADMP CC(C)c1[nH+]ccn1Cc1cccc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000774280112 1051547354 /nfs/dbraw/zinc/54/73/54/1051547354.db2.gz CPZJNKQFNBUUHI-IHWFROFDSA-N 2 1 338.499 4.092 20 0 EIADMP CC(C)c1[nH+]ccn1Cc1cccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC000774280112 1051547361 /nfs/dbraw/zinc/54/73/61/1051547361.db2.gz CPZJNKQFNBUUHI-IHWFROFDSA-N 2 1 338.499 4.092 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000774376630 1051568164 /nfs/dbraw/zinc/56/81/64/1051568164.db2.gz KHFFJIYTKSQUHK-LLVKDONJSA-N 2 1 330.303 4.101 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000272354311 1051569597 /nfs/dbraw/zinc/56/95/97/1051569597.db2.gz RCBQXHMQMONGAC-ZRGWGRIASA-N 2 1 343.540 4.321 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000774376579 1051570183 /nfs/dbraw/zinc/57/01/83/1051570183.db2.gz LBPALXFPRQREFY-GFCCVEGCSA-N 2 1 344.330 4.347 20 0 EIADMP C[C@@H]([NH2+]C[C@@H](C)c1cccc(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000775490376 1051575639 /nfs/dbraw/zinc/57/56/39/1051575639.db2.gz WQDSGNOVRIZTMU-OPYAIIAOSA-N 2 1 340.486 4.429 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@]1(C)Cc1ccc(Cl)c(F)c1 ZINC001175419012 1051581757 /nfs/dbraw/zinc/58/17/57/1051581757.db2.gz REMZFHYFIGQIBX-LJQANCHMSA-N 2 1 349.881 4.471 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@]1(C)Cc1ccc(Cl)c(F)c1 ZINC001175419012 1051581776 /nfs/dbraw/zinc/58/17/76/1051581776.db2.gz REMZFHYFIGQIBX-LJQANCHMSA-N 2 1 349.881 4.471 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000774449659 1051596060 /nfs/dbraw/zinc/59/60/60/1051596060.db2.gz XFWZGDXYHSDDPG-LLVKDONJSA-N 2 1 344.330 4.489 20 0 EIADMP CCC(CC)(C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)SC ZINC000775511594 1051660137 /nfs/dbraw/zinc/66/01/37/1051660137.db2.gz DUIDCTFIHDIIPZ-MJGOQNOKSA-N 2 1 334.573 4.408 20 0 EIADMP CC(C)C[N@H+](Cc1cccc(Cl)c1F)CC1CC[NH+](C)CC1 ZINC001175601120 1051665046 /nfs/dbraw/zinc/66/50/46/1051665046.db2.gz HBAPJYPMCJVZME-UHFFFAOYSA-N 2 1 326.887 4.279 20 0 EIADMP CC(C)COc1cccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192323752 1051691069 /nfs/dbraw/zinc/69/10/69/1051691069.db2.gz FCNKMXJVYXYQAC-UGKGYDQZSA-N 2 1 342.527 4.170 20 0 EIADMP CC(C)COc1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001192323752 1051691077 /nfs/dbraw/zinc/69/10/77/1051691077.db2.gz FCNKMXJVYXYQAC-UGKGYDQZSA-N 2 1 342.527 4.170 20 0 EIADMP CC(C)COc1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001192323752 1051691081 /nfs/dbraw/zinc/69/10/81/1051691081.db2.gz FCNKMXJVYXYQAC-UGKGYDQZSA-N 2 1 342.527 4.170 20 0 EIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1ccc(F)c2cccnc12 ZINC001175688897 1051730249 /nfs/dbraw/zinc/73/02/49/1051730249.db2.gz QMVQRULFHOUTOA-UHFFFAOYSA-N 2 1 329.463 4.072 20 0 EIADMP CC[C@]1(CCc2ccccc2)CCC[N@@H+]1CCCc1c[nH+]cn1C ZINC001175757600 1051770728 /nfs/dbraw/zinc/77/07/28/1051770728.db2.gz DOFDWXQILPOVLJ-OAQYLSRUSA-N 2 1 325.500 4.230 20 0 EIADMP CC[C@]1(CCc2ccccc2)CCC[N@H+]1CCCc1c[nH+]cn1C ZINC001175757600 1051770734 /nfs/dbraw/zinc/77/07/34/1051770734.db2.gz DOFDWXQILPOVLJ-OAQYLSRUSA-N 2 1 325.500 4.230 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2nc3ccccc3o2)CC1 ZINC000159065861 1051807975 /nfs/dbraw/zinc/80/79/75/1051807975.db2.gz VAYCIFIEJJBYJC-KRWDZBQOSA-N 2 1 341.499 4.304 20 0 EIADMP CCC1([NH+]2CCCCC2)CC[NH+](Cc2cc(C)ccc2NC)CC1 ZINC001183533413 1051863627 /nfs/dbraw/zinc/86/36/27/1051863627.db2.gz LCLZFBGDOUPYTK-UHFFFAOYSA-N 2 1 329.532 4.267 20 0 EIADMP C[C@H]1C[N@@H+](Cc2cccc(CC3CCC3)c2)CCN1c1cc[nH+]cc1 ZINC001183534606 1051864428 /nfs/dbraw/zinc/86/44/28/1051864428.db2.gz RMQNXRVBSNRTKZ-SFHVURJKSA-N 2 1 335.495 4.135 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001193249484 1051890883 /nfs/dbraw/zinc/89/08/83/1051890883.db2.gz NAPLJYBWCOVLHG-ZBFHGGJFSA-N 2 1 338.442 4.031 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)c(C)s1 ZINC000163458616 1051988373 /nfs/dbraw/zinc/98/83/73/1051988373.db2.gz UDOVVWQUJBLZNC-HNNXBMFYSA-N 2 1 329.513 4.388 20 0 EIADMP COCc1c(C)cc(C)c(C[N@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)c1C ZINC001184374138 1051999464 /nfs/dbraw/zinc/99/94/64/1051999464.db2.gz JWUCQCBXUGEXRC-UHFFFAOYSA-N 2 1 332.532 4.111 20 0 EIADMP CCC(CC)[C@@H](c1ccc(Cl)cc1)[N@H+](C)C[C@@H](O)C[NH+](C)CC ZINC001193974316 1052035624 /nfs/dbraw/zinc/03/56/24/1052035624.db2.gz BOIUGEMZNICWEB-OALUTQOASA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@@H](c1ccc(Cl)cc1)[N@@H+](C)C[C@@H](O)C[NH+](C)CC ZINC001193974316 1052035630 /nfs/dbraw/zinc/03/56/30/1052035630.db2.gz BOIUGEMZNICWEB-OALUTQOASA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@@H](c1ccc(Cl)cc1)[NH+](C)C[C@@H](O)C[N@H+](C)CC ZINC001193974316 1052035637 /nfs/dbraw/zinc/03/56/37/1052035637.db2.gz BOIUGEMZNICWEB-OALUTQOASA-N 2 1 340.939 4.062 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(OCC(C)C)cc1 ZINC000164652528 1052035639 /nfs/dbraw/zinc/03/56/39/1052035639.db2.gz JPKIDYMTCOVRFF-QGZVFWFLSA-N 2 1 329.488 4.357 20 0 EIADMP CCC(CC)[C@@H](c1ccc(Cl)cc1)[NH+](C)C[C@@H](O)C[N@@H+](C)CC ZINC001193974316 1052035650 /nfs/dbraw/zinc/03/56/50/1052035650.db2.gz BOIUGEMZNICWEB-OALUTQOASA-N 2 1 340.939 4.062 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000166172536 1052086599 /nfs/dbraw/zinc/08/65/99/1052086599.db2.gz FCEQNTHQKQVAJG-URVUXULASA-N 2 1 344.543 4.399 20 0 EIADMP C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1C[C@H]2C[NH+](C)C[C@@]2(C)C1 ZINC001176639905 1052147854 /nfs/dbraw/zinc/14/78/54/1052147854.db2.gz JXXHSLPQCHETAO-KPLVRAHFSA-N 2 1 336.479 4.423 20 0 EIADMP C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1C[C@H]2C[NH+](C)C[C@@]2(C)C1 ZINC001176639905 1052147860 /nfs/dbraw/zinc/14/78/60/1052147860.db2.gz JXXHSLPQCHETAO-KPLVRAHFSA-N 2 1 336.479 4.423 20 0 EIADMP C[C@@H](c1ccc(Oc2ccccc2)cc1)[NH+]1C[C@H]2C[N@H+](C)C[C@@]2(C)C1 ZINC001176639905 1052147870 /nfs/dbraw/zinc/14/78/70/1052147870.db2.gz JXXHSLPQCHETAO-KPLVRAHFSA-N 2 1 336.479 4.423 20 0 EIADMP C[C@@H](c1ccc(Oc2ccccc2)cc1)[NH+]1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC001176639905 1052147878 /nfs/dbraw/zinc/14/78/78/1052147878.db2.gz JXXHSLPQCHETAO-KPLVRAHFSA-N 2 1 336.479 4.423 20 0 EIADMP C[NH+](C)CC(C)(C)C[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000671189813 1052202911 /nfs/dbraw/zinc/20/29/11/1052202911.db2.gz UFKXTXHMOOSJGU-UHFFFAOYSA-N 2 1 337.920 4.141 20 0 EIADMP CC[C@H](c1ccccc1)[NH+]1CCN(c2cc[nH+]cc2C(F)(F)F)CC1 ZINC001185526370 1052255335 /nfs/dbraw/zinc/25/53/35/1052255335.db2.gz AEFZNJHFCJNLNV-QGZVFWFLSA-N 2 1 349.400 4.374 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cccc2n[nH]cc21 ZINC000623358200 1052631000 /nfs/dbraw/zinc/63/10/00/1052631000.db2.gz SSWQEXIIXIDHIE-QGZVFWFLSA-N 2 1 348.494 4.227 20 0 EIADMP Cc1ccc(C[C@H](N[C@@H]2CC[N@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420808 1052652645 /nfs/dbraw/zinc/65/26/45/1052652645.db2.gz PDUDXHPIRNJCFA-CTNGQTDRSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@H]([NH2+][C@@H]2CCN(C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420808 1052652647 /nfs/dbraw/zinc/65/26/47/1052652647.db2.gz PDUDXHPIRNJCFA-CTNGQTDRSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@H]([NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420808 1052652648 /nfs/dbraw/zinc/65/26/48/1052652648.db2.gz PDUDXHPIRNJCFA-CTNGQTDRSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420808 1052652649 /nfs/dbraw/zinc/65/26/49/1052652649.db2.gz PDUDXHPIRNJCFA-CTNGQTDRSA-N 2 1 337.511 4.136 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1(C)C ZINC000623512324 1052667284 /nfs/dbraw/zinc/66/72/84/1052667284.db2.gz BLZPDGQSFNLLQK-XIRDDKMYSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Br)cc1F ZINC000623524424 1052671519 /nfs/dbraw/zinc/67/15/19/1052671519.db2.gz SMNNQWURSWOCOW-WCQYABFASA-N 2 1 343.284 4.112 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1OC ZINC000177899437 1052693497 /nfs/dbraw/zinc/69/34/97/1052693497.db2.gz OKWRACFXKHFAJR-KRWDZBQOSA-N 2 1 348.531 4.398 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000178707756 1052711579 /nfs/dbraw/zinc/71/15/79/1052711579.db2.gz RFLTZDHNXCPGFC-QWHCGFSZSA-N 2 1 341.377 4.077 20 0 EIADMP Clc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000623861233 1052824335 /nfs/dbraw/zinc/82/43/35/1052824335.db2.gz SJGQZRZFOOYSFG-BFUOFWGJSA-N 2 1 343.902 4.273 20 0 EIADMP COc1ccc([C@H]([NH2+]C[C@@H]2CCCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000624121677 1052867623 /nfs/dbraw/zinc/86/76/23/1052867623.db2.gz AUPOUYYBTFCHBJ-PGRDOPGGSA-N 2 1 338.495 4.106 20 0 EIADMP COc1ccc([C@H]([NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000624121677 1052867625 /nfs/dbraw/zinc/86/76/25/1052867625.db2.gz AUPOUYYBTFCHBJ-PGRDOPGGSA-N 2 1 338.495 4.106 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000624123491 1052868625 /nfs/dbraw/zinc/86/86/25/1052868625.db2.gz NFEYHAZOUFTXRR-MSOLQXFVSA-N 2 1 339.483 4.256 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000624123491 1052868627 /nfs/dbraw/zinc/86/86/27/1052868627.db2.gz NFEYHAZOUFTXRR-MSOLQXFVSA-N 2 1 339.483 4.256 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000624124051 1052868716 /nfs/dbraw/zinc/86/87/16/1052868716.db2.gz VZJICWSWENQDBP-CBBWQLFWSA-N 2 1 326.937 4.215 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000181570540 1052888369 /nfs/dbraw/zinc/88/83/69/1052888369.db2.gz WUVAPZRMHLEVFK-HNNXBMFYSA-N 2 1 345.462 4.250 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@@H+]1C ZINC000182332240 1052926953 /nfs/dbraw/zinc/92/69/53/1052926953.db2.gz JGYFHJDQNDAZQV-CZUORRHYSA-N 2 1 326.406 4.157 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@H+]1C ZINC000182332240 1052926959 /nfs/dbraw/zinc/92/69/59/1052926959.db2.gz JGYFHJDQNDAZQV-CZUORRHYSA-N 2 1 326.406 4.157 20 0 EIADMP CC[NH+](CC)CCCC1CC[NH+]([C@H](C)c2nc(C(C)C)no2)CC1 ZINC000182762302 1052949181 /nfs/dbraw/zinc/94/91/81/1052949181.db2.gz MBMCJKMOLCHOCU-MRXNPFEDSA-N 2 1 336.524 4.088 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+][C@H](c2ccccc2)c2ccc(F)cn2)cc1 ZINC000183308570 1052970153 /nfs/dbraw/zinc/97/01/53/1052970153.db2.gz SWTALRDNENCZJO-JOCHJYFZSA-N 2 1 349.453 4.162 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCC[C@H]2CCCCO2)cc1 ZINC000183989281 1052988855 /nfs/dbraw/zinc/98/88/55/1052988855.db2.gz RMUKVYZBMRWVBY-OXQOHEQNSA-N 2 1 327.472 4.181 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000381131099 1053054613 /nfs/dbraw/zinc/05/46/13/1053054613.db2.gz KHCIPDQMARXAJU-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H]([NH2+]Cc1cc(Cl)cs1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382062851 1053134938 /nfs/dbraw/zinc/13/49/38/1053134938.db2.gz PYXCHVBJSWHZOZ-GOEBONIOSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc2ccccc2[nH]1 ZINC000775628277 1053222312 /nfs/dbraw/zinc/22/23/12/1053222312.db2.gz QSTOMFVCZAVHFI-UYAOXDASSA-N 2 1 347.506 4.383 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2C[C@H](O)c3ccccc32)cc1 ZINC000850527325 1053288228 /nfs/dbraw/zinc/28/82/28/1053288228.db2.gz FUUYWZGMFVQOHX-WVFSVQOHSA-N 2 1 333.435 4.010 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CCC[C@@H]3Cc3ccccn3)CC2)cc1 ZINC000850543141 1053303320 /nfs/dbraw/zinc/30/33/20/1053303320.db2.gz ZAOGKQZBUZJSRL-NFBKMPQASA-N 2 1 349.522 4.047 20 0 EIADMP Cc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000383428569 1053339437 /nfs/dbraw/zinc/33/94/37/1053339437.db2.gz BIUMWIXIEPRFTR-YLJYHZDGSA-N 2 1 326.459 4.134 20 0 EIADMP CSc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000383677400 1053373087 /nfs/dbraw/zinc/37/30/87/1053373087.db2.gz NSCKIMJFFTYGOC-FXAWDEMLSA-N 2 1 340.536 4.409 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)cc2)cs1 ZINC000339072187 1053475122 /nfs/dbraw/zinc/47/51/22/1053475122.db2.gz UQOGSYJIWKPCHE-KYNGSXCRSA-N 2 1 341.524 4.396 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](CCc2ccccc2)C(C)C)cn1 ZINC000765250237 1053476226 /nfs/dbraw/zinc/47/62/26/1053476226.db2.gz HWOBJBJJFNNSLH-OAQYLSRUSA-N 2 1 348.494 4.323 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cnc(Cl)c(F)c1 ZINC000865413408 1053497474 /nfs/dbraw/zinc/49/74/74/1053497474.db2.gz HEMXBWRUDRCXTQ-UHFFFAOYSA-N 2 1 335.854 4.004 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000765450260 1053549462 /nfs/dbraw/zinc/54/94/62/1053549462.db2.gz PBYNWNYEOWEPQC-IEBWSBKVSA-N 2 1 334.573 4.408 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccnc(Cl)c1 ZINC000765449397 1053551240 /nfs/dbraw/zinc/55/12/40/1053551240.db2.gz JJJAPKMQMWUBKW-SJLPKXTDSA-N 2 1 343.902 4.298 20 0 EIADMP Fc1ccccc1C1CC([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000386065340 1053579552 /nfs/dbraw/zinc/57/95/52/1053579552.db2.gz FGECBNQUSKWFAQ-HDYDNRTBSA-N 2 1 338.470 4.183 20 0 EIADMP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000765506206 1053586851 /nfs/dbraw/zinc/58/68/51/1053586851.db2.gz CYVYVDLNTWIZPU-HOTGVXAUSA-N 2 1 340.602 4.470 20 0 EIADMP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000765506206 1053586859 /nfs/dbraw/zinc/58/68/59/1053586859.db2.gz CYVYVDLNTWIZPU-HOTGVXAUSA-N 2 1 340.602 4.470 20 0 EIADMP CC(F)(F)C(C)(C)C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000865788899 1053593764 /nfs/dbraw/zinc/59/37/64/1053593764.db2.gz ISNXSMVHXOBKLL-KRWDZBQOSA-N 2 1 336.470 4.455 20 0 EIADMP CC(F)(F)C(C)(C)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000865788899 1053593771 /nfs/dbraw/zinc/59/37/71/1053593771.db2.gz ISNXSMVHXOBKLL-KRWDZBQOSA-N 2 1 336.470 4.455 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1nccc2c1CCCC2 ZINC000921528078 1053701988 /nfs/dbraw/zinc/70/19/88/1053701988.db2.gz REUVDZFZCUHGEQ-UHFFFAOYSA-N 2 1 337.511 4.090 20 0 EIADMP CC[N@@H+](CCOC1CCCCCC1)Cc1ccc(C[NH+](C)C)cc1 ZINC001196622798 1053716420 /nfs/dbraw/zinc/71/64/20/1053716420.db2.gz LEMKQARSCDEBCL-UHFFFAOYSA-N 2 1 332.532 4.310 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C2CCC2)[C@@H]2CCOC2)cc1 ZINC000866512134 1053762259 /nfs/dbraw/zinc/76/22/59/1053762259.db2.gz ZXSBEFWVDQTWPR-DLVCFXQMSA-N 2 1 339.483 4.037 20 0 EIADMP CC1CC[NH+](CC[C@H]2CCC[N@H+]2C[C@H]2CCCCC2(F)F)CC1 ZINC001196934745 1053805127 /nfs/dbraw/zinc/80/51/27/1053805127.db2.gz CGTGAMPUFTWTLY-QZTJIDSGSA-N 2 1 328.491 4.398 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCC[C@]1(C)Cc1ccc(F)c(Cl)c1 ZINC001197003449 1053820453 /nfs/dbraw/zinc/82/04/53/1053820453.db2.gz HHZBRQUBIAFYHA-GOSISDBHSA-N 2 1 335.854 4.081 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCC[C@]1(C)Cc1ccc(F)c(Cl)c1 ZINC001197003449 1053820457 /nfs/dbraw/zinc/82/04/57/1053820457.db2.gz HHZBRQUBIAFYHA-GOSISDBHSA-N 2 1 335.854 4.081 20 0 EIADMP C[N@H+]1CC[C@@H]2CN(CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031942 1053827750 /nfs/dbraw/zinc/82/77/50/1053827750.db2.gz NFLNZDJNOSRVLI-CRAIPNDOSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@@H+]1CC[C@@H]2C[NH+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031942 1053827753 /nfs/dbraw/zinc/82/77/53/1053827753.db2.gz NFLNZDJNOSRVLI-CRAIPNDOSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@@H]2C[NH+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031942 1053827758 /nfs/dbraw/zinc/82/77/58/1053827758.db2.gz NFLNZDJNOSRVLI-CRAIPNDOSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2C[N@H+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031942 1053827767 /nfs/dbraw/zinc/82/77/67/1053827767.db2.gz NFLNZDJNOSRVLI-CRAIPNDOSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2C[N@@H+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031942 1053827769 /nfs/dbraw/zinc/82/77/69/1053827769.db2.gz NFLNZDJNOSRVLI-CRAIPNDOSA-N 2 1 341.326 4.342 20 0 EIADMP COc1c(C)cc([C@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1Cl ZINC000796726279 1054031460 /nfs/dbraw/zinc/03/14/60/1054031460.db2.gz DHWLEZPEGCOVSH-AWEZNQCLSA-N 2 1 336.907 4.325 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cc(O)ccc1F ZINC000872023827 1054337443 /nfs/dbraw/zinc/33/74/43/1054337443.db2.gz VYWFNOYKCGQLAH-OAHLLOKOSA-N 2 1 330.447 4.222 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cc(O)ccc1F ZINC000872023827 1054337458 /nfs/dbraw/zinc/33/74/58/1054337458.db2.gz VYWFNOYKCGQLAH-OAHLLOKOSA-N 2 1 330.447 4.222 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cccc(O)c2F)c1 ZINC000872025783 1054341660 /nfs/dbraw/zinc/34/16/60/1054341660.db2.gz SVVDXFNLOPJXMT-HNNXBMFYSA-N 2 1 330.447 4.224 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)cc1F ZINC000872027062 1054342894 /nfs/dbraw/zinc/34/28/94/1054342894.db2.gz JOCNCEXFWSOZAN-APWZRJJASA-N 2 1 345.462 4.003 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)CC1 ZINC000872036619 1054354092 /nfs/dbraw/zinc/35/40/92/1054354092.db2.gz XRZVVOKYNUKNCY-JRGCBEDISA-N 2 1 344.543 4.395 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)C1 ZINC001199344130 1054387893 /nfs/dbraw/zinc/38/78/93/1054387893.db2.gz FWHNGVHMZMHIBR-SFHVURJKSA-N 2 1 344.543 4.392 20 0 EIADMP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2cccc(OC(C)(C)C)c2)C1 ZINC001199329755 1054394584 /nfs/dbraw/zinc/39/45/84/1054394584.db2.gz ZBZLUGVVBUVPRU-ROUUACIJSA-N 2 1 332.532 4.322 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC2CC[NH+](C3CCCCC3)CC2)C1 ZINC001199760853 1054463850 /nfs/dbraw/zinc/46/38/50/1054463850.db2.gz STJOFKUHYRCGSE-KDURUIRLSA-N 2 1 349.607 4.130 20 0 EIADMP CC(C)c1cccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)c1 ZINC000858365467 1054474643 /nfs/dbraw/zinc/47/46/43/1054474643.db2.gz OFMUCODWACIKCC-UTKZUKDTSA-N 2 1 330.516 4.104 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Oc3cccnc3)c(C)c2)C1 ZINC001199842993 1054477272 /nfs/dbraw/zinc/47/72/72/1054477272.db2.gz LSKXXRUTHVZTEX-IBGZPJMESA-N 2 1 339.483 4.004 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cccc(Oc3ccc(F)cc3)c2)C1 ZINC001199844441 1054478814 /nfs/dbraw/zinc/47/88/14/1054478814.db2.gz ZGMOWSCXFPTGCV-GOSISDBHSA-N 2 1 342.458 4.440 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(SC(F)F)cc1 ZINC000858490895 1054498283 /nfs/dbraw/zinc/49/82/83/1054498283.db2.gz RUNKDZPYWUVZSI-KBPBESRZSA-N 2 1 328.472 4.384 20 0 EIADMP CSc1ccc(C[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)s1 ZINC001200940972 1054597082 /nfs/dbraw/zinc/59/70/82/1054597082.db2.gz BEWSPIIDWSTTAO-HNNXBMFYSA-N 2 1 334.554 4.470 20 0 EIADMP CSc1ccc(C[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)s1 ZINC001200940972 1054597098 /nfs/dbraw/zinc/59/70/98/1054597098.db2.gz BEWSPIIDWSTTAO-HNNXBMFYSA-N 2 1 334.554 4.470 20 0 EIADMP CC(C)=CCC[C@@H](C)C[N@H+]1CC[C@@]2(C[NH+](C)C[C@@H]2COCC2CC2)C1 ZINC001201486157 1054814666 /nfs/dbraw/zinc/81/46/66/1054814666.db2.gz GJEJKEQVHSZANB-CEMLEFRQSA-N 2 1 348.575 4.049 20 0 EIADMP CC(C)=CCC[C@@H](C)C[NH+]1CC[C@]2(C1)C[N@H+](C)C[C@@H]2COCC1CC1 ZINC001201486157 1054814673 /nfs/dbraw/zinc/81/46/73/1054814673.db2.gz GJEJKEQVHSZANB-CEMLEFRQSA-N 2 1 348.575 4.049 20 0 EIADMP CC(C)=CCC[C@@H](C)C[NH+]1CC[C@]2(C1)C[N@@H+](C)C[C@@H]2COCC1CC1 ZINC001201486157 1054814679 /nfs/dbraw/zinc/81/46/79/1054814679.db2.gz GJEJKEQVHSZANB-CEMLEFRQSA-N 2 1 348.575 4.049 20 0 EIADMP CC[C@H](C)C[NH+]1CCC2(CC[N@@H+](Cc3cccc(OC)c3)C2)CC1 ZINC001201510286 1054824017 /nfs/dbraw/zinc/82/40/17/1054824017.db2.gz ZBYNIWRGXBOFEI-SFHVURJKSA-N 2 1 330.516 4.029 20 0 EIADMP c1ccc(CCC[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC001201672757 1054873511 /nfs/dbraw/zinc/87/35/11/1054873511.db2.gz XEWPHMPDEHYQPR-XZOQPEGZSA-N 2 1 334.507 4.073 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1Cl ZINC001202018627 1054982738 /nfs/dbraw/zinc/98/27/38/1054982738.db2.gz REHJRONLQIEYDF-MRXNPFEDSA-N 2 1 338.923 4.481 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1Cl ZINC001202018627 1054982741 /nfs/dbraw/zinc/98/27/41/1054982741.db2.gz REHJRONLQIEYDF-MRXNPFEDSA-N 2 1 338.923 4.481 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc2c(ccnc2Cl)o1 ZINC000876933419 1054985323 /nfs/dbraw/zinc/98/53/23/1054985323.db2.gz OQUGPXFQHDWPDN-AWEZNQCLSA-N 2 1 335.879 4.225 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc2c(ccnc2Cl)o1 ZINC000876933420 1054986235 /nfs/dbraw/zinc/98/62/35/1054986235.db2.gz OQUGPXFQHDWPDN-CQSZACIVSA-N 2 1 335.879 4.225 20 0 EIADMP Cc1c(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)ccnc1F ZINC000862271096 1055041402 /nfs/dbraw/zinc/04/14/02/1055041402.db2.gz CNONWMBYDVEIJU-MRXNPFEDSA-N 2 1 341.474 4.051 20 0 EIADMP Cc1c(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)ccnc1F ZINC000862271369 1055042393 /nfs/dbraw/zinc/04/23/93/1055042393.db2.gz MKXYCSHATAEJIV-INIZCTEOSA-N 2 1 341.474 4.193 20 0 EIADMP COc1ccc(C2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCCCC2)cc1 ZINC000166310956 1055043515 /nfs/dbraw/zinc/04/35/15/1055043515.db2.gz IODYYAFGDVXJHP-WOJBJXKFSA-N 2 1 342.527 4.114 20 0 EIADMP FC(F)C1(C[NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000671762705 1055052801 /nfs/dbraw/zinc/05/28/01/1055052801.db2.gz GYPRWQFEIDKXDS-GUDVDZBRSA-N 2 1 348.481 4.312 20 0 EIADMP CC[C@H](C)Oc1cc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)ccc1OC ZINC001202233112 1055109767 /nfs/dbraw/zinc/10/97/67/1055109767.db2.gz GAWDSVDIDYLMSZ-KRWDZBQOSA-N 2 1 348.531 4.084 20 0 EIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](CCC(F)(F)F)C[C@@H]21 ZINC001202328551 1055142752 /nfs/dbraw/zinc/14/27/52/1055142752.db2.gz HNJRBGOQNWHGLN-VNQPRFMTSA-N 2 1 346.462 4.233 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+](CCC(F)(F)F)C[C@@H]21 ZINC001202328551 1055142754 /nfs/dbraw/zinc/14/27/54/1055142754.db2.gz HNJRBGOQNWHGLN-VNQPRFMTSA-N 2 1 346.462 4.233 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+](CCC(F)(F)F)C[C@@H]21 ZINC001202328551 1055142762 /nfs/dbraw/zinc/14/27/62/1055142762.db2.gz HNJRBGOQNWHGLN-VNQPRFMTSA-N 2 1 346.462 4.233 20 0 EIADMP COc1cc([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+]2C)ccc1OCCC(C)C ZINC001168604126 1055151974 /nfs/dbraw/zinc/15/19/74/1055151974.db2.gz KYBQANZSVTWHHW-HKUYNNGSSA-N 2 1 348.531 4.255 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccnc(Cl)c1 ZINC000126844576 1055176703 /nfs/dbraw/zinc/17/67/03/1055176703.db2.gz PPVULDUTGGKNCS-LSDHHAIUSA-N 2 1 349.931 4.359 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccnc(Cl)c1 ZINC000126844576 1055176710 /nfs/dbraw/zinc/17/67/10/1055176710.db2.gz PPVULDUTGGKNCS-LSDHHAIUSA-N 2 1 349.931 4.359 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC000863546964 1055228086 /nfs/dbraw/zinc/22/80/86/1055228086.db2.gz IHQSPCNWBZKBSZ-MISYRCLQSA-N 2 1 326.871 4.410 20 0 EIADMP [NH3+][C@H]1C[C@@H]([NH2+]Cc2cn(C(F)F)c3ccccc23)c2ccccc21 ZINC000863547138 1055229023 /nfs/dbraw/zinc/22/90/23/1055229023.db2.gz PGSVZKBODZIIOY-DLBZAZTESA-N 2 1 327.378 4.271 20 0 EIADMP C[C@H]([NH2+]C1CCC(C(F)F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000282300149 1055790939 /nfs/dbraw/zinc/79/09/39/1055790939.db2.gz MGAHYHHSXLHRKX-WEOZKBJRSA-N 2 1 336.470 4.311 20 0 EIADMP Clc1cccc2c1C[C@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001168676005 1056647562 /nfs/dbraw/zinc/64/75/62/1056647562.db2.gz MGWIMSVXIZFQBH-LJQANCHMSA-N 2 1 340.898 4.061 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1OC ZINC000742374727 1058598639 /nfs/dbraw/zinc/59/86/39/1058598639.db2.gz DSSBRCAAPVIIEM-PKOBYXMFSA-N 2 1 348.531 4.227 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000742374727 1058598656 /nfs/dbraw/zinc/59/86/56/1058598656.db2.gz DSSBRCAAPVIIEM-PKOBYXMFSA-N 2 1 348.531 4.227 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3cccc4cnccc43)C2)CC1 ZINC000183200948 1059949305 /nfs/dbraw/zinc/94/93/05/1059949305.db2.gz SXUHBXQQPITDJF-IBGZPJMESA-N 2 1 337.511 4.179 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1cnn(-c2ccccc2)c1)C(C)C ZINC000766383962 1060315594 /nfs/dbraw/zinc/31/55/94/1060315594.db2.gz DEMODSUOLJYPEJ-SFHVURJKSA-N 2 1 328.504 4.032 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1cnn(-c2ccccc2)c1)C(C)C ZINC000766383960 1060317531 /nfs/dbraw/zinc/31/75/31/1060317531.db2.gz DEMODSUOLJYPEJ-GOSISDBHSA-N 2 1 328.504 4.032 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(F)F)cc2)[C@@H](C)C1 ZINC000746469508 1060373980 /nfs/dbraw/zinc/37/39/80/1060373980.db2.gz COFBAFZSOXPIOW-BBRMVZONSA-N 2 1 328.472 4.163 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(SC(F)F)cc2)[C@@H](C)C1 ZINC000746469508 1060373999 /nfs/dbraw/zinc/37/39/99/1060373999.db2.gz COFBAFZSOXPIOW-BBRMVZONSA-N 2 1 328.472 4.163 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(SC(F)F)cc2)[C@@H](C)C1 ZINC000746469508 1060374018 /nfs/dbraw/zinc/37/40/18/1060374018.db2.gz COFBAFZSOXPIOW-BBRMVZONSA-N 2 1 328.472 4.163 20 0 EIADMP C[C@H]1CCCC[C@@H]1C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001168825265 1060430549 /nfs/dbraw/zinc/43/05/49/1060430549.db2.gz HRUOHJMONODKKW-AZUAARDMSA-N 2 1 329.532 4.446 20 0 EIADMP CO[C@H](C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1)c1ccc(Cl)cc1 ZINC001168836794 1060444800 /nfs/dbraw/zinc/44/48/00/1060444800.db2.gz FMIDTWOLVVQWHF-HXUWFJFHSA-N 2 1 346.902 4.221 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCc1ccc(Oc3ccccc3)cc1)C2 ZINC001169096480 1060634443 /nfs/dbraw/zinc/63/44/43/1060634443.db2.gz XIZHZOMUUOALER-OWZKRDHZSA-N 2 1 336.479 4.236 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CCCc3cc(Br)ccc31)C2 ZINC001169101515 1060637036 /nfs/dbraw/zinc/63/70/36/1060637036.db2.gz TZEYQEIFWNTAQB-CUSZFKRNSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)c1cccc(C(F)(F)F)c1)C2 ZINC001169101583 1060637626 /nfs/dbraw/zinc/63/76/26/1060637626.db2.gz UJPMLCZMELOBPD-PHZGNYQRSA-N 2 1 326.406 4.155 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(C(F)(F)F)c(Cl)c1)C2 ZINC001169098956 1060638175 /nfs/dbraw/zinc/63/81/75/1060638175.db2.gz MTZWQXKZHVOKGP-XYYAHUGASA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(C(F)(F)F)c(Cl)c1)C2 ZINC001169098956 1060638178 /nfs/dbraw/zinc/63/81/78/1060638178.db2.gz MTZWQXKZHVOKGP-XYYAHUGASA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](NC1(c3ccccc3Br)CCC1)C2 ZINC001169109357 1060658836 /nfs/dbraw/zinc/65/88/36/1060658836.db2.gz BDDOCWRBPMKNDD-QDMKHBRRSA-N 2 1 349.316 4.043 20 0 EIADMP 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 1060660419 /nfs/dbraw/zinc/66/04/19/1060660419.db2.gz OMLXCFHNMAOCEV-DZJNRPSUSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CC[C@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141063 1060660428 /nfs/dbraw/zinc/66/04/28/1060660428.db2.gz OMLXCFHNMAOCEV-DZJNRPSUSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CC[C@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141063 1060660443 /nfs/dbraw/zinc/66/04/43/1060660443.db2.gz OMLXCFHNMAOCEV-DZJNRPSUSA-N 2 1 338.417 4.120 20 0 EIADMP 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 1060661233 /nfs/dbraw/zinc/66/12/33/1060661233.db2.gz OMLXCFHNMAOCEV-OWLYRPNTSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CC[C@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141065 1060661238 /nfs/dbraw/zinc/66/12/38/1060661238.db2.gz OMLXCFHNMAOCEV-OWLYRPNTSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CC[C@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141065 1060661242 /nfs/dbraw/zinc/66/12/42/1060661242.db2.gz OMLXCFHNMAOCEV-OWLYRPNTSA-N 2 1 338.417 4.120 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1cccc(Br)c1)C2 ZINC001169147566 1060665442 /nfs/dbraw/zinc/66/54/42/1060665442.db2.gz UYZZPIZTUFZZLE-MHORFTMASA-N 2 1 349.316 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1cccc(Br)c1)C2 ZINC001169147566 1060665453 /nfs/dbraw/zinc/66/54/53/1060665453.db2.gz UYZZPIZTUFZZLE-MHORFTMASA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1cccc(Br)c1)C2 ZINC001169147566 1060665463 /nfs/dbraw/zinc/66/54/63/1060665463.db2.gz UYZZPIZTUFZZLE-MHORFTMASA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1cccc(Br)c1)C2 ZINC001169147566 1060665473 /nfs/dbraw/zinc/66/54/73/1060665473.db2.gz UYZZPIZTUFZZLE-MHORFTMASA-N 2 1 349.316 4.211 20 0 EIADMP C[C@H](c1cccc(Br)c1)[N@@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169162482 1060672325 /nfs/dbraw/zinc/67/23/25/1060672325.db2.gz TZKBJVHQKJIXTQ-VZEFYGNVSA-N 2 1 337.305 4.067 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(Cc3ccc(C(F)(F)F)cc3)CCC2)CC1 ZINC001169242096 1060715541 /nfs/dbraw/zinc/71/55/41/1060715541.db2.gz VWKOBTIONAAJPV-UHFFFAOYSA-N 2 1 340.433 4.245 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CCC[C@H]1C[NH3+] ZINC001206011913 1060842139 /nfs/dbraw/zinc/84/21/39/1060842139.db2.gz HANOUXUPGYBENU-YPMHNXCESA-N 2 1 334.813 4.166 20 0 EIADMP C[C@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)CCC[C@H]1C[NH3+] ZINC001206013211 1060862957 /nfs/dbraw/zinc/86/29/57/1060862957.db2.gz QIVIPSVBQFYZPO-QWRGUYRKSA-N 2 1 335.706 4.454 20 0 EIADMP CC1(C)CC([NH2+]Cc2cnc(-c3ccccc3)s2)CC(C)(C)[NH2+]1 ZINC000103341055 1060898107 /nfs/dbraw/zinc/89/81/07/1060898107.db2.gz QMARPBKTHGRWFE-UHFFFAOYSA-N 2 1 329.513 4.209 20 0 EIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1sccc1Br ZINC000037232543 213136251 /nfs/dbraw/zinc/13/62/51/213136251.db2.gz KJVQUYPXLMEUFW-JTQLQIEISA-N 2 1 345.350 4.470 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](CN[C@H](C)c2sccc2Br)C1 ZINC000531702763 1031487065 /nfs/dbraw/zinc/48/70/65/1031487065.db2.gz WGUHFPFAIGUXIU-OLZOCXBDSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2sccc2Br)C1 ZINC000531702763 1031487078 /nfs/dbraw/zinc/48/70/78/1031487078.db2.gz WGUHFPFAIGUXIU-OLZOCXBDSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2sccc2Br)C1 ZINC000531702763 1031487089 /nfs/dbraw/zinc/48/70/89/1031487089.db2.gz WGUHFPFAIGUXIU-OLZOCXBDSA-N 2 1 345.350 4.282 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3cccc(OC)c3o2)c1 ZINC000729682076 1032131752 /nfs/dbraw/zinc/13/17/52/1032131752.db2.gz JREUQOZACFRFLA-UHFFFAOYSA-N 2 1 338.451 4.183 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+]C3CC[NH+](C4CC4)CC3)cc2)cs1 ZINC000459381794 1032164747 /nfs/dbraw/zinc/16/47/47/1032164747.db2.gz DUMKMZUVWMSQGX-AWEZNQCLSA-N 2 1 341.524 4.396 20 0 EIADMP CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]CCc1c[nH+]cn1C ZINC000459381068 1032233058 /nfs/dbraw/zinc/23/30/58/1032233058.db2.gz CDZPGHLLVWPKFH-LJQANCHMSA-N 2 1 329.488 4.128 20 0 EIADMP CC[N@@H+](C)C[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc32)C1 ZINC000450363664 1032446649 /nfs/dbraw/zinc/44/66/49/1032446649.db2.gz VVCWVIMBGLGNOV-CYBMUJFWSA-N 2 1 337.389 4.032 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556101 1032451357 /nfs/dbraw/zinc/45/13/57/1032451357.db2.gz JTQAXXBMAOOBNC-CRAIPNDOSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556101 1032451364 /nfs/dbraw/zinc/45/13/64/1032451364.db2.gz JTQAXXBMAOOBNC-CRAIPNDOSA-N 2 1 336.470 4.311 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H](C)C3CCCCC3)CC2)oc1C ZINC000177327703 1032503788 /nfs/dbraw/zinc/50/37/88/1032503788.db2.gz ISCNJFDGRKERDX-MRXNPFEDSA-N 2 1 333.520 4.062 20 0 EIADMP COc1cc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)ccc1C ZINC000177986754 1032515430 /nfs/dbraw/zinc/51/54/30/1032515430.db2.gz OBXCPVJOQDSIDP-MRXNPFEDSA-N 2 1 335.451 4.349 20 0 EIADMP C[C@H](c1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1)C(F)(F)F ZINC000450504323 1032533905 /nfs/dbraw/zinc/53/39/05/1032533905.db2.gz UMSHESASPLNLOZ-ZTFGCOKTSA-N 2 1 340.433 4.269 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1)C(F)(F)F ZINC000450504323 1032533912 /nfs/dbraw/zinc/53/39/12/1032533912.db2.gz UMSHESASPLNLOZ-ZTFGCOKTSA-N 2 1 340.433 4.269 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1)C(F)(F)F ZINC000450504323 1032533916 /nfs/dbraw/zinc/53/39/16/1032533916.db2.gz UMSHESASPLNLOZ-ZTFGCOKTSA-N 2 1 340.433 4.269 20 0 EIADMP FC1(F)CC(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000450499643 1032542154 /nfs/dbraw/zinc/54/21/54/1032542154.db2.gz JJFKJTIQZGGCHZ-RTBURBONSA-N 2 1 334.454 4.018 20 0 EIADMP FC1(F)CC(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC000450499643 1032542160 /nfs/dbraw/zinc/54/21/60/1032542160.db2.gz JJFKJTIQZGGCHZ-RTBURBONSA-N 2 1 334.454 4.018 20 0 EIADMP FC1(F)CC(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC000450499643 1032542165 /nfs/dbraw/zinc/54/21/65/1032542165.db2.gz JJFKJTIQZGGCHZ-RTBURBONSA-N 2 1 334.454 4.018 20 0 EIADMP CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000429581005 1032782116 /nfs/dbraw/zinc/78/21/16/1032782116.db2.gz RUEVDFVRJGWJFE-MRXNPFEDSA-N 2 1 339.483 4.191 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCCO2 ZINC000643545835 1018893499 /nfs/dbraw/zinc/89/34/99/1018893499.db2.gz CWRVWNJJMULTJC-PKOBYXMFSA-N 2 1 328.500 4.288 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](C)c1ccccc1Cl ZINC000339557181 1019230671 /nfs/dbraw/zinc/23/06/71/1019230671.db2.gz QAMWRCYVZCBJNV-AWEZNQCLSA-N 2 1 326.831 4.080 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](C)c1ccccc1Cl ZINC000339557183 1019232570 /nfs/dbraw/zinc/23/25/70/1019232570.db2.gz QAMWRCYVZCBJNV-CQSZACIVSA-N 2 1 326.831 4.080 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccccc2OCc2ccccc2)CC1 ZINC000432799006 1032820747 /nfs/dbraw/zinc/82/07/47/1032820747.db2.gz VCIVJOWBMMXLPY-OAQYLSRUSA-N 2 1 338.495 4.182 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccccc2OCc2ccccc2)CC1 ZINC000432799006 1032820748 /nfs/dbraw/zinc/82/07/48/1032820748.db2.gz VCIVJOWBMMXLPY-OAQYLSRUSA-N 2 1 338.495 4.182 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000274765449 1019411454 /nfs/dbraw/zinc/41/14/54/1019411454.db2.gz LECKHYPHVZWILZ-FVTFTPSCSA-N 2 1 344.543 4.080 20 0 EIADMP COc1cc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)ccc1Cl ZINC000648816774 1019687794 /nfs/dbraw/zinc/68/77/94/1019687794.db2.gz IJSYCLFZGRLTRX-UHFFFAOYSA-N 2 1 336.907 4.235 20 0 EIADMP Cc1nc2c(s1)[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)CCC2 ZINC000154869800 1020078240 /nfs/dbraw/zinc/07/82/40/1020078240.db2.gz DYPQZCLJUYDUAH-GOSISDBHSA-N 2 1 343.540 4.459 20 0 EIADMP COC(C)(C)CC[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001209409085 1020267639 /nfs/dbraw/zinc/26/76/39/1020267639.db2.gz BJWAZPJEAKMEMN-UHFFFAOYSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000398153887 1020504045 /nfs/dbraw/zinc/50/40/45/1020504045.db2.gz QCFBOHSOHMNLFQ-BKAOJLMESA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000398153887 1020504050 /nfs/dbraw/zinc/50/40/50/1020504050.db2.gz QCFBOHSOHMNLFQ-BKAOJLMESA-N 2 1 334.507 4.433 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2cc(F)cc3F)c1 ZINC000121279781 1020795096 /nfs/dbraw/zinc/79/50/96/1020795096.db2.gz NNUAFLAQVZWUOA-HXUWFJFHSA-N 2 1 330.422 4.194 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000683691508 1021100353 /nfs/dbraw/zinc/10/03/53/1021100353.db2.gz YNVFDSFOHIZERQ-WJMWBRGCSA-N 2 1 335.495 4.236 20 0 EIADMP Clc1ccccc1CC[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001167326869 1021129978 /nfs/dbraw/zinc/12/99/78/1021129978.db2.gz VTUSENMWZIOMBB-GOSISDBHSA-N 2 1 334.935 4.471 20 0 EIADMP Clc1ccccc1CC[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001167326869 1021129989 /nfs/dbraw/zinc/12/99/89/1021129989.db2.gz VTUSENMWZIOMBB-GOSISDBHSA-N 2 1 334.935 4.471 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc(OC(F)F)c2)c1 ZINC000057968937 1021280196 /nfs/dbraw/zinc/28/01/96/1021280196.db2.gz YCYIWPBBZPLQEH-UHFFFAOYSA-N 2 1 348.437 4.418 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000472468662 1021389088 /nfs/dbraw/zinc/38/90/88/1021389088.db2.gz UFXMFZNGXWYSNS-GOEBONIOSA-N 2 1 340.433 4.430 20 0 EIADMP c1nc(C2CC2)c(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000683767403 1021412448 /nfs/dbraw/zinc/41/24/48/1021412448.db2.gz RMVUSCJIDCAKBI-KRWDZBQOSA-N 2 1 341.524 4.022 20 0 EIADMP c1nc(C2CC2)c(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000683767403 1021412475 /nfs/dbraw/zinc/41/24/75/1021412475.db2.gz RMVUSCJIDCAKBI-KRWDZBQOSA-N 2 1 341.524 4.022 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000272354302 1021643503 /nfs/dbraw/zinc/64/35/03/1021643503.db2.gz RCBQXHMQMONGAC-VCBZYWHSSA-N 2 1 343.540 4.321 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@H](C)c2cccc(Cl)c2)cn1 ZINC000187692198 1021792348 /nfs/dbraw/zinc/79/23/48/1021792348.db2.gz RFBVBJZKYLYMCW-AWEZNQCLSA-N 2 1 340.858 4.122 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC000414103516 1021857854 /nfs/dbraw/zinc/85/78/54/1021857854.db2.gz DUXDLFYWESCUCR-SQNIBIBYSA-N 2 1 330.516 4.307 20 0 EIADMP COc1cc(Cl)c(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1Cl ZINC000511492624 1021894710 /nfs/dbraw/zinc/89/47/10/1021894710.db2.gz FJIDGSRAJKMVFQ-UHFFFAOYSA-N 2 1 345.314 4.166 20 0 EIADMP COc1ccccc1[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000089554843 1021933884 /nfs/dbraw/zinc/93/38/84/1021933884.db2.gz WCCKGJKBPYDLLJ-WOIUINJBSA-N 2 1 336.479 4.001 20 0 EIADMP CC[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000414168507 1022016821 /nfs/dbraw/zinc/01/68/21/1022016821.db2.gz AFEPZGYBROJFMW-WMLDXEAASA-N 2 1 326.431 4.061 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000414182582 1022055827 /nfs/dbraw/zinc/05/58/27/1022055827.db2.gz MWVJOXUYTMBSTE-ZWKOTPCHSA-N 2 1 339.483 4.256 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000414182580 1022056061 /nfs/dbraw/zinc/05/60/61/1022056061.db2.gz MWVJOXUYTMBSTE-QZTJIDSGSA-N 2 1 339.483 4.256 20 0 EIADMP Cc1cc(F)ncc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000892574010 1022255140 /nfs/dbraw/zinc/25/51/40/1022255140.db2.gz HNKVCEKTAQSMQH-INIZCTEOSA-N 2 1 341.474 4.051 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC(C)(C)c2cccnc2)cc1 ZINC000414331000 1022573941 /nfs/dbraw/zinc/57/39/41/1022573941.db2.gz JTWIGIDISFABSS-INIZCTEOSA-N 2 1 334.467 4.204 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CC2 ZINC000134313636 1022650322 /nfs/dbraw/zinc/65/03/22/1022650322.db2.gz YWBCFUISXMKDCD-BZNIZROVSA-N 2 1 325.283 4.055 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CC2 ZINC000134313636 1022650334 /nfs/dbraw/zinc/65/03/34/1022650334.db2.gz YWBCFUISXMKDCD-BZNIZROVSA-N 2 1 325.283 4.055 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000374542763 1022788729 /nfs/dbraw/zinc/78/87/29/1022788729.db2.gz HSYDIUXRGOTNOZ-PCCBWWKXSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000374542763 1022788745 /nfs/dbraw/zinc/78/87/45/1022788745.db2.gz HSYDIUXRGOTNOZ-PCCBWWKXSA-N 2 1 344.543 4.080 20 0 EIADMP Clc1cc2cccnc2c(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1 ZINC000647543893 1022796806 /nfs/dbraw/zinc/79/68/06/1022796806.db2.gz UDWOJAYPLJFYHZ-DLBZAZTESA-N 2 1 343.902 4.100 20 0 EIADMP CCOc1cccc(C[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000311003474 1022811376 /nfs/dbraw/zinc/81/13/76/1022811376.db2.gz KGMUZTVRSYCCND-JOCHJYFZSA-N 2 1 338.495 4.087 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548153697 1022828112 /nfs/dbraw/zinc/82/81/12/1022828112.db2.gz DGZUSAJFZAPPRF-NQIIRXRSSA-N 2 1 338.495 4.004 20 0 EIADMP c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[NH+]2Cc2ccccc2)cc1 ZINC000656404126 1022844550 /nfs/dbraw/zinc/84/45/50/1022844550.db2.gz WYQSTLLFJCLBJL-AFXVXQJMSA-N 2 1 332.491 4.029 20 0 EIADMP c1ccc(C[NH+]2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[N@@H+]2Cc2ccccc2)cc1 ZINC000656404126 1022844551 /nfs/dbraw/zinc/84/45/51/1022844551.db2.gz WYQSTLLFJCLBJL-AFXVXQJMSA-N 2 1 332.491 4.029 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000311066163 1022865024 /nfs/dbraw/zinc/86/50/24/1022865024.db2.gz YDGHYKQIIYHNNI-XMSQKQJNSA-N 2 1 340.486 4.259 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@H+](C)[C@H]1c1cccs1)c1cccnc1 ZINC000363863288 1022866128 /nfs/dbraw/zinc/86/61/28/1022866128.db2.gz KJAFPAAPZLAYFW-JENIJYKNSA-N 2 1 329.513 4.267 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1cccs1)c1cccnc1 ZINC000363863288 1022866131 /nfs/dbraw/zinc/86/61/31/1022866131.db2.gz KJAFPAAPZLAYFW-JENIJYKNSA-N 2 1 329.513 4.267 20 0 EIADMP CSc1ccc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)s1 ZINC000581458602 1023234590 /nfs/dbraw/zinc/23/45/90/1023234590.db2.gz AIZCEOJVTOAKJK-UHFFFAOYSA-N 2 1 332.538 4.008 20 0 EIADMP CSc1ccc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)s1 ZINC000581458602 1023234600 /nfs/dbraw/zinc/23/46/00/1023234600.db2.gz AIZCEOJVTOAKJK-UHFFFAOYSA-N 2 1 332.538 4.008 20 0 EIADMP C[C@@H](C[N@@H+](C)C1CCN(CCc2ccccn2)CC1)C1CCCCC1 ZINC000549472628 1023337415 /nfs/dbraw/zinc/33/74/15/1023337415.db2.gz XYVBVOPGYLFGBH-IBGZPJMESA-N 2 1 343.559 4.237 20 0 EIADMP Brc1cccc2c1CCC[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000341188594 1023341695 /nfs/dbraw/zinc/34/16/95/1023341695.db2.gz MWPJBJJWRZJEBD-IYOUNJFTSA-N 2 1 349.316 4.043 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cccc3c2CCCN3)CC[N@H+]1Cc1ccccc1 ZINC000415046476 1023409535 /nfs/dbraw/zinc/40/95/35/1023409535.db2.gz ZTYLDQFIAXMZEM-GHTZIAJQSA-N 2 1 349.522 4.187 20 0 EIADMP CCO[C@H]1C[C@H]([N@@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001167473938 1023425983 /nfs/dbraw/zinc/42/59/83/1023425983.db2.gz NOZIBWOICQMNIT-SFTDATJTSA-N 2 1 344.543 4.308 20 0 EIADMP CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001167473936 1023426513 /nfs/dbraw/zinc/42/65/13/1023426513.db2.gz NOZIBWOICQMNIT-NHCUHLMSSA-N 2 1 344.543 4.308 20 0 EIADMP Fc1ccc(CC[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c(Cl)c1 ZINC000415087943 1023437386 /nfs/dbraw/zinc/43/73/86/1023437386.db2.gz LITWYURKOBCUMJ-MJGOQNOKSA-N 2 1 332.850 4.105 20 0 EIADMP Fc1ccc(CC[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c(Cl)c1 ZINC000415087941 1023437484 /nfs/dbraw/zinc/43/74/84/1023437484.db2.gz LITWYURKOBCUMJ-HKUYNNGSSA-N 2 1 332.850 4.105 20 0 EIADMP Cc1sc([C@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)nc1-c1ccc(Cl)cc1 ZINC000415088846 1023439152 /nfs/dbraw/zinc/43/91/52/1023439152.db2.gz VSTVZXKMXCAMNQ-JSGCOSHPSA-N 2 1 349.931 4.422 20 0 EIADMP C[C@H](C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500106261 1023506004 /nfs/dbraw/zinc/50/60/04/1023506004.db2.gz ZLIHJQSZQXBZLJ-CVEARBPZSA-N 2 1 340.433 4.227 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+]CC(C(C)C)C(C)C)CC2)oc1C ZINC000377410624 1023520356 /nfs/dbraw/zinc/52/03/56/1023520356.db2.gz FPMDXFMDXCLMQX-UHFFFAOYSA-N 2 1 335.536 4.021 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000394556592 1023607018 /nfs/dbraw/zinc/60/70/18/1023607018.db2.gz IXSPKLHYOKXVBD-UHOSZYNNSA-N 2 1 336.470 4.312 20 0 EIADMP CC[NH+](CC)Cc1cc(NCCC[N@H+]2CCCC[C@@H]2C)ccc1OC ZINC001167754259 1023636299 /nfs/dbraw/zinc/63/62/99/1023636299.db2.gz QBYHBCZDTDKEAF-SFHVURJKSA-N 2 1 347.547 4.213 20 0 EIADMP CC(C)C1=[NH+]CCc2ccc(NCCC[N@H+]3CCCC[C@@H]3C)cc21 ZINC001167754789 1023641703 /nfs/dbraw/zinc/64/17/03/1023641703.db2.gz VLEZLPFNGYFEBZ-KRWDZBQOSA-N 2 1 327.516 4.364 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@H]1CCC[NH+]([C@@H]2CCc3ccccc32)CC1 ZINC000377699659 1023694812 /nfs/dbraw/zinc/69/48/12/1023694812.db2.gz QIAUNHSTPBERPR-RBBKRZOGSA-N 2 1 335.495 4.055 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH+]([C@@H]2CCc3ccccc32)CC1 ZINC000377699659 1023694815 /nfs/dbraw/zinc/69/48/15/1023694815.db2.gz QIAUNHSTPBERPR-RBBKRZOGSA-N 2 1 335.495 4.055 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)CC1 ZINC000377699659 1023694818 /nfs/dbraw/zinc/69/48/18/1023694818.db2.gz QIAUNHSTPBERPR-RBBKRZOGSA-N 2 1 335.495 4.055 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)CC1 ZINC000377699659 1023694822 /nfs/dbraw/zinc/69/48/22/1023694822.db2.gz QIAUNHSTPBERPR-RBBKRZOGSA-N 2 1 335.495 4.055 20 0 EIADMP Cc1ccc2cc(C[N@H+](C)C3CCN(c4cc[nH+]cc4)CC3)ccc2n1 ZINC000377709736 1023705477 /nfs/dbraw/zinc/70/54/77/1023705477.db2.gz VBUDDQQBXSVKFD-UHFFFAOYSA-N 2 1 346.478 4.039 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2c[nH]c3ccccc23)CC1 ZINC000472856026 1023741256 /nfs/dbraw/zinc/74/12/56/1023741256.db2.gz WQJBZRNCRAJVNU-GOSISDBHSA-N 2 1 325.500 4.222 20 0 EIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390744204 1023820024 /nfs/dbraw/zinc/82/00/24/1023820024.db2.gz OMYRZDVLVWTWEV-NVXWUHKLSA-N 2 1 328.422 4.219 20 0 EIADMP CCC[C@@H]([NH2+]CCn1cc[nH+]c1C)c1cccc(C(F)(F)F)c1 ZINC000341633591 1024040545 /nfs/dbraw/zinc/04/05/45/1024040545.db2.gz BKFBNLGWJLASEA-MRXNPFEDSA-N 2 1 325.378 4.341 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000549523508 1024121561 /nfs/dbraw/zinc/12/15/61/1024121561.db2.gz HIPRGPDAKUBYFB-LEOXJPRUSA-N 2 1 334.507 4.433 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)c1 ZINC000123937353 1024249712 /nfs/dbraw/zinc/24/97/12/1024249712.db2.gz NOOUZFVSAWDOMH-CYBMUJFWSA-N 2 1 336.401 4.406 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510699557 1024252446 /nfs/dbraw/zinc/25/24/46/1024252446.db2.gz BZSMHBUQTFDQRG-RDJZCZTQSA-N 2 1 342.449 4.348 20 0 EIADMP FCCC[C@H]1CCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000510723887 1024319192 /nfs/dbraw/zinc/31/91/92/1024319192.db2.gz UQRFZZRGLWNUCT-CTNGQTDRSA-N 2 1 332.507 4.202 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cc(C)ccc1OC(F)F ZINC000164614394 1024703304 /nfs/dbraw/zinc/70/33/04/1024703304.db2.gz CZOAQLXTOXFIIP-AWEZNQCLSA-N 2 1 337.414 4.232 20 0 EIADMP C[C@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)C1(c2ccccc2)CCCC1 ZINC000511929448 1024806724 /nfs/dbraw/zinc/80/67/24/1024806724.db2.gz YOBLNXHASZVNNC-INIZCTEOSA-N 2 1 343.540 4.195 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)CCc1cccc(C(F)(F)F)c1 ZINC000510959073 1024866421 /nfs/dbraw/zinc/86/64/21/1024866421.db2.gz NRPXPWKJWVDKEP-AWEZNQCLSA-N 2 1 339.405 4.211 20 0 EIADMP Cc1ccncc1[C@@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510967779 1024870325 /nfs/dbraw/zinc/87/03/25/1024870325.db2.gz NFQLLUKTGNDOSV-NQIIRXRSSA-N 2 1 337.511 4.341 20 0 EIADMP Cc1ccncc1[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510967779 1024870328 /nfs/dbraw/zinc/87/03/28/1024870328.db2.gz NFQLLUKTGNDOSV-NQIIRXRSSA-N 2 1 337.511 4.341 20 0 EIADMP CC(C)c1ccc(OC2CC[NH+](CC[C@@H]3CCC[N@H+]3C)CC2)cc1 ZINC000535765558 1024922488 /nfs/dbraw/zinc/92/24/88/1024922488.db2.gz VYYNVVSOFLIVNZ-IBGZPJMESA-N 2 1 330.516 4.138 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1cscn1 ZINC000535777400 1024935102 /nfs/dbraw/zinc/93/51/02/1024935102.db2.gz FGNCJOQWENFDDQ-ZACQAIPSSA-N 2 1 343.540 4.472 20 0 EIADMP CC[C@@H]([NH2+]CC1CC[NH+](Cc2csc(C)n2)CC1)c1cccs1 ZINC000161721592 1025068175 /nfs/dbraw/zinc/06/81/75/1025068175.db2.gz IPYCUGCHUSKIFY-QGZVFWFLSA-N 2 1 349.569 4.466 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)c1ccc(C)cc1 ZINC000162232341 1025115313 /nfs/dbraw/zinc/11/53/13/1025115313.db2.gz ONDGLPGDFOARHT-HXUWFJFHSA-N 2 1 338.499 4.112 20 0 EIADMP FC(F)(F)[C@@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC000663435087 1025338848 /nfs/dbraw/zinc/33/88/48/1025338848.db2.gz POWISNCARFLGPM-QGZVFWFLSA-N 2 1 326.406 4.057 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2occc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511985606 1025393992 /nfs/dbraw/zinc/39/39/92/1025393992.db2.gz AQDRCOCJWSSLRC-UWJYYQICSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2occc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511985601 1025394613 /nfs/dbraw/zinc/39/46/13/1025394613.db2.gz AQDRCOCJWSSLRC-LAUBAEHRSA-N 2 1 334.463 4.433 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1Cl ZINC000663467358 1025398051 /nfs/dbraw/zinc/39/80/51/1025398051.db2.gz DZNBDXODMCLFLT-HOCLYGCPSA-N 2 1 336.907 4.121 20 0 EIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663470230 1025413109 /nfs/dbraw/zinc/41/31/09/1025413109.db2.gz TWWIHJDOQUGEGP-WMLDXEAASA-N 2 1 335.561 4.348 20 0 EIADMP C[C@@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469913 1025417014 /nfs/dbraw/zinc/41/70/14/1025417014.db2.gz RREQOHPAMNBVOG-ZBFHGGJFSA-N 2 1 338.442 4.061 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469913 1025417026 /nfs/dbraw/zinc/41/70/26/1025417026.db2.gz RREQOHPAMNBVOG-ZBFHGGJFSA-N 2 1 338.442 4.061 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469913 1025417038 /nfs/dbraw/zinc/41/70/38/1025417038.db2.gz RREQOHPAMNBVOG-ZBFHGGJFSA-N 2 1 338.442 4.061 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cnc2ccsc2c1 ZINC000663470617 1025420377 /nfs/dbraw/zinc/42/03/77/1025420377.db2.gz VMOQNMWCNJMMKX-ZBFHGGJFSA-N 2 1 329.513 4.069 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(Cl)c(Cl)c1 ZINC000925781080 1025528779 /nfs/dbraw/zinc/52/87/79/1025528779.db2.gz WLUMVVCSIFQRPF-SMDDNHRTSA-N 2 1 337.241 4.279 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1c1ccc(OC)c(OC)c1 ZINC001167825464 1025606305 /nfs/dbraw/zinc/60/63/05/1025606305.db2.gz JHQOVICCIUBRFH-MJGOQNOKSA-N 2 1 348.531 4.351 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001167826147 1025618087 /nfs/dbraw/zinc/61/80/87/1025618087.db2.gz NCTXMMUODRSHKU-FQEVSTJZSA-N 3 1 345.575 4.093 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(N(C)Cc2ccccc2)CC1 ZINC001167826147 1025618097 /nfs/dbraw/zinc/61/80/97/1025618097.db2.gz NCTXMMUODRSHKU-FQEVSTJZSA-N 2 1 345.575 4.093 20 0 EIADMP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000643524154 1025676615 /nfs/dbraw/zinc/67/66/15/1025676615.db2.gz QLGZEWXEDHDCHO-SJBKTWHCSA-N 2 1 349.453 4.323 20 0 EIADMP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000643524152 1025678952 /nfs/dbraw/zinc/67/89/52/1025678952.db2.gz QLGZEWXEDHDCHO-KCZVDYSFSA-N 2 1 349.453 4.323 20 0 EIADMP CN(CCSc1cccc(Cl)c1)CC[C@H]1CCCC[N@H+]1C ZINC001167508631 1025768902 /nfs/dbraw/zinc/76/89/02/1025768902.db2.gz ILXUPWZJLPNARX-MRXNPFEDSA-N 2 1 326.937 4.238 20 0 EIADMP C[N@H+](CCSc1cccc(Cl)c1)CC[C@H]1CCCC[NH+]1C ZINC001167508631 1025768930 /nfs/dbraw/zinc/76/89/30/1025768930.db2.gz ILXUPWZJLPNARX-MRXNPFEDSA-N 2 1 326.937 4.238 20 0 EIADMP C[N@@H+](CCSc1cccc(Cl)c1)CC[C@H]1CCCC[NH+]1C ZINC001167508631 1025768960 /nfs/dbraw/zinc/76/89/60/1025768960.db2.gz ILXUPWZJLPNARX-MRXNPFEDSA-N 2 1 326.937 4.238 20 0 EIADMP C[NH+](CCSc1cccc(Cl)c1)CC[C@H]1CCCC[N@@H+]1C ZINC001167508631 1025768988 /nfs/dbraw/zinc/76/89/88/1025768988.db2.gz ILXUPWZJLPNARX-MRXNPFEDSA-N 2 1 326.937 4.238 20 0 EIADMP C[NH+](CCSc1cccc(Cl)c1)CC[C@H]1CCCC[N@H+]1C ZINC001167508631 1025769040 /nfs/dbraw/zinc/76/90/40/1025769040.db2.gz ILXUPWZJLPNARX-MRXNPFEDSA-N 2 1 326.937 4.238 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(F)c(F)c1F ZINC000657297477 1025778928 /nfs/dbraw/zinc/77/89/28/1025778928.db2.gz ODRRQPHDHIKBOM-UHFFFAOYSA-N 2 1 336.401 4.236 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1c1cccc(C(=O)OC)c1 ZINC001167834086 1025811629 /nfs/dbraw/zinc/81/16/29/1025811629.db2.gz HLINSFRWUMWWCZ-YLJYHZDGSA-N 2 1 346.515 4.121 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1Cl ZINC001167836178 1025845714 /nfs/dbraw/zinc/84/57/14/1025845714.db2.gz WZDWTUVAPSXSAM-SQNIBIBYSA-N 2 1 349.950 4.113 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](CC)[C@H]1CCN(Cc2ccccc2)C1 ZINC001167838967 1025852261 /nfs/dbraw/zinc/85/22/61/1025852261.db2.gz XGONZEJYRFVWEM-UNMCSNQZSA-N 2 1 345.575 4.093 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H](c2cccc(OC)c2)C1 ZINC001167839556 1025853610 /nfs/dbraw/zinc/85/36/10/1025853610.db2.gz ABJCKCYVLTVXBF-UYAOXDASSA-N 2 1 332.532 4.385 20 0 EIADMP CC[C@@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)C(C)(C)c1ccccc1 ZINC000512067325 1025875830 /nfs/dbraw/zinc/87/58/30/1025875830.db2.gz KWUDCGMSWLICKM-QGZVFWFLSA-N 2 1 331.529 4.051 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCOc2cccc(C)c2)cc1 ZINC000537971474 1025879033 /nfs/dbraw/zinc/87/90/33/1025879033.db2.gz QXDKCWPZYXVTAH-KRWDZBQOSA-N 2 1 335.451 4.219 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)CCCS2 ZINC000187744014 1025888886 /nfs/dbraw/zinc/88/88/86/1025888886.db2.gz MIBQCKKCVYCALX-IBGZPJMESA-N 2 1 348.556 4.332 20 0 EIADMP COc1cccc([C@@H]2C[C@H](C)C[N@H+]2CCCCn2ccnc2C)c1 ZINC000344034472 1025889953 /nfs/dbraw/zinc/88/99/53/1025889953.db2.gz FASLQLGNNBFDKQ-JXFKEZNVSA-N 2 1 327.472 4.063 20 0 EIADMP COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2CCCCn2cc[nH+]c2C)c1 ZINC000344034472 1025889957 /nfs/dbraw/zinc/88/99/57/1025889957.db2.gz FASLQLGNNBFDKQ-JXFKEZNVSA-N 2 1 327.472 4.063 20 0 EIADMP COc1cccc([C@@H]2C[C@H](C)C[N@H+]2CCCCn2cc[nH+]c2C)c1 ZINC000344034472 1025889961 /nfs/dbraw/zinc/88/99/61/1025889961.db2.gz FASLQLGNNBFDKQ-JXFKEZNVSA-N 2 1 327.472 4.063 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@H](c2ccccc2F)C2CCCC2)CCCO1 ZINC000432420125 1025898903 /nfs/dbraw/zinc/89/89/03/1025898903.db2.gz IYVIVNZMTWAMQW-UTKZUKDTSA-N 2 1 348.506 4.148 20 0 EIADMP Clc1ccc2c(c1)CC[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)C2 ZINC001167971281 1026056471 /nfs/dbraw/zinc/05/64/71/1026056471.db2.gz VZMKVMXNCPNNKF-UDEWTMQYSA-N 2 1 344.930 4.192 20 0 EIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167971237 1026065573 /nfs/dbraw/zinc/06/55/73/1026065573.db2.gz UNDOQEAVUGACLR-LRLLJDFBSA-N 2 1 332.919 4.266 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000344165062 1026080495 /nfs/dbraw/zinc/08/04/95/1026080495.db2.gz LCHAAWXHMYWWFE-MRXNPFEDSA-N 2 1 337.389 4.090 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000344165062 1026080515 /nfs/dbraw/zinc/08/05/15/1026080515.db2.gz LCHAAWXHMYWWFE-MRXNPFEDSA-N 2 1 337.389 4.090 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000431353866 1026149516 /nfs/dbraw/zinc/14/95/16/1026149516.db2.gz XCSHWZKNYSTUFS-UWVAXJGDSA-N 2 1 328.500 4.240 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000431353868 1026149853 /nfs/dbraw/zinc/14/98/53/1026149853.db2.gz XCSHWZKNYSTUFS-ZWOKBUDYSA-N 2 1 328.500 4.240 20 0 EIADMP COc1ccc(C[N@H+](CCCCn2cc[nH+]c2C)C(C)(C)C)cc1 ZINC000344227218 1026156042 /nfs/dbraw/zinc/15/60/42/1026156042.db2.gz ANFREHOBQIAQLS-UHFFFAOYSA-N 2 1 329.488 4.281 20 0 EIADMP COc1ccc(C[N@@H+](CCCCn2cc[nH+]c2C)C(C)(C)C)cc1 ZINC000344227218 1026156051 /nfs/dbraw/zinc/15/60/51/1026156051.db2.gz ANFREHOBQIAQLS-UHFFFAOYSA-N 2 1 329.488 4.281 20 0 EIADMP C[Si](C)(C)C([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)[Si](C)(C)C ZINC001167974212 1026184355 /nfs/dbraw/zinc/18/43/55/1026184355.db2.gz RAVFWQRSNPIUQP-ALOPSCKCSA-N 2 1 338.688 4.105 20 0 EIADMP C[C@H](c1ncc(-c2ccccc2)o1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000152248157 1026252323 /nfs/dbraw/zinc/25/23/23/1026252323.db2.gz SQHSNBPWVWESRE-QGZVFWFLSA-N 2 1 339.483 4.210 20 0 EIADMP COc1cccc(CC(C)(C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167978129 1026339416 /nfs/dbraw/zinc/33/94/16/1026339416.db2.gz KFBCFMHJRIIUBM-IHWFROFDSA-N 2 1 342.527 4.011 20 0 EIADMP Clc1ncccc1[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CC1 ZINC001167978633 1026346126 /nfs/dbraw/zinc/34/61/26/1026346126.db2.gz PZIWEHXXOKDVMF-RGPMPMONSA-N 2 1 345.918 4.181 20 0 EIADMP Clc1ncccc1[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C1CC1 ZINC001167978633 1026346135 /nfs/dbraw/zinc/34/61/35/1026346135.db2.gz PZIWEHXXOKDVMF-RGPMPMONSA-N 2 1 345.918 4.181 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)cc1 ZINC000163536493 1026381383 /nfs/dbraw/zinc/38/13/83/1026381383.db2.gz BNBDCLTVRJTKNW-QGZVFWFLSA-N 2 1 339.483 4.108 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000163485870 1026381890 /nfs/dbraw/zinc/38/18/90/1026381890.db2.gz KQYVGYLGOYLMDW-KRWDZBQOSA-N 2 1 339.483 4.027 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000550239235 1026392248 /nfs/dbraw/zinc/39/22/48/1026392248.db2.gz TUPAZDOIFKPBPH-YOEHRIQHSA-N 2 1 326.406 4.184 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000550239235 1026392262 /nfs/dbraw/zinc/39/22/62/1026392262.db2.gz TUPAZDOIFKPBPH-YOEHRIQHSA-N 2 1 326.406 4.184 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000550239235 1026392283 /nfs/dbraw/zinc/39/22/83/1026392283.db2.gz TUPAZDOIFKPBPH-YOEHRIQHSA-N 2 1 326.406 4.184 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000550239235 1026392295 /nfs/dbraw/zinc/39/22/95/1026392295.db2.gz TUPAZDOIFKPBPH-YOEHRIQHSA-N 2 1 326.406 4.184 20 0 EIADMP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)cs2)cs1 ZINC000152425028 1026542477 /nfs/dbraw/zinc/54/24/77/1026542477.db2.gz JGYSWIYSQSFGFW-OCCSQVGLSA-N 2 1 347.553 4.315 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc3ccccc3s2)[C@H](C)C1 ZINC000132698518 1026565095 /nfs/dbraw/zinc/56/50/95/1026565095.db2.gz ITARHSAFPBFCMO-VQIMIIECSA-N 2 1 346.540 4.128 20 0 EIADMP CC(C)Sc1ccc(C[NH+]2CCC(Cc3[nH+]ccn3C)CC2)cc1 ZINC000511116634 1026581272 /nfs/dbraw/zinc/58/12/72/1026581272.db2.gz SFFSHIKJRJOQTB-UHFFFAOYSA-N 2 1 343.540 4.375 20 0 EIADMP CCOc1ccc([C@@H](CC)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1OCC ZINC000152466920 1026587488 /nfs/dbraw/zinc/58/74/88/1026587488.db2.gz ULVCCFQPFKQDSA-VQIMIIECSA-N 2 1 346.515 4.009 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2ccncc2s1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000657430591 1026644679 /nfs/dbraw/zinc/64/46/79/1026644679.db2.gz RSQZTABUPRTFDR-GDBMZVCRSA-N 2 1 329.513 4.039 20 0 EIADMP C[C@H](N[C@@H]1CCc2c1c(F)ccc2F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512312361 1026680774 /nfs/dbraw/zinc/68/07/74/1026680774.db2.gz DOONYDLLOFPKEA-IQUTYRLHSA-N 2 1 334.454 4.195 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2c1c(F)ccc2F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512312361 1026680784 /nfs/dbraw/zinc/68/07/84/1026680784.db2.gz DOONYDLLOFPKEA-IQUTYRLHSA-N 2 1 334.454 4.195 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2c1c(F)ccc2F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512312361 1026680792 /nfs/dbraw/zinc/68/07/92/1026680792.db2.gz DOONYDLLOFPKEA-IQUTYRLHSA-N 2 1 334.454 4.195 20 0 EIADMP Fc1ccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c(F)c1 ZINC000432659567 1026687016 /nfs/dbraw/zinc/68/70/16/1026687016.db2.gz SAGKADKXGXHNNS-SFHVURJKSA-N 2 1 348.462 4.171 20 0 EIADMP Fc1ccc(C[N@@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c(F)c1 ZINC000432659567 1026687021 /nfs/dbraw/zinc/68/70/21/1026687021.db2.gz SAGKADKXGXHNNS-SFHVURJKSA-N 2 1 348.462 4.171 20 0 EIADMP Fc1ccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c(F)c1 ZINC000432659563 1026687661 /nfs/dbraw/zinc/68/76/61/1026687661.db2.gz SAGKADKXGXHNNS-GOSISDBHSA-N 2 1 348.462 4.171 20 0 EIADMP Fc1ccc(C[N@@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c(F)c1 ZINC000432659563 1026687666 /nfs/dbraw/zinc/68/76/66/1026687666.db2.gz SAGKADKXGXHNNS-GOSISDBHSA-N 2 1 348.462 4.171 20 0 EIADMP Fc1cccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c1F ZINC000432667610 1026696290 /nfs/dbraw/zinc/69/62/90/1026696290.db2.gz UOWMWWQVJBVPOY-KRWDZBQOSA-N 2 1 348.462 4.171 20 0 EIADMP Fc1cccc(C[N@@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c1F ZINC000432667610 1026696292 /nfs/dbraw/zinc/69/62/92/1026696292.db2.gz UOWMWWQVJBVPOY-KRWDZBQOSA-N 2 1 348.462 4.171 20 0 EIADMP CCC[NH+]1CCN(c2ccccc2C[N@@H+](C)[C@@H](C)c2ccco2)CC1 ZINC000507212864 1026704439 /nfs/dbraw/zinc/70/44/39/1026704439.db2.gz PCIVDWDOLLKTDB-SFHVURJKSA-N 2 1 341.499 4.005 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)CCOc2ccc3ccccc3c2)CC1 ZINC000507322440 1026745889 /nfs/dbraw/zinc/74/58/89/1026745889.db2.gz BMZQJQJONZJKHP-UHFFFAOYSA-N 2 1 326.484 4.023 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCOc2ccc3ccccc3c2)CC1 ZINC000507322440 1026745899 /nfs/dbraw/zinc/74/58/99/1026745899.db2.gz BMZQJQJONZJKHP-UHFFFAOYSA-N 2 1 326.484 4.023 20 0 EIADMP CCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000582560157 1026805267 /nfs/dbraw/zinc/80/52/67/1026805267.db2.gz CWFFKGAYMQIECV-IRLDBZIGSA-N 2 1 338.495 4.401 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000507522274 1026827096 /nfs/dbraw/zinc/82/70/96/1026827096.db2.gz FUQNXSHRTNKHLU-SFHVURJKSA-N 2 1 337.511 4.481 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)cc1C ZINC000152840572 1026855153 /nfs/dbraw/zinc/85/51/53/1026855153.db2.gz QKFXRRUCCAZQKP-LJQANCHMSA-N 2 1 337.511 4.056 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@H]3CCCc4cccnc43)C2)c1 ZINC000684956482 1026889943 /nfs/dbraw/zinc/88/99/43/1026889943.db2.gz ZWYUICVBXZSXPD-APWZRJJASA-N 2 1 341.524 4.022 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CCCc4cccnc43)C2)c1 ZINC000684956482 1026889946 /nfs/dbraw/zinc/88/99/46/1026889946.db2.gz ZWYUICVBXZSXPD-APWZRJJASA-N 2 1 341.524 4.022 20 0 EIADMP CCO[C@@H](CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000582664320 1026915175 /nfs/dbraw/zinc/91/51/75/1026915175.db2.gz FDQUZWJIMDBVBR-RTWAWAEBSA-N 2 1 344.543 4.224 20 0 EIADMP CCO[C@@H](CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000582664320 1026915183 /nfs/dbraw/zinc/91/51/83/1026915183.db2.gz FDQUZWJIMDBVBR-RTWAWAEBSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582665307 1026916061 /nfs/dbraw/zinc/91/60/61/1026916061.db2.gz ZWWILIKGKPKDMH-IEBWSBKVSA-N 2 1 340.536 4.466 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582665307 1026916072 /nfs/dbraw/zinc/91/60/72/1026916072.db2.gz ZWWILIKGKPKDMH-IEBWSBKVSA-N 2 1 340.536 4.466 20 0 EIADMP c1sc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)nc1C1CC1 ZINC000342749304 1026947950 /nfs/dbraw/zinc/94/79/50/1026947950.db2.gz JZPMGXHQNYTVCX-UHFFFAOYSA-N 2 1 333.545 4.109 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cc1OC ZINC000474476298 1027107810 /nfs/dbraw/zinc/10/78/10/1027107810.db2.gz WXGBPMYDZGKMPK-KZNAEPCWSA-N 2 1 348.531 4.050 20 0 EIADMP C[C@H]([NH2+]CC1([NH+](C)C)CCCC1)[C@H](C)c1nc2ccccc2s1 ZINC000474497961 1027146876 /nfs/dbraw/zinc/14/68/76/1027146876.db2.gz ZMTPONJSBJRXNJ-GJZGRUSLSA-N 2 1 331.529 4.252 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1cccc(Br)c1)C1CC1 ZINC000342858153 1027320602 /nfs/dbraw/zinc/32/06/02/1027320602.db2.gz AYSXSESGMQCWRC-UHFFFAOYSA-N 2 1 348.288 4.009 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1cccc(Br)c1)C1CC1 ZINC000342858153 1027320626 /nfs/dbraw/zinc/32/06/26/1027320626.db2.gz AYSXSESGMQCWRC-UHFFFAOYSA-N 2 1 348.288 4.009 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H]1Cc1c(F)cccc1Cl ZINC000342858756 1027329922 /nfs/dbraw/zinc/32/99/22/1027329922.db2.gz BZZDIMNPRDVBIK-OAHLLOKOSA-N 2 1 335.854 4.081 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H]1Cc1c(F)cccc1Cl ZINC000342858756 1027329941 /nfs/dbraw/zinc/32/99/41/1027329941.db2.gz BZZDIMNPRDVBIK-OAHLLOKOSA-N 2 1 335.854 4.081 20 0 EIADMP C[C@@H](CC[NH+](C)C)[NH2+]Cc1cccc(OCc2ccccc2Cl)c1 ZINC000520221063 1027332163 /nfs/dbraw/zinc/33/21/63/1027332163.db2.gz JSRKUIMPVJZZNI-INIZCTEOSA-N 2 1 346.902 4.349 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000474628557 1027335653 /nfs/dbraw/zinc/33/56/53/1027335653.db2.gz LBXKIXAXRKKFOX-APIJFGDWSA-N 2 1 326.937 4.215 20 0 EIADMP C[N@@H+]1CC[C@@H]2[C@@H](CCCN2c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000302709304 1027368870 /nfs/dbraw/zinc/36/88/70/1027368870.db2.gz DEQSBXCXEQAZNW-SUMWQHHRSA-N 2 1 349.400 4.174 20 0 EIADMP C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000302709304 1027368883 /nfs/dbraw/zinc/36/88/83/1027368883.db2.gz DEQSBXCXEQAZNW-SUMWQHHRSA-N 2 1 349.400 4.174 20 0 EIADMP C[C@H](c1ccccn1)[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000342874067 1027393426 /nfs/dbraw/zinc/39/34/26/1027393426.db2.gz KOAZBINNCWOIMV-LJQANCHMSA-N 2 1 335.495 4.131 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)C3C(C)(C)C3(C)C)CC2)oc1C ZINC000474718171 1027435944 /nfs/dbraw/zinc/43/59/44/1027435944.db2.gz FAWMVMFHKZGMKE-HNNXBMFYSA-N 2 1 347.547 4.164 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC000441323647 1027453286 /nfs/dbraw/zinc/45/32/86/1027453286.db2.gz OGFIWEXOYMUTGF-UHFFFAOYSA-N 2 1 337.389 4.265 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC000441323647 1027453301 /nfs/dbraw/zinc/45/33/01/1027453301.db2.gz OGFIWEXOYMUTGF-UHFFFAOYSA-N 2 1 337.389 4.265 20 0 EIADMP Cc1cccc(C)c1OCCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441391664 1027514546 /nfs/dbraw/zinc/51/45/46/1027514546.db2.gz BIJGRLVQHCEYQJ-FPOVZHCZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441391664 1027514550 /nfs/dbraw/zinc/51/45/50/1027514550.db2.gz BIJGRLVQHCEYQJ-FPOVZHCZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441391664 1027514570 /nfs/dbraw/zinc/51/45/70/1027514570.db2.gz BIJGRLVQHCEYQJ-FPOVZHCZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441391664 1027514583 /nfs/dbraw/zinc/51/45/83/1027514583.db2.gz BIJGRLVQHCEYQJ-FPOVZHCZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCCc3ncccc32)CC1 ZINC000631570672 1027555611 /nfs/dbraw/zinc/55/56/11/1027555611.db2.gz XHWGRBQXXHODFS-QFIPXVFZSA-N 2 1 335.495 4.022 20 0 EIADMP Fc1cccc(Oc2ccc(CN[C@H]3CC[N@H+]4CCC[C@H]4C3)cc2)c1 ZINC000443962586 1028122376 /nfs/dbraw/zinc/12/23/76/1028122376.db2.gz GNDYALXWRHLSGA-OALUTQOASA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)c1 ZINC000443962586 1028122392 /nfs/dbraw/zinc/12/23/92/1028122392.db2.gz GNDYALXWRHLSGA-OALUTQOASA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)cc2)c1 ZINC000443962586 1028122403 /nfs/dbraw/zinc/12/24/03/1028122403.db2.gz GNDYALXWRHLSGA-OALUTQOASA-N 2 1 340.442 4.334 20 0 EIADMP C[N@H+](CCCCOC(C)(C)C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000475040511 1028134983 /nfs/dbraw/zinc/13/49/83/1028134983.db2.gz WGRCYZAAJPPVFH-UHFFFAOYSA-N 2 1 332.532 4.178 20 0 EIADMP C[N@@H+](CCCCOC(C)(C)C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000475040511 1028134996 /nfs/dbraw/zinc/13/49/96/1028134996.db2.gz WGRCYZAAJPPVFH-UHFFFAOYSA-N 2 1 332.532 4.178 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000583174989 1028174658 /nfs/dbraw/zinc/17/46/58/1028174658.db2.gz LTXNOSJHYOIEIJ-REZBVGGZSA-N 2 1 338.442 4.107 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000583174989 1028174673 /nfs/dbraw/zinc/17/46/73/1028174673.db2.gz LTXNOSJHYOIEIJ-REZBVGGZSA-N 2 1 338.442 4.107 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000280809193 1028196411 /nfs/dbraw/zinc/19/64/11/1028196411.db2.gz LUJDGBMYZOMMTP-ODVANORSSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000280809193 1028196421 /nfs/dbraw/zinc/19/64/21/1028196421.db2.gz LUJDGBMYZOMMTP-ODVANORSSA-N 2 1 326.406 4.024 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000443971988 1028217617 /nfs/dbraw/zinc/21/76/17/1028217617.db2.gz LPYFMWKWSQELHG-QGZVFWFLSA-N 2 1 328.431 4.049 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCOCc2ccccc2)CC1 ZINC001167658441 1028220526 /nfs/dbraw/zinc/22/05/26/1028220526.db2.gz HHLNWLBGEJYKFL-FQEVSTJZSA-N 2 1 344.543 4.180 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H]1Cc1ccc(C)cc1 ZINC000346159709 1028297407 /nfs/dbraw/zinc/29/74/07/1028297407.db2.gz CXDCMTNESVSHPL-QFIPXVFZSA-N 2 1 346.478 4.091 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000346167431 1028298502 /nfs/dbraw/zinc/29/85/02/1028298502.db2.gz KIIBVDIJZRESEY-BEFAXECRSA-N 2 1 336.439 4.142 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@@]3(C2)CCCCO3)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168048485 1028298627 /nfs/dbraw/zinc/29/86/27/1028298627.db2.gz VXDAOMLZXPHMNN-NPDDRXJXSA-N 2 1 342.527 4.073 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)s1 ZINC000162719182 1028306458 /nfs/dbraw/zinc/30/64/58/1028306458.db2.gz JSOMWVUXDSGSDH-OAHLLOKOSA-N 2 1 347.528 4.224 20 0 EIADMP Cc1nccn1CC[N@H+]1CCc2ccccc2[C@H]1Cc1ccccc1 ZINC000346179709 1028308937 /nfs/dbraw/zinc/30/89/37/1028308937.db2.gz JKRZTCFEIIQCHU-JOCHJYFZSA-N 2 1 331.463 4.034 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@](C)(c2ccccc2)C1 ZINC000346230543 1028334839 /nfs/dbraw/zinc/33/48/39/1028334839.db2.gz WQQGZLKPPNOQAV-QFIPXVFZSA-N 2 1 346.478 4.129 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@](C)(c2ccccc2)C1 ZINC000346230542 1028336607 /nfs/dbraw/zinc/33/66/07/1028336607.db2.gz WQQGZLKPPNOQAV-JOCHJYFZSA-N 2 1 346.478 4.129 20 0 EIADMP C[C@H](c1ccccc1)N1CCC([NH2+][C@@H](C)c2cncc(F)c2)CC1 ZINC000125160485 1028356896 /nfs/dbraw/zinc/35/68/96/1028356896.db2.gz XNADHELPFSCIJE-JKSUJKDBSA-N 2 1 327.447 4.097 20 0 EIADMP FC1(F)CC[C@@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000281080509 1028379874 /nfs/dbraw/zinc/37/98/74/1028379874.db2.gz JGEPWXACDHOWRX-AKHDSKFASA-N 2 1 334.454 4.207 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000346350242 1028383895 /nfs/dbraw/zinc/38/38/95/1028383895.db2.gz JTRFTWXYTDLOFE-GLCJEOIMSA-N 2 1 344.462 4.254 20 0 EIADMP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1cnc(C(F)(F)F)s1 ZINC000444003988 1028725847 /nfs/dbraw/zinc/72/58/47/1028725847.db2.gz PLORCEVWLPETJA-OCCSQVGLSA-N 2 1 349.466 4.152 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccnc(Cl)c2)c1 ZINC000161720681 1028743194 /nfs/dbraw/zinc/74/31/94/1028743194.db2.gz JOQSFSNQFFPRSW-HNNXBMFYSA-N 2 1 331.891 4.426 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21)[NH+]1CCCCC1 ZINC000346868722 1028803259 /nfs/dbraw/zinc/80/32/59/1028803259.db2.gz CLLIAUIEOVXVDK-IEBWSBKVSA-N 2 1 328.500 4.287 20 0 EIADMP C(=C\C[N@H+]1CCC[C@@H]1c1cccnc1)\C[NH+]1CCC[C@@H]1c1cccnc1 ZINC000346978600 1028830822 /nfs/dbraw/zinc/83/08/22/1028830822.db2.gz UEZABGVONGZQNQ-KTAFUJLCSA-N 2 1 348.494 4.007 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+]CC[C@H]3CCc4ccccc4N3)CC2)cc1 ZINC000650720442 1028880999 /nfs/dbraw/zinc/88/09/99/1028880999.db2.gz PNGFXMBTMDSBBN-JOCHJYFZSA-N 2 1 349.522 4.058 20 0 EIADMP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C/C=C\c1ccc(OCc2ccccc2)cc1 ZINC000583572431 1028882373 /nfs/dbraw/zinc/88/23/73/1028882373.db2.gz IQSCKUZAJHQEPA-CDKMSYNUSA-N 2 1 336.479 4.090 20 0 EIADMP C[C@@H]1C[C@@H]([NH3+])CC[N@H+]1C/C=C\c1ccc(OCc2ccccc2)cc1 ZINC000583572431 1028882377 /nfs/dbraw/zinc/88/23/77/1028882377.db2.gz IQSCKUZAJHQEPA-CDKMSYNUSA-N 2 1 336.479 4.090 20 0 EIADMP CC(C)c1csc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)n1 ZINC000128533876 1028892378 /nfs/dbraw/zinc/89/23/78/1028892378.db2.gz GIEKMYASGMRKJP-HNNXBMFYSA-N 2 1 347.528 4.058 20 0 EIADMP CC(C)c1csc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)n1 ZINC000128584053 1028898502 /nfs/dbraw/zinc/89/85/02/1028898502.db2.gz HUZRKFOWMSJIHE-OAHLLOKOSA-N 2 1 347.528 4.058 20 0 EIADMP CCOC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCCC1 ZINC000583692769 1029044703 /nfs/dbraw/zinc/04/47/03/1029044703.db2.gz CHIMNFDPWQROOD-HXUWFJFHSA-N 2 1 342.527 4.123 20 0 EIADMP CCOC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCCC1 ZINC000583692769 1029044722 /nfs/dbraw/zinc/04/47/22/1029044722.db2.gz CHIMNFDPWQROOD-HXUWFJFHSA-N 2 1 342.527 4.123 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccc(OC(F)F)cc2)C1 ZINC000151133019 1029150445 /nfs/dbraw/zinc/15/04/45/1029150445.db2.gz IZPAJPSNOYOGFZ-PBHICJAKSA-N 2 1 326.431 4.061 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccc(OC(F)F)cc2)C1 ZINC000151133080 1029150490 /nfs/dbraw/zinc/15/04/90/1029150490.db2.gz IZPAJPSNOYOGFZ-YOEHRIQHSA-N 2 1 326.431 4.061 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(Cl)ccc1OC ZINC000650753400 1029162543 /nfs/dbraw/zinc/16/25/43/1029162543.db2.gz MPGFDCGGFBKQEO-QGZVFWFLSA-N 2 1 336.838 4.187 20 0 EIADMP Cc1nc(F)ccc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000278421069 1029180543 /nfs/dbraw/zinc/18/05/43/1029180543.db2.gz QQHLCPAHPMNYGL-MRXNPFEDSA-N 2 1 341.474 4.051 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000583826820 1029242096 /nfs/dbraw/zinc/24/20/96/1029242096.db2.gz CBHZFJDSRJVGLJ-MRXNPFEDSA-N 2 1 325.500 4.076 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000475119973 1029264809 /nfs/dbraw/zinc/26/48/09/1029264809.db2.gz DWDSLILYMBZVTD-UHFFFAOYSA-N 2 1 326.406 4.074 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[N@H+](C)CCC[NH+]1CCCC1 ZINC000583903650 1029347609 /nfs/dbraw/zinc/34/76/09/1029347609.db2.gz DZCRQPYMOXEXGJ-JQIJEIRASA-N 2 1 338.442 4.109 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[N@@H+](C)CCC[NH+]1CCCC1 ZINC000583903650 1029347626 /nfs/dbraw/zinc/34/76/26/1029347626.db2.gz DZCRQPYMOXEXGJ-JQIJEIRASA-N 2 1 338.442 4.109 20 0 EIADMP CCc1cccc(F)c1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000475199311 1029429908 /nfs/dbraw/zinc/42/99/08/1029429908.db2.gz UMNFRUSKPPPTFV-UHFFFAOYSA-N 2 1 341.474 4.301 20 0 EIADMP CCC[N@@H+](C1CCOCC1)C1C[C@H](C)N(Cc2ccccc2)[C@@H](C)C1 ZINC001168059633 1029437940 /nfs/dbraw/zinc/43/79/40/1029437940.db2.gz USQPLUTXAFCUSS-OALUTQOASA-N 2 1 344.543 4.319 20 0 EIADMP CCC[N@H+](C1CCOCC1)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168059633 1029437948 /nfs/dbraw/zinc/43/79/48/1029437948.db2.gz USQPLUTXAFCUSS-OALUTQOASA-N 2 1 344.543 4.319 20 0 EIADMP CCC[N@@H+](C1CCOCC1)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168059633 1029437956 /nfs/dbraw/zinc/43/79/56/1029437956.db2.gz USQPLUTXAFCUSS-OALUTQOASA-N 2 1 344.543 4.319 20 0 EIADMP CC(C)[N@H+](CCCCCO)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060697 1029494234 /nfs/dbraw/zinc/49/42/34/1029494234.db2.gz XSYIYRAVDYZUOI-PMACEKPBSA-N 2 1 346.559 4.301 20 0 EIADMP CC(C)[N@@H+](CCCCCO)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060697 1029494239 /nfs/dbraw/zinc/49/42/39/1029494239.db2.gz XSYIYRAVDYZUOI-PMACEKPBSA-N 2 1 346.559 4.301 20 0 EIADMP C[C@H](CC[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)OCc1ccccc1 ZINC000475313369 1029525172 /nfs/dbraw/zinc/52/51/72/1029525172.db2.gz PDYWFZLWAWGFBN-SVFBPWRDSA-N 2 1 344.543 4.224 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000325120025 1029610288 /nfs/dbraw/zinc/61/02/88/1029610288.db2.gz TXDUZUIUWHWESU-QGZVFWFLSA-N 2 1 326.484 4.203 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC000325120025 1029610298 /nfs/dbraw/zinc/61/02/98/1029610298.db2.gz TXDUZUIUWHWESU-QGZVFWFLSA-N 2 1 326.484 4.203 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+](Cc1ccccc1)Cc1ccccc1F ZINC000584121770 1029632907 /nfs/dbraw/zinc/63/29/07/1029632907.db2.gz XKMVJPYMUNIUBW-UHFFFAOYSA-N 2 1 337.442 4.194 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC000584121770 1029632911 /nfs/dbraw/zinc/63/29/11/1029632911.db2.gz XKMVJPYMUNIUBW-UHFFFAOYSA-N 2 1 337.442 4.194 20 0 EIADMP CC[N@H+](Cc1ccccn1)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168065458 1029649981 /nfs/dbraw/zinc/64/99/81/1029649981.db2.gz WLTSIEWQFYPUNP-OALUTQOASA-N 2 1 337.511 4.345 20 0 EIADMP CC[N@@H+](Cc1ccccn1)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168065458 1029649987 /nfs/dbraw/zinc/64/99/87/1029649987.db2.gz WLTSIEWQFYPUNP-OALUTQOASA-N 2 1 337.511 4.345 20 0 EIADMP C[N@@H+](CCCSc1ccccc1Cl)C[C@H]1CCC[NH+](C)C1 ZINC000525488187 1029653180 /nfs/dbraw/zinc/65/31/80/1029653180.db2.gz FQMHIYUCKRRMEV-HNNXBMFYSA-N 2 1 326.937 4.096 20 0 EIADMP C[NH+](CCCSc1ccccc1Cl)C[C@H]1CCC[N@H+](C)C1 ZINC000525488187 1029653184 /nfs/dbraw/zinc/65/31/84/1029653184.db2.gz FQMHIYUCKRRMEV-HNNXBMFYSA-N 2 1 326.937 4.096 20 0 EIADMP C[NH+](CCCSc1ccccc1Cl)C[C@H]1CCC[N@@H+](C)C1 ZINC000525488187 1029653191 /nfs/dbraw/zinc/65/31/91/1029653191.db2.gz FQMHIYUCKRRMEV-HNNXBMFYSA-N 2 1 326.937 4.096 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](CN(C)Cc3cccc(F)c3)C2)s1 ZINC000584259149 1029698290 /nfs/dbraw/zinc/69/82/90/1029698290.db2.gz YOSSQWDXGFTCOD-QGZVFWFLSA-N 2 1 332.488 4.150 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)Cc3cccc(F)c3)C2)s1 ZINC000584259149 1029698303 /nfs/dbraw/zinc/69/83/03/1029698303.db2.gz YOSSQWDXGFTCOD-QGZVFWFLSA-N 2 1 332.488 4.150 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)Cc3cccc(F)c3)C2)s1 ZINC000584259149 1029698304 /nfs/dbraw/zinc/69/83/04/1029698304.db2.gz YOSSQWDXGFTCOD-QGZVFWFLSA-N 2 1 332.488 4.150 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CCC(C(F)F)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168065796 1029711868 /nfs/dbraw/zinc/71/18/68/1029711868.db2.gz YGDUHVALNFCFQE-HGKCTWBKSA-N 2 1 336.470 4.405 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000301386764 1029721537 /nfs/dbraw/zinc/72/15/37/1029721537.db2.gz WCONIRANVJRVMO-MRXNPFEDSA-N 2 1 329.875 4.343 20 0 EIADMP CC(C)OCC[NH+]1CCC(Nc2cc[nH+]c3ccc(Cl)cc23)CC1 ZINC000301480930 1029740840 /nfs/dbraw/zinc/74/08/40/1029740840.db2.gz SAXGGWCKVSZFJJ-UHFFFAOYSA-N 2 1 347.890 4.190 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNCc1ccc(Cl)cc1F ZINC000708519308 1029743514 /nfs/dbraw/zinc/74/35/14/1029743514.db2.gz HNRPWTURFWUPRO-QAPCUYQASA-N 2 1 346.877 4.337 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)cc1F ZINC000708519308 1029743520 /nfs/dbraw/zinc/74/35/20/1029743520.db2.gz HNRPWTURFWUPRO-QAPCUYQASA-N 2 1 346.877 4.337 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)cc1F ZINC000708519308 1029743524 /nfs/dbraw/zinc/74/35/24/1029743524.db2.gz HNRPWTURFWUPRO-QAPCUYQASA-N 2 1 346.877 4.337 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081635622 1029810601 /nfs/dbraw/zinc/81/06/01/1029810601.db2.gz CHFDMRGSKJGPAF-GDBMZVCRSA-N 2 1 338.442 4.013 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081635622 1029810605 /nfs/dbraw/zinc/81/06/05/1029810605.db2.gz CHFDMRGSKJGPAF-GDBMZVCRSA-N 2 1 338.442 4.013 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000081635622 1029810609 /nfs/dbraw/zinc/81/06/09/1029810609.db2.gz CHFDMRGSKJGPAF-GDBMZVCRSA-N 2 1 338.442 4.013 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081635622 1029810616 /nfs/dbraw/zinc/81/06/16/1029810616.db2.gz CHFDMRGSKJGPAF-GDBMZVCRSA-N 2 1 338.442 4.013 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNCc1ccc(F)cc1Cl ZINC000708523246 1029813172 /nfs/dbraw/zinc/81/31/72/1029813172.db2.gz LNYFQECPRRPPNA-CRAIPNDOSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(F)cc1Cl ZINC000708523246 1029813173 /nfs/dbraw/zinc/81/31/73/1029813173.db2.gz LNYFQECPRRPPNA-CRAIPNDOSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(F)cc1Cl ZINC000708523246 1029813175 /nfs/dbraw/zinc/81/31/75/1029813175.db2.gz LNYFQECPRRPPNA-CRAIPNDOSA-N 2 1 346.877 4.337 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cnc(C2CCCCC2)s1 ZINC000084021665 1029822670 /nfs/dbraw/zinc/82/26/70/1029822670.db2.gz HYQSSKVSGIGTSK-AWEZNQCLSA-N 2 1 332.517 4.122 20 0 EIADMP C[N@H+]1CC[C@@H](C[NH2+]Cc2ccc3occc3c2)[C@H]1c1cccs1 ZINC000375751890 1029864758 /nfs/dbraw/zinc/86/47/58/1029864758.db2.gz YBYZZMBGUXNQDJ-LPHOPBHVSA-N 2 1 326.465 4.277 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000091265330 1029882896 /nfs/dbraw/zinc/88/28/96/1029882896.db2.gz BPMHMXHLLDGRMO-QGZVFWFLSA-N 2 1 326.406 4.230 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cccnc1 ZINC000091313592 1029883725 /nfs/dbraw/zinc/88/37/25/1029883725.db2.gz TXPDWNSVXUDSTC-YLJYHZDGSA-N 2 1 343.540 4.342 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccnc1 ZINC000091313592 1029883727 /nfs/dbraw/zinc/88/37/27/1029883727.db2.gz TXPDWNSVXUDSTC-YLJYHZDGSA-N 2 1 343.540 4.342 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657867194 1029951063 /nfs/dbraw/zinc/95/10/63/1029951063.db2.gz KJUJATXCGMCYMJ-MJGOQNOKSA-N 2 1 349.478 4.043 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657867194 1029951090 /nfs/dbraw/zinc/95/10/90/1029951090.db2.gz KJUJATXCGMCYMJ-MJGOQNOKSA-N 2 1 349.478 4.043 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@H+](C[C@H]3CCCCC3(F)F)C1)CCCC2 ZINC000450788098 1029984000 /nfs/dbraw/zinc/98/40/00/1029984000.db2.gz TUOLCUOOIRFOKH-CVEARBPZSA-N 2 1 337.458 4.143 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@@H+](C[C@H]3CCCCC3(F)F)C1)CCCC2 ZINC000450788098 1029984017 /nfs/dbraw/zinc/98/40/17/1029984017.db2.gz TUOLCUOOIRFOKH-CVEARBPZSA-N 2 1 337.458 4.143 20 0 EIADMP Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C3CCC3)C1)CCC2 ZINC000183187796 1029992936 /nfs/dbraw/zinc/99/29/36/1029992936.db2.gz DHDHOQQKKDMISZ-UNEWFSDZSA-N 2 1 333.545 4.072 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000657875702 1030144424 /nfs/dbraw/zinc/14/44/24/1030144424.db2.gz HSGZOLSWTBAQGI-TZMCWYRMSA-N 2 1 348.840 4.221 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H](c2cccnc2)C2CC2)C3)cc1 ZINC000447588807 1030189543 /nfs/dbraw/zinc/18/95/43/1030189543.db2.gz VNTDPFGVYHXBDI-KAOXLYBCSA-N 2 1 347.506 4.318 20 0 EIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000261895241 1030259505 /nfs/dbraw/zinc/25/95/05/1030259505.db2.gz OFRPEUBQQFGASB-ZIAGYGMSSA-N 2 1 326.406 4.230 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cnn(C(C)(C)C)c2)CC1)CC(C)C ZINC000685462626 1030341246 /nfs/dbraw/zinc/34/12/46/1030341246.db2.gz KIUHCPWYYBROTH-UHFFFAOYSA-N 2 1 348.579 4.218 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)ccc1C ZINC000447813057 1030355493 /nfs/dbraw/zinc/35/54/93/1030355493.db2.gz PTOCSLBXQFWEJH-GOSISDBHSA-N 2 1 344.524 4.067 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1C ZINC000447813057 1030355509 /nfs/dbraw/zinc/35/55/09/1030355509.db2.gz PTOCSLBXQFWEJH-GOSISDBHSA-N 2 1 344.524 4.067 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470102 1030356090 /nfs/dbraw/zinc/35/60/90/1030356090.db2.gz WFKFTOJMZXJMBP-PGRDOPGGSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470102 1030356110 /nfs/dbraw/zinc/35/61/10/1030356110.db2.gz WFKFTOJMZXJMBP-PGRDOPGGSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470102 1030356128 /nfs/dbraw/zinc/35/61/28/1030356128.db2.gz WFKFTOJMZXJMBP-PGRDOPGGSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470102 1030356146 /nfs/dbraw/zinc/35/61/46/1030356146.db2.gz WFKFTOJMZXJMBP-PGRDOPGGSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470101 1030357222 /nfs/dbraw/zinc/35/72/22/1030357222.db2.gz WFKFTOJMZXJMBP-GCJKJVERSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470101 1030357241 /nfs/dbraw/zinc/35/72/41/1030357241.db2.gz WFKFTOJMZXJMBP-GCJKJVERSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470101 1030357256 /nfs/dbraw/zinc/35/72/56/1030357256.db2.gz WFKFTOJMZXJMBP-GCJKJVERSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685470101 1030357273 /nfs/dbraw/zinc/35/72/73/1030357273.db2.gz WFKFTOJMZXJMBP-GCJKJVERSA-N 2 1 337.511 4.227 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000657893066 1030392855 /nfs/dbraw/zinc/39/28/55/1030392855.db2.gz ZSXOBQNORMPBTL-BZPMIXESSA-N 2 1 348.840 4.362 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000657893066 1030392873 /nfs/dbraw/zinc/39/28/73/1030392873.db2.gz ZSXOBQNORMPBTL-BZPMIXESSA-N 2 1 348.840 4.362 20 0 EIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(SC2CCCC2)cc1 ZINC000530513343 1030504472 /nfs/dbraw/zinc/50/44/72/1030504472.db2.gz KTTQZBSUDMGVNK-HNNXBMFYSA-N 2 1 329.513 4.348 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3csc(Cl)c3)CC2)[nH+]1 ZINC000191294213 1030613018 /nfs/dbraw/zinc/61/30/18/1030613018.db2.gz PSTRRBJXAQVFRH-CYBMUJFWSA-N 2 1 335.904 4.425 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3csc(Cl)c3)CC2)[nH+]1 ZINC000191294199 1030613513 /nfs/dbraw/zinc/61/35/13/1030613513.db2.gz PSTRRBJXAQVFRH-ZDUSSCGKSA-N 2 1 335.904 4.425 20 0 EIADMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cnn1C(C)(C)C ZINC000191325779 1030617308 /nfs/dbraw/zinc/61/73/08/1030617308.db2.gz JLNLOWYSWRGGMH-INIZCTEOSA-N 2 1 346.563 4.394 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000685665175 1030664256 /nfs/dbraw/zinc/66/42/56/1030664256.db2.gz HDQIYFLOXYCNAU-LPHOPBHVSA-N 2 1 343.540 4.404 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000685665175 1030664269 /nfs/dbraw/zinc/66/42/69/1030664269.db2.gz HDQIYFLOXYCNAU-LPHOPBHVSA-N 2 1 343.540 4.404 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1coc2ccccc12 ZINC000398108254 1030696760 /nfs/dbraw/zinc/69/67/60/1030696760.db2.gz CDZZNAMKPLQJRD-UTKZUKDTSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1coc2ccccc12 ZINC000398108254 1030696766 /nfs/dbraw/zinc/69/67/66/1030696766.db2.gz CDZZNAMKPLQJRD-UTKZUKDTSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000398141017 1030712719 /nfs/dbraw/zinc/71/27/19/1030712719.db2.gz MKDMZWFOSIQGRI-UWJYYQICSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000398141017 1030712743 /nfs/dbraw/zinc/71/27/43/1030712743.db2.gz MKDMZWFOSIQGRI-UWJYYQICSA-N 2 1 333.479 4.168 20 0 EIADMP CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc(-n3ccnc3)cc2)s1 ZINC000122200465 1030734705 /nfs/dbraw/zinc/73/47/05/1030734705.db2.gz JZEZMQCZWMAXKF-OAHLLOKOSA-N 2 1 340.496 4.393 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3c(F)cccc3F)o2)CCN1C ZINC000093644178 1030739925 /nfs/dbraw/zinc/73/99/25/1030739925.db2.gz KJHJAGJMJGFZQR-UONOGXRCSA-N 2 1 334.410 4.139 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccccn1 ZINC000658064688 1030804169 /nfs/dbraw/zinc/80/41/69/1030804169.db2.gz QDBVLIPEOCQMGL-LCKKVJLRSA-N 2 1 349.522 4.075 20 0 EIADMP CC[C@@H](COCC1CC1)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000658089999 1030818860 /nfs/dbraw/zinc/81/88/60/1030818860.db2.gz DKRBQKAOCCYZII-BEFAXECRSA-N 2 1 327.472 4.037 20 0 EIADMP CC1(C)[C@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1(F)F ZINC000658280749 1030938563 /nfs/dbraw/zinc/93/85/63/1030938563.db2.gz LCKZLVROWVDLOO-FJIDUMEYSA-N 2 1 334.454 4.063 20 0 EIADMP c1ccc(C[N@@H+]2C[C@@H](C[NH2+][C@H]3CCCSCC3)C3(CCC3)C2)cc1 ZINC000658318855 1030980331 /nfs/dbraw/zinc/98/03/31/1030980331.db2.gz SYJIGFXSIYEVLD-UXHICEINSA-N 2 1 344.568 4.164 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319486 1030981817 /nfs/dbraw/zinc/98/18/17/1030981817.db2.gz CHDFHURGPJGCHJ-WIYYLYMNSA-N 2 1 335.495 4.035 20 0 EIADMP COCCC1CC[NH+](C2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000527937892 1030981659 /nfs/dbraw/zinc/98/16/59/1030981659.db2.gz VNCCKVZBWJLSNM-UHFFFAOYSA-N 2 1 344.543 4.178 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cccnc1 ZINC000658320506 1030984774 /nfs/dbraw/zinc/98/47/74/1030984774.db2.gz YWLGNKGGFLMZFN-NQIIRXRSSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CCc3cccnc3CC2)CC1 ZINC000421830395 1031036002 /nfs/dbraw/zinc/03/60/02/1031036002.db2.gz JUUDDVRAZPSZLW-RXVVDRJESA-N 2 1 349.522 4.144 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCOc2ccc3ccccc3c2)CC[N@@H+]1C ZINC000531381781 1031176588 /nfs/dbraw/zinc/17/65/88/1031176588.db2.gz IKENAGHTTQFRTO-XLIONFOSSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCOc2ccc3ccccc3c2)CC[N@H+]1C ZINC000531381781 1031176591 /nfs/dbraw/zinc/17/65/91/1031176591.db2.gz IKENAGHTTQFRTO-XLIONFOSSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCOc2ccc3ccccc3c2)CC[NH+]1C ZINC000531381781 1031176595 /nfs/dbraw/zinc/17/65/95/1031176595.db2.gz IKENAGHTTQFRTO-XLIONFOSSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCOc2ccc3ccccc3c2)CC[NH+]1C ZINC000531381781 1031176600 /nfs/dbraw/zinc/17/66/00/1031176600.db2.gz IKENAGHTTQFRTO-XLIONFOSSA-N 2 1 326.484 4.023 20 0 EIADMP C[N@@H+]1CC[C@H](N[C@H]2CCCOc3ccccc32)C[C@H]1c1ccccc1 ZINC000340219129 1031195244 /nfs/dbraw/zinc/19/52/44/1031195244.db2.gz IHHBPSSBEMVQKX-JBACZVJFSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@H+]1CC[C@H](N[C@H]2CCCOc3ccccc32)C[C@H]1c1ccccc1 ZINC000340219129 1031195257 /nfs/dbraw/zinc/19/52/57/1031195257.db2.gz IHHBPSSBEMVQKX-JBACZVJFSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCOc3ccccc32)C[C@H]1c1ccccc1 ZINC000340219129 1031195268 /nfs/dbraw/zinc/19/52/68/1031195268.db2.gz IHHBPSSBEMVQKX-JBACZVJFSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCOc3ccccc32)C[C@H]1c1ccccc1 ZINC000340219129 1031195278 /nfs/dbraw/zinc/19/52/78/1031195278.db2.gz IHHBPSSBEMVQKX-JBACZVJFSA-N 2 1 336.479 4.325 20 0 EIADMP Clc1ccc(C[C@@H]2CCC[C@@H]2[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000449071471 1031423887 /nfs/dbraw/zinc/42/38/87/1031423887.db2.gz NYIYDNSDLNVTOK-JXFKEZNVSA-N 2 1 332.919 4.268 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]C2CCC(OC3CCCC3)CC2)C1 ZINC000449081659 1031437505 /nfs/dbraw/zinc/43/75/05/1031437505.db2.gz GYUINPOQOWOMHU-JSOIOWGOSA-N 2 1 336.564 4.359 20 0 EIADMP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H](C)c2cccc(O)c2)CC1 ZINC000449129589 1031467866 /nfs/dbraw/zinc/46/78/66/1031467866.db2.gz CSAIJQUWEVHKKB-QZTJIDSGSA-N 2 1 338.495 4.138 20 0 EIADMP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000531678114 1031471581 /nfs/dbraw/zinc/47/15/81/1031471581.db2.gz VRROQNAPIHJLCV-KSFYIVLOSA-N 2 1 338.470 4.313 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H](CC)C3CCC3)CC2)cs1 ZINC000449151016 1031483941 /nfs/dbraw/zinc/48/39/41/1031483941.db2.gz VEWDAFXNMYEBGE-SFHVURJKSA-N 2 1 335.561 4.086 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCSc3ccccc32)c1 ZINC000123917552 1031493577 /nfs/dbraw/zinc/49/35/77/1031493577.db2.gz PADVWXUBIVDBNR-LJQANCHMSA-N 2 1 326.509 4.465 20 0 EIADMP COc1cc(C)ccc1[C@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000531737064 1031516428 /nfs/dbraw/zinc/51/64/28/1031516428.db2.gz CMYXAHQNWHUYSP-KRWDZBQOSA-N 2 1 330.516 4.451 20 0 EIADMP COCC1CCC([NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000449182191 1031519794 /nfs/dbraw/zinc/51/97/94/1031519794.db2.gz BAUUULOVANMAGT-DMKPSLHHSA-N 2 1 327.472 4.037 20 0 EIADMP CC[C@@H]([NH2+]CC1([NH2+][C@H](C)c2ccccc2)CCCC1)C1CCOCC1 ZINC000531722654 1031522693 /nfs/dbraw/zinc/52/26/93/1031522693.db2.gz IUQRRDUXWZBYJE-WIYYLYMNSA-N 2 1 344.543 4.445 20 0 EIADMP CC(C)[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1CC1 ZINC000531725019 1031527202 /nfs/dbraw/zinc/52/72/02/1031527202.db2.gz UMRHQYGJKLFRPZ-NRFANRHFSA-N 2 1 326.484 4.436 20 0 EIADMP Cc1[nH]c2ccccc2c1C1CC[NH+](CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC000124971863 1031562220 /nfs/dbraw/zinc/56/22/20/1031562220.db2.gz LOCHTFBFMMFGRK-SFHVURJKSA-N 2 1 325.500 4.140 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000125535975 1031600679 /nfs/dbraw/zinc/60/06/79/1031600679.db2.gz QJGPURVAKGVXDH-GOSISDBHSA-N 2 1 329.513 4.086 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000125535975 1031600698 /nfs/dbraw/zinc/60/06/98/1031600698.db2.gz QJGPURVAKGVXDH-GOSISDBHSA-N 2 1 329.513 4.086 20 0 EIADMP Cc1cccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1F ZINC000449291126 1031621288 /nfs/dbraw/zinc/62/12/88/1031621288.db2.gz JISVBAGRDPUFQM-UHFFFAOYSA-N 2 1 327.447 4.047 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1cccc(OC)c1 ZINC000128099620 1031723068 /nfs/dbraw/zinc/72/30/68/1031723068.db2.gz ZFLCSKLAHMDQIH-FQEVSTJZSA-N 2 1 339.483 4.108 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1cccc(OC)c1 ZINC000128099847 1031724815 /nfs/dbraw/zinc/72/48/15/1031724815.db2.gz ZFLCSKLAHMDQIH-HXUWFJFHSA-N 2 1 339.483 4.108 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCO[C@@H](C(C)C)C2)cc1 ZINC000449494199 1031803780 /nfs/dbraw/zinc/80/37/80/1031803780.db2.gz MYYCQYRZLNEFBW-DJPFJPOOSA-N 2 1 341.499 4.283 20 0 EIADMP C/C=C\COc1ccc(CC[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000449560321 1031848162 /nfs/dbraw/zinc/84/81/62/1031848162.db2.gz JJJMNEODENUPIH-XWMUGEHUSA-N 2 1 342.527 4.177 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)C1CCOCC1 ZINC000531947150 1031859718 /nfs/dbraw/zinc/85/97/18/1031859718.db2.gz HNGSHGJGTZTUDG-AVRDEDQJSA-N 2 1 344.543 4.213 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(NC2CC[NH+](C3CC3)CC2)cc1 ZINC000459344584 1031863849 /nfs/dbraw/zinc/86/38/49/1031863849.db2.gz NXZKXOZBZHKYNV-QGZVFWFLSA-N 2 1 327.516 4.100 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccccc2C(F)(F)F)C1 ZINC000531958972 1031878902 /nfs/dbraw/zinc/87/89/02/1031878902.db2.gz HCMKGAVIKAHKPO-LSDHHAIUSA-N 2 1 328.422 4.476 20 0 EIADMP Fc1ccc(CC2([NH2+]C3CC[NH+](Cc4ccccc4)CC3)CC2)cc1 ZINC000453369377 1031915150 /nfs/dbraw/zinc/91/51/50/1031915150.db2.gz UVEPFMYQSUIZBA-UHFFFAOYSA-N 2 1 338.470 4.155 20 0 EIADMP COc1ccc([C@@H]([NH2+]CCCC[N@@H+](C)C2CC2)c2ccccc2)cc1 ZINC000453399779 1031933760 /nfs/dbraw/zinc/93/37/60/1031933760.db2.gz LIZGDZMFEWGWAD-QFIPXVFZSA-N 2 1 338.495 4.249 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]CCCC[N@@H+](C)C3CC3)oc21 ZINC000453417535 1031951622 /nfs/dbraw/zinc/95/16/22/1031951622.db2.gz XUGYKEQVGUAKCT-HNNXBMFYSA-N 2 1 330.472 4.357 20 0 EIADMP C[N@@H+](CCCC[NH2+]C1CC(c2ccc(C(F)(F)F)cc2)C1)C1CC1 ZINC000453395986 1031965746 /nfs/dbraw/zinc/96/57/46/1031965746.db2.gz IJTWUAINQNWEKW-UHFFFAOYSA-N 2 1 340.433 4.415 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Br)cc1F ZINC000453420113 1031975240 /nfs/dbraw/zinc/97/52/40/1031975240.db2.gz ZDVMRTBSCIFKOC-LBPRGKRZSA-N 2 1 343.284 4.113 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCOC(C)(C)C2)CC1 ZINC000453424147 1031978100 /nfs/dbraw/zinc/97/81/00/1031978100.db2.gz NIJFTUIFIMABBV-QNGMFEMESA-N 2 1 344.543 4.224 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCOC(C)(C)C2)CC1 ZINC000453424146 1031979364 /nfs/dbraw/zinc/97/93/64/1031979364.db2.gz NIJFTUIFIMABBV-MWXLCCTBSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccc(Cl)nc1 ZINC000179135362 1032018200 /nfs/dbraw/zinc/01/82/00/1032018200.db2.gz ZMHJBOORUBZAJO-JKSUJKDBSA-N 2 1 331.891 4.296 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(Cl)nc1 ZINC000179135362 1032018223 /nfs/dbraw/zinc/01/82/23/1032018223.db2.gz ZMHJBOORUBZAJO-JKSUJKDBSA-N 2 1 331.891 4.296 20 0 EIADMP C[N@@H+](CCCOc1cccc2ccccc21)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512557095 1033340837 /nfs/dbraw/zinc/34/08/37/1033340837.db2.gz LIJRRQAYUANQKE-YOFSQIOKSA-N 2 1 338.495 4.166 20 0 EIADMP C[NH+](CCCOc1cccc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000512557095 1033340848 /nfs/dbraw/zinc/34/08/48/1033340848.db2.gz LIJRRQAYUANQKE-YOFSQIOKSA-N 2 1 338.495 4.166 20 0 EIADMP C[NH+](CCCOc1cccc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000512557095 1033340863 /nfs/dbraw/zinc/34/08/63/1033340863.db2.gz LIJRRQAYUANQKE-YOFSQIOKSA-N 2 1 338.495 4.166 20 0 EIADMP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+]CC4CCSCC4)[C@H]3C2)cc1 ZINC000512612335 1033493445 /nfs/dbraw/zinc/49/34/45/1033493445.db2.gz OMBCFARABUWQKZ-ACRUOGEOSA-N 2 1 344.568 4.020 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000512646589 1033612876 /nfs/dbraw/zinc/61/28/76/1033612876.db2.gz BMWAUGSCCQIEGO-IYWMVGAKSA-N 2 1 348.481 4.455 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000512653432 1033620799 /nfs/dbraw/zinc/62/07/99/1033620799.db2.gz FHIFODHMDTVILA-OKZBNKHCSA-N 2 1 340.433 4.219 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512741791 1033841328 /nfs/dbraw/zinc/84/13/28/1033841328.db2.gz ZPKISUWAQYTNPN-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512741791 1033841332 /nfs/dbraw/zinc/84/13/32/1033841332.db2.gz ZPKISUWAQYTNPN-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512741791 1033841333 /nfs/dbraw/zinc/84/13/33/1033841333.db2.gz ZPKISUWAQYTNPN-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512741791 1033841337 /nfs/dbraw/zinc/84/13/37/1033841337.db2.gz ZPKISUWAQYTNPN-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP COCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCCC1 ZINC000513341518 1034889279 /nfs/dbraw/zinc/88/92/79/1034889279.db2.gz WCMYHAZKHGUJAR-TZIWHRDSSA-N 2 1 344.543 4.226 20 0 EIADMP COCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCCC1 ZINC000513341518 1034889282 /nfs/dbraw/zinc/88/92/82/1034889282.db2.gz WCMYHAZKHGUJAR-TZIWHRDSSA-N 2 1 344.543 4.226 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)c1 ZINC000513365062 1034893411 /nfs/dbraw/zinc/89/34/11/1034893411.db2.gz KFHQLTHSOYYYJE-LJQANCHMSA-N 2 1 330.422 4.194 20 0 EIADMP c1cc2c(cccc2C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)[nH]1 ZINC000513437901 1034946201 /nfs/dbraw/zinc/94/62/01/1034946201.db2.gz GROSGYUDHDQGST-SFHVURJKSA-N 2 1 325.500 4.256 20 0 EIADMP COc1cccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000513510913 1035005488 /nfs/dbraw/zinc/00/54/88/1035005488.db2.gz GNHOOBOTGVCYPJ-GHTZIAJQSA-N 2 1 338.495 4.086 20 0 EIADMP CCc1nc(C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cs1 ZINC000513546753 1035028303 /nfs/dbraw/zinc/02/83/03/1035028303.db2.gz ZPSJVNKCPWTJRS-AEFFLSMTSA-N 2 1 343.540 4.096 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]C4CCSCC4)[C@@H]3C2)cc1 ZINC000513683636 1035100396 /nfs/dbraw/zinc/10/03/96/1035100396.db2.gz LUBPYKMVIWMFOB-CEWLAPEOSA-N 2 1 344.568 4.162 20 0 EIADMP C[C@@H](c1cc(F)ccc1F)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501017326 1035350947 /nfs/dbraw/zinc/35/09/47/1035350947.db2.gz AZRDQTGDYCVLSY-HNNXBMFYSA-N 2 1 345.437 4.269 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000501427111 1035442994 /nfs/dbraw/zinc/44/29/94/1035442994.db2.gz VSRGTVVKGNWPIA-MRXNPFEDSA-N 2 1 344.449 4.028 20 0 EIADMP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3nc(-c4ccccc4Cl)cs3)C[C@H]21 ZINC000420302382 1035502629 /nfs/dbraw/zinc/50/26/29/1035502629.db2.gz FUOFVAXWRFCLFU-JGGQBBKZSA-N 2 1 347.915 4.023 20 0 EIADMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3nc(-c4ccccc4Cl)cs3)C[C@H]21 ZINC000420302382 1035502637 /nfs/dbraw/zinc/50/26/37/1035502637.db2.gz FUOFVAXWRFCLFU-JGGQBBKZSA-N 2 1 347.915 4.023 20 0 EIADMP Cc1cc(C)c(C[N@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)c(C)c1 ZINC000420315547 1035509570 /nfs/dbraw/zinc/50/95/70/1035509570.db2.gz RXONFSSLNVFCKM-OAQYLSRUSA-N 2 1 337.511 4.151 20 0 EIADMP Cc1cc(C)c(C[N@@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)c(C)c1 ZINC000420315547 1035509590 /nfs/dbraw/zinc/50/95/90/1035509590.db2.gz RXONFSSLNVFCKM-OAQYLSRUSA-N 2 1 337.511 4.151 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000595073428 1035555763 /nfs/dbraw/zinc/55/57/63/1035555763.db2.gz SLDWDSCGUNGRBI-PKOBYXMFSA-N 2 1 332.557 4.020 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1cnn(C2CCC2)c1 ZINC000924856473 1035657283 /nfs/dbraw/zinc/65/72/83/1035657283.db2.gz OFYFYSUCTITLDV-KRWDZBQOSA-N 2 1 344.547 4.303 20 0 EIADMP CC(C)[NH2+]CCCC[C@H]([NH3+])c1nc(-c2ccc3sccc3c2)no1 ZINC001212145573 1035941155 /nfs/dbraw/zinc/94/11/55/1035941155.db2.gz XIXXLFYQDYCCIP-HNNXBMFYSA-N 2 1 344.484 4.119 20 0 EIADMP CC[N@H+]1CCC[C@H]1CN[C@@H](C)c1ccc(SC(F)F)c(OC)c1 ZINC000156592953 1036053752 /nfs/dbraw/zinc/05/37/52/1036053752.db2.gz QJSDZLJIIJPCDX-JSGCOSHPSA-N 2 1 344.471 4.145 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)C1 ZINC000502415624 1036199616 /nfs/dbraw/zinc/19/96/16/1036199616.db2.gz MWJJJMOAJQQOHD-ROUUACIJSA-N 2 1 332.536 4.017 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)C1 ZINC000502415624 1036199639 /nfs/dbraw/zinc/19/96/39/1036199639.db2.gz MWJJJMOAJQQOHD-ROUUACIJSA-N 2 1 332.536 4.017 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)oc1C ZINC000502476729 1036256590 /nfs/dbraw/zinc/25/65/90/1036256590.db2.gz YRGTYGGBRPCHRW-FUHIMQAGSA-N 2 1 326.484 4.458 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000502476729 1036256603 /nfs/dbraw/zinc/25/66/03/1036256603.db2.gz YRGTYGGBRPCHRW-FUHIMQAGSA-N 2 1 326.484 4.458 20 0 EIADMP Fc1cccc([C@H]2C[C@@H]2[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000906589311 1036335646 /nfs/dbraw/zinc/33/56/46/1036335646.db2.gz VNXQATCLNPJVKK-UXHICEINSA-N 2 1 339.458 4.094 20 0 EIADMP CCSCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000572036355 1036397918 /nfs/dbraw/zinc/39/79/18/1036397918.db2.gz NNTAFJVOTZBNSP-PKOBYXMFSA-N 2 1 332.557 4.305 20 0 EIADMP CCSCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000572036355 1036397931 /nfs/dbraw/zinc/39/79/31/1036397931.db2.gz NNTAFJVOTZBNSP-PKOBYXMFSA-N 2 1 332.557 4.305 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1cnn(C2CCCC2)c1 ZINC000502698436 1036512066 /nfs/dbraw/zinc/51/20/66/1036512066.db2.gz SFYAQHWYKYDODE-QGZVFWFLSA-N 2 1 332.536 4.303 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1cnn(C2CCCC2)c1 ZINC000502698436 1036512091 /nfs/dbraw/zinc/51/20/91/1036512091.db2.gz SFYAQHWYKYDODE-QGZVFWFLSA-N 2 1 332.536 4.303 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000502699189 1036522741 /nfs/dbraw/zinc/52/27/41/1036522741.db2.gz XMMPUJWYZLAFAR-YUXAGFNASA-N 2 1 344.543 4.356 20 0 EIADMP CCC[N@H+](CCCCn1cc[nH+]c1C)[C@H]1CCc2ccccc2C1 ZINC000502701672 1036527412 /nfs/dbraw/zinc/52/74/12/1036527412.db2.gz KEIPHJSSROFGGS-NRFANRHFSA-N 2 1 325.500 4.241 20 0 EIADMP CCC[N@@H+](CCCCn1cc[nH+]c1C)[C@H]1CCc2ccccc2C1 ZINC000502701672 1036527450 /nfs/dbraw/zinc/52/74/50/1036527450.db2.gz KEIPHJSSROFGGS-NRFANRHFSA-N 2 1 325.500 4.241 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](CCc1ccccc1)C1CCCC1 ZINC000502703081 1036530995 /nfs/dbraw/zinc/53/09/95/1036530995.db2.gz VGPMETZMXRFLIJ-UHFFFAOYSA-N 2 1 325.500 4.459 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](CCc1ccccc1)C1CCCC1 ZINC000502703081 1036531030 /nfs/dbraw/zinc/53/10/30/1036531030.db2.gz VGPMETZMXRFLIJ-UHFFFAOYSA-N 2 1 325.500 4.459 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)CC1 ZINC000602709892 1036582200 /nfs/dbraw/zinc/58/22/00/1036582200.db2.gz JKAKYPCQCGQEFL-UYAOXDASSA-N 2 1 344.568 4.477 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)CC1 ZINC000602709892 1036582218 /nfs/dbraw/zinc/58/22/18/1036582218.db2.gz JKAKYPCQCGQEFL-UYAOXDASSA-N 2 1 344.568 4.477 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[C@@H]1c1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486479363 1036726556 /nfs/dbraw/zinc/72/65/56/1036726556.db2.gz VFVYEWZFCSNSIK-FDTGPBLFSA-N 2 1 334.507 4.290 20 0 EIADMP c1ccc(C[N@@H+](C2CCSCC2)C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168389238 1036736301 /nfs/dbraw/zinc/73/63/01/1036736301.db2.gz MAPFDGOXTGZKIF-UHFFFAOYSA-N 2 1 344.568 4.259 20 0 EIADMP Clc1ccccc1OC1CC[NH+](C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168392653 1036853441 /nfs/dbraw/zinc/85/34/41/1036853441.db2.gz RNXIDYPMOCWQSV-UHFFFAOYSA-N 2 1 348.918 4.058 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3[nH]nc4ccccc43)cc2)C1 ZINC000589641196 1036857336 /nfs/dbraw/zinc/85/73/36/1036857336.db2.gz XAORUCVHJSJQRE-KRWDZBQOSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc3[nH]cnc3c2)C1 ZINC000589642042 1036857592 /nfs/dbraw/zinc/85/75/92/1036857592.db2.gz ZEUMBBCITINOLJ-QGZVFWFLSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc3nc[nH]c3c2)C1 ZINC000589642042 1036857595 /nfs/dbraw/zinc/85/75/95/1036857595.db2.gz ZEUMBBCITINOLJ-QGZVFWFLSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc3nc[nH]c3c2)C1 ZINC000589642042 1036857596 /nfs/dbraw/zinc/85/75/96/1036857596.db2.gz ZEUMBBCITINOLJ-QGZVFWFLSA-N 2 1 348.494 4.085 20 0 EIADMP FC1(F)CCC(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)CC1 ZINC000503043880 1036884347 /nfs/dbraw/zinc/88/43/47/1036884347.db2.gz AUSUJBAESDVYOR-VAMGGRTRSA-N 2 1 348.481 4.312 20 0 EIADMP Clc1ccsc1CNC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000486928382 1036892630 /nfs/dbraw/zinc/89/26/30/1036892630.db2.gz VBYMHQUUSSFENH-CYBMUJFWSA-N 2 1 340.945 4.465 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@H]1CCCN(Cc2cccs2)C1 ZINC000486928382 1036892635 /nfs/dbraw/zinc/89/26/35/1036892635.db2.gz VBYMHQUUSSFENH-CYBMUJFWSA-N 2 1 340.945 4.465 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000486928382 1036892640 /nfs/dbraw/zinc/89/26/40/1036892640.db2.gz VBYMHQUUSSFENH-CYBMUJFWSA-N 2 1 340.945 4.465 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000486928382 1036892643 /nfs/dbraw/zinc/89/26/43/1036892643.db2.gz VBYMHQUUSSFENH-CYBMUJFWSA-N 2 1 340.945 4.465 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000503081989 1036894461 /nfs/dbraw/zinc/89/44/61/1036894461.db2.gz VMUDZVNAKVSFDF-MRXNPFEDSA-N 2 1 338.948 4.381 20 0 EIADMP FC1(F)CCC(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC000503078243 1036895082 /nfs/dbraw/zinc/89/50/82/1036895082.db2.gz QZKPXNLVCYFQLL-UHFFFAOYSA-N 2 1 336.470 4.109 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1CCCc1ccccc1 ZINC000503076772 1036895261 /nfs/dbraw/zinc/89/52/61/1036895261.db2.gz ZFNAQLTYOCAQHN-NRFANRHFSA-N 2 1 325.500 4.459 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1CCCc1ccccc1 ZINC000503076772 1036895265 /nfs/dbraw/zinc/89/52/65/1036895265.db2.gz ZFNAQLTYOCAQHN-NRFANRHFSA-N 2 1 325.500 4.459 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000271737667 1037000730 /nfs/dbraw/zinc/00/07/30/1037000730.db2.gz PRZQLSUXAKLTQQ-NSHDSACASA-N 2 1 330.303 4.099 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C/C=C/c1ccncc1 ZINC000487320919 1037118020 /nfs/dbraw/zinc/11/80/20/1037118020.db2.gz ITXFSFVOWCUUAG-GQCTYLIASA-N 2 1 347.462 4.110 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc2c(c1)COC2 ZINC000272691537 1037269847 /nfs/dbraw/zinc/26/98/47/1037269847.db2.gz PQQGJUYLHSHXRI-XYJFISCASA-N 2 1 328.500 4.020 20 0 EIADMP Cc1cnc([C@H](C)C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000273508580 1037486894 /nfs/dbraw/zinc/48/68/94/1037486894.db2.gz ZZDNCGACKAIKLA-GJYPPUQNSA-N 2 1 343.540 4.055 20 0 EIADMP Clc1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c(Cl)c1 ZINC000488329214 1037514254 /nfs/dbraw/zinc/51/42/54/1037514254.db2.gz WEOHNVRPUSOFQK-UHFFFAOYSA-N 2 1 327.299 4.301 20 0 EIADMP c1c2ccccc2oc1CNC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000488514662 1037642219 /nfs/dbraw/zinc/64/22/19/1037642219.db2.gz NSHFXKBSPKWZMM-IBGZPJMESA-N 2 1 334.463 4.087 20 0 EIADMP c1c2ccccc2oc1C[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000488514662 1037642229 /nfs/dbraw/zinc/64/22/29/1037642229.db2.gz NSHFXKBSPKWZMM-IBGZPJMESA-N 2 1 334.463 4.087 20 0 EIADMP c1c2ccccc2oc1C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000488514662 1037642260 /nfs/dbraw/zinc/64/22/60/1037642260.db2.gz NSHFXKBSPKWZMM-IBGZPJMESA-N 2 1 334.463 4.087 20 0 EIADMP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000414653272 1037678826 /nfs/dbraw/zinc/67/88/26/1037678826.db2.gz DZPOVSDMMAIABT-ZIAGYGMSSA-N 2 1 341.480 4.116 20 0 EIADMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000414653272 1037678831 /nfs/dbraw/zinc/67/88/31/1037678831.db2.gz DZPOVSDMMAIABT-ZIAGYGMSSA-N 2 1 341.480 4.116 20 0 EIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H]2CCc3ccccc3C2)CC1 ZINC000573965421 1037795683 /nfs/dbraw/zinc/79/56/83/1037795683.db2.gz VCXFEIMBSRIZLL-SFHVURJKSA-N 2 1 336.479 4.038 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1OCC ZINC000422751003 1037826431 /nfs/dbraw/zinc/82/64/31/1037826431.db2.gz FDKWSUWNPMNXGM-GDIGMMSISA-N 2 1 340.467 4.279 20 0 EIADMP C[C@@H]([NH2+]CCSCc1cccc2ccccc21)c1c[nH+]ccc1N ZINC000422757057 1037826982 /nfs/dbraw/zinc/82/69/82/1037826982.db2.gz JGPNPDJLPSHSEI-OAHLLOKOSA-N 2 1 337.492 4.231 20 0 EIADMP C[C@H]([NH2+]CCSCc1cccc2ccccc21)c1c[nH+]ccc1N ZINC000422757056 1037827511 /nfs/dbraw/zinc/82/75/11/1037827511.db2.gz JGPNPDJLPSHSEI-HNNXBMFYSA-N 2 1 337.492 4.231 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414690882 1037832915 /nfs/dbraw/zinc/83/29/15/1037832915.db2.gz AXIFKXRPEDTUOG-HYVNUMGLSA-N 2 1 343.540 4.499 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)ccc1OC(C)C ZINC000422814209 1037839692 /nfs/dbraw/zinc/83/96/92/1037839692.db2.gz UAWJSBIDCOMBTA-KYNGSXCRSA-N 2 1 340.467 4.278 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CN[C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422863319 1037848724 /nfs/dbraw/zinc/84/87/24/1037848724.db2.gz OOGSDHXIGRQNMG-VSDWSMLSSA-N 2 1 349.522 4.295 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422863319 1037848726 /nfs/dbraw/zinc/84/87/26/1037848726.db2.gz OOGSDHXIGRQNMG-VSDWSMLSSA-N 3 1 349.522 4.295 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422863319 1037848736 /nfs/dbraw/zinc/84/87/36/1037848736.db2.gz OOGSDHXIGRQNMG-VSDWSMLSSA-N 3 1 349.522 4.295 20 0 EIADMP CC[C@H](C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000414706126 1037886823 /nfs/dbraw/zinc/88/68/23/1037886823.db2.gz AABSGHUCWCBEAR-KNQAVFIVSA-N 2 1 337.511 4.220 20 0 EIADMP C[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574039357 1037922222 /nfs/dbraw/zinc/92/22/22/1037922222.db2.gz MTSHWUNKXFECLR-GDBMZVCRSA-N 2 1 326.406 4.114 20 0 EIADMP C[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574039357 1037922245 /nfs/dbraw/zinc/92/22/45/1037922245.db2.gz MTSHWUNKXFECLR-GDBMZVCRSA-N 2 1 326.406 4.114 20 0 EIADMP C[C@@H](CC(F)(F)F)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574039359 1037923059 /nfs/dbraw/zinc/92/30/59/1037923059.db2.gz MTSHWUNKXFECLR-HOCLYGCPSA-N 2 1 326.406 4.114 20 0 EIADMP C[C@@H](CC(F)(F)F)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574039359 1037923082 /nfs/dbraw/zinc/92/30/82/1037923082.db2.gz MTSHWUNKXFECLR-HOCLYGCPSA-N 2 1 326.406 4.114 20 0 EIADMP CC(C)N(C)c1ccccc1C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000423056738 1037925804 /nfs/dbraw/zinc/92/58/04/1037925804.db2.gz GDKCNPSHJOLKFX-SFTDATJTSA-N 2 1 337.511 4.114 20 0 EIADMP Fc1cc(-c2ccco2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423081125 1037942609 /nfs/dbraw/zinc/94/26/09/1037942609.db2.gz BFTWOTSEKXLDHW-YTQUADARSA-N 2 1 328.431 4.096 20 0 EIADMP Clc1ccc([C@H]2CC[C@H]([NH2+]CCC[NH2+]Cc3cccnc3)C2)cc1 ZINC000423186585 1038016669 /nfs/dbraw/zinc/01/66/69/1038016669.db2.gz LBVSDVWEWPZJBB-ICSRJNTNSA-N 2 1 343.902 4.141 20 0 EIADMP Cc1ccc(C[N@@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)s1 ZINC000414721885 1038022986 /nfs/dbraw/zinc/02/29/86/1038022986.db2.gz JMUHRKYHQMZKDT-KRWDZBQOSA-N 2 1 332.538 4.262 20 0 EIADMP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(F)c2ccccc21 ZINC000423187374 1038041702 /nfs/dbraw/zinc/04/17/02/1038041702.db2.gz MRTFROCOSINCJH-INIZCTEOSA-N 2 1 337.442 4.204 20 0 EIADMP COc1ccc2cc([C@@H](C)[NH2+]CCC[NH2+]Cc3cccnc3)ccc2c1 ZINC000423190797 1038045289 /nfs/dbraw/zinc/04/52/89/1038045289.db2.gz RLVTYCYOWNSRGY-QGZVFWFLSA-N 2 1 349.478 4.074 20 0 EIADMP Fc1ccc([C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2ccc(Cl)cc2)cc1 ZINC000423218142 1038063872 /nfs/dbraw/zinc/06/38/72/1038063872.db2.gz VCFAFIKZDFCHOH-AUUYWEPGSA-N 2 1 332.850 4.158 20 0 EIADMP Fc1cc(F)cc(C[N@@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c1 ZINC000414724797 1038069319 /nfs/dbraw/zinc/06/93/19/1038069319.db2.gz SZSVJKLYMUQWMA-SFHVURJKSA-N 2 1 348.462 4.171 20 0 EIADMP C[C@@H]([NH2+][C@@H](C[NH3+])C1CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423265118 1038071916 /nfs/dbraw/zinc/07/19/16/1038071916.db2.gz ASMDIMQBGMAXIX-OQPBUACISA-N 2 1 340.311 4.112 20 0 EIADMP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+][C@@H](C[NH3+])CC(C)C)s2)cc1 ZINC000423258119 1038087899 /nfs/dbraw/zinc/08/78/99/1038087899.db2.gz BAWHBSIDHDSCKL-CZUORRHYSA-N 2 1 347.528 4.151 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423290809 1038096789 /nfs/dbraw/zinc/09/67/89/1038096789.db2.gz FODDJEPMBCTEFR-CVEARBPZSA-N 3 1 334.467 4.051 20 0 EIADMP CCCC[C@H](C[NH3+])[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000423303548 1038129189 /nfs/dbraw/zinc/12/91/89/1038129189.db2.gz XFUABXYSXCBAMF-RTBURBONSA-N 2 1 331.891 4.126 20 0 EIADMP Fc1ccc(F)c([C@@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2Cl)c1 ZINC000423338828 1038149123 /nfs/dbraw/zinc/14/91/23/1038149123.db2.gz IRGCGGWGKBMQFW-IBGZPJMESA-N 2 1 348.824 4.217 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000423444787 1038226209 /nfs/dbraw/zinc/22/62/09/1038226209.db2.gz MCXAKZSBEREZHE-GCJKJVERSA-N 2 1 349.522 4.045 20 0 EIADMP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423454640 1038251772 /nfs/dbraw/zinc/25/17/72/1038251772.db2.gz ZHRIHOYPAZFEAQ-COPLHBTASA-N 2 1 335.904 4.166 20 0 EIADMP C[C@@H]1C[C@H](C[N@H+]2CCC[C@@H]2c2ccc(Br)s2)CC[NH2+]1 ZINC000414760292 1038351365 /nfs/dbraw/zinc/35/13/65/1038351365.db2.gz QHDJGKJAWFSZHV-JHJVBQTASA-N 2 1 343.334 4.036 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)C1 ZINC000594784440 1038400970 /nfs/dbraw/zinc/40/09/70/1038400970.db2.gz KPNCJRFUUQICNU-HXUWFJFHSA-N 2 1 347.506 4.121 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC[N@H+]1C ZINC000608061501 1038453680 /nfs/dbraw/zinc/45/36/80/1038453680.db2.gz WIQARCLZVWEGLI-KSSFIOAISA-N 2 1 346.421 4.329 20 0 EIADMP C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cccc(C[NH+](C)C)c1 ZINC000924968401 1038683020 /nfs/dbraw/zinc/68/30/20/1038683020.db2.gz BBRYVIKRBHZCBR-AWEZNQCLSA-N 2 1 331.529 4.353 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(C)c(OC)c2)CC1)CC1CC1 ZINC001168424547 1038785789 /nfs/dbraw/zinc/78/57/89/1038785789.db2.gz VOOMZUZLRLNGHX-UHFFFAOYSA-N 2 1 344.543 4.338 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2nc(C)c(C)s2)CC1)CC(C)C ZINC000539097438 1038837062 /nfs/dbraw/zinc/83/70/62/1038837062.db2.gz VSGVCNILIMWJOP-UHFFFAOYSA-N 2 1 337.577 4.340 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@H](C)c3c2cccc3C)[C@H](C)C1 ZINC000504921119 1038844095 /nfs/dbraw/zinc/84/40/95/1038844095.db2.gz QXKPVXUODWIJDB-IZZBFERCSA-N 2 1 344.543 4.270 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000539217823 1038887936 /nfs/dbraw/zinc/88/79/36/1038887936.db2.gz NLILVAAOJPXVII-FOIQADDNSA-N 2 1 329.463 4.488 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)C[C@@H]1C ZINC000537614627 1038890251 /nfs/dbraw/zinc/89/02/51/1038890251.db2.gz MKHNEXBWDIZJJS-JKSUJKDBSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)C[C@@H]1C ZINC000537614627 1038890253 /nfs/dbraw/zinc/89/02/53/1038890253.db2.gz MKHNEXBWDIZJJS-JKSUJKDBSA-N 2 1 330.447 4.390 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3F)o2)C[C@@H]1C ZINC000537614627 1038890254 /nfs/dbraw/zinc/89/02/54/1038890254.db2.gz MKHNEXBWDIZJJS-JKSUJKDBSA-N 2 1 330.447 4.390 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)C[C@@H]1C ZINC000537614627 1038890257 /nfs/dbraw/zinc/89/02/57/1038890257.db2.gz MKHNEXBWDIZJJS-JKSUJKDBSA-N 2 1 330.447 4.390 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 ZINC000462120571 1038937408 /nfs/dbraw/zinc/93/74/08/1038937408.db2.gz UKPSHLOKUJQFIP-KCZVDYSFSA-N 2 1 326.528 4.252 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000481040998 1038989280 /nfs/dbraw/zinc/98/92/80/1038989280.db2.gz RXZBAZFQRMVTPS-CABCVRRESA-N 2 1 342.499 4.426 20 0 EIADMP CSc1ccccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000481187265 1039090988 /nfs/dbraw/zinc/09/09/88/1039090988.db2.gz ZAKFLJTZFYBXGZ-XLIONFOSSA-N 2 1 340.536 4.409 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cnc(C3CCCCC3)s2)C[C@@H]1C ZINC000552071570 1039095972 /nfs/dbraw/zinc/09/59/72/1039095972.db2.gz PIUOXVGACWSHQS-DOTOQJQBSA-N 2 1 335.561 4.495 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(F)c(F)c2F)C[C@H]1c1ccccc1 ZINC000550780546 1039130408 /nfs/dbraw/zinc/13/04/08/1039130408.db2.gz HSAPQDJNKZKVKB-AEFFLSMTSA-N 2 1 348.412 4.072 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc(F)c(F)c2F)C[C@H]1c1ccccc1 ZINC000550780546 1039130428 /nfs/dbraw/zinc/13/04/28/1039130428.db2.gz HSAPQDJNKZKVKB-AEFFLSMTSA-N 2 1 348.412 4.072 20 0 EIADMP CCc1ccc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)nc1 ZINC000555381658 1039135021 /nfs/dbraw/zinc/13/50/21/1039135021.db2.gz ZXMHOFFRAQESJA-SFHVURJKSA-N 2 1 329.532 4.121 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccc2n[nH]cc2c1 ZINC000552099421 1039158603 /nfs/dbraw/zinc/15/86/03/1039158603.db2.gz IEMODLIUSFRSPC-LLGFUMIMSA-N 2 1 348.494 4.267 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccc2n[nH]cc2c1 ZINC000552099421 1039158614 /nfs/dbraw/zinc/15/86/14/1039158614.db2.gz IEMODLIUSFRSPC-LLGFUMIMSA-N 2 1 348.494 4.267 20 0 EIADMP Cc1ncc([C@H](C)[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)s1 ZINC000090419087 1039226848 /nfs/dbraw/zinc/22/68/48/1039226848.db2.gz FXRVOJNZYUJRES-OLZOCXBDSA-N 2 1 326.469 4.357 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2OC(F)F)C1 ZINC000481296912 1039234907 /nfs/dbraw/zinc/23/49/07/1039234907.db2.gz BDIMYOLMVBQDEG-GJZGRUSLSA-N 2 1 348.437 4.434 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCc3cc(F)ccc32)CC1 ZINC000481329455 1039305312 /nfs/dbraw/zinc/30/53/12/1039305312.db2.gz ZMGAFCTVIQOHLE-JOCHJYFZSA-N 2 1 338.470 4.376 20 0 EIADMP Fc1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000513858758 1039339111 /nfs/dbraw/zinc/33/91/11/1039339111.db2.gz DFRSBEOITUMAKH-FOIQADDNSA-N 2 1 344.499 4.376 20 0 EIADMP Fc1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000513858758 1039339123 /nfs/dbraw/zinc/33/91/23/1039339123.db2.gz DFRSBEOITUMAKH-FOIQADDNSA-N 2 1 344.499 4.376 20 0 EIADMP C[N@H+]1CC[C@@H]2C[NH+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@@H]2C1 ZINC001168345098 1039382979 /nfs/dbraw/zinc/38/29/79/1039382979.db2.gz NMJCSEWGQJMMLN-NNVNDSJASA-N 2 1 332.919 4.250 20 0 EIADMP C[NH+]1CC[C@@H]2C[N@@H+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@@H]2C1 ZINC001168345098 1039382997 /nfs/dbraw/zinc/38/29/97/1039382997.db2.gz NMJCSEWGQJMMLN-NNVNDSJASA-N 2 1 332.919 4.250 20 0 EIADMP C[NH+]1CC[C@@H]2C[N@H+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@@H]2C1 ZINC001168345098 1039383010 /nfs/dbraw/zinc/38/30/10/1039383010.db2.gz NMJCSEWGQJMMLN-NNVNDSJASA-N 2 1 332.919 4.250 20 0 EIADMP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](C1CCC(c3ccc(Cl)cc3)CC1)C2 ZINC001168347475 1039497171 /nfs/dbraw/zinc/49/71/71/1039497171.db2.gz LTMUMIJWLMAJLY-LNXHZJMOSA-N 2 1 332.919 4.250 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)CCc1cccc(Cl)c1Cl ZINC000434469948 1039498616 /nfs/dbraw/zinc/49/86/16/1039498616.db2.gz LLSKEVWRMRPEMD-UHFFFAOYSA-N 2 1 326.271 4.063 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)CCc1cccc(Cl)c1Cl ZINC000434469948 1039498652 /nfs/dbraw/zinc/49/86/52/1039498652.db2.gz LLSKEVWRMRPEMD-UHFFFAOYSA-N 2 1 326.271 4.063 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCCCNc2ccccn2)cc1 ZINC000162876902 1039533067 /nfs/dbraw/zinc/53/30/67/1039533067.db2.gz HMBQQTFSAXDLJC-QGZVFWFLSA-N 2 1 349.482 4.119 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCCCNc2ccccn2)cc1 ZINC000162876999 1039535498 /nfs/dbraw/zinc/53/54/98/1039535498.db2.gz HMBQQTFSAXDLJC-KRWDZBQOSA-N 2 1 349.482 4.119 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)[C@H]1CCC[NH2+]C1 ZINC000414846921 1039577971 /nfs/dbraw/zinc/57/79/71/1039577971.db2.gz FLQNREGUAAHYGH-KGLIPLIRSA-N 2 1 341.480 4.034 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000552562150 1039640425 /nfs/dbraw/zinc/64/04/25/1039640425.db2.gz RMORPFGLGKJBEM-ZIFCJYIRSA-N 2 1 328.525 4.322 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000552562150 1039640440 /nfs/dbraw/zinc/64/04/40/1039640440.db2.gz RMORPFGLGKJBEM-ZIFCJYIRSA-N 2 1 328.525 4.322 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)Cc1ccccc1C(F)(F)F ZINC000481650585 1039687635 /nfs/dbraw/zinc/68/76/35/1039687635.db2.gz BILWXBVJPOCPKZ-ZIAGYGMSSA-N 2 1 339.405 4.067 20 0 EIADMP COc1ccc2oc(C[NH2+]CCCC[N@H+]3CCCC[C@H]3C)cc2c1 ZINC000478346936 1039687718 /nfs/dbraw/zinc/68/77/18/1039687718.db2.gz UXWHIZCWJIJSPV-MRXNPFEDSA-N 2 1 330.472 4.186 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC[N@@H+]1C ZINC000481740609 1039803049 /nfs/dbraw/zinc/80/30/49/1039803049.db2.gz MUTHHPPYNRGWLB-LPTQZCDUSA-N 2 1 344.449 4.321 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc3ccccc3n2)C[C@@H]1c1ccccc1 ZINC000551029285 1039886014 /nfs/dbraw/zinc/88/60/14/1039886014.db2.gz CBIANMYTINVFEZ-JTHBVZDNSA-N 2 1 345.490 4.202 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc3ccccc3n2)C[C@@H]1c1ccccc1 ZINC000551029285 1039886018 /nfs/dbraw/zinc/88/60/18/1039886018.db2.gz CBIANMYTINVFEZ-JTHBVZDNSA-N 2 1 345.490 4.202 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)Cc2ccccc2C(F)(F)F)C1 ZINC000481925961 1039900053 /nfs/dbraw/zinc/90/00/53/1039900053.db2.gz NPJTUSBBKCEGNF-JKSUJKDBSA-N 2 1 342.449 4.346 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccccc1OCc1ccccc1 ZINC000481956888 1039912680 /nfs/dbraw/zinc/91/26/80/1039912680.db2.gz DZPZXAXJNDIZSH-ZWKOTPCHSA-N 2 1 326.484 4.256 20 0 EIADMP CCC(CC)[C@H](CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)OC ZINC000551087467 1039970729 /nfs/dbraw/zinc/97/07/29/1039970729.db2.gz RPWICWWETKKLHR-NJYVYQBISA-N 2 1 332.532 4.253 20 0 EIADMP CCC(CC)[C@H](CC[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)OC ZINC000551087467 1039970741 /nfs/dbraw/zinc/97/07/41/1039970741.db2.gz RPWICWWETKKLHR-NJYVYQBISA-N 2 1 332.532 4.253 20 0 EIADMP c1cc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)cs1 ZINC000537695353 1040003725 /nfs/dbraw/zinc/00/37/25/1040003725.db2.gz LZEZVVGXAVJMKS-UXHICEINSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)cs1 ZINC000537695353 1040003737 /nfs/dbraw/zinc/00/37/37/1040003737.db2.gz LZEZVVGXAVJMKS-UXHICEINSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)cs1 ZINC000537695353 1040003752 /nfs/dbraw/zinc/00/37/52/1040003752.db2.gz LZEZVVGXAVJMKS-UXHICEINSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)cs1 ZINC000537695353 1040003772 /nfs/dbraw/zinc/00/37/72/1040003772.db2.gz LZEZVVGXAVJMKS-UXHICEINSA-N 2 1 326.509 4.235 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CC[C@@](C)(c2ccc(C)cc2)C1 ZINC000435034226 1040024812 /nfs/dbraw/zinc/02/48/12/1040024812.db2.gz CDTYTEKXAVOXKE-JOCHJYFZSA-N 2 1 346.478 4.048 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2ccc(Cl)c(Cl)c2)CC[N@H+]1C ZINC000482135993 1040026935 /nfs/dbraw/zinc/02/69/35/1040026935.db2.gz FYLHBZACXHUDHK-JSGCOSHPSA-N 2 1 329.315 4.343 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2ccc(Cl)c(Cl)c2)CC[N@H+]1C ZINC000482135994 1040027489 /nfs/dbraw/zinc/02/74/89/1040027489.db2.gz FYLHBZACXHUDHK-OCCSQVGLSA-N 2 1 329.315 4.343 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000666969029 1040055131 /nfs/dbraw/zinc/05/51/31/1040055131.db2.gz XZLNFBAPAXKCSU-WMZOPIPTSA-N 2 1 333.545 4.155 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000666969029 1040055140 /nfs/dbraw/zinc/05/51/40/1040055140.db2.gz XZLNFBAPAXKCSU-WMZOPIPTSA-N 2 1 333.545 4.155 20 0 EIADMP C[C@@H]([NH2+]CCc1ccc2[nH]ccc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000514633513 1040068989 /nfs/dbraw/zinc/06/89/89/1040068989.db2.gz GARKPRQOZDCAPG-XMSQKQJNSA-N 2 1 347.506 4.211 20 0 EIADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccccc2OCc2ccccc2)C1 ZINC000551223457 1040079545 /nfs/dbraw/zinc/07/95/45/1040079545.db2.gz SJZLUKKFQRHINO-HXUWFJFHSA-N 2 1 338.495 4.086 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccccc2OCc2ccccc2)C1 ZINC000551223457 1040079567 /nfs/dbraw/zinc/07/95/67/1040079567.db2.gz SJZLUKKFQRHINO-HXUWFJFHSA-N 2 1 338.495 4.086 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]CC2Cc3ccccc3C2)[C@H]1c1cccs1 ZINC000514697956 1040149052 /nfs/dbraw/zinc/14/90/52/1040149052.db2.gz VIKVHLRRXBLMLW-CTNGQTDRSA-N 2 1 340.536 4.136 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]CC2Cc3ccccc3C2)[C@H]1c1cccs1 ZINC000514697956 1040149084 /nfs/dbraw/zinc/14/90/84/1040149084.db2.gz VIKVHLRRXBLMLW-CTNGQTDRSA-N 2 1 340.536 4.136 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000482336225 1040183919 /nfs/dbraw/zinc/18/39/19/1040183919.db2.gz RVECHZWGPGIUIM-LSDHHAIUSA-N 2 1 328.422 4.476 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc(F)c1 ZINC000482442765 1040250828 /nfs/dbraw/zinc/25/08/28/1040250828.db2.gz XCIACAPNNAVCIN-MJGOQNOKSA-N 2 1 326.459 4.041 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccs1 ZINC000482443015 1040252110 /nfs/dbraw/zinc/25/21/10/1040252110.db2.gz FCYNTBQBECHXDS-RTBURBONSA-N 2 1 328.525 4.353 20 0 EIADMP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482456273 1040253674 /nfs/dbraw/zinc/25/36/74/1040253674.db2.gz ZGWQUNFJGWFIJH-RFWXGWTQSA-N 2 1 334.507 4.074 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@H](Cc3ccccc3)C3CC3)C2)cc1 ZINC000482452122 1040262844 /nfs/dbraw/zinc/26/28/44/1040262844.db2.gz ABHIMGHYFMWALQ-ISKFKSNPSA-N 2 1 348.534 4.162 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1F ZINC000482459762 1040264630 /nfs/dbraw/zinc/26/46/30/1040264630.db2.gz OMFOSNPKVFPARB-MJGOQNOKSA-N 2 1 326.459 4.041 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1F ZINC000482459762 1040264641 /nfs/dbraw/zinc/26/46/41/1040264641.db2.gz OMFOSNPKVFPARB-MJGOQNOKSA-N 2 1 326.459 4.041 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1F ZINC000482459763 1040266944 /nfs/dbraw/zinc/26/69/44/1040266944.db2.gz OMFOSNPKVFPARB-PKOBYXMFSA-N 2 1 326.459 4.041 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1F ZINC000482459763 1040266963 /nfs/dbraw/zinc/26/69/63/1040266963.db2.gz OMFOSNPKVFPARB-PKOBYXMFSA-N 2 1 326.459 4.041 20 0 EIADMP c1ccc(Oc2ccccc2C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168356044 1040301616 /nfs/dbraw/zinc/30/16/16/1040301616.db2.gz JNHSBBLMWKBQAF-UHFFFAOYSA-N 2 1 336.479 4.443 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCc3c2cccc3O)CC1 ZINC000482544410 1040343938 /nfs/dbraw/zinc/34/39/38/1040343938.db2.gz SFNKYRYMTNQBSO-XPGWFJOJSA-N 2 1 328.500 4.012 20 0 EIADMP Cc1ccc(F)cc1C[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000491247727 1040361402 /nfs/dbraw/zinc/36/14/02/1040361402.db2.gz FPQRWNKUGZAWDG-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(F)cc1C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000491247727 1040361416 /nfs/dbraw/zinc/36/14/16/1040361416.db2.gz FPQRWNKUGZAWDG-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(F)cc1C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000491247727 1040361429 /nfs/dbraw/zinc/36/14/29/1040361429.db2.gz FPQRWNKUGZAWDG-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(F)cc1C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000491247727 1040361441 /nfs/dbraw/zinc/36/14/41/1040361441.db2.gz FPQRWNKUGZAWDG-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP CC(C)COc1ccc(C(C)(C)C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000482643062 1040403421 /nfs/dbraw/zinc/40/34/21/1040403421.db2.gz ODJBWYZZBYIQOU-MJGOQNOKSA-N 2 1 332.532 4.071 20 0 EIADMP C[C@@H]([NH2+]C1CC(N2CCCCC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000479527244 1040424669 /nfs/dbraw/zinc/42/46/69/1040424669.db2.gz NFWMCNIJZRHGCD-IUDNXUCKSA-N 2 1 342.405 4.253 20 0 EIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000479527244 1040424680 /nfs/dbraw/zinc/42/46/80/1040424680.db2.gz NFWMCNIJZRHGCD-IUDNXUCKSA-N 2 1 342.405 4.253 20 0 EIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(-c2ccncc2)cc1 ZINC000479519619 1040436231 /nfs/dbraw/zinc/43/62/31/1040436231.db2.gz UIUYFRHBXFKDMA-PPNDLDFTSA-N 2 1 335.495 4.416 20 0 EIADMP CCC1(Cc2ccccc2)CC[NH+]([C@H]2CC[N@H+]3CCC[C@H]3C2)CC1 ZINC000479540581 1040446375 /nfs/dbraw/zinc/44/63/75/1040446375.db2.gz GHACOGIEPKFVBY-SFTDATJTSA-N 2 1 326.528 4.348 20 0 EIADMP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c(F)c1 ZINC000553852326 1040569650 /nfs/dbraw/zinc/56/96/50/1040569650.db2.gz DHVMBBJLXNGBCJ-UHFFFAOYSA-N 2 1 342.458 4.110 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(CC)cc2)[C@H](C)C1 ZINC000479876914 1040739927 /nfs/dbraw/zinc/73/99/27/1040739927.db2.gz VJCIZYFQVPBEGG-LQWHRVPQSA-N 2 1 332.532 4.037 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)ccc1SC ZINC000479898538 1040756581 /nfs/dbraw/zinc/75/65/81/1040756581.db2.gz DKBTUCXQLORHEH-CVEARBPZSA-N 2 1 336.545 4.332 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)ccc1SC ZINC000479898538 1040756597 /nfs/dbraw/zinc/75/65/97/1040756597.db2.gz DKBTUCXQLORHEH-CVEARBPZSA-N 2 1 336.545 4.332 20 0 EIADMP CCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)C[C@@H]2C)cc1OCC ZINC000539817498 1040809564 /nfs/dbraw/zinc/80/95/64/1040809564.db2.gz OJNBFMMYFKFRMO-HKUYNNGSSA-N 2 1 348.531 4.036 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000483332354 1040817080 /nfs/dbraw/zinc/81/70/80/1040817080.db2.gz BHUMESLIPQCPAY-UHFFFAOYSA-N 2 1 346.421 4.285 20 0 EIADMP CC[C@@H](c1ccccc1)[N@@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1 ZINC000436056706 1040844498 /nfs/dbraw/zinc/84/44/98/1040844498.db2.gz TXHQPRQSDBGMBU-AEFFLSMTSA-N 2 1 329.513 4.014 20 0 EIADMP CC[C@@H](c1ccccc1)[N@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1 ZINC000436056706 1040844503 /nfs/dbraw/zinc/84/45/03/1040844503.db2.gz TXHQPRQSDBGMBU-AEFFLSMTSA-N 2 1 329.513 4.014 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1nc2c(s1)CCCC2 ZINC000537883072 1040872682 /nfs/dbraw/zinc/87/26/82/1040872682.db2.gz QQVZAXXVLDWKCE-BBWFWOEESA-N 2 1 349.588 4.431 20 0 EIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C1CC[NH+](CC)CC1 ZINC000480030654 1040878267 /nfs/dbraw/zinc/87/82/67/1040878267.db2.gz KGHJPGKHXRZEOB-HNNXBMFYSA-N 2 1 326.937 4.285 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@H]3C[C@@H](C)CC(C)(C)C3)CCCC2)CC1 ZINC000462744750 1040892985 /nfs/dbraw/zinc/89/29/85/1040892985.db2.gz MOFXANNMQGYQSW-MSOLQXFVSA-N 2 1 336.564 4.214 20 0 EIADMP CCC(C)(C)C1CCC([NH2+]CC2([NH+]3CCCC3)CCOCC2)CC1 ZINC000462745932 1040894168 /nfs/dbraw/zinc/89/41/68/1040894168.db2.gz RLLACCDNOQXVEF-UHFFFAOYSA-N 2 1 336.564 4.216 20 0 EIADMP Cc1ccccc1C[NH+]1CCC(Nc2cc[nH+]c3ccsc32)CC1 ZINC000462775865 1040910317 /nfs/dbraw/zinc/91/03/17/1040910317.db2.gz HBYSDGYLHQSKQI-UHFFFAOYSA-N 2 1 337.492 4.103 20 0 EIADMP FC(F)(F)CCC(CCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000924648685 1040939215 /nfs/dbraw/zinc/93/92/15/1040939215.db2.gz NKTSGVNRJFXZIB-NSHDSACASA-N 2 1 346.359 4.114 20 0 EIADMP C[C@@H](CC[NH2+][C@@H](C)c1ccc2c(c1)COC2)[N@@H+](C)Cc1ccccc1 ZINC000483672076 1040962525 /nfs/dbraw/zinc/96/25/25/1040962525.db2.gz PPUYZLPVPHLNLJ-ROUUACIJSA-N 2 1 338.495 4.278 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@@H]3C)cc2)cc1 ZINC000537988486 1040963431 /nfs/dbraw/zinc/96/34/31/1040963431.db2.gz VGGQQABYWYUOLS-GSHUGGBRSA-N 2 1 338.495 4.181 20 0 EIADMP C[C@@]1(C[NH2+]Cc2cnc3ccccc3c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000311774215 1040967450 /nfs/dbraw/zinc/96/74/50/1040967450.db2.gz JUORDUDQWAULLH-QHCPKHFHSA-N 2 1 345.490 4.237 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+][C@H]4CCCSCC4)C[C@@H]3C2)cc1 ZINC000898519254 1040971712 /nfs/dbraw/zinc/97/17/12/1040971712.db2.gz OBFQDPVLDUINKF-WOZUAGRISA-N 2 1 344.568 4.162 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCOc2ccccc2C)cc1 ZINC000537992285 1040989108 /nfs/dbraw/zinc/98/91/08/1040989108.db2.gz XIWDKGBXDUNWLQ-KRWDZBQOSA-N 2 1 335.451 4.219 20 0 EIADMP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000483743788 1040995818 /nfs/dbraw/zinc/99/58/18/1040995818.db2.gz IGWXXKDABRIHOF-QVHKTLOISA-N 2 1 345.314 4.222 20 0 EIADMP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000483743788 1040995848 /nfs/dbraw/zinc/99/58/48/1040995848.db2.gz IGWXXKDABRIHOF-QVHKTLOISA-N 2 1 345.314 4.222 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000483729140 1040998271 /nfs/dbraw/zinc/99/82/71/1040998271.db2.gz OLWXYLCKDDCTBF-WFXMLNOXSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000483729140 1040998293 /nfs/dbraw/zinc/99/82/93/1040998293.db2.gz OLWXYLCKDDCTBF-WFXMLNOXSA-N 2 1 338.495 4.399 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3c(cccc3F)[nH]2)c1 ZINC000436233419 1041000714 /nfs/dbraw/zinc/00/07/14/1041000714.db2.gz OMWMUUPYTGHOCI-UHFFFAOYSA-N 2 1 325.431 4.049 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC(Nc2cc[nH+]c3ccsc32)CC1 ZINC000462834884 1041015480 /nfs/dbraw/zinc/01/54/80/1041015480.db2.gz BVGZAQWVEIFEGX-HNNXBMFYSA-N 2 1 337.492 4.356 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC1 ZINC000436280117 1041024658 /nfs/dbraw/zinc/02/46/58/1041024658.db2.gz CRTPBIZDYSNHKM-CZIWCDLHSA-N 2 1 326.406 4.025 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC000538116496 1041047609 /nfs/dbraw/zinc/04/76/09/1041047609.db2.gz LBVMBCFTTNZXOD-BWAGFHJFSA-N 2 1 337.511 4.421 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC000538116496 1041047626 /nfs/dbraw/zinc/04/76/26/1041047626.db2.gz LBVMBCFTTNZXOD-BWAGFHJFSA-N 2 1 337.511 4.421 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000436306942 1041050615 /nfs/dbraw/zinc/05/06/15/1041050615.db2.gz QCFBOHSOHMNLFQ-HWHRFOGPSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000436306942 1041050632 /nfs/dbraw/zinc/05/06/32/1041050632.db2.gz QCFBOHSOHMNLFQ-HWHRFOGPSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H](C1CC1)[NH+](C)C ZINC000462889223 1041051468 /nfs/dbraw/zinc/05/14/68/1041051468.db2.gz RNWZCZBPCCIJKO-FOIQADDNSA-N 2 1 327.516 4.154 20 0 EIADMP FC1(CC[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CCC1 ZINC000554374981 1041060659 /nfs/dbraw/zinc/06/06/59/1041060659.db2.gz DFGODXVOKUAYDI-XUVXKRRUSA-N 2 1 330.491 4.159 20 0 EIADMP FC1(CC[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CCC1 ZINC000554374980 1041062353 /nfs/dbraw/zinc/06/23/53/1041062353.db2.gz DFGODXVOKUAYDI-VAMGGRTRSA-N 2 1 330.491 4.159 20 0 EIADMP C(NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436299355 1041065251 /nfs/dbraw/zinc/06/52/51/1041065251.db2.gz JTPIIKIQTKGQJX-QFIPXVFZSA-N 2 1 347.591 4.170 20 0 EIADMP CC[NH+](CC)CCC[NH+]1CCC(c2nc3cccc(C)c3o2)CC1 ZINC000191874665 1041079725 /nfs/dbraw/zinc/07/97/25/1041079725.db2.gz ONDXWOHHUNHLPL-UHFFFAOYSA-N 2 1 329.488 4.048 20 0 EIADMP 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 1041082819 /nfs/dbraw/zinc/08/28/19/1041082819.db2.gz PKUMMOQJYBTHLZ-RUEOWNRQSA-N 2 1 340.433 4.270 20 0 EIADMP CC[C@H]([NH2+]CC(CC)(CC)[NH2+][C@@H](C)c1ccccc1)[C@H]1CCOC1 ZINC000484142479 1041132264 /nfs/dbraw/zinc/13/22/64/1041132264.db2.gz SESCZWGQHPUZDX-IHPCNDPISA-N 2 1 332.532 4.301 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@H]3C)cc2)cs1 ZINC000480272826 1041154276 /nfs/dbraw/zinc/15/42/76/1041154276.db2.gz DYRDXGVCGBITEV-BKEDOTJMSA-N 2 1 343.540 4.498 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1cccs1 ZINC000540162340 1041224139 /nfs/dbraw/zinc/22/41/39/1041224139.db2.gz BRNKLSPMHOHKAD-PXNSSMCTSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1cccs1 ZINC000540162340 1041224156 /nfs/dbraw/zinc/22/41/56/1041224156.db2.gz BRNKLSPMHOHKAD-PXNSSMCTSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1OC(F)(F)F ZINC000484487184 1041259598 /nfs/dbraw/zinc/25/95/98/1041259598.db2.gz MFYLABSGJZVQQK-MJBXVCDLSA-N 2 1 330.394 4.109 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]C[C@H]1CC2c3ccccc3C1c1ccccc12 ZINC000540194449 1041270961 /nfs/dbraw/zinc/27/09/61/1041270961.db2.gz ITZWRVHOUMJDPF-MNNVLDMHSA-N 2 1 346.518 4.214 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C[C@H]1CC2c3ccccc3C1c1ccccc12 ZINC000540194441 1041271052 /nfs/dbraw/zinc/27/10/52/1041271052.db2.gz ITZWRVHOUMJDPF-BGUQPKOPSA-N 2 1 346.518 4.214 20 0 EIADMP CC[N@H+](CCC1CC[NH+]([C@H](C)c2nc(C3CC3)no2)CC1)CC(C)C ZINC000540197150 1041272972 /nfs/dbraw/zinc/27/29/72/1041272972.db2.gz ZUVSSCABYOUNLN-MRXNPFEDSA-N 2 1 348.535 4.088 20 0 EIADMP CC[N@@H+](CCC1CC[NH+]([C@H](C)c2nc(C3CC3)no2)CC1)CC(C)C ZINC000540197150 1041272985 /nfs/dbraw/zinc/27/29/85/1041272985.db2.gz ZUVSSCABYOUNLN-MRXNPFEDSA-N 2 1 348.535 4.088 20 0 EIADMP Cc1ccccc1OCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463063898 1041298125 /nfs/dbraw/zinc/29/81/25/1041298125.db2.gz FTFGNRQFWPGFJU-CTNGQTDRSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1ccccc1OCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463063898 1041298141 /nfs/dbraw/zinc/29/81/41/1041298141.db2.gz FTFGNRQFWPGFJU-CTNGQTDRSA-N 2 1 338.495 4.017 20 0 EIADMP COc1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)ccc1C ZINC000463071233 1041315380 /nfs/dbraw/zinc/31/53/80/1041315380.db2.gz WJLMUXGXMMSYDA-NQIIRXRSSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1C ZINC000463071233 1041315391 /nfs/dbraw/zinc/31/53/91/1041315391.db2.gz WJLMUXGXMMSYDA-NQIIRXRSSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)ccc1C ZINC000463071234 1041315613 /nfs/dbraw/zinc/31/56/13/1041315613.db2.gz WJLMUXGXMMSYDA-RXVVDRJESA-N 2 1 338.495 4.146 20 0 EIADMP COc1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ccc1C ZINC000463071234 1041315622 /nfs/dbraw/zinc/31/56/22/1041315622.db2.gz WJLMUXGXMMSYDA-RXVVDRJESA-N 2 1 338.495 4.146 20 0 EIADMP COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000538408211 1041324185 /nfs/dbraw/zinc/32/41/85/1041324185.db2.gz SZHHEKBJFVZTOO-SFHVURJKSA-N 2 1 336.907 4.287 20 0 EIADMP C[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccc(F)cc1 ZINC000463118445 1041357988 /nfs/dbraw/zinc/35/79/88/1041357988.db2.gz XLSBYQGYEGWHBV-SFHVURJKSA-N 2 1 340.486 4.226 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000540317357 1041364927 /nfs/dbraw/zinc/36/49/27/1041364927.db2.gz NICLJUWYWPAOKC-OAHLLOKOSA-N 2 1 325.481 4.444 20 0 EIADMP Cc1ccc(OCC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000463133537 1041369299 /nfs/dbraw/zinc/36/92/99/1041369299.db2.gz TZDPKHMRBFMBMT-PZJWPPBQSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1ccc(OCC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000463133537 1041369302 /nfs/dbraw/zinc/36/93/02/1041369302.db2.gz TZDPKHMRBFMBMT-PZJWPPBQSA-N 2 1 338.495 4.017 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@H]3CCc4ccccc43)CC2)cc1 ZINC000463136252 1041370792 /nfs/dbraw/zinc/37/07/92/1041370792.db2.gz CWNIANHHDKXNRR-QFIPXVFZSA-N 2 1 338.470 4.110 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463137448 1041372690 /nfs/dbraw/zinc/37/26/90/1041372690.db2.gz QZDDPCOHFMNSSW-FXAWDEMLSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463137448 1041372700 /nfs/dbraw/zinc/37/27/00/1041372700.db2.gz QZDDPCOHFMNSSW-FXAWDEMLSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463139934 1041374155 /nfs/dbraw/zinc/37/41/55/1041374155.db2.gz USFGGKNAHWYJMF-KNQAVFIVSA-N 2 1 334.507 4.361 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccccc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463139934 1041374160 /nfs/dbraw/zinc/37/41/60/1041374160.db2.gz USFGGKNAHWYJMF-KNQAVFIVSA-N 2 1 334.507 4.361 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463139933 1041374438 /nfs/dbraw/zinc/37/44/38/1041374438.db2.gz USFGGKNAHWYJMF-DENIHFKCSA-N 2 1 334.507 4.361 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3ccccc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463139933 1041374447 /nfs/dbraw/zinc/37/44/47/1041374447.db2.gz USFGGKNAHWYJMF-DENIHFKCSA-N 2 1 334.507 4.361 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000463162022 1041379246 /nfs/dbraw/zinc/37/92/46/1041379246.db2.gz JZSOVVDYWQIKTR-FCHUYYIVSA-N 2 1 335.495 4.176 20 0 EIADMP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463189776 1041406325 /nfs/dbraw/zinc/40/63/25/1041406325.db2.gz KYZRVALLUCBWLO-YJMBLLCNSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463189776 1041406329 /nfs/dbraw/zinc/40/63/29/1041406329.db2.gz KYZRVALLUCBWLO-YJMBLLCNSA-N 2 1 344.543 4.080 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]CC3(Cc4ccccc4)CC3)CC2)cc1 ZINC000463191657 1041408996 /nfs/dbraw/zinc/40/89/96/1041408996.db2.gz MUWWPCXYVNYJGE-UHFFFAOYSA-N 2 1 348.534 4.306 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cc(F)ccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463187843 1041418287 /nfs/dbraw/zinc/41/82/87/1041418287.db2.gz DYLNNYMVHDUEAC-OXJNMPFZSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cc(F)ccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463187843 1041418292 /nfs/dbraw/zinc/41/82/92/1041418292.db2.gz DYLNNYMVHDUEAC-OXJNMPFZSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(SCC(F)F)cc1 ZINC000480615336 1041425945 /nfs/dbraw/zinc/42/59/45/1041425945.db2.gz RWGWYGULZVYRMM-JQFCIGGWSA-N 2 1 340.483 4.321 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(SCC(F)F)cc1 ZINC000480615336 1041425952 /nfs/dbraw/zinc/42/59/52/1041425952.db2.gz RWGWYGULZVYRMM-JQFCIGGWSA-N 2 1 340.483 4.321 20 0 EIADMP Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000924668091 1041438635 /nfs/dbraw/zinc/43/86/35/1041438635.db2.gz OIPCMYGZFPIQCS-HZPDHXFCSA-N 2 1 341.499 4.374 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1Nc1ccc2c(c1)nc(C(C)(C)C)n2C ZINC000538627239 1041459686 /nfs/dbraw/zinc/45/96/86/1041459686.db2.gz CQXJSYYYIJEEAP-IJEWVQPXSA-N 2 1 328.504 4.011 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000538627239 1041459689 /nfs/dbraw/zinc/45/96/89/1041459689.db2.gz CQXJSYYYIJEEAP-IJEWVQPXSA-N 2 1 328.504 4.011 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000538627239 1041459692 /nfs/dbraw/zinc/45/96/92/1041459692.db2.gz CQXJSYYYIJEEAP-IJEWVQPXSA-N 2 1 328.504 4.011 20 0 EIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000480692420 1041475874 /nfs/dbraw/zinc/47/58/74/1041475874.db2.gz IGUSJXWGIZQOAW-ZJOUEHCJSA-N 2 1 330.516 4.389 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCOC1 ZINC000480703451 1041480046 /nfs/dbraw/zinc/48/00/46/1041480046.db2.gz YPRHDNPTZCZWAM-OSZJIOELSA-N 2 1 344.543 4.069 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000195132181 1041484515 /nfs/dbraw/zinc/48/45/15/1041484515.db2.gz WJKCORPLOJQRGP-WMZOPIPTSA-N 2 1 342.458 4.007 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cnc(C3CC3)s2)CC1 ZINC000538721342 1041489157 /nfs/dbraw/zinc/48/91/57/1041489157.db2.gz DDRYBWSEMDZQAI-INIZCTEOSA-N 2 1 347.572 4.497 20 0 EIADMP CCC[N@H+]1CC[C@@H](CN[C@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722227 1041489569 /nfs/dbraw/zinc/48/95/69/1041489569.db2.gz KALWYMVIIQRVPI-LAUBAEHRSA-N 2 1 326.459 4.237 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722227 1041489578 /nfs/dbraw/zinc/48/95/78/1041489578.db2.gz KALWYMVIIQRVPI-LAUBAEHRSA-N 2 1 326.459 4.237 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722227 1041489581 /nfs/dbraw/zinc/48/95/81/1041489581.db2.gz KALWYMVIIQRVPI-LAUBAEHRSA-N 2 1 326.459 4.237 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000480733987 1041495578 /nfs/dbraw/zinc/49/55/78/1041495578.db2.gz BLHRAZKPJLFGAW-IKGGRYGDSA-N 2 1 338.948 4.427 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538752361 1041526876 /nfs/dbraw/zinc/52/68/76/1041526876.db2.gz DDFWPFAXNMWAOZ-INIZCTEOSA-N 2 1 340.458 4.069 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538752361 1041526884 /nfs/dbraw/zinc/52/68/84/1041526884.db2.gz DDFWPFAXNMWAOZ-INIZCTEOSA-N 2 1 340.458 4.069 20 0 EIADMP Cn1c[nH+]cc1CCC[NH2+][C@@](C)(Cc1ccccc1)c1ccccc1 ZINC000516782695 1041752110 /nfs/dbraw/zinc/75/21/10/1041752110.db2.gz ZQMYMUYZACDGNO-QFIPXVFZSA-N 2 1 333.479 4.100 20 0 EIADMP COc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1 ZINC000540962864 1041753487 /nfs/dbraw/zinc/75/34/87/1041753487.db2.gz XRCHRDRUYPJUDB-NQIIRXRSSA-N 2 1 338.495 4.004 20 0 EIADMP CC(C)Oc1cccc(C[NH2+]CCC[N@@H+](C)Cc2ccccc2)c1 ZINC000301193032 1041895147 /nfs/dbraw/zinc/89/51/47/1041895147.db2.gz MRRBOTPVQUJBCY-UHFFFAOYSA-N 2 1 326.484 4.086 20 0 EIADMP CC[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)CC(F)(F)F ZINC000402688704 1041946866 /nfs/dbraw/zinc/94/68/66/1041946866.db2.gz HENLUERVXJSJIO-XYJFISCASA-N 2 1 342.449 4.465 20 0 EIADMP CC[C@@H]1CCC[C@@H](C[N@@H+](C)C2CCN(CCc3ccccn3)CC2)C1 ZINC000541536595 1041999375 /nfs/dbraw/zinc/99/93/75/1041999375.db2.gz CWDFCQMVGIDHCD-WOJBJXKFSA-N 2 1 343.559 4.237 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402757739 1042004626 /nfs/dbraw/zinc/00/46/26/1042004626.db2.gz GDVVHUYJVJMJAI-ZOBUZTSGSA-N 2 1 328.422 4.075 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCOCc2ccccc2)C1 ZINC000541579333 1042014797 /nfs/dbraw/zinc/01/47/97/1042014797.db2.gz WQKWBZKFLLMJIS-IRLDBZIGSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCOCc2ccccc2)C1 ZINC000541579333 1042014802 /nfs/dbraw/zinc/01/48/02/1042014802.db2.gz WQKWBZKFLLMJIS-IRLDBZIGSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCOCc2ccccc2)C1 ZINC000541579333 1042014809 /nfs/dbraw/zinc/01/48/09/1042014809.db2.gz WQKWBZKFLLMJIS-IRLDBZIGSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1OC(F)F)C[NH+](C)C ZINC000425940475 1042020193 /nfs/dbraw/zinc/02/01/93/1042020193.db2.gz HCIWBHDUQLPJMR-KBPBESRZSA-N 2 1 336.426 4.290 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)CC(F)(F)F ZINC000402771428 1042028988 /nfs/dbraw/zinc/02/89/88/1042028988.db2.gz LGRWOEMYMWNVDE-UXLLHSPISA-N 2 1 328.422 4.218 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)CC(F)(F)F ZINC000402771428 1042028994 /nfs/dbraw/zinc/02/89/94/1042028994.db2.gz LGRWOEMYMWNVDE-UXLLHSPISA-N 2 1 328.422 4.218 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)CC(F)(F)F ZINC000402796793 1042040711 /nfs/dbraw/zinc/04/07/11/1042040711.db2.gz VYJVFJGJJHIOAA-DZJNRPSUSA-N 2 1 340.433 4.075 20 0 EIADMP CCCC[C@@H](CC)C[N@H+]1CCC[C@@]2(CCC[NH+](C[C@H](C)CO)C2)C1 ZINC001280201522 1042113502 /nfs/dbraw/zinc/11/35/02/1042113502.db2.gz SMDWAPFRCSZCJC-PWRODBHTSA-N 2 1 338.580 4.009 20 0 EIADMP CCCC[C@@H](CC)C[NH+]1CCC[C@@]2(CCC[N@H+](C[C@H](C)CO)C2)C1 ZINC001280201522 1042113505 /nfs/dbraw/zinc/11/35/05/1042113505.db2.gz SMDWAPFRCSZCJC-PWRODBHTSA-N 2 1 338.580 4.009 20 0 EIADMP CCCC[C@@H](CC)C[NH+]1CCC[C@@]2(CCC[N@@H+](C[C@H](C)CO)C2)C1 ZINC001280201522 1042113511 /nfs/dbraw/zinc/11/35/11/1042113511.db2.gz SMDWAPFRCSZCJC-PWRODBHTSA-N 2 1 338.580 4.009 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](CCOc2cccc(C(C)(C)C)c2)C1 ZINC000464779082 1042160723 /nfs/dbraw/zinc/16/07/23/1042160723.db2.gz PAEWVXZUFOUCAG-GOSISDBHSA-N 2 1 332.532 4.027 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCOc2cccc(C(C)(C)C)c2)C1 ZINC000464779082 1042160725 /nfs/dbraw/zinc/16/07/25/1042160725.db2.gz PAEWVXZUFOUCAG-GOSISDBHSA-N 2 1 332.532 4.027 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](CSC)c2ccc(C(F)(F)F)cc2)C1 ZINC000541916178 1042179079 /nfs/dbraw/zinc/17/90/79/1042179079.db2.gz DTIGOMLQKZAYKM-BBRMVZONSA-N 2 1 346.462 4.041 20 0 EIADMP C[C@H](c1cccc(F)c1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464836212 1042181045 /nfs/dbraw/zinc/18/10/45/1042181045.db2.gz JNMBOWHEOLUMBR-IEBWSBKVSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@H](c1cccc(F)c1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464836212 1042181047 /nfs/dbraw/zinc/18/10/47/1042181047.db2.gz JNMBOWHEOLUMBR-IEBWSBKVSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@H](c1cccc(F)c1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464836212 1042181052 /nfs/dbraw/zinc/18/10/52/1042181052.db2.gz JNMBOWHEOLUMBR-IEBWSBKVSA-N 2 1 326.459 4.341 20 0 EIADMP CC(C)(C)OC1CC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000492144019 1042565162 /nfs/dbraw/zinc/56/51/62/1042565162.db2.gz NXHGOVHJRSLDBU-BWQRXAFVSA-N 2 1 342.527 4.118 20 0 EIADMP C[C@@H]([NH2+]CCCc1cccc(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492326085 1042613839 /nfs/dbraw/zinc/61/38/39/1042613839.db2.gz BBAFCNLNSXYOKN-WIYYLYMNSA-N 2 1 340.486 4.259 20 0 EIADMP CC(C)CSCCC[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492426622 1042649194 /nfs/dbraw/zinc/64/91/94/1042649194.db2.gz WLTOBZDNXVIREY-AZUAARDMSA-N 2 1 334.573 4.266 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2cccc(-c3ccncc3)c2)C1 ZINC000439479476 1042656339 /nfs/dbraw/zinc/65/63/39/1042656339.db2.gz UHZVQLYGCWMGFC-KDURUIRLSA-N 2 1 337.511 4.206 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CCC[C@H]3CCCCO3)CC[N@@H+]2C2CC2)cc1 ZINC000639047121 1042819366 /nfs/dbraw/zinc/81/93/66/1042819366.db2.gz KAPBHAGTWQZLOV-NNWRFLSQSA-N 2 1 342.527 4.293 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CCC[C@H]3CCCCO3)CC[N@H+]2C2CC2)cc1 ZINC000639047121 1042819367 /nfs/dbraw/zinc/81/93/67/1042819367.db2.gz KAPBHAGTWQZLOV-NNWRFLSQSA-N 2 1 342.527 4.293 20 0 EIADMP Fc1cc(Cl)ccc1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309794751 1042821904 /nfs/dbraw/zinc/82/19/04/1042821904.db2.gz IJTFZXMVFHJUPT-INIZCTEOSA-N 2 1 332.850 4.091 20 0 EIADMP Fc1cc(Cl)ccc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309794751 1042821906 /nfs/dbraw/zinc/82/19/06/1042821906.db2.gz IJTFZXMVFHJUPT-INIZCTEOSA-N 2 1 332.850 4.091 20 0 EIADMP Cc1ccc(F)c(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310235040 1042832223 /nfs/dbraw/zinc/83/22/23/1042832223.db2.gz KOKHXRXOVUOFPH-PKOBYXMFSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1ccc(F)c(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310235040 1042832225 /nfs/dbraw/zinc/83/22/25/1042832225.db2.gz KOKHXRXOVUOFPH-PKOBYXMFSA-N 2 1 326.459 4.134 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1Cl ZINC000177269934 1042832896 /nfs/dbraw/zinc/83/28/96/1042832896.db2.gz BBBIJXTZXCQYEZ-OAHLLOKOSA-N 2 1 332.875 4.131 20 0 EIADMP C[NH+]1CCC([NH2+]Cc2ccc(OC(C)(C)C)cc2C(F)(F)F)CC1 ZINC000177388576 1042836824 /nfs/dbraw/zinc/83/68/24/1042836824.db2.gz JUNITTJSVQMSNR-UHFFFAOYSA-N 2 1 344.421 4.067 20 0 EIADMP CC(C)OCC[NH+]1CCC([NH2+][C@H](C)c2ccc3ccccc3c2)CC1 ZINC000177485879 1042839524 /nfs/dbraw/zinc/83/95/24/1042839524.db2.gz WHJHEKHBMJJRGU-GOSISDBHSA-N 2 1 340.511 4.380 20 0 EIADMP Cc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc(C)c1O ZINC000310842010 1042846634 /nfs/dbraw/zinc/84/66/34/1042846634.db2.gz NWLHYLIDLQUMBO-RXVVDRJESA-N 2 1 338.495 4.009 20 0 EIADMP C[C@H]([NH2+]Cc1coc2ccccc12)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311129921 1042854027 /nfs/dbraw/zinc/85/40/27/1042854027.db2.gz WJBKMGOAOKRSBJ-HKUYNNGSSA-N 2 1 334.463 4.433 20 0 EIADMP COCCC[C@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000178439905 1042866561 /nfs/dbraw/zinc/86/65/61/1042866561.db2.gz WIOTYGOJIQUFAB-SFHVURJKSA-N 2 1 332.532 4.356 20 0 EIADMP CC1(c2ccccc2)CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001168002814 1042886398 /nfs/dbraw/zinc/88/63/98/1042886398.db2.gz ZFPRYNLLEXZSLE-CBQGHPETSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cccs2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168004876 1042942320 /nfs/dbraw/zinc/94/23/20/1042942320.db2.gz BDEMNYAGBXDIDC-IZZQQSIFSA-N 2 1 328.525 4.322 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2cc(Br)cs2)CC1 ZINC000194088845 1042982161 /nfs/dbraw/zinc/98/21/61/1042982161.db2.gz SNXZLARPVYGYTN-NSHDSACASA-N 2 1 331.323 4.034 20 0 EIADMP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000493978307 1042990355 /nfs/dbraw/zinc/99/03/55/1042990355.db2.gz RMCJMPHOFFAYNX-XMSQKQJNSA-N 2 1 340.511 4.393 20 0 EIADMP C[C@@H]1CC([NH2+]Cc2ccnc(Cl)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168006946 1043010802 /nfs/dbraw/zinc/01/08/02/1043010802.db2.gz PSHGUCPCZMUBCZ-HZPDHXFCSA-N 2 1 343.902 4.266 20 0 EIADMP COc1ccc2oc(C[NH2+][C@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)cc2c1 ZINC000183100894 1043037591 /nfs/dbraw/zinc/03/75/91/1043037591.db2.gz LLFPMPQQKFLGON-HZPDHXFCSA-N 2 1 342.483 4.184 20 0 EIADMP COc1ccc2oc(C[NH2+][C@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)cc2c1 ZINC000183100894 1043037597 /nfs/dbraw/zinc/03/75/97/1043037597.db2.gz LLFPMPQQKFLGON-HZPDHXFCSA-N 2 1 342.483 4.184 20 0 EIADMP CC[C@@H]1C[C@H](C[N@@H+](C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813146 1043056531 /nfs/dbraw/zinc/05/65/31/1043056531.db2.gz JDTJNAOBNBVIIP-WSWWRLHASA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813146 1043056543 /nfs/dbraw/zinc/05/65/43/1043056543.db2.gz JDTJNAOBNBVIIP-WSWWRLHASA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813146 1043056556 /nfs/dbraw/zinc/05/65/56/1043056556.db2.gz JDTJNAOBNBVIIP-WSWWRLHASA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813146 1043056575 /nfs/dbraw/zinc/05/65/75/1043056575.db2.gz JDTJNAOBNBVIIP-WSWWRLHASA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813146 1043056583 /nfs/dbraw/zinc/05/65/83/1043056583.db2.gz JDTJNAOBNBVIIP-WSWWRLHASA-N 2 1 344.543 4.177 20 0 EIADMP C[C@H](c1ccncc1)[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000673857218 1043126421 /nfs/dbraw/zinc/12/64/21/1043126421.db2.gz LEVILVIRXOAPPI-DENIHFKCSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccncc1)[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000673857218 1043126426 /nfs/dbraw/zinc/12/64/26/1043126426.db2.gz LEVILVIRXOAPPI-DENIHFKCSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccncc1)[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000673857218 1043126434 /nfs/dbraw/zinc/12/64/34/1043126434.db2.gz LEVILVIRXOAPPI-DENIHFKCSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccncc1)[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000673857218 1043126439 /nfs/dbraw/zinc/12/64/39/1043126439.db2.gz LEVILVIRXOAPPI-DENIHFKCSA-N 2 1 335.495 4.131 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCc3nc(C)ncc32)cc1 ZINC000766046657 1043247154 /nfs/dbraw/zinc/24/71/54/1043247154.db2.gz ZKYGAVPZZAUIKX-JLTOFOAXSA-N 2 1 347.466 4.007 20 0 EIADMP c1c[nH]c([C@H]2CCC[N@@H+]2CCCCC[NH+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000077266673 1043273059 /nfs/dbraw/zinc/27/30/59/1043273059.db2.gz GYDGRFNBCFSBRP-OYRHEFFESA-N 2 1 340.515 4.487 20 0 EIADMP c1c[nH]c([C@H]2CCC[NH+]2CCCCC[N@@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000077266673 1043273066 /nfs/dbraw/zinc/27/30/66/1043273066.db2.gz GYDGRFNBCFSBRP-OYRHEFFESA-N 2 1 340.515 4.487 20 0 EIADMP c1c[nH]c([C@H]2CCC[NH+]2CCCCC[N@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000077266673 1043273074 /nfs/dbraw/zinc/27/30/74/1043273074.db2.gz GYDGRFNBCFSBRP-OYRHEFFESA-N 2 1 340.515 4.487 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)oc21 ZINC000166024512 1043278660 /nfs/dbraw/zinc/27/86/60/1043278660.db2.gz IELZANHCUWXTCZ-BHYGNILZSA-N 2 1 328.456 4.109 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)oc21 ZINC000166024512 1043278666 /nfs/dbraw/zinc/27/86/66/1043278666.db2.gz IELZANHCUWXTCZ-BHYGNILZSA-N 2 1 328.456 4.109 20 0 EIADMP FC(F)(F)C1CC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000672623129 1043314809 /nfs/dbraw/zinc/31/48/09/1043314809.db2.gz UKCXTUXXRMDZFC-CSRJKQTDSA-N 2 1 338.417 4.113 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C1CCSCC1 ZINC000187215555 1043336543 /nfs/dbraw/zinc/33/65/43/1043336543.db2.gz FYRRGBXZXGBERM-IAGOWNOFSA-N 2 1 332.557 4.333 20 0 EIADMP CCCc1csc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)n1 ZINC000494373609 1043454496 /nfs/dbraw/zinc/45/44/96/1043454496.db2.gz ZPEJYPAZNBRKQF-UHFFFAOYSA-N 2 1 331.529 4.226 20 0 EIADMP CCCc1csc(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)n1 ZINC000494373609 1043454505 /nfs/dbraw/zinc/45/45/05/1043454505.db2.gz ZPEJYPAZNBRKQF-UHFFFAOYSA-N 2 1 331.529 4.226 20 0 EIADMP CCc1nc(C)c(CN(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC000428242686 1043461904 /nfs/dbraw/zinc/46/19/04/1043461904.db2.gz WEBWELBOWQSTNO-LPHOPBHVSA-N 2 1 341.499 4.030 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3cccnc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000674336108 1043603960 /nfs/dbraw/zinc/60/39/60/1043603960.db2.gz ZAMKKSBYZHQQOB-XMSQKQJNSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3cccnc3c2)CC[N@H+]1Cc1ccccc1 ZINC000674336108 1043603984 /nfs/dbraw/zinc/60/39/84/1043603984.db2.gz ZAMKKSBYZHQQOB-XMSQKQJNSA-N 2 1 345.490 4.378 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccccn1 ZINC000639219160 1043656179 /nfs/dbraw/zinc/65/61/79/1043656179.db2.gz QBVWCDXCMANZTK-CTNGQTDRSA-N 2 1 349.522 4.317 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccccn1 ZINC000639219160 1043656188 /nfs/dbraw/zinc/65/61/88/1043656188.db2.gz QBVWCDXCMANZTK-CTNGQTDRSA-N 2 1 349.522 4.317 20 0 EIADMP Cn1cc[nH+]c1C[C@@H](Nc1cc[nH+]c2ccccc12)c1ccccc1 ZINC000078559021 1043680892 /nfs/dbraw/zinc/68/08/92/1043680892.db2.gz FRBZACWBZYHUCF-HXUWFJFHSA-N 2 1 328.419 4.364 20 0 EIADMP FC1(F)CCC[C@@H]1C[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639231439 1043793688 /nfs/dbraw/zinc/79/36/88/1043793688.db2.gz XGJNRCRXPBNBFO-AOIWGVFYSA-N 2 1 334.454 4.380 20 0 EIADMP FC1(F)CCC[C@@H]1C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639231439 1043793711 /nfs/dbraw/zinc/79/37/11/1043793711.db2.gz XGJNRCRXPBNBFO-AOIWGVFYSA-N 2 1 334.454 4.380 20 0 EIADMP C[NH+](C)[C@H](C[NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1)C1CC1 ZINC000442711329 1043814613 /nfs/dbraw/zinc/81/46/13/1043814613.db2.gz DQVPWBLFJQOHAS-BPQIPLTHSA-N 2 1 340.433 4.271 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000442779553 1043832355 /nfs/dbraw/zinc/83/23/55/1043832355.db2.gz JEARKIFSLQDKBG-LFVTVUPYSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000442779553 1043832359 /nfs/dbraw/zinc/83/23/59/1043832359.db2.gz JEARKIFSLQDKBG-LFVTVUPYSA-N 2 1 340.433 4.414 20 0 EIADMP c1ccc(SC2(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCCC2)cc1 ZINC000166560275 1044050555 /nfs/dbraw/zinc/05/05/55/1044050555.db2.gz LSAGWGNZEOWXAD-ZWKOTPCHSA-N 2 1 330.541 4.308 20 0 EIADMP C[C@@H]1C[C@@H](n2nc(C[NH3+])c3ccccc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168015209 1044077972 /nfs/dbraw/zinc/07/79/72/1044077972.db2.gz PNWDVTXTZZQDQT-IZZQQSIFSA-N 2 1 348.494 4.109 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCSc2c(Cl)cccc21 ZINC000358082467 1044155019 /nfs/dbraw/zinc/15/50/19/1044155019.db2.gz NSQHXZQEDKYIQS-BLLLJJGKSA-N 2 1 335.904 4.308 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035645 1044172718 /nfs/dbraw/zinc/17/27/18/1044172718.db2.gz CMUWDRBBSFHYDV-KDOFPFPSSA-N 2 1 332.875 4.372 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035645 1044172742 /nfs/dbraw/zinc/17/27/42/1044172742.db2.gz CMUWDRBBSFHYDV-KDOFPFPSSA-N 2 1 332.875 4.372 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035645 1044172762 /nfs/dbraw/zinc/17/27/62/1044172762.db2.gz CMUWDRBBSFHYDV-KDOFPFPSSA-N 2 1 332.875 4.372 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035645 1044172786 /nfs/dbraw/zinc/17/27/86/1044172786.db2.gz CMUWDRBBSFHYDV-KDOFPFPSSA-N 2 1 332.875 4.372 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000658265850 1044197059 /nfs/dbraw/zinc/19/70/59/1044197059.db2.gz VJQIMJFKXNFMLG-OTBHMBEGSA-N 2 1 348.481 4.455 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000658265850 1044197087 /nfs/dbraw/zinc/19/70/87/1044197087.db2.gz VJQIMJFKXNFMLG-OTBHMBEGSA-N 2 1 348.481 4.455 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1cccc(Cl)c1Cl ZINC000543245728 1044231242 /nfs/dbraw/zinc/23/12/42/1044231242.db2.gz GVGQEJIXZRBTGO-UHFFFAOYSA-N 2 1 347.249 4.172 20 0 EIADMP Cc1cc(F)cc(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC001143589591 1044305192 /nfs/dbraw/zinc/30/51/92/1044305192.db2.gz DCPWNECCWRONBS-QFIPXVFZSA-N 2 1 338.470 4.232 20 0 EIADMP Cc1cc(F)cc(C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC001143589591 1044305204 /nfs/dbraw/zinc/30/52/04/1044305204.db2.gz DCPWNECCWRONBS-QFIPXVFZSA-N 2 1 338.470 4.232 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC001143589591 1044305210 /nfs/dbraw/zinc/30/52/10/1044305210.db2.gz DCPWNECCWRONBS-QFIPXVFZSA-N 2 1 338.470 4.232 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1 ZINC001143589591 1044305223 /nfs/dbraw/zinc/30/52/23/1044305223.db2.gz DCPWNECCWRONBS-QFIPXVFZSA-N 2 1 338.470 4.232 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)cc1 ZINC000348066895 1044388076 /nfs/dbraw/zinc/38/80/76/1044388076.db2.gz BTGUEEUVWHFNKK-PSAKCFHXSA-N 2 1 339.483 4.035 20 0 EIADMP Cc1ccccc1[C@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000466407017 1044401040 /nfs/dbraw/zinc/40/10/40/1044401040.db2.gz NDQSXAMGFOBJFX-AQYVVDRMSA-N 2 1 334.507 4.495 20 0 EIADMP c1ccc2c(c1)CSC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000675782308 1044496851 /nfs/dbraw/zinc/49/68/51/1044496851.db2.gz DQNYIHGWKRUJKB-FQEVSTJZSA-N 2 1 330.541 4.361 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000675817268 1044513915 /nfs/dbraw/zinc/51/39/15/1044513915.db2.gz ULLDFHUHNVPPDL-BDJLRTHQSA-N 2 1 338.282 4.412 20 0 EIADMP c1ccc(C[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C2CCCCC2)cc1 ZINC000480742558 1044573072 /nfs/dbraw/zinc/57/30/72/1044573072.db2.gz CKUDWWFRSXWQEU-FKBYEOEOSA-N 2 1 326.528 4.394 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ncoc3c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168024418 1044615988 /nfs/dbraw/zinc/61/59/88/1044615988.db2.gz GHGCMILFAAYWFE-XEMDLRDOSA-N 2 1 349.478 4.359 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000443662020 1044641650 /nfs/dbraw/zinc/64/16/50/1044641650.db2.gz UKCUEEALMCCLJF-SFHVURJKSA-N 2 1 340.433 4.464 20 0 EIADMP C[C@@H]1CC([NH2+]Cc2cncc(Cl)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168028704 1044748598 /nfs/dbraw/zinc/74/85/98/1044748598.db2.gz QGEUYLAMUQNHSJ-HZPDHXFCSA-N 2 1 343.902 4.266 20 0 EIADMP [NH3+]C12CC(CC[N@@H+]3CC=C(c4cc(Cl)cc(Cl)c4)CC3)(C1)C2 ZINC001205000882 1044796361 /nfs/dbraw/zinc/79/63/61/1044796361.db2.gz MDTBMSPMBTVFBO-UHFFFAOYSA-N 2 1 337.294 4.354 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@@H+](CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000474273496 1044831628 /nfs/dbraw/zinc/83/16/28/1044831628.db2.gz LWLWYJSWXCIFIE-OAHLLOKOSA-N 2 1 329.315 4.200 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861474 1044833750 /nfs/dbraw/zinc/83/37/50/1044833750.db2.gz TVGCUDSIDLIMQX-UONOGXRCSA-N 2 1 330.488 4.230 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861474 1044833751 /nfs/dbraw/zinc/83/37/51/1044833751.db2.gz TVGCUDSIDLIMQX-UONOGXRCSA-N 2 1 330.488 4.230 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH2+]C[C@H]3CC[N@@H+](CC)C3)ccc21 ZINC000327321134 1044834217 /nfs/dbraw/zinc/83/42/17/1044834217.db2.gz ZXNQIDJRHWMTOA-GOSISDBHSA-N 2 1 335.495 4.246 20 0 EIADMP Cc1ccc(CCC[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)cn1 ZINC000474278097 1044837044 /nfs/dbraw/zinc/83/70/44/1044837044.db2.gz OAHJTUGDBCSJKP-FQEVSTJZSA-N 2 1 343.559 4.299 20 0 EIADMP Cc1nc(C(C)C)oc1C[N@@H+]1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000428962216 1044908363 /nfs/dbraw/zinc/90/83/63/1044908363.db2.gz NGFXGCFBURNXDF-INIZCTEOSA-N 2 1 342.487 4.019 20 0 EIADMP Cc1nc(C(C)C)oc1C[N@H+]1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000428962216 1044908373 /nfs/dbraw/zinc/90/83/73/1044908373.db2.gz NGFXGCFBURNXDF-INIZCTEOSA-N 2 1 342.487 4.019 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+][C@H]3CCSC4(CCC4)C3)CC2)cc1 ZINC000922841719 1044986687 /nfs/dbraw/zinc/98/66/87/1044986687.db2.gz FROUWRKQVZBJLA-IBGZPJMESA-N 2 1 330.541 4.059 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH+]1CCC2(CCC[N@@H+]2CC2CC2)CC1 ZINC001168487691 1045046008 /nfs/dbraw/zinc/04/60/08/1045046008.db2.gz PNHUQVQIFOXLDW-QGZVFWFLSA-N 2 1 330.491 4.097 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1 ZINC001168487691 1045046022 /nfs/dbraw/zinc/04/60/22/1045046022.db2.gz PNHUQVQIFOXLDW-QGZVFWFLSA-N 2 1 330.491 4.097 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CC(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000509069623 1045054111 /nfs/dbraw/zinc/05/41/11/1045054111.db2.gz LDCIJLFNCAIJGV-GMAHTHKFSA-N 2 1 334.507 4.235 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CC(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000509069623 1045054125 /nfs/dbraw/zinc/05/41/25/1045054125.db2.gz LDCIJLFNCAIJGV-GMAHTHKFSA-N 2 1 334.507 4.235 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CC(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000509069623 1045054137 /nfs/dbraw/zinc/05/41/37/1045054137.db2.gz LDCIJLFNCAIJGV-GMAHTHKFSA-N 2 1 334.507 4.235 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CC(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000509069621 1045055731 /nfs/dbraw/zinc/05/57/31/1045055731.db2.gz LDCIJLFNCAIJGV-GGAORHGYSA-N 2 1 334.507 4.235 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CC(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000509069621 1045055741 /nfs/dbraw/zinc/05/57/41/1045055741.db2.gz LDCIJLFNCAIJGV-GGAORHGYSA-N 2 1 334.507 4.235 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CC(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000509069621 1045055751 /nfs/dbraw/zinc/05/57/51/1045055751.db2.gz LDCIJLFNCAIJGV-GGAORHGYSA-N 2 1 334.507 4.235 20 0 EIADMP c1ccc([C@@H]2C[C@@H](N[C@H]3CC[N@H+]4CCC[C@@H]4C3)c3ccccc3O2)cc1 ZINC000922887090 1045085547 /nfs/dbraw/zinc/08/55/47/1045085547.db2.gz YXDDQWCLAJJRSN-KPYOPSEVSA-N 2 1 348.490 4.468 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)c3ccccc3O2)cc1 ZINC000922887090 1045085560 /nfs/dbraw/zinc/08/55/60/1045085560.db2.gz YXDDQWCLAJJRSN-KPYOPSEVSA-N 2 1 348.490 4.468 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)c3ccccc3O2)cc1 ZINC000922887090 1045085575 /nfs/dbraw/zinc/08/55/75/1045085575.db2.gz YXDDQWCLAJJRSN-KPYOPSEVSA-N 2 1 348.490 4.468 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)c3ccccc3O2)cc1 ZINC000922887096 1045087356 /nfs/dbraw/zinc/08/73/56/1045087356.db2.gz YXDDQWCLAJJRSN-ZNTQHIFFSA-N 2 1 348.490 4.468 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)c3ccccc3O2)cc1 ZINC000922887096 1045087374 /nfs/dbraw/zinc/08/73/74/1045087374.db2.gz YXDDQWCLAJJRSN-ZNTQHIFFSA-N 2 1 348.490 4.468 20 0 EIADMP CC(C)(C)c1nc(C[N@@H+]2CCC[C@H](C[C@H]([NH3+])C3CCCC3)C2)co1 ZINC000923421339 1045098516 /nfs/dbraw/zinc/09/85/16/1045098516.db2.gz NBZDUSZAQPDADL-QAPCUYQASA-N 2 1 333.520 4.092 20 0 EIADMP CC(C)(C)c1nc(C[N@H+]2CCC[C@H](C[C@H]([NH3+])C3CCCC3)C2)co1 ZINC000923421339 1045098531 /nfs/dbraw/zinc/09/85/31/1045098531.db2.gz NBZDUSZAQPDADL-QAPCUYQASA-N 2 1 333.520 4.092 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC000626007884 1045114325 /nfs/dbraw/zinc/11/43/25/1045114325.db2.gz YLLHUVXCKKXCAW-UHFFFAOYSA-N 2 1 337.389 4.049 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC000626007884 1045114346 /nfs/dbraw/zinc/11/43/46/1045114346.db2.gz YLLHUVXCKKXCAW-UHFFFAOYSA-N 2 1 337.389 4.049 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2noc3c2CCCC3)CC1 ZINC000158986278 1045138066 /nfs/dbraw/zinc/13/80/66/1045138066.db2.gz IKERUSXSUWFWOS-QGZVFWFLSA-N 2 1 345.531 4.030 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2noc3c2CCCC3)CC1 ZINC000158986278 1045138078 /nfs/dbraw/zinc/13/80/78/1045138078.db2.gz IKERUSXSUWFWOS-QGZVFWFLSA-N 2 1 345.531 4.030 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2scnc2C2CC2)cc1 ZINC000487275381 1045223203 /nfs/dbraw/zinc/22/32/03/1045223203.db2.gz PCOHWVBUTFUSPW-CYBMUJFWSA-N 2 1 338.480 4.365 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1Cc2cccc(Cl)c2C1 ZINC001168741224 1045229548 /nfs/dbraw/zinc/22/95/48/1045229548.db2.gz XLFIOEUITOUGAD-BZSNNMDCSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@H]1Cc2cccc(Cl)c2C1 ZINC001168741224 1045229558 /nfs/dbraw/zinc/22/95/58/1045229558.db2.gz XLFIOEUITOUGAD-BZSNNMDCSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@H]1Cc2cccc(Cl)c2C1 ZINC001168741224 1045229570 /nfs/dbraw/zinc/22/95/70/1045229570.db2.gz XLFIOEUITOUGAD-BZSNNMDCSA-N 2 1 332.919 4.146 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCCc4ccccc43)CC2)cc1 ZINC000236586041 1045360844 /nfs/dbraw/zinc/36/08/44/1045360844.db2.gz XSCMHBKUAQJRLC-HSZRJFAPSA-N 2 1 334.507 4.361 20 0 EIADMP C[C@@H](CC[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000237565532 1045390026 /nfs/dbraw/zinc/39/00/26/1045390026.db2.gz REHDFNYQZCUUTD-UNMCSNQZSA-N 2 1 336.523 4.334 20 0 EIADMP Cc1ccccc1C1CC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000237706986 1045393409 /nfs/dbraw/zinc/39/34/09/1045393409.db2.gz NDQSXAMGFOBJFX-UHFFFAOYSA-N 2 1 334.507 4.495 20 0 EIADMP CC1(C)CC([NH2+]Cc2cc(F)cc(C(F)(F)F)c2)CC(C)(C)[NH2+]1 ZINC000322814500 1045498806 /nfs/dbraw/zinc/49/88/06/1045498806.db2.gz AHRNTBZCYCZTIN-UHFFFAOYSA-N 2 1 332.385 4.243 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCSc1ccccc1 ZINC000397977361 1045819518 /nfs/dbraw/zinc/81/95/18/1045819518.db2.gz KZLAHAZGPLXGSG-NQIIRXRSSA-N 2 1 340.536 4.279 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c(C)o1 ZINC000398010510 1045821600 /nfs/dbraw/zinc/82/16/00/1045821600.db2.gz CRNVXILITBIQAG-WJPUGNRLSA-N 2 1 326.484 4.458 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c(C)o1 ZINC000398010510 1045821602 /nfs/dbraw/zinc/82/16/02/1045821602.db2.gz CRNVXILITBIQAG-WJPUGNRLSA-N 2 1 326.484 4.458 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000398025056 1045824270 /nfs/dbraw/zinc/82/42/70/1045824270.db2.gz CATARXGKWSWIJB-FGSXEWAUSA-N 2 1 338.495 4.256 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000398025056 1045824271 /nfs/dbraw/zinc/82/42/71/1045824271.db2.gz CATARXGKWSWIJB-FGSXEWAUSA-N 2 1 338.495 4.256 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc2c(c1)COC(C)(C)O2 ZINC000768677087 1045825783 /nfs/dbraw/zinc/82/57/83/1045825783.db2.gz IGFVFQDAJRASOZ-QGZVFWFLSA-N 2 1 346.515 4.076 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1F ZINC000398042683 1045826677 /nfs/dbraw/zinc/82/66/77/1045826677.db2.gz UAMJCKRRKQBFLD-LLGFUMIMSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1F ZINC000398042683 1045826681 /nfs/dbraw/zinc/82/66/81/1045826681.db2.gz UAMJCKRRKQBFLD-LLGFUMIMSA-N 2 1 326.459 4.387 20 0 EIADMP COc1ccccc1[C@H](C)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398142365 1045830921 /nfs/dbraw/zinc/83/09/21/1045830921.db2.gz MUDSXZGCDMZNTG-LVCYWYKZSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398142365 1045830925 /nfs/dbraw/zinc/83/09/25/1045830925.db2.gz MUDSXZGCDMZNTG-LVCYWYKZSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398142365 1045830927 /nfs/dbraw/zinc/83/09/27/1045830927.db2.gz MUDSXZGCDMZNTG-LVCYWYKZSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398142365 1045830931 /nfs/dbraw/zinc/83/09/31/1045830931.db2.gz MUDSXZGCDMZNTG-LVCYWYKZSA-N 2 1 338.495 4.256 20 0 EIADMP c1nc(C2CCCC2)sc1CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246818780 1045831409 /nfs/dbraw/zinc/83/14/09/1045831409.db2.gz RHCXCGHKTMYJSZ-LPHOPBHVSA-N 2 1 345.556 4.249 20 0 EIADMP CCc1ccccc1C[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170205351 1045926239 /nfs/dbraw/zinc/92/62/39/1045926239.db2.gz KRXUEXMWGBFESP-QHCPKHFHSA-N 2 1 334.507 4.347 20 0 EIADMP CCc1ccccc1C[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001170205351 1045926243 /nfs/dbraw/zinc/92/62/43/1045926243.db2.gz KRXUEXMWGBFESP-QHCPKHFHSA-N 2 1 334.507 4.347 20 0 EIADMP CCc1ccccc1C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001170205351 1045926250 /nfs/dbraw/zinc/92/62/50/1045926250.db2.gz KRXUEXMWGBFESP-QHCPKHFHSA-N 2 1 334.507 4.347 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(SC(F)(F)F)cc2)CC[N@@H+]1C ZINC000769484506 1045971473 /nfs/dbraw/zinc/97/14/73/1045971473.db2.gz KPBUZWKDBOLFDI-TZMCWYRMSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(SC(F)(F)F)cc2)CC[NH+]1C ZINC000769484506 1045971498 /nfs/dbraw/zinc/97/14/98/1045971498.db2.gz KPBUZWKDBOLFDI-TZMCWYRMSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(SC(F)(F)F)cc2)CC[N@H+]1C ZINC000769484506 1045971486 /nfs/dbraw/zinc/97/14/86/1045971486.db2.gz KPBUZWKDBOLFDI-TZMCWYRMSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(SC(F)(F)F)cc2)CC[NH+]1C ZINC000769484506 1045971510 /nfs/dbraw/zinc/97/15/10/1045971510.db2.gz KPBUZWKDBOLFDI-TZMCWYRMSA-N 2 1 332.435 4.213 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000261896112 1046163436 /nfs/dbraw/zinc/16/34/36/1046163436.db2.gz VAUQAPFXRCAALB-JXFKEZNVSA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000261896112 1046163446 /nfs/dbraw/zinc/16/34/46/1046163446.db2.gz VAUQAPFXRCAALB-JXFKEZNVSA-N 2 1 343.540 4.419 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)C1CCCCC1 ZINC000162318374 1046174080 /nfs/dbraw/zinc/17/40/80/1046174080.db2.gz BJEAQKBNYAZNRG-IBGZPJMESA-N 2 1 330.520 4.011 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(Cl)s2)[C@H](C)C1 ZINC000124069663 1046215013 /nfs/dbraw/zinc/21/50/13/1046215013.db2.gz PGVWWSNWJWBKNV-ILXRZTDVSA-N 2 1 344.952 4.189 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(Cl)s2)[C@H](C)C1 ZINC000124069663 1046215027 /nfs/dbraw/zinc/21/50/27/1046215027.db2.gz PGVWWSNWJWBKNV-ILXRZTDVSA-N 2 1 344.952 4.189 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccccc2OC(F)F)C1 ZINC000125821338 1046352986 /nfs/dbraw/zinc/35/29/86/1046352986.db2.gz JYFCWYIYDOYHQT-LSDHHAIUSA-N 2 1 326.431 4.059 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccccc2OC(F)F)C1 ZINC000125821338 1046353002 /nfs/dbraw/zinc/35/30/02/1046353002.db2.gz JYFCWYIYDOYHQT-LSDHHAIUSA-N 2 1 326.431 4.059 20 0 EIADMP C[C@H]([NH2+]CCc1ccc(Cl)s1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508718460 1046374593 /nfs/dbraw/zinc/37/45/93/1046374593.db2.gz IZAOAWBQCPDPEG-DOTOQJQBSA-N 2 1 348.943 4.444 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H]2CC2(Cl)Cl)CC1)CC1CC1 ZINC000771475330 1046408350 /nfs/dbraw/zinc/40/83/50/1046408350.db2.gz IYAUZLSOTJECTM-INIZCTEOSA-N 2 1 333.347 4.014 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCCO2 ZINC000126484169 1046488039 /nfs/dbraw/zinc/48/80/39/1046488039.db2.gz JDRPVRZJNJPCHV-HXUWFJFHSA-N 2 1 328.500 4.240 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CCCO2 ZINC000126535776 1046495963 /nfs/dbraw/zinc/49/59/63/1046495963.db2.gz XDDJVTJLBSAVKD-OXQOHEQNSA-N 2 1 328.500 4.098 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000771926701 1046518049 /nfs/dbraw/zinc/51/80/49/1046518049.db2.gz HKARKQKIUNZADM-UHFFFAOYSA-N 2 1 336.401 4.399 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CC[C@@H](c4ccccc4)C3)CC2)[nH+]1 ZINC000127049564 1046597640 /nfs/dbraw/zinc/59/76/40/1046597640.db2.gz PZLNNIRXJVNTCU-CTNGQTDRSA-N 2 1 335.495 4.285 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c3ccccc23)C[C@H]1C ZINC000536659335 1046607756 /nfs/dbraw/zinc/60/77/56/1046607756.db2.gz WUPZOLPGGRKQMT-SJLPKXTDSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OC)c3ccccc23)C[C@H]1C ZINC000536659335 1046607769 /nfs/dbraw/zinc/60/77/69/1046607769.db2.gz WUPZOLPGGRKQMT-SJLPKXTDSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(OC)c3ccccc23)C[C@H]1C ZINC000536659335 1046607784 /nfs/dbraw/zinc/60/77/84/1046607784.db2.gz WUPZOLPGGRKQMT-SJLPKXTDSA-N 2 1 326.484 4.153 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[N@@H+]1C ZINC000536660052 1046628380 /nfs/dbraw/zinc/62/83/80/1046628380.db2.gz VCRMDIHVFPCHCQ-PBHICJAKSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[N@H+]1C ZINC000536660052 1046628399 /nfs/dbraw/zinc/62/83/99/1046628399.db2.gz VCRMDIHVFPCHCQ-PBHICJAKSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[NH+]1C ZINC000536660052 1046628409 /nfs/dbraw/zinc/62/84/09/1046628409.db2.gz VCRMDIHVFPCHCQ-PBHICJAKSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[NH+]1C ZINC000536660052 1046628436 /nfs/dbraw/zinc/62/84/36/1046628436.db2.gz VCRMDIHVFPCHCQ-PBHICJAKSA-N 2 1 332.488 4.469 20 0 EIADMP COc1ccc(-c2ccccc2)cc1CN(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000536661962 1046632420 /nfs/dbraw/zinc/63/24/20/1046632420.db2.gz JKENQNLPXJFYDB-UWJYYQICSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@H+](C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000536661962 1046632422 /nfs/dbraw/zinc/63/24/22/1046632422.db2.gz JKENQNLPXJFYDB-UWJYYQICSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000536661962 1046632426 /nfs/dbraw/zinc/63/24/26/1046632426.db2.gz JKENQNLPXJFYDB-UWJYYQICSA-N 2 1 338.495 4.277 20 0 EIADMP CO[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379645994 1046741246 /nfs/dbraw/zinc/74/12/46/1046741246.db2.gz IIKBSQKVVDTSQN-VLCRHTCISA-N 2 1 338.495 4.017 20 0 EIADMP CO[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379645994 1046741258 /nfs/dbraw/zinc/74/12/58/1046741258.db2.gz IIKBSQKVVDTSQN-VLCRHTCISA-N 2 1 338.495 4.017 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)s1 ZINC000128239079 1046785842 /nfs/dbraw/zinc/78/58/42/1046785842.db2.gz QLZBURFLSAOTCA-HNNXBMFYSA-N 2 1 329.513 4.334 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cccc(Cl)c1Cl ZINC000536866226 1046832864 /nfs/dbraw/zinc/83/28/64/1046832864.db2.gz ZOOVLWCKDDHJDQ-NEPJUHHUSA-N 2 1 326.271 4.485 20 0 EIADMP COc1cccc2c1C[C@H]([NH2+][C@H](C)c1ccc(-n3cc[nH+]c3C)cc1)C2 ZINC000459722637 1046864710 /nfs/dbraw/zinc/86/47/10/1046864710.db2.gz IDSVSYGRCBUHQY-DNVCBOLYSA-N 2 1 347.462 4.007 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000459726847 1046865060 /nfs/dbraw/zinc/86/50/60/1046865060.db2.gz BWUGPPLJBVSNFQ-MXWWQKGMSA-N 2 1 340.433 4.273 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000459730180 1046866724 /nfs/dbraw/zinc/86/67/24/1046866724.db2.gz LNWYHFCAVKASNX-PBNJOUANSA-N 2 1 338.470 4.182 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2OC)C2CCCC2)C1 ZINC000536959191 1046870999 /nfs/dbraw/zinc/87/09/99/1046870999.db2.gz KUXJAFHGOMGCCV-UTKZUKDTSA-N 2 1 330.516 4.248 20 0 EIADMP Cc1nc(F)ccc1C[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000787202671 1046949092 /nfs/dbraw/zinc/94/90/92/1046949092.db2.gz SKZDGJHTROITJB-INIZCTEOSA-N 2 1 333.495 4.006 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@H]3CCC[N@H+](CC(C)C)C3)oc21 ZINC000537305921 1047087768 /nfs/dbraw/zinc/08/77/68/1047087768.db2.gz CRDOZOLEGWVXMP-IAGOWNOFSA-N 2 1 344.499 4.460 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@H]3CCC[N@@H+](CC(C)C)C3)oc21 ZINC000537305921 1047087787 /nfs/dbraw/zinc/08/77/87/1047087787.db2.gz CRDOZOLEGWVXMP-IAGOWNOFSA-N 2 1 344.499 4.460 20 0 EIADMP FC(F)(F)c1cc(C[NH2+]C2CC[NH+](C3CC3)CC2)ccc1Cl ZINC000237860322 1047152029 /nfs/dbraw/zinc/15/20/29/1047152029.db2.gz SPZSMIXLLUIUMN-UHFFFAOYSA-N 2 1 332.797 4.075 20 0 EIADMP C[C@@H](CC[NH2+][C@H]1CCc2nc(Cl)ccc21)[N@H+](C)Cc1ccccc1 ZINC000806141307 1047168323 /nfs/dbraw/zinc/16/83/23/1047168323.db2.gz IEHKDHURDUODOM-YJBOKZPZSA-N 2 1 343.902 4.223 20 0 EIADMP C[C@@H](CC[NH2+][C@H]1CCc2nc(Cl)ccc21)[N@@H+](C)Cc1ccccc1 ZINC000806141307 1047168341 /nfs/dbraw/zinc/16/83/41/1047168341.db2.gz IEHKDHURDUODOM-YJBOKZPZSA-N 2 1 343.902 4.223 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2COCc3cccc(Cl)c32)C1 ZINC000788524998 1047202143 /nfs/dbraw/zinc/20/21/43/1047202143.db2.gz ADTAJWLIMVPGOI-CRAIPNDOSA-N 2 1 336.907 4.013 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCc3ccc(Cl)nc32)C1 ZINC000788538619 1047216451 /nfs/dbraw/zinc/21/64/51/1047216451.db2.gz HZVLETKVVVJAOJ-UXLLHSPISA-N 2 1 335.923 4.070 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1cc[nH]c(=O)c1 ZINC000788530259 1047228406 /nfs/dbraw/zinc/22/84/06/1047228406.db2.gz WQMDQLIXXPNGJY-SJORKVTESA-N 2 1 339.483 4.012 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(F)c(Cl)c2)C[C@@H]1c1ccccc1 ZINC000556075934 1047434194 /nfs/dbraw/zinc/43/41/94/1047434194.db2.gz FPJVBJONXCFATE-QFBILLFUSA-N 2 1 332.850 4.404 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(F)c(Cl)c2)C[C@@H]1c1ccccc1 ZINC000556075934 1047434206 /nfs/dbraw/zinc/43/42/06/1047434206.db2.gz FPJVBJONXCFATE-QFBILLFUSA-N 2 1 332.850 4.404 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)CCS1 ZINC000897788145 1047483420 /nfs/dbraw/zinc/48/34/20/1047483420.db2.gz CCRSPCXHWVEFCA-MUGJNUQGSA-N 2 1 344.568 4.303 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)[C@@]1(C)CCCO1 ZINC000556235956 1047600355 /nfs/dbraw/zinc/60/03/55/1047600355.db2.gz KQPARIKCOFEPCD-DBXWQHBBSA-N 2 1 330.516 4.108 20 0 EIADMP FC(F)(F)Sc1ccccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000898281721 1047607185 /nfs/dbraw/zinc/60/71/85/1047607185.db2.gz PCSYIWSHVAUGNL-KBPBESRZSA-N 2 1 330.419 4.015 20 0 EIADMP FC(F)(F)Sc1ccccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000898281721 1047607236 /nfs/dbraw/zinc/60/72/36/1047607236.db2.gz PCSYIWSHVAUGNL-KBPBESRZSA-N 2 1 330.419 4.015 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242196 1047622123 /nfs/dbraw/zinc/62/21/23/1047622123.db2.gz RJIGLFQNEXNFOK-QGQQZZQASA-N 2 1 334.507 4.290 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242196 1047622131 /nfs/dbraw/zinc/62/21/31/1047622131.db2.gz RJIGLFQNEXNFOK-QGQQZZQASA-N 2 1 334.507 4.290 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000105480443 1047634535 /nfs/dbraw/zinc/63/45/35/1047634535.db2.gz QKXOIJYFANKAIF-KSSFIOAISA-N 2 1 346.421 4.187 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000105480443 1047634545 /nfs/dbraw/zinc/63/45/45/1047634545.db2.gz QKXOIJYFANKAIF-KSSFIOAISA-N 2 1 346.421 4.187 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+]Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000556385914 1047723872 /nfs/dbraw/zinc/72/38/72/1047723872.db2.gz LJKNDGZMYXIJIJ-UHFFFAOYSA-N 2 1 325.843 4.302 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000550606177 1047747166 /nfs/dbraw/zinc/74/71/66/1047747166.db2.gz FNEDSKRBVSTLST-IRLDBZIGSA-N 2 1 338.495 4.399 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCCOC2CCCCC2)C[C@@H]1c1ccccc1 ZINC000550606703 1047758061 /nfs/dbraw/zinc/75/80/61/1047758061.db2.gz JGPMDDKYJJKDPV-PZJWPPBQSA-N 2 1 330.516 4.151 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCOC2CCCCC2)C[C@@H]1c1ccccc1 ZINC000550606703 1047758069 /nfs/dbraw/zinc/75/80/69/1047758069.db2.gz JGPMDDKYJJKDPV-PZJWPPBQSA-N 2 1 330.516 4.151 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(C2CC2)c1 ZINC000550629446 1047781190 /nfs/dbraw/zinc/78/11/90/1047781190.db2.gz QVJGVMBURCECDX-KSZLIROESA-N 2 1 330.516 4.104 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C12CCCC2 ZINC000550665544 1047810135 /nfs/dbraw/zinc/81/01/35/1047810135.db2.gz MGCTYYAAMPUSHJ-IVAOSVALSA-N 2 1 342.527 4.149 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C12CCCC2 ZINC000550665544 1047810137 /nfs/dbraw/zinc/81/01/37/1047810137.db2.gz MGCTYYAAMPUSHJ-IVAOSVALSA-N 2 1 342.527 4.149 20 0 EIADMP Cc1cccc(O[C@H](C)C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550666092 1047810803 /nfs/dbraw/zinc/81/08/03/1047810803.db2.gz UQPDQSWAOYQUKT-SYYKKAFVSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1cccc(O[C@H](C)C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550666092 1047810804 /nfs/dbraw/zinc/81/08/04/1047810804.db2.gz UQPDQSWAOYQUKT-SYYKKAFVSA-N 2 1 338.495 4.187 20 0 EIADMP COCCC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000550678094 1047813350 /nfs/dbraw/zinc/81/33/50/1047813350.db2.gz AOWJHMLBTHXDJP-VQTJNVASSA-N 2 1 330.516 4.008 20 0 EIADMP COCCC1(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000550678094 1047813351 /nfs/dbraw/zinc/81/33/51/1047813351.db2.gz AOWJHMLBTHXDJP-VQTJNVASSA-N 2 1 330.516 4.008 20 0 EIADMP C[C@@H]1C[C@H](N(C)Cc2cnc(-c3ccc(Cl)cc3)s2)CC[N@H+]1C ZINC000556598242 1047834455 /nfs/dbraw/zinc/83/44/55/1047834455.db2.gz IWCZBWCXMXAXIZ-CZUORRHYSA-N 2 1 349.931 4.378 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2cnc(-c3ccc(Cl)cc3)s2)CCN1C ZINC000556598242 1047834456 /nfs/dbraw/zinc/83/44/56/1047834456.db2.gz IWCZBWCXMXAXIZ-CZUORRHYSA-N 2 1 349.931 4.378 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cnc(-c3ccc(Cl)cc3)s2)CCN1C ZINC000556598242 1047834457 /nfs/dbraw/zinc/83/44/57/1047834457.db2.gz IWCZBWCXMXAXIZ-CZUORRHYSA-N 2 1 349.931 4.378 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556609727 1047840228 /nfs/dbraw/zinc/84/02/28/1047840228.db2.gz ACGYCMVZISSDPG-IGCXYCKISA-N 2 1 349.931 4.282 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556609727 1047840232 /nfs/dbraw/zinc/84/02/32/1047840232.db2.gz ACGYCMVZISSDPG-IGCXYCKISA-N 2 1 349.931 4.282 20 0 EIADMP C[C@H]1SCC[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000814173587 1047867320 /nfs/dbraw/zinc/86/73/20/1047867320.db2.gz STUMHEPDPLWXSQ-MNIJEXPFSA-N 2 1 330.541 4.056 20 0 EIADMP CC(C)[C@@H](NCC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939036 1047991917 /nfs/dbraw/zinc/99/19/17/1047991917.db2.gz FDXHNMPIJDWPHW-DYESRHJHSA-N 2 1 343.490 4.418 20 0 EIADMP CC(C)[C@@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939036 1047991943 /nfs/dbraw/zinc/99/19/43/1047991943.db2.gz FDXHNMPIJDWPHW-DYESRHJHSA-N 2 1 343.490 4.418 20 0 EIADMP CC(C)[C@@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939036 1047991960 /nfs/dbraw/zinc/99/19/60/1047991960.db2.gz FDXHNMPIJDWPHW-DYESRHJHSA-N 2 1 343.490 4.418 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CC[C@H](O)c2ccccc2)CC1 ZINC000808734392 1048094900 /nfs/dbraw/zinc/09/49/00/1048094900.db2.gz VAPVNPFNPWHYNX-UGKGYDQZSA-N 2 1 344.543 4.087 20 0 EIADMP C[N@H+](Cc1ccc(C(F)(F)F)cc1Cl)CC1CC[NH+](C)CC1 ZINC001143712628 1048170793 /nfs/dbraw/zinc/17/07/93/1048170793.db2.gz YMGQFRBPLWEVIB-UHFFFAOYSA-N 2 1 334.813 4.132 20 0 EIADMP [NH3+][C@H]1CCc2c3ccccc3n(-c3cccc(C4=[NH+]CCC4)c3)c2C1 ZINC001171099650 1048184352 /nfs/dbraw/zinc/18/43/52/1048184352.db2.gz OVTBBPOZSXXTPZ-INIZCTEOSA-N 2 1 329.447 4.029 20 0 EIADMP C[N@H+](CCC[NH+]1CCCC1)Cc1ccc(C(F)(F)F)c(Cl)c1 ZINC001143807881 1048202558 /nfs/dbraw/zinc/20/25/58/1048202558.db2.gz PCNQUIIDXAEOPC-UHFFFAOYSA-N 2 1 334.813 4.277 20 0 EIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1ccc(C(F)(F)F)c(Cl)c1 ZINC001143807881 1048202579 /nfs/dbraw/zinc/20/25/79/1048202579.db2.gz PCNQUIIDXAEOPC-UHFFFAOYSA-N 2 1 334.813 4.277 20 0 EIADMP C[NH+]1CCC2(CC[N@H+](Cc3c(F)ccc(Cl)c3Cl)C2)CC1 ZINC001143866803 1048255895 /nfs/dbraw/zinc/25/58/95/1048255895.db2.gz LCFMAIYKLUPJGY-UHFFFAOYSA-N 2 1 331.262 4.050 20 0 EIADMP C[NH+]1CCC2(CC[N@@H+](Cc3c(F)ccc(Cl)c3Cl)C2)CC1 ZINC001143866803 1048255935 /nfs/dbraw/zinc/25/59/35/1048255935.db2.gz LCFMAIYKLUPJGY-UHFFFAOYSA-N 2 1 331.262 4.050 20 0 EIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)s1 ZINC000499140408 1048337360 /nfs/dbraw/zinc/33/73/60/1048337360.db2.gz VVMJPZVXHNBMIK-REPLKXPHSA-N 2 1 326.509 4.342 20 0 EIADMP c1ccc(CCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000499163144 1048371945 /nfs/dbraw/zinc/37/19/45/1048371945.db2.gz UEGQAMLYHRTDNE-NUNAXRQHSA-N 2 1 334.507 4.404 20 0 EIADMP CCc1cc(C[N@@H+](C)Cc2ccc(-n3ccnc3)cc2)cc(CC)c1O ZINC001144150209 1048461065 /nfs/dbraw/zinc/46/10/65/1048461065.db2.gz DYZNVQLYPUNXNO-UHFFFAOYSA-N 2 1 349.478 4.335 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cnc(C(C)(C)C)s2)cc1 ZINC000809738833 1048511799 /nfs/dbraw/zinc/51/17/99/1048511799.db2.gz LZUAWTUIYCCTLP-UHFFFAOYSA-N 2 1 331.529 4.134 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cnc(C(C)(C)C)s2)cc1 ZINC000809738833 1048511805 /nfs/dbraw/zinc/51/18/05/1048511805.db2.gz LZUAWTUIYCCTLP-UHFFFAOYSA-N 2 1 331.529 4.134 20 0 EIADMP COc1ccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c(Cl)c1 ZINC000809738804 1048513470 /nfs/dbraw/zinc/51/34/70/1048513470.db2.gz KOFTZMVOUPYVED-UHFFFAOYSA-N 2 1 332.875 4.042 20 0 EIADMP COc1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)c(Cl)c1 ZINC000809738804 1048513487 /nfs/dbraw/zinc/51/34/87/1048513487.db2.gz KOFTZMVOUPYVED-UHFFFAOYSA-N 2 1 332.875 4.042 20 0 EIADMP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000815575485 1048536544 /nfs/dbraw/zinc/53/65/44/1048536544.db2.gz SRZIXWDAOWFUDA-ICSRJNTNSA-N 2 1 340.486 4.349 20 0 EIADMP CC(C)c1ccc(C2(O)CCC([NH2+][C@@H](C)C[N@H+](C)C(C)C)CC2)cc1 ZINC000810245166 1048728033 /nfs/dbraw/zinc/72/80/33/1048728033.db2.gz UBLAZOJMOPONRA-XTWGIRIWSA-N 2 1 346.559 4.259 20 0 EIADMP CC(C)c1ccc(C2(O)CCC([NH2+][C@@H](C)C[N@@H+](C)C(C)C)CC2)cc1 ZINC000810245166 1048728042 /nfs/dbraw/zinc/72/80/42/1048728042.db2.gz UBLAZOJMOPONRA-XTWGIRIWSA-N 2 1 346.559 4.259 20 0 EIADMP CCCC[C@@H](C[NH3+])[NH2+][C@@H](C)c1ccc(SC(F)F)c(OC)c1 ZINC000817963090 1049068756 /nfs/dbraw/zinc/06/87/56/1049068756.db2.gz MXWQOLUDUIVXQQ-AAEUAGOBSA-N 2 1 332.460 4.178 20 0 EIADMP CCCC[C@@H](C[NH3+])[NH2+]C1CCC(O)(c2ccc(C(C)C)cc2)CC1 ZINC000817962375 1049070046 /nfs/dbraw/zinc/07/00/46/1049070046.db2.gz IUXWPCLJNVSTCR-KBWCOIMZSA-N 2 1 332.532 4.047 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H](C[NH3+])C2CCCC2)ccc1SC(F)F ZINC000817980501 1049078390 /nfs/dbraw/zinc/07/83/90/1049078390.db2.gz CBJULTWCJDEGDJ-SMDDNHRTSA-N 2 1 344.471 4.178 20 0 EIADMP COC1(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCCCC1 ZINC000348176399 1049474401 /nfs/dbraw/zinc/47/44/01/1049474401.db2.gz VOSNOQJFXUZYTG-MRXNPFEDSA-N 2 1 327.472 4.181 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170681251 1049523639 /nfs/dbraw/zinc/52/36/39/1049523639.db2.gz NKUKVLOSACCJQK-BZSNNMDCSA-N 2 1 336.470 4.050 20 0 EIADMP CCC(CC)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2c(F)cccc2C1 ZINC001171414154 1049645740 /nfs/dbraw/zinc/64/57/40/1049645740.db2.gz NQKOXKYZILIEFM-BHIYHBOVSA-N 2 1 332.507 4.444 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495140 1049721877 /nfs/dbraw/zinc/72/18/77/1049721877.db2.gz XTNDEBFJWRHBDH-GBESFXJTSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495140 1049721886 /nfs/dbraw/zinc/72/18/86/1049721886.db2.gz XTNDEBFJWRHBDH-GBESFXJTSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495140 1049721893 /nfs/dbraw/zinc/72/18/93/1049721893.db2.gz XTNDEBFJWRHBDH-GBESFXJTSA-N 2 1 348.481 4.161 20 0 EIADMP c1cc(N2CCC[N@H+](Cc3ccc(C4CCCC4)cc3)CC2)cc[nH+]1 ZINC001171554462 1049754111 /nfs/dbraw/zinc/75/41/11/1049754111.db2.gz HXWLLUPVXQCZDO-UHFFFAOYSA-N 2 1 335.495 4.452 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)C[C@@H]1C)C2 ZINC001171563877 1049755998 /nfs/dbraw/zinc/75/59/98/1049755998.db2.gz OISKXLRSWMYDSS-APTRMMRNSA-N 2 1 348.534 4.353 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)C[C@@H]1C)C2 ZINC001171563877 1049756003 /nfs/dbraw/zinc/75/60/03/1049756003.db2.gz OISKXLRSWMYDSS-APTRMMRNSA-N 2 1 348.534 4.353 20 0 EIADMP C[NH+]1C(C)(C)CC(NCc2ccc(C[NH+]3CCCC3)cc2)CC1(C)C ZINC001171613748 1049765430 /nfs/dbraw/zinc/76/54/30/1049765430.db2.gz PDCWQEIKIZNPNS-UHFFFAOYSA-N 2 1 343.559 4.023 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@@H](c2cncc(Cl)c2)C2CC2)CC1(C)C ZINC001171627533 1049768991 /nfs/dbraw/zinc/76/89/91/1049768991.db2.gz VDMYMVAEHPGURI-QGZVFWFLSA-N 2 1 335.923 4.427 20 0 EIADMP CCC(CC)[N@H+](C1CC(C)(C)[NH+](C)C(C)(C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001171627126 1049769447 /nfs/dbraw/zinc/76/94/47/1049769447.db2.gz LBTIFNBFZFOPBC-SAABIXHNSA-N 3 1 337.596 4.398 20 0 EIADMP CCC(CC)[N@@H+](C1CC(C)(C)N(C)C(C)(C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001171627126 1049769455 /nfs/dbraw/zinc/76/94/55/1049769455.db2.gz LBTIFNBFZFOPBC-SAABIXHNSA-N 2 1 337.596 4.398 20 0 EIADMP CCC(CC)[N@H+](C1CC(C)(C)N(C)C(C)(C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001171627126 1049769460 /nfs/dbraw/zinc/76/94/60/1049769460.db2.gz LBTIFNBFZFOPBC-SAABIXHNSA-N 2 1 337.596 4.398 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001171658590 1049772034 /nfs/dbraw/zinc/77/20/34/1049772034.db2.gz TXNNNIOJXHZJKC-NZQKXSOJSA-N 2 1 336.523 4.428 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)cc1 ZINC001171666934 1049774732 /nfs/dbraw/zinc/77/47/32/1049774732.db2.gz SGJOMJAOQGETCY-SFHVURJKSA-N 2 1 340.486 4.405 20 0 EIADMP C[N@@H+](Cc1cccc2cccnc21)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171635990 1049777645 /nfs/dbraw/zinc/77/76/45/1049777645.db2.gz BPLQMPTYBOBWTH-UHFFFAOYSA-N 2 1 325.500 4.318 20 0 EIADMP C[NH2+]Cc1ccc2c(ccn2[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC001171744479 1049790191 /nfs/dbraw/zinc/79/01/91/1049790191.db2.gz HARYVHNJWSHJRN-LAUBAEHRSA-N 2 1 333.479 4.196 20 0 EIADMP C[C@@H]1C[C@@H](n2c(C[NH3+])cc3cccc(F)c32)C[N@H+]1Cc1ccccc1 ZINC001171741663 1049801423 /nfs/dbraw/zinc/80/14/23/1049801423.db2.gz QSJMHHDTQCOPDE-DNVCBOLYSA-N 2 1 337.442 4.075 20 0 EIADMP Fc1cccc2c1C[C@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001170997068 1049808134 /nfs/dbraw/zinc/80/81/34/1049808134.db2.gz QMHYUUJDASMPIQ-RTBURBONSA-N 2 1 330.491 4.023 20 0 EIADMP Cc1ncsc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000813790533 1049816405 /nfs/dbraw/zinc/81/64/05/1049816405.db2.gz PXEVIANYKXLXIZ-YQQQUEKLSA-N 2 1 341.524 4.127 20 0 EIADMP Cc1ncsc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813790533 1049816411 /nfs/dbraw/zinc/81/64/11/1049816411.db2.gz PXEVIANYKXLXIZ-YQQQUEKLSA-N 2 1 341.524 4.127 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCc2cccs2)CC[N@H+]1Cc1ccccc1 ZINC001171963614 1049825797 /nfs/dbraw/zinc/82/57/97/1049825797.db2.gz IICPWFNMWWCHSN-GOSISDBHSA-N 2 1 328.525 4.323 20 0 EIADMP CCCC[N@@H+](C)CCCN[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171964550 1049826514 /nfs/dbraw/zinc/82/65/14/1049826514.db2.gz GTLKQKJBUPOLHO-OAQYLSRUSA-N 2 1 345.575 4.141 20 0 EIADMP CCCC[NH+](C)CCCN[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964550 1049826516 /nfs/dbraw/zinc/82/65/16/1049826516.db2.gz GTLKQKJBUPOLHO-OAQYLSRUSA-N 2 1 345.575 4.141 20 0 EIADMP CCCC[NH+](C)CCCN[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964550 1049826519 /nfs/dbraw/zinc/82/65/19/1049826519.db2.gz GTLKQKJBUPOLHO-OAQYLSRUSA-N 2 1 345.575 4.141 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001171974437 1049835985 /nfs/dbraw/zinc/83/59/85/1049835985.db2.gz UHCUKPZPAMQEDT-HNNXBMFYSA-N 2 1 340.433 4.054 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccc(N)c1 ZINC001171976945 1049837796 /nfs/dbraw/zinc/83/77/96/1049837796.db2.gz VZUMOZFTTYPJBE-UWJYYQICSA-N 2 1 337.511 4.363 20 0 EIADMP CC1(C)C[C@H](n2ncc3c2cccc3C[NH3+])CC[N@H+]1Cc1ccccc1 ZINC001171981987 1049838290 /nfs/dbraw/zinc/83/82/90/1049838290.db2.gz FSZWIBFUCBRRQG-LJQANCHMSA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@@H](n2ncc3cccc(C[NH3+])c32)CC[N@H+]1Cc1ccccc1 ZINC001171982083 1049838308 /nfs/dbraw/zinc/83/83/08/1049838308.db2.gz HCNRTDDKFHTOLZ-FQEVSTJZSA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CC[C@@H](c3ccncc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171983734 1049838853 /nfs/dbraw/zinc/83/88/53/1049838853.db2.gz GNPYKHHGKJIARF-YADHBBJMSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CC[C@@H](c3ccncc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983734 1049838857 /nfs/dbraw/zinc/83/88/57/1049838857.db2.gz GNPYKHHGKJIARF-YADHBBJMSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CC[C@@H](c3ccncc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983734 1049838859 /nfs/dbraw/zinc/83/88/59/1049838859.db2.gz GNPYKHHGKJIARF-YADHBBJMSA-N 2 1 349.522 4.314 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170717255 1049839184 /nfs/dbraw/zinc/83/91/84/1049839184.db2.gz URWWURVVBLBJFN-SFHVURJKSA-N 2 1 336.470 4.018 20 0 EIADMP c1cc2c(o1)CCC[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245725367 1049839250 /nfs/dbraw/zinc/83/92/50/1049839250.db2.gz PIOQHRLTOHCOBX-WERVVEIQSA-N 2 1 336.479 4.442 20 0 EIADMP c1cc2c(o1)CCC[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245725367 1049839256 /nfs/dbraw/zinc/83/92/56/1049839256.db2.gz PIOQHRLTOHCOBX-WERVVEIQSA-N 2 1 336.479 4.442 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CC[C@@H](c3ccccn3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171983815 1049839682 /nfs/dbraw/zinc/83/96/82/1049839682.db2.gz GWHZCPGRAPDMNJ-RTWAWAEBSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CC[C@@H](c3ccccn3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983815 1049839685 /nfs/dbraw/zinc/83/96/85/1049839685.db2.gz GWHZCPGRAPDMNJ-RTWAWAEBSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CC[C@@H](c3ccccn3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983815 1049839686 /nfs/dbraw/zinc/83/96/86/1049839686.db2.gz GWHZCPGRAPDMNJ-RTWAWAEBSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([NH+]2CC[C@@H](c3cccnc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171985387 1049840849 /nfs/dbraw/zinc/84/08/49/1049840849.db2.gz WAWRLKIWNLBWIJ-FGZHOGPDSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CC[C@@H](c3cccnc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171985387 1049840850 /nfs/dbraw/zinc/84/08/50/1049840850.db2.gz WAWRLKIWNLBWIJ-FGZHOGPDSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CC[C@@H](c3cccnc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171985387 1049840853 /nfs/dbraw/zinc/84/08/53/1049840853.db2.gz WAWRLKIWNLBWIJ-FGZHOGPDSA-N 2 1 349.522 4.314 20 0 EIADMP COC(C)(C)[C@H]1CCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987838 1049841047 /nfs/dbraw/zinc/84/10/47/1049841047.db2.gz KJTYTZZLFJIPIK-WOJBJXKFSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@H]1CCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987838 1049841051 /nfs/dbraw/zinc/84/10/51/1049841051.db2.gz KJTYTZZLFJIPIK-WOJBJXKFSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@H]1CCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987838 1049841056 /nfs/dbraw/zinc/84/10/56/1049841056.db2.gz KJTYTZZLFJIPIK-WOJBJXKFSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@H]1CCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987838 1049841057 /nfs/dbraw/zinc/84/10/57/1049841057.db2.gz KJTYTZZLFJIPIK-WOJBJXKFSA-N 2 1 344.543 4.319 20 0 EIADMP Cc1cc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)ccc1Oc1cccnc1 ZINC000245730741 1049841361 /nfs/dbraw/zinc/84/13/61/1049841361.db2.gz JSENJGATOPIWHP-PKOBYXMFSA-N 2 1 339.483 4.097 20 0 EIADMP Cc1cc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1Oc1cccnc1 ZINC000245730741 1049841369 /nfs/dbraw/zinc/84/13/69/1049841369.db2.gz JSENJGATOPIWHP-PKOBYXMFSA-N 2 1 339.483 4.097 20 0 EIADMP Cc1cc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)ccc1Oc1cccnc1 ZINC000245730741 1049841371 /nfs/dbraw/zinc/84/13/71/1049841371.db2.gz JSENJGATOPIWHP-PKOBYXMFSA-N 2 1 339.483 4.097 20 0 EIADMP Cc1cc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)ccc1Oc1cccnc1 ZINC000245730741 1049841378 /nfs/dbraw/zinc/84/13/78/1049841378.db2.gz JSENJGATOPIWHP-PKOBYXMFSA-N 2 1 339.483 4.097 20 0 EIADMP F[C@H]1CCCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070336 1049843110 /nfs/dbraw/zinc/84/31/10/1049843110.db2.gz ZFSNHYUYEKLLCT-BURNTYAHSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070336 1049843111 /nfs/dbraw/zinc/84/31/11/1049843111.db2.gz ZFSNHYUYEKLLCT-BURNTYAHSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070336 1049843113 /nfs/dbraw/zinc/84/31/13/1049843113.db2.gz ZFSNHYUYEKLLCT-BURNTYAHSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070336 1049843119 /nfs/dbraw/zinc/84/31/19/1049843119.db2.gz ZFSNHYUYEKLLCT-BURNTYAHSA-N 2 1 330.491 4.396 20 0 EIADMP C[N@@H+](CCc1cccnc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076445 1049843879 /nfs/dbraw/zinc/84/38/79/1049843879.db2.gz YQBUQILZRJSANY-NUNAXRQHSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1cccnc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076445 1049843882 /nfs/dbraw/zinc/84/38/82/1049843882.db2.gz YQBUQILZRJSANY-NUNAXRQHSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1cccnc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076445 1049843886 /nfs/dbraw/zinc/84/38/86/1049843886.db2.gz YQBUQILZRJSANY-NUNAXRQHSA-N 2 1 349.522 4.142 20 0 EIADMP F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076901 1049844060 /nfs/dbraw/zinc/84/40/60/1049844060.db2.gz AWJNNIBMTYBDAG-DGGDGUMWSA-N 2 1 328.475 4.004 20 0 EIADMP F[C@H]1C[C@@H]2C[C@H]1C[N@H+]2[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076901 1049844061 /nfs/dbraw/zinc/84/40/61/1049844061.db2.gz AWJNNIBMTYBDAG-DGGDGUMWSA-N 2 1 328.475 4.004 20 0 EIADMP F[C@H]1C[C@@H]2C[C@H]1C[NH+]2[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076901 1049844064 /nfs/dbraw/zinc/84/40/64/1049844064.db2.gz AWJNNIBMTYBDAG-DGGDGUMWSA-N 2 1 328.475 4.004 20 0 EIADMP F[C@H]1C[C@@H]2C[C@H]1C[NH+]2[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076901 1049844067 /nfs/dbraw/zinc/84/40/67/1049844067.db2.gz AWJNNIBMTYBDAG-DGGDGUMWSA-N 2 1 328.475 4.004 20 0 EIADMP CO[C@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172078805 1049846685 /nfs/dbraw/zinc/84/66/85/1049846685.db2.gz IXJKXAMNDOMHJC-YPHBOWRQSA-N 2 1 342.527 4.119 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CC(c4cccnc4)C2)C3)cc1 ZINC001172084534 1049847331 /nfs/dbraw/zinc/84/73/31/1049847331.db2.gz YMFFQKQELOIIHH-JKHIJQBDSA-N 2 1 347.506 4.067 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CC(c4cccnc4)C2)C3)cc1 ZINC001172084534 1049847335 /nfs/dbraw/zinc/84/73/35/1049847335.db2.gz YMFFQKQELOIIHH-JKHIJQBDSA-N 2 1 347.506 4.067 20 0 EIADMP C[C@H]1C[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)CC[C@@]1(C)c1cccc(O)c1 ZINC001172125389 1049852742 /nfs/dbraw/zinc/85/27/42/1049852742.db2.gz QIEHTUBWBPJDJW-HBFRDEGOSA-N 2 1 342.527 4.007 20 0 EIADMP C[C@H]1C[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)CC[C@@]1(C)c1cccc(O)c1 ZINC001172125389 1049852745 /nfs/dbraw/zinc/85/27/45/1049852745.db2.gz QIEHTUBWBPJDJW-HBFRDEGOSA-N 2 1 342.527 4.007 20 0 EIADMP C[C@H]1C[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)CC[C@@]1(C)c1cccc(O)c1 ZINC001172125389 1049852747 /nfs/dbraw/zinc/85/27/47/1049852747.db2.gz QIEHTUBWBPJDJW-HBFRDEGOSA-N 2 1 342.527 4.007 20 0 EIADMP C[C@H]1C[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CC[C@@]1(C)c1cccc(O)c1 ZINC001172125389 1049852751 /nfs/dbraw/zinc/85/27/51/1049852751.db2.gz QIEHTUBWBPJDJW-HBFRDEGOSA-N 2 1 342.527 4.007 20 0 EIADMP C[C@H]1C[C@@H](CF)[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172069893 1049853011 /nfs/dbraw/zinc/85/30/11/1049853011.db2.gz VITHZZRWWYBAPQ-URZNZNTCSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@H]1C[C@@H](CF)[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172069893 1049853015 /nfs/dbraw/zinc/85/30/15/1049853015.db2.gz VITHZZRWWYBAPQ-URZNZNTCSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@H]1C[C@@H](CF)[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172069893 1049853017 /nfs/dbraw/zinc/85/30/17/1049853017.db2.gz VITHZZRWWYBAPQ-URZNZNTCSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@H]1C[C@@H](CF)[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172069893 1049853021 /nfs/dbraw/zinc/85/30/21/1049853021.db2.gz VITHZZRWWYBAPQ-URZNZNTCSA-N 2 1 330.491 4.252 20 0 EIADMP COC[C@@H]1CCCC[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069319 1049853164 /nfs/dbraw/zinc/85/31/64/1049853164.db2.gz PAQSLIMHGKMSRJ-LNRXMEIDSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@@H]1CCCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069319 1049853167 /nfs/dbraw/zinc/85/31/67/1049853167.db2.gz PAQSLIMHGKMSRJ-LNRXMEIDSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@@H]1CCCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069319 1049853169 /nfs/dbraw/zinc/85/31/69/1049853169.db2.gz PAQSLIMHGKMSRJ-LNRXMEIDSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@@H]1CCCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069319 1049853170 /nfs/dbraw/zinc/85/31/70/1049853170.db2.gz PAQSLIMHGKMSRJ-LNRXMEIDSA-N 2 1 342.527 4.073 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Br)s1 ZINC001172103745 1049855470 /nfs/dbraw/zinc/85/54/70/1049855470.db2.gz XDUHJBGCTDZDSX-LPWJVIDDSA-N 2 1 343.334 4.177 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3cccc(C(F)(F)F)c3)CC1)C2 ZINC001172104345 1049857087 /nfs/dbraw/zinc/85/70/87/1049857087.db2.gz BQQSODGMLYYGOP-OSYLJGHBSA-N 2 1 338.417 4.299 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3cccc(C(F)(F)F)c3)CC1)C2 ZINC001172104345 1049857090 /nfs/dbraw/zinc/85/70/90/1049857090.db2.gz BQQSODGMLYYGOP-OSYLJGHBSA-N 2 1 338.417 4.299 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1C(F)(F)F ZINC001172106010 1049857312 /nfs/dbraw/zinc/85/73/12/1049857312.db2.gz MDTDWHUTXURRPI-PHZGNYQRSA-N 2 1 326.406 4.119 20 0 EIADMP C[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172124294 1049859583 /nfs/dbraw/zinc/85/95/83/1049859583.db2.gz KKJWEGURDRXURG-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172124294 1049859587 /nfs/dbraw/zinc/85/95/87/1049859587.db2.gz KKJWEGURDRXURG-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172124294 1049859589 /nfs/dbraw/zinc/85/95/89/1049859589.db2.gz KKJWEGURDRXURG-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CSc2ccccc2C1 ZINC001172206332 1049864614 /nfs/dbraw/zinc/86/46/14/1049864614.db2.gz ONPOOHUOZSJKIU-OTWHNJEPSA-N 2 1 330.541 4.042 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@@H]1CSc2ccccc2C1 ZINC001172206332 1049864616 /nfs/dbraw/zinc/86/46/16/1049864616.db2.gz ONPOOHUOZSJKIU-OTWHNJEPSA-N 2 1 330.541 4.042 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@@H]1CSc2ccccc2C1 ZINC001172206332 1049864618 /nfs/dbraw/zinc/86/46/18/1049864618.db2.gz ONPOOHUOZSJKIU-OTWHNJEPSA-N 2 1 330.541 4.042 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CSc2ccccc2C1 ZINC001172206330 1049864685 /nfs/dbraw/zinc/86/46/85/1049864685.db2.gz ONPOOHUOZSJKIU-GBESFXJTSA-N 2 1 330.541 4.042 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@H]1CSc2ccccc2C1 ZINC001172206330 1049864687 /nfs/dbraw/zinc/86/46/87/1049864687.db2.gz ONPOOHUOZSJKIU-GBESFXJTSA-N 2 1 330.541 4.042 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@H]1CSc2ccccc2C1 ZINC001172206330 1049864688 /nfs/dbraw/zinc/86/46/88/1049864688.db2.gz ONPOOHUOZSJKIU-GBESFXJTSA-N 2 1 330.541 4.042 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172320720 1049877262 /nfs/dbraw/zinc/87/72/62/1049877262.db2.gz ZXJMHTGTDVCUPE-IWFBPKFRSA-N 2 1 332.532 4.223 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172320720 1049877265 /nfs/dbraw/zinc/87/72/65/1049877265.db2.gz ZXJMHTGTDVCUPE-IWFBPKFRSA-N 2 1 332.532 4.223 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C[C@@H]1C ZINC001172379937 1049885687 /nfs/dbraw/zinc/88/56/87/1049885687.db2.gz UJZIVSXLMXZTKI-WSTZPKSXSA-N 2 1 330.516 4.392 20 0 EIADMP C[C@@H]1CC[C@@H]([NH2+][C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2[NH3+])C[C@H]1C ZINC001172369566 1049897134 /nfs/dbraw/zinc/89/71/34/1049897134.db2.gz RTASDKLVWUTVDQ-ZLKNNRNNSA-N 2 1 346.518 4.388 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001172446144 1049914203 /nfs/dbraw/zinc/91/42/03/1049914203.db2.gz ISHMXWZCLOJJIJ-AZUAARDMSA-N 2 1 348.531 4.160 20 0 EIADMP CC(C)OCC[C@@H](C)[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172453241 1049916477 /nfs/dbraw/zinc/91/64/77/1049916477.db2.gz FRPUHDBNGXOMTI-IRLDBZIGSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@@H](C)[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172453241 1049916481 /nfs/dbraw/zinc/91/64/81/1049916481.db2.gz FRPUHDBNGXOMTI-IRLDBZIGSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@@H](C)[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172453241 1049916492 /nfs/dbraw/zinc/91/64/92/1049916492.db2.gz FRPUHDBNGXOMTI-IRLDBZIGSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)COCC[C@H](C)[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172467181 1049919968 /nfs/dbraw/zinc/91/99/68/1049919968.db2.gz IVMOEAGMUDMLMZ-JBACZVJFSA-N 2 1 332.532 4.210 20 0 EIADMP Cc1cccc(N([C@@H]2CC[C@@H](c3ccccc3)C2)C2CC[NH2+]CC2)[nH+]1 ZINC001172566107 1049935758 /nfs/dbraw/zinc/93/57/58/1049935758.db2.gz SCEGGKDXSBBAOX-TZIWHRDSSA-N 2 1 335.495 4.285 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2sc(-c3ccccc3F)nc2C)C1 ZINC000246858965 1050003695 /nfs/dbraw/zinc/00/36/95/1050003695.db2.gz CWXYCSHDNGMBCU-HIFRSBDPSA-N 2 1 347.503 4.250 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2sc(-c3ccccc3F)nc2C)C1 ZINC000246858980 1050004186 /nfs/dbraw/zinc/00/41/86/1050004186.db2.gz CWXYCSHDNGMBCU-UKRRQHHQSA-N 2 1 347.503 4.250 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Br)s1 ZINC000246945109 1050006222 /nfs/dbraw/zinc/00/62/22/1050006222.db2.gz HCUDNDCJLJLKLP-SDDRHHMPSA-N 2 1 331.323 4.034 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1OC ZINC000246937499 1050006545 /nfs/dbraw/zinc/00/65/45/1050006545.db2.gz HLHWWMUNXVPJBI-XYJFISCASA-N 2 1 334.504 4.007 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000246937499 1050006547 /nfs/dbraw/zinc/00/65/47/1050006547.db2.gz HLHWWMUNXVPJBI-XYJFISCASA-N 2 1 334.504 4.007 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1cncc(F)c1 ZINC000246959050 1050007870 /nfs/dbraw/zinc/00/78/70/1050007870.db2.gz ILVWQLCTZKDODH-IAGOWNOFSA-N 2 1 341.474 4.446 20 0 EIADMP Cc1ccsc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000247083226 1050013839 /nfs/dbraw/zinc/01/38/39/1050013839.db2.gz OYDOXZQTFKRTPR-DLBZAZTESA-N 2 1 344.524 4.128 20 0 EIADMP Cc1ccsc1[C@@H](C)[NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000247083226 1050013842 /nfs/dbraw/zinc/01/38/42/1050013842.db2.gz OYDOXZQTFKRTPR-DLBZAZTESA-N 2 1 344.524 4.128 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248388794 1050052831 /nfs/dbraw/zinc/05/28/31/1050052831.db2.gz ADVYFYJMIYLWDU-BZSNNMDCSA-N 2 1 330.516 4.307 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248388794 1050052838 /nfs/dbraw/zinc/05/28/38/1050052838.db2.gz ADVYFYJMIYLWDU-BZSNNMDCSA-N 2 1 330.516 4.307 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)CCCS2 ZINC000249181281 1050094545 /nfs/dbraw/zinc/09/45/45/1050094545.db2.gz IIFXFDGMSHGQPO-APWZRJJASA-N 2 1 348.556 4.332 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000249270303 1050096320 /nfs/dbraw/zinc/09/63/20/1050096320.db2.gz JZQMFMKZEQMDBW-SJORKVTESA-N 2 1 328.422 4.349 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc3ccccc3)C1)CC2 ZINC001172825420 1050166754 /nfs/dbraw/zinc/16/67/54/1050166754.db2.gz GXKYYGRURNLFIJ-QPPBQGQZSA-N 2 1 348.534 4.354 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)[C@H](C)C1)CC2 ZINC001172825363 1050166948 /nfs/dbraw/zinc/16/69/48/1050166948.db2.gz GLUVZEQILGDFHR-FOVJLYNBSA-N 2 1 348.534 4.495 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)[C@H](C)C1)CC2 ZINC001172825363 1050166954 /nfs/dbraw/zinc/16/69/54/1050166954.db2.gz GLUVZEQILGDFHR-FOVJLYNBSA-N 2 1 348.534 4.495 20 0 EIADMP Fc1ccc(/C=C\C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)c(F)c1 ZINC001177245025 1050172761 /nfs/dbraw/zinc/17/27/61/1050172761.db2.gz KROOOTLWXJDBBK-CLTKARDFSA-N 2 1 342.433 4.016 20 0 EIADMP Fc1ccc(/C=C\C[NH2+]CCC[N@H+]2CCc3ccccc3C2)c(F)c1 ZINC001177245025 1050172765 /nfs/dbraw/zinc/17/27/65/1050172765.db2.gz KROOOTLWXJDBBK-CLTKARDFSA-N 2 1 342.433 4.016 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)C[C@H]1C)CC2 ZINC001172837770 1050173582 /nfs/dbraw/zinc/17/35/82/1050173582.db2.gz MWUAHBKSJWLZRK-CTUHWIOQSA-N 2 1 348.534 4.353 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)C[C@H]1C)CC2 ZINC001172837770 1050173589 /nfs/dbraw/zinc/17/35/89/1050173589.db2.gz MWUAHBKSJWLZRK-CTUHWIOQSA-N 2 1 348.534 4.353 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc(Cl)nc3)cc2)C1 ZINC001177256641 1050176138 /nfs/dbraw/zinc/17/61/38/1050176138.db2.gz KIPRVWUNWUHNCM-INIZCTEOSA-N 2 1 343.902 4.257 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2cccc(C(F)(F)F)c2)C1 ZINC001177294001 1050177521 /nfs/dbraw/zinc/17/75/21/1050177521.db2.gz CCZLGWZCTAJBAP-GASCZTMLSA-N 2 1 328.422 4.163 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2cccc(C(F)(F)F)c2)C1 ZINC001177294001 1050177533 /nfs/dbraw/zinc/17/75/33/1050177533.db2.gz CCZLGWZCTAJBAP-GASCZTMLSA-N 2 1 328.422 4.163 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cn(C)nc2C2CCCCC2)C1 ZINC001177299276 1050179956 /nfs/dbraw/zinc/17/99/56/1050179956.db2.gz NJEBONZTLZTNCI-GOSISDBHSA-N 2 1 346.563 4.070 20 0 EIADMP CCOc1c(Cl)cccc1C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC001177299247 1050180418 /nfs/dbraw/zinc/18/04/18/1050180418.db2.gz METZTIGLMJEHSP-INIZCTEOSA-N 2 1 338.923 4.340 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H](C)Cc2ccc(F)cc2Cl)CC1 ZINC001172869329 1050206823 /nfs/dbraw/zinc/20/68/23/1050206823.db2.gz ZKLOXGVHKKOTRY-HNNXBMFYSA-N 2 1 340.914 4.462 20 0 EIADMP C[C@@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172879105 1050221120 /nfs/dbraw/zinc/22/11/20/1050221120.db2.gz MBMYGHIKWMIKOE-QSPRXWTASA-N 2 1 338.948 4.426 20 0 EIADMP C[C@@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172879105 1050221130 /nfs/dbraw/zinc/22/11/30/1050221130.db2.gz MBMYGHIKWMIKOE-QSPRXWTASA-N 2 1 338.948 4.426 20 0 EIADMP CCCOC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC001173096506 1050287945 /nfs/dbraw/zinc/28/79/45/1050287945.db2.gz QAOCHVRUGAUAAI-FTWXPCQCSA-N 2 1 344.543 4.224 20 0 EIADMP CCCOC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC001173096506 1050287962 /nfs/dbraw/zinc/28/79/62/1050287962.db2.gz QAOCHVRUGAUAAI-FTWXPCQCSA-N 2 1 344.543 4.224 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H](Oc3ccccc3C)C2)CC1 ZINC001173112198 1050310057 /nfs/dbraw/zinc/31/00/57/1050310057.db2.gz SMSVAQANODZVDG-XVAXZDLZSA-N 2 1 344.543 4.491 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+]2CC=C(c3ccc(OC)cc3)CC2)CC1 ZINC001173112624 1050310492 /nfs/dbraw/zinc/31/04/92/1050310492.db2.gz AWGVALAQEVLIFL-UHFFFAOYSA-N 2 1 342.527 4.437 20 0 EIADMP CC(C)([NH3+])CC[NH2+]CCC(C)(C)[NH2+]C1CCC2(CCCCC2)CC1 ZINC001173115858 1050312722 /nfs/dbraw/zinc/31/27/22/1050312722.db2.gz CNIGPNJNKQLMQG-UHFFFAOYSA-N 3 1 337.596 4.355 20 0 EIADMP c1ccc(OC2CCC([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)CC2)cc1 ZINC001173198923 1050343414 /nfs/dbraw/zinc/34/34/14/1050343414.db2.gz LCYISZRUIMQOSD-GSVIPDFHSA-N 2 1 342.527 4.373 20 0 EIADMP c1ccc(OC2CCC([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)CC2)cc1 ZINC001173198923 1050343430 /nfs/dbraw/zinc/34/34/30/1050343430.db2.gz LCYISZRUIMQOSD-GSVIPDFHSA-N 2 1 342.527 4.373 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173204436 1050363044 /nfs/dbraw/zinc/36/30/44/1050363044.db2.gz PBCIDIAUSCIGTC-UHFFFAOYSA-N 2 1 344.543 4.429 20 0 EIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001173207339 1050368564 /nfs/dbraw/zinc/36/85/64/1050368564.db2.gz QVKQXBUGCXEIDV-PMOQBDJRSA-N 2 1 348.534 4.481 20 0 EIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH+]1C[C@H]2CC[N@H+](C)C[C@H]2C1 ZINC001173207339 1050368573 /nfs/dbraw/zinc/36/85/73/1050368573.db2.gz QVKQXBUGCXEIDV-PMOQBDJRSA-N 2 1 348.534 4.481 20 0 EIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH+]1C[C@H]2CC[N@@H+](C)C[C@H]2C1 ZINC001173207339 1050368581 /nfs/dbraw/zinc/36/85/81/1050368581.db2.gz QVKQXBUGCXEIDV-PMOQBDJRSA-N 2 1 348.534 4.481 20 0 EIADMP CCc1ccc(C[C@H](C)N(c2cccc(C)[nH+]2)C2CC[NH2+]CC2)cc1 ZINC001173249116 1050377319 /nfs/dbraw/zinc/37/73/19/1050377319.db2.gz XWQVIMGZYGGYDC-SFHVURJKSA-N 2 1 337.511 4.142 20 0 EIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2cccc(OC)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173271847 1050392561 /nfs/dbraw/zinc/39/25/61/1050392561.db2.gz RMIPXAIPMTYXTP-FRYIKTPZSA-N 2 1 330.516 4.346 20 0 EIADMP CC[C@H]1CC[C@@H]([NH+]2CCC3(CCC[N@H+]3Cc3c(C)noc3C)CC2)C1 ZINC001173284387 1050411404 /nfs/dbraw/zinc/41/14/04/1050411404.db2.gz ZNLMFJFMJWUCDC-RBUKOAKNSA-N 2 1 345.531 4.301 20 0 EIADMP CC[N@H+]1CC[C@@H](n2cc(C[NH2+]Cc3ccccc3)c3ccccc32)C1 ZINC001173367370 1050442739 /nfs/dbraw/zinc/44/27/39/1050442739.db2.gz GXBCXPQXBXQQMQ-HXUWFJFHSA-N 2 1 333.479 4.198 20 0 EIADMP CSCc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001178458103 1050474065 /nfs/dbraw/zinc/47/40/65/1050474065.db2.gz PTDPNSDNBIBCTM-QFBILLFUSA-N 2 1 332.557 4.292 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001178457722 1050474295 /nfs/dbraw/zinc/47/42/95/1050474295.db2.gz CGLPVPRKQIHJMJ-HKUYNNGSSA-N 2 1 330.516 4.216 20 0 EIADMP CCC[NH+](CCC)c1ccc(Nc2cnn(CCC[NH+](C)C)c2)cc1 ZINC001187118295 1050478530 /nfs/dbraw/zinc/47/85/30/1050478530.db2.gz WDZGRGZBKLWSML-UHFFFAOYSA-N 2 1 343.519 4.205 20 0 EIADMP CC[N@@H+]1C[C@@H]2C[NH+]([C@@H](C)CCc3ccc(Cl)c(Cl)c3)C[C@@H]2C1 ZINC001173551151 1050488508 /nfs/dbraw/zinc/48/85/08/1050488508.db2.gz QYJWWIJXKUVYGU-CWRNSKLLSA-N 2 1 341.326 4.198 20 0 EIADMP CC[NH+]1C[C@@H]2C[N@H+]([C@@H](C)CCc3ccc(Cl)c(Cl)c3)C[C@@H]2C1 ZINC001173551151 1050488515 /nfs/dbraw/zinc/48/85/15/1050488515.db2.gz QYJWWIJXKUVYGU-CWRNSKLLSA-N 2 1 341.326 4.198 20 0 EIADMP CC[NH+]1C[C@@H]2C[N@@H+]([C@@H](C)CCc3ccc(Cl)c(Cl)c3)C[C@@H]2C1 ZINC001173551151 1050488526 /nfs/dbraw/zinc/48/85/26/1050488526.db2.gz QYJWWIJXKUVYGU-CWRNSKLLSA-N 2 1 341.326 4.198 20 0 EIADMP CC(C)C[N@@H+](C)CCCNCc1cc(Cl)cc(C(F)(F)F)c1 ZINC001179081764 1050627551 /nfs/dbraw/zinc/62/75/51/1050627551.db2.gz ODRLMGYJVZIRNA-UHFFFAOYSA-N 2 1 336.829 4.426 20 0 EIADMP CC(C)C[N@H+](C)CCC[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001179081764 1050627560 /nfs/dbraw/zinc/62/75/60/1050627560.db2.gz ODRLMGYJVZIRNA-UHFFFAOYSA-N 2 1 336.829 4.426 20 0 EIADMP CC(C)C[N@@H+](C)CCC[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001179081764 1050627570 /nfs/dbraw/zinc/62/75/70/1050627570.db2.gz ODRLMGYJVZIRNA-UHFFFAOYSA-N 2 1 336.829 4.426 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000093644483 1050648555 /nfs/dbraw/zinc/64/85/55/1050648555.db2.gz PHRNZPDSLIKRCC-YLJYHZDGSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000093644483 1050648561 /nfs/dbraw/zinc/64/85/61/1050648561.db2.gz PHRNZPDSLIKRCC-YLJYHZDGSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000093644483 1050648566 /nfs/dbraw/zinc/64/85/66/1050648566.db2.gz PHRNZPDSLIKRCC-YLJYHZDGSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000093644483 1050648573 /nfs/dbraw/zinc/64/85/73/1050648573.db2.gz PHRNZPDSLIKRCC-YLJYHZDGSA-N 2 1 338.495 4.277 20 0 EIADMP COc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1C ZINC001179205096 1050649962 /nfs/dbraw/zinc/64/99/62/1050649962.db2.gz JHIUIRRSTJJVLO-UTKZUKDTSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1C ZINC001179205096 1050649965 /nfs/dbraw/zinc/64/99/65/1050649965.db2.gz JHIUIRRSTJJVLO-UTKZUKDTSA-N 2 1 338.495 4.146 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2([C@@H]3CCCCO3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001179429677 1050688338 /nfs/dbraw/zinc/68/83/38/1050688338.db2.gz GIJGPHRLTMCELO-GIVPXCGWSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2([C@@H]3CCCCO3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC001179429677 1050688343 /nfs/dbraw/zinc/68/83/43/1050688343.db2.gz GIJGPHRLTMCELO-GIVPXCGWSA-N 2 1 342.527 4.121 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c1 ZINC001179816795 1050786572 /nfs/dbraw/zinc/78/65/72/1050786572.db2.gz NTXGFHPXNHPHEP-HMXCVIKNSA-N 2 1 330.516 4.076 20 0 EIADMP Cc1ccc(C[C@@H]2CCC[N@H+](Cc3ccnn3-c3cc[nH+]cc3)C2)cc1 ZINC001179858191 1050797382 /nfs/dbraw/zinc/79/73/82/1050797382.db2.gz ARMSFPNMPXAAFQ-FQEVSTJZSA-N 2 1 346.478 4.030 20 0 EIADMP Cc1ccc(C[C@@H]2CCC[N@@H+](Cc3ccnn3-c3cc[nH+]cc3)C2)cc1 ZINC001179858191 1050797395 /nfs/dbraw/zinc/79/73/95/1050797395.db2.gz ARMSFPNMPXAAFQ-FQEVSTJZSA-N 2 1 346.478 4.030 20 0 EIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877913 1050815370 /nfs/dbraw/zinc/81/53/70/1050815370.db2.gz KHSXWLHZIFGZMC-CQQBXOTJSA-N 2 1 326.528 4.433 20 0 EIADMP Cc1cc(C)c(/C=C/C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877913 1050815375 /nfs/dbraw/zinc/81/53/75/1050815375.db2.gz KHSXWLHZIFGZMC-CQQBXOTJSA-N 2 1 326.528 4.433 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCc2cccc(Cl)c2)C1 ZINC001180031080 1050860985 /nfs/dbraw/zinc/86/09/85/1050860985.db2.gz UNLDQOOUSDDBFI-IEBWSBKVSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCc2cccc(Cl)c2)C1 ZINC001180031080 1050860988 /nfs/dbraw/zinc/86/09/88/1050860988.db2.gz UNLDQOOUSDDBFI-IEBWSBKVSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCc2cccc(Cl)c2)C1 ZINC001180031080 1050860992 /nfs/dbraw/zinc/86/09/92/1050860992.db2.gz UNLDQOOUSDDBFI-IEBWSBKVSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCc2cccc(Cl)c2)C1 ZINC001180031080 1050860995 /nfs/dbraw/zinc/86/09/95/1050860995.db2.gz UNLDQOOUSDDBFI-IEBWSBKVSA-N 2 1 334.935 4.469 20 0 EIADMP Cn1cc[nH+]c1CC1CC[NH+]([C@H]2CCc3c2cccc3Cl)CC1 ZINC000152816207 1050862645 /nfs/dbraw/zinc/86/26/45/1050862645.db2.gz WYHGIPYHMWMMGZ-SFHVURJKSA-N 2 1 329.875 4.016 20 0 EIADMP Cc1cc(C)c(/C=C/C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1C ZINC001180082796 1050879886 /nfs/dbraw/zinc/87/98/86/1050879886.db2.gz SWBPQGADZJTFBC-LYSGITKLSA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C/C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1C ZINC001180082796 1050879893 /nfs/dbraw/zinc/87/98/93/1050879893.db2.gz SWBPQGADZJTFBC-LYSGITKLSA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C/C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1C ZINC001180082796 1050879896 /nfs/dbraw/zinc/87/98/96/1050879896.db2.gz SWBPQGADZJTFBC-LYSGITKLSA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1C ZINC001180082796 1050879905 /nfs/dbraw/zinc/87/99/05/1050879905.db2.gz SWBPQGADZJTFBC-LYSGITKLSA-N 2 1 326.528 4.289 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000152995068 1050924227 /nfs/dbraw/zinc/92/42/27/1050924227.db2.gz HWNZODOSUZOXCJ-CAOSSQGBSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)C1CCCC1 ZINC001180301654 1050945790 /nfs/dbraw/zinc/94/57/90/1050945790.db2.gz OUDFYHZMGVUPNG-ZHNGQKSSSA-N 2 1 326.528 4.455 20 0 EIADMP CO[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001180350279 1050964296 /nfs/dbraw/zinc/96/42/96/1050964296.db2.gz XOTYMGOJWPLFAR-VLCRHTCISA-N 2 1 344.543 4.082 20 0 EIADMP Cc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000620109489 1051024897 /nfs/dbraw/zinc/02/48/97/1051024897.db2.gz JLZQDFKRUGVFEU-ZWKOTPCHSA-N 2 1 326.509 4.440 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCO[C@H](C)C3)c2)cc1 ZINC000153500717 1051061169 /nfs/dbraw/zinc/06/11/69/1051061169.db2.gz XJIZVPYKWWMANL-RTBURBONSA-N 2 1 338.495 4.067 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCO[C@H](C)C3)c2)cc1 ZINC000153500717 1051061175 /nfs/dbraw/zinc/06/11/75/1051061175.db2.gz XJIZVPYKWWMANL-RTBURBONSA-N 2 1 338.495 4.067 20 0 EIADMP c1cc2cc(C[NH2+]C[C@H]3CCC[N@@H+](Cc4ccccc4)C3)ccc2[nH]1 ZINC000385729278 1051175149 /nfs/dbraw/zinc/17/51/49/1051175149.db2.gz KHFVLPPQPCPLAU-HXUWFJFHSA-N 2 1 333.479 4.170 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC[N@@H+]1C ZINC000775393147 1051200033 /nfs/dbraw/zinc/20/00/33/1051200033.db2.gz LNHQCZMULJIFDY-MRRJBJDNSA-N 2 1 340.483 4.451 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC[N@H+]1C ZINC000775393147 1051200048 /nfs/dbraw/zinc/20/00/48/1051200048.db2.gz LNHQCZMULJIFDY-MRRJBJDNSA-N 2 1 340.483 4.451 20 0 EIADMP CC[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)CC(F)(F)F ZINC000414248971 1051230536 /nfs/dbraw/zinc/23/05/36/1051230536.db2.gz GEQXSLNNFLOXJL-XIRDDKMYSA-N 2 1 328.422 4.390 20 0 EIADMP CC[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)CC(F)(F)F ZINC000414248971 1051230550 /nfs/dbraw/zinc/23/05/50/1051230550.db2.gz GEQXSLNNFLOXJL-XIRDDKMYSA-N 2 1 328.422 4.390 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)C1 ZINC000163218333 1051241842 /nfs/dbraw/zinc/24/18/42/1051241842.db2.gz COIYEYQSBOTCQA-DOTOQJQBSA-N 2 1 343.540 4.419 20 0 EIADMP CC(C)C[N@@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccc(F)c(Cl)c1 ZINC001174916076 1051246494 /nfs/dbraw/zinc/24/64/94/1051246494.db2.gz OCJGGDMBIDVXRE-INIZCTEOSA-N 2 1 326.887 4.421 20 0 EIADMP CC(C)C[NH+](CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(F)c(Cl)c1 ZINC001174916076 1051246505 /nfs/dbraw/zinc/24/65/05/1051246505.db2.gz OCJGGDMBIDVXRE-INIZCTEOSA-N 2 1 326.887 4.421 20 0 EIADMP CC(C)C[NH+](CC[C@@H]1CCC[N@H+]1C)Cc1ccc(F)c(Cl)c1 ZINC001174916076 1051246515 /nfs/dbraw/zinc/24/65/15/1051246515.db2.gz OCJGGDMBIDVXRE-INIZCTEOSA-N 2 1 326.887 4.421 20 0 EIADMP CC(C)c1ccc(C[N@H+]2CCO[C@@H](CCC[NH+](C)C)C2)c(C(C)C)c1 ZINC001174933821 1051257669 /nfs/dbraw/zinc/25/76/69/1051257669.db2.gz OWLWOSKBVPOHLJ-NRFANRHFSA-N 2 1 346.559 4.476 20 0 EIADMP CC(C)CCOc1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000620757911 1051267962 /nfs/dbraw/zinc/26/79/62/1051267962.db2.gz AGDAUWPGWYMHMA-UHFFFAOYSA-N 2 1 330.516 4.218 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(C)c(Cl)n1 ZINC001175062436 1051314439 /nfs/dbraw/zinc/31/44/39/1051314439.db2.gz QFGIHNQZVCXVBF-UHFFFAOYSA-N 2 1 331.891 4.127 20 0 EIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)CC1 ZINC001205546372 1051318684 /nfs/dbraw/zinc/31/86/84/1051318684.db2.gz UOSBIZJMDCXUFL-AWEZNQCLSA-N 2 1 338.776 4.012 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCc2ccccc2Cl)C1 ZINC001191057545 1051334823 /nfs/dbraw/zinc/33/48/23/1051334823.db2.gz KIKZWQCPXVYFGH-ROUUACIJSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCc2ccccc2Cl)C1 ZINC001191057545 1051334829 /nfs/dbraw/zinc/33/48/29/1051334829.db2.gz KIKZWQCPXVYFGH-ROUUACIJSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCc2ccccc2Cl)C1 ZINC001191057545 1051334834 /nfs/dbraw/zinc/33/48/34/1051334834.db2.gz KIKZWQCPXVYFGH-ROUUACIJSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCc2ccccc2Cl)C1 ZINC001191057545 1051334843 /nfs/dbraw/zinc/33/48/43/1051334843.db2.gz KIKZWQCPXVYFGH-ROUUACIJSA-N 2 1 334.935 4.469 20 0 EIADMP CC(C)COc1cccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC001191099869 1051350729 /nfs/dbraw/zinc/35/07/29/1051350729.db2.gz QAFCEGPERJJHKH-FQEVSTJZSA-N 2 1 330.516 4.172 20 0 EIADMP CC(C)COc1cccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC001191099869 1051350742 /nfs/dbraw/zinc/35/07/42/1051350742.db2.gz QAFCEGPERJJHKH-FQEVSTJZSA-N 2 1 330.516 4.172 20 0 EIADMP C=Cc1ccc(CC[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001181945462 1051358699 /nfs/dbraw/zinc/35/86/99/1051358699.db2.gz MFCASKALIGYAED-XXBNENTESA-N 2 1 334.507 4.372 20 0 EIADMP COC1CCC(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001182196751 1051423621 /nfs/dbraw/zinc/42/36/21/1051423621.db2.gz VYPCYJWRXXRGSQ-IRQNMHNUSA-N 2 1 344.543 4.084 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccc3ccc(Cl)cc3n2)CC1 ZINC001191416939 1051451806 /nfs/dbraw/zinc/45/18/06/1051451806.db2.gz LJYSVCPYDIMRKL-UHFFFAOYSA-N 2 1 331.891 4.194 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc3ccc(Cl)cc3n2)CC1 ZINC001191416939 1051451810 /nfs/dbraw/zinc/45/18/10/1051451810.db2.gz LJYSVCPYDIMRKL-UHFFFAOYSA-N 2 1 331.891 4.194 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@H]1C ZINC001191417132 1051453417 /nfs/dbraw/zinc/45/34/17/1051453417.db2.gz NMPYNGKWAVSPED-KDOFPFPSSA-N 2 1 331.891 4.193 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@H]1C ZINC001191417132 1051453428 /nfs/dbraw/zinc/45/34/28/1051453428.db2.gz NMPYNGKWAVSPED-KDOFPFPSSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@H]1C ZINC001191417132 1051453441 /nfs/dbraw/zinc/45/34/41/1051453441.db2.gz NMPYNGKWAVSPED-KDOFPFPSSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@H]1C ZINC001191417132 1051453448 /nfs/dbraw/zinc/45/34/48/1051453448.db2.gz NMPYNGKWAVSPED-KDOFPFPSSA-N 2 1 331.891 4.193 20 0 EIADMP COc1ccc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)cc1C ZINC001191550824 1051486311 /nfs/dbraw/zinc/48/63/11/1051486311.db2.gz MNCYHIQYUCQHHO-IBGZPJMESA-N 2 1 344.543 4.480 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCOC2CCCCC2)CC1 ZINC001191551558 1051486322 /nfs/dbraw/zinc/48/63/22/1051486322.db2.gz RADWJIYNAWKWTJ-IBGZPJMESA-N 2 1 336.564 4.312 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1ccc2cc(OC)ccc2c1 ZINC000163256000 1051564256 /nfs/dbraw/zinc/56/42/56/1051564256.db2.gz FLZBKIBHOAJHLJ-IIBYNOLFSA-N 2 1 326.484 4.231 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000775507536 1051649277 /nfs/dbraw/zinc/64/92/77/1051649277.db2.gz AFCGZGZPAULTTK-HKUYNNGSSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000775507536 1051649282 /nfs/dbraw/zinc/64/92/82/1051649282.db2.gz AFCGZGZPAULTTK-HKUYNNGSSA-N 2 1 326.459 4.134 20 0 EIADMP CC[C@@H](c1ccccc1)[NH+]1CCC(CCC[N@@H+](C)CCOC)CC1 ZINC001192325452 1051691202 /nfs/dbraw/zinc/69/12/02/1051691202.db2.gz NOBGPIDVPQEETD-NRFANRHFSA-N 2 1 332.532 4.208 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000158103681 1051713475 /nfs/dbraw/zinc/71/34/75/1051713475.db2.gz VWGONZGOKZVIMA-KGLIPLIRSA-N 2 1 346.462 4.333 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000158161898 1051722201 /nfs/dbraw/zinc/72/22/01/1051722201.db2.gz HJHWZLDLJJYTKR-KKSFZXQISA-N 2 1 326.484 4.231 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+]C1(c2ccc(C(C)(C)C)cc2)CCCC1 ZINC001192584096 1051768145 /nfs/dbraw/zinc/76/81/45/1051768145.db2.gz FMYQIYUAIOPNRR-UHFFFAOYSA-N 2 1 325.500 4.319 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1cccc(OC(F)(F)F)c1 ZINC000775549669 1051816017 /nfs/dbraw/zinc/81/60/17/1051816017.db2.gz ZGZFYQFQQKMWJZ-ZFWWWQNUSA-N 2 1 330.394 4.110 20 0 EIADMP CC1(C)CN(Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cncc(Cl)c1 ZINC000621291502 1051822718 /nfs/dbraw/zinc/82/27/18/1051822718.db2.gz UMTLAJAJBFARIP-IBGZPJMESA-N 2 1 343.902 4.125 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C1(c2ccc(C(F)(F)F)cc2)CCC1 ZINC000621352129 1051837774 /nfs/dbraw/zinc/83/77/74/1051837774.db2.gz OPERHSQMNMLGCR-UHFFFAOYSA-N 2 1 337.389 4.269 20 0 EIADMP C[C@H]1CC[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CC[C@@H]1C[NH3+] ZINC001205618042 1051843644 /nfs/dbraw/zinc/84/36/44/1051843644.db2.gz QWIXBGCGQDSBAQ-GXTWGEPZSA-N 2 1 332.435 4.105 20 0 EIADMP [NH3+]Cc1ccc(Nc2ccc3c(c2)C[N@H+](Cc2ccccc2)C3)cc1 ZINC001175968817 1051852683 /nfs/dbraw/zinc/85/26/83/1051852683.db2.gz KMMOHMWFJFVABI-UHFFFAOYSA-N 2 1 329.447 4.405 20 0 EIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@@H]1C[N@H+](CC[C@H]1CCCC1(F)F)C2 ZINC001175974393 1051856875 /nfs/dbraw/zinc/85/68/75/1051856875.db2.gz UUXHMSUGLUUFPK-HSALFYBXSA-N 2 1 348.481 4.266 20 0 EIADMP C[C@]12C[NH+](CC[C@H]3CCCC3(F)F)C[C@H]1C[N@H+](Cc1ccccc1)C2 ZINC001175974393 1051856880 /nfs/dbraw/zinc/85/68/80/1051856880.db2.gz UUXHMSUGLUUFPK-HSALFYBXSA-N 2 1 348.481 4.266 20 0 EIADMP C[C@]12C[NH+](CC[C@H]3CCCC3(F)F)C[C@H]1C[N@@H+](Cc1ccccc1)C2 ZINC001175974393 1051856884 /nfs/dbraw/zinc/85/68/84/1051856884.db2.gz UUXHMSUGLUUFPK-HSALFYBXSA-N 2 1 348.481 4.266 20 0 EIADMP CCC1([NH+]2CCCCC2)CC[NH+](Cc2ccc3[nH]ccc3c2)CC1 ZINC001183535058 1051864528 /nfs/dbraw/zinc/86/45/28/1051864528.db2.gz SYTAGNHVIZEPNZ-UHFFFAOYSA-N 2 1 325.500 4.398 20 0 EIADMP CC[C@@H]([NH2+]CCC[NH+](CC)CC)c1cc(F)cc(Br)c1 ZINC001193535320 1051936876 /nfs/dbraw/zinc/93/68/76/1051936876.db2.gz CJPYVFXYXUKVAA-MRXNPFEDSA-N 2 1 345.300 4.361 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC(C)(C)CO1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001184045760 1051944171 /nfs/dbraw/zinc/94/41/71/1051944171.db2.gz QCTHVMYNINRUCM-SESVDKBCSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000164626141 1052034458 /nfs/dbraw/zinc/03/44/58/1052034458.db2.gz NWMPXXOEEAOXMY-QGZVFWFLSA-N 2 1 334.467 4.385 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC(C)(C)OC2(C)C)[C@H]1c1cccs1 ZINC000165004515 1052048394 /nfs/dbraw/zinc/04/83/94/1052048394.db2.gz ORQUBEGJEJNYEE-OIISXLGYSA-N 2 1 336.545 4.067 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC(C)(C)OC2(C)C)[C@H]1c1cccs1 ZINC000165004515 1052048410 /nfs/dbraw/zinc/04/84/10/1052048410.db2.gz ORQUBEGJEJNYEE-OIISXLGYSA-N 2 1 336.545 4.067 20 0 EIADMP Cc1ccsc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165309837 1052058668 /nfs/dbraw/zinc/05/86/68/1052058668.db2.gz DLVLXDIJMLATDM-IEBWSBKVSA-N 2 1 328.525 4.272 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000167510863 1052120064 /nfs/dbraw/zinc/12/00/64/1052120064.db2.gz PEXOPKSNMZTDDZ-ZOCZFRKYSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000167511106 1052120894 /nfs/dbraw/zinc/12/08/94/1052120894.db2.gz PEXOPKSNMZTDDZ-WHSLLNHNSA-N 2 1 348.494 4.048 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(Cc2cc(F)cc(F)c2)CC1 ZINC001194376655 1052133526 /nfs/dbraw/zinc/13/35/26/1052133526.db2.gz KCCVWMLKENAATI-UHFFFAOYSA-N 2 1 347.453 4.205 20 0 EIADMP C[C@H]1CCC[C@@H](C[NH2+]c2ccc(N3CCC([NH+](C)C)CC3)cc2)C1 ZINC000774824218 1052172497 /nfs/dbraw/zinc/17/24/97/1052172497.db2.gz MAWSXPGDOUGQQL-ZWKOTPCHSA-N 2 1 329.532 4.455 20 0 EIADMP C[C@@H]1C[C@H](NCC2=Cc3ccccc3OC2)CC[N@H+]1Cc1ccccc1 ZINC000175978010 1052601916 /nfs/dbraw/zinc/60/19/16/1052601916.db2.gz IYXJESHBXMTHCL-XMSQKQJNSA-N 2 1 348.490 4.105 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2=Cc3ccccc3OC2)CC[N@@H+]1Cc1ccccc1 ZINC000175978010 1052601918 /nfs/dbraw/zinc/60/19/18/1052601918.db2.gz IYXJESHBXMTHCL-XMSQKQJNSA-N 2 1 348.490 4.105 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2cccc3n[nH]cc32)cc1 ZINC000623357510 1052632363 /nfs/dbraw/zinc/63/23/63/1052632363.db2.gz SQSUXTHUOMPMIB-QGZVFWFLSA-N 2 1 348.494 4.227 20 0 EIADMP CC[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1OC(F)F ZINC000623355781 1052634181 /nfs/dbraw/zinc/63/41/81/1052634181.db2.gz VMTZTEDGFVVVFN-UKRRQHHQSA-N 2 1 326.431 4.202 20 0 EIADMP CC[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1OC(F)F ZINC000623355781 1052634186 /nfs/dbraw/zinc/63/41/86/1052634186.db2.gz VMTZTEDGFVVVFN-UKRRQHHQSA-N 2 1 326.431 4.202 20 0 EIADMP CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623363356 1052635623 /nfs/dbraw/zinc/63/56/23/1052635623.db2.gz PTOYWPKJNXCLKN-IEBWSBKVSA-N 2 1 332.532 4.257 20 0 EIADMP C[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000623447496 1052657822 /nfs/dbraw/zinc/65/78/22/1052657822.db2.gz TUJCJWJLQWLRQQ-WMLDXEAASA-N 2 1 334.479 4.138 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000623447496 1052657826 /nfs/dbraw/zinc/65/78/26/1052657826.db2.gz TUJCJWJLQWLRQQ-WMLDXEAASA-N 2 1 334.479 4.138 20 0 EIADMP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623487709 1052664328 /nfs/dbraw/zinc/66/43/28/1052664328.db2.gz NVIMUUGRBODESG-HIFRSBDPSA-N 2 1 328.422 4.099 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC1(C)C ZINC000623512573 1052667218 /nfs/dbraw/zinc/66/72/18/1052667218.db2.gz NDWUPDWBVIOXQX-XIRDDKMYSA-N 2 1 340.433 4.414 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1(C)C ZINC000623516685 1052670446 /nfs/dbraw/zinc/67/04/46/1052670446.db2.gz AQEHTGFICVNQHX-HNNXBMFYSA-N 2 1 349.931 4.426 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1(C)C ZINC000623516685 1052670450 /nfs/dbraw/zinc/67/04/50/1052670450.db2.gz AQEHTGFICVNQHX-HNNXBMFYSA-N 2 1 349.931 4.426 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(F)cc2C(F)(F)F)CC1 ZINC000623908331 1052835901 /nfs/dbraw/zinc/83/59/01/1052835901.db2.gz XSVCNOFXOHHLAO-LBPRGKRZSA-N 2 1 332.385 4.368 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccccc1OC(F)F ZINC000624121092 1052867781 /nfs/dbraw/zinc/86/77/81/1052867781.db2.gz NXLSPJMKPQFZCR-GDBMZVCRSA-N 2 1 326.431 4.061 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccccc1OC(F)F ZINC000624121092 1052867782 /nfs/dbraw/zinc/86/77/82/1052867782.db2.gz NXLSPJMKPQFZCR-GDBMZVCRSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000624123492 1052868750 /nfs/dbraw/zinc/86/87/50/1052868750.db2.gz NFEYHAZOUFTXRR-QZTJIDSGSA-N 2 1 339.483 4.256 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000624123492 1052868747 /nfs/dbraw/zinc/86/87/47/1052868747.db2.gz NFEYHAZOUFTXRR-QZTJIDSGSA-N 2 1 339.483 4.256 20 0 EIADMP CCC[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2C)CC1)c1cccnc1 ZINC000185053116 1053012292 /nfs/dbraw/zinc/01/22/92/1053012292.db2.gz MQGZXOVEHQLGFB-JOCHJYFZSA-N 2 1 337.511 4.485 20 0 EIADMP C[C@H]([NH2+]Cc1cc(F)cc2cccnc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185722894 1053021541 /nfs/dbraw/zinc/02/15/41/1053021541.db2.gz FBDFHONQBNRCFN-RDJZCZTQSA-N 2 1 341.474 4.117 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000381131098 1053054929 /nfs/dbraw/zinc/05/49/29/1053054929.db2.gz KHCIPDQMARXAJU-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@@H]3CCCSCC3)cc2)CC1 ZINC000850456399 1053233550 /nfs/dbraw/zinc/23/35/50/1053233550.db2.gz FJWDEHAUDFZDTC-GOSISDBHSA-N 2 1 347.572 4.162 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc2c(c1)CCCO2 ZINC000850457045 1053234644 /nfs/dbraw/zinc/23/46/44/1053234644.db2.gz FPPOJNVWOYMCJC-ABSDTBQOSA-N 2 1 342.527 4.315 20 0 EIADMP Cc1c(C)c(C)c(C[N@H+]2CCCN(c3cc[nH+]cc3)CC2)c(C)c1C ZINC001195537092 1053429912 /nfs/dbraw/zinc/42/99/12/1053429912.db2.gz XZSBCSMTZROHRL-UHFFFAOYSA-N 2 1 337.511 4.336 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(F)c1 ZINC000765361054 1053515849 /nfs/dbraw/zinc/51/58/49/1053515849.db2.gz VDLWRZFSXBFLNH-FGSXEWAUSA-N 2 1 340.486 4.429 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2ccccc2o1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386238407 1053644926 /nfs/dbraw/zinc/64/49/26/1053644926.db2.gz BOAPTJQWEWMOHV-YLJYHZDGSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2ccccc2o1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386238407 1053644939 /nfs/dbraw/zinc/64/49/39/1053644939.db2.gz BOAPTJQWEWMOHV-YLJYHZDGSA-N 2 1 334.463 4.433 20 0 EIADMP CC1(C)C[N@@H+](CCCCF)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001196545102 1053696417 /nfs/dbraw/zinc/69/64/17/1053696417.db2.gz KUSFFNITZGBRTG-FQEVSTJZSA-N 2 1 332.507 4.359 20 0 EIADMP C[C@@H]1CCCCN1c1cccc(N2C[C@H](CC[NH3+])c3ccccc32)[nH+]1 ZINC001168544419 1053701394 /nfs/dbraw/zinc/70/13/94/1053701394.db2.gz OPMQTRPQWKYGPR-SJORKVTESA-N 2 1 336.483 4.045 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386612528 1053802386 /nfs/dbraw/zinc/80/23/86/1053802386.db2.gz KQHGRCAASPCOBQ-AZUAARDMSA-N 2 1 338.495 4.004 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc(C)cnc2Cl)c1 ZINC000921549602 1053844312 /nfs/dbraw/zinc/84/43/12/1053844312.db2.gz CKKSMSWFRWDKAJ-UHFFFAOYSA-N 2 1 331.891 4.175 20 0 EIADMP CC(C)C[N@H+](Cc1nsc2ccccc21)CC1CC[NH+](C)CC1 ZINC001197194274 1053851204 /nfs/dbraw/zinc/85/12/04/1053851204.db2.gz KWIXOVBRMLCPPX-UHFFFAOYSA-N 2 1 331.529 4.096 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C(C)(C)c1ccc(C(F)(F)F)cc1 ZINC001197340722 1053889464 /nfs/dbraw/zinc/88/94/64/1053889464.db2.gz CNZLMDKQPBVSIK-UHFFFAOYSA-N 2 1 325.378 4.125 20 0 EIADMP Cc1cnc(Cl)c(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)c1 ZINC000921608075 1053911549 /nfs/dbraw/zinc/91/15/49/1053911549.db2.gz RWOHASJCGBDYER-UHFFFAOYSA-N 2 1 331.891 4.173 20 0 EIADMP Cc1cnc(Cl)c(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000921608075 1053911567 /nfs/dbraw/zinc/91/15/67/1053911567.db2.gz RWOHASJCGBDYER-UHFFFAOYSA-N 2 1 331.891 4.173 20 0 EIADMP Cc1cc(CNc2ccc([NH+]3CCC(C[NH+](C)C)CC3)cc2)c(C)o1 ZINC000123133748 1054100227 /nfs/dbraw/zinc/10/02/27/1054100227.db2.gz FFTVZWCMXISXJM-UHFFFAOYSA-N 2 1 341.499 4.287 20 0 EIADMP CN(C)c1cc[nH+]cc1C[NH2+]CCC(c1ccccc1)c1ccccc1 ZINC001198952274 1054310994 /nfs/dbraw/zinc/31/09/94/1054310994.db2.gz FTVGCHVVTYVXIN-UHFFFAOYSA-N 2 1 345.490 4.459 20 0 EIADMP CCOc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+](C)CC)c2)c1 ZINC000123940138 1054381713 /nfs/dbraw/zinc/38/17/13/1054381713.db2.gz OFFODTACZPTHFY-KRWDZBQOSA-N 2 1 326.484 4.388 20 0 EIADMP Fc1cccc2c(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c[nH]c21 ZINC001137056580 1054389650 /nfs/dbraw/zinc/38/96/50/1054389650.db2.gz YYEMTDFQVWARMD-QGZVFWFLSA-N 2 1 329.463 4.147 20 0 EIADMP Fc1cccc2c(C[N@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c[nH]c21 ZINC001137056580 1054389661 /nfs/dbraw/zinc/38/96/61/1054389661.db2.gz YYEMTDFQVWARMD-QGZVFWFLSA-N 2 1 329.463 4.147 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCOC3(CCCCC3)C2)C1 ZINC001199319405 1054390129 /nfs/dbraw/zinc/39/01/29/1054390129.db2.gz AWWHHRCZKBFZIX-ZCNNSNEGSA-N 2 1 336.564 4.216 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC001199319978 1054390700 /nfs/dbraw/zinc/39/07/00/1054390700.db2.gz GJAGRXXJGCVLFZ-XQBPLPMBSA-N 2 1 328.544 4.282 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCOC3(CCCCC3)C2)C1 ZINC001199319403 1054390853 /nfs/dbraw/zinc/39/08/53/1054390853.db2.gz AWWHHRCZKBFZIX-HSALFYBXSA-N 2 1 336.564 4.216 20 0 EIADMP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2ccc(SC(F)F)cc2)C1 ZINC001199328869 1054392243 /nfs/dbraw/zinc/39/22/43/1054392243.db2.gz KQMXAJSUEUNRIG-HUUCEWRRSA-N 2 1 342.499 4.459 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001199403057 1054406389 /nfs/dbraw/zinc/40/63/89/1054406389.db2.gz DFTXVBYIKGJKBB-KRWDZBQOSA-N 2 1 327.516 4.348 20 0 EIADMP CC(C)c1cccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)c1 ZINC000858365462 1054475654 /nfs/dbraw/zinc/47/56/54/1054475654.db2.gz OFMUCODWACIKCC-DYESRHJHSA-N 2 1 330.516 4.104 20 0 EIADMP C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001199963329 1054504085 /nfs/dbraw/zinc/50/40/85/1054504085.db2.gz WJORURSJCVQHEV-WFASDCNBSA-N 2 1 329.315 4.387 20 0 EIADMP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@@H](C)c1ccc(C(F)(F)F)nc1 ZINC000873297502 1054526842 /nfs/dbraw/zinc/52/68/42/1054526842.db2.gz XSGMZSVDXOPNFI-VNHYZAJKSA-N 2 1 329.410 4.062 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000347536530 1054533125 /nfs/dbraw/zinc/53/31/25/1054533125.db2.gz HYJJZXMJOPNMNW-SFHVURJKSA-N 2 1 343.490 4.361 20 0 EIADMP CN(C)c1cc[nH+]cc1C[NH2+]CCc1ccc(-c2ccccc2)cc1 ZINC001201008794 1054632142 /nfs/dbraw/zinc/63/21/42/1054632142.db2.gz RJFREMZWHHHDET-UHFFFAOYSA-N 2 1 331.463 4.147 20 0 EIADMP CC[NH+](CC)CCC[NH2+]Cc1c(OC(F)F)ccc2ccccc21 ZINC000060816268 1054724594 /nfs/dbraw/zinc/72/45/94/1054724594.db2.gz ZFLJSQHJAJZFJR-UHFFFAOYSA-N 2 1 336.426 4.263 20 0 EIADMP COc1ccc2cc(C[NH2+]CCC[N@H+]3CCCC[C@@H]3C)ccc2c1 ZINC000061029124 1054739324 /nfs/dbraw/zinc/73/93/24/1054739324.db2.gz RZXBLTGKBSYICQ-KRWDZBQOSA-N 2 1 326.484 4.203 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2cccc(F)c2)C[N@H+]1Cc1ccccc1 ZINC001201492553 1054819246 /nfs/dbraw/zinc/81/92/46/1054819246.db2.gz RJRIQKQDHLBWOC-FXAWDEMLSA-N 2 1 326.459 4.216 20 0 EIADMP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201549379 1054839702 /nfs/dbraw/zinc/83/97/02/1054839702.db2.gz AWHIVGAWEUMRSI-JYAXBFRTSA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201549379 1054839705 /nfs/dbraw/zinc/83/97/05/1054839705.db2.gz AWHIVGAWEUMRSI-JYAXBFRTSA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201549379 1054839709 /nfs/dbraw/zinc/83/97/09/1054839709.db2.gz AWHIVGAWEUMRSI-JYAXBFRTSA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201549379 1054839714 /nfs/dbraw/zinc/83/97/14/1054839714.db2.gz AWHIVGAWEUMRSI-JYAXBFRTSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[NH+]1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001201525224 1054843730 /nfs/dbraw/zinc/84/37/30/1054843730.db2.gz DKFFRSBPJBHPNU-UHFFFAOYSA-N 2 1 329.532 4.194 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(F)F)c(F)c2)C1 ZINC001201557110 1054847351 /nfs/dbraw/zinc/84/73/51/1054847351.db2.gz DVALHEDSYMPMML-OAHLLOKOSA-N 2 1 328.422 4.221 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(F)F)c(F)c2)C1 ZINC001201557110 1054847353 /nfs/dbraw/zinc/84/73/53/1054847353.db2.gz DVALHEDSYMPMML-OAHLLOKOSA-N 2 1 328.422 4.221 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCC2(CC1)C[N@H+](Cc1ccoc1)CCO2 ZINC001201559085 1054849138 /nfs/dbraw/zinc/84/91/38/1054849138.db2.gz IRXGLNGLKWCNOH-IBGZPJMESA-N 2 1 348.531 4.163 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCC2(CC1)C[N@@H+](Cc1ccoc1)CCO2 ZINC001201559085 1054849142 /nfs/dbraw/zinc/84/91/42/1054849142.db2.gz IRXGLNGLKWCNOH-IBGZPJMESA-N 2 1 348.531 4.163 20 0 EIADMP CCCCCC[NH+]1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201750111 1054894722 /nfs/dbraw/zinc/89/47/22/1054894722.db2.gz HMHZMZAGCHOEKC-NRFANRHFSA-N 2 1 344.543 4.322 20 0 EIADMP CCCCCC[NH+]1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001201750032 1054895044 /nfs/dbraw/zinc/89/50/44/1054895044.db2.gz FCJDOGCODYFVGC-UHFFFAOYSA-N 2 1 329.532 4.338 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc(OC(F)F)c2)CC1 ZINC000065352909 1054915501 /nfs/dbraw/zinc/91/55/01/1054915501.db2.gz JBMHWKUQUSRZCG-UHFFFAOYSA-N 2 1 340.458 4.232 20 0 EIADMP Clc1nccc2oc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)cc21 ZINC000876990191 1054995537 /nfs/dbraw/zinc/99/55/37/1054995537.db2.gz SYWUWDFIPLFNFD-UHFFFAOYSA-N 2 1 347.890 4.225 20 0 EIADMP C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CC[NH+](CCC(C)(C)C)CC2 ZINC001202072760 1055003175 /nfs/dbraw/zinc/00/31/75/1055003175.db2.gz BJLRWLVUUDRYMJ-FQEVSTJZSA-N 2 1 344.543 4.178 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc(Cl)c2N)[C@H]1c1cccs1 ZINC000877055176 1055009944 /nfs/dbraw/zinc/00/99/44/1055009944.db2.gz QEWFPIMDIQQQGI-KSSFIOAISA-N 2 1 349.931 4.156 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc(Cl)c2N)[C@H]1c1cccs1 ZINC000877055176 1055009960 /nfs/dbraw/zinc/00/99/60/1055009960.db2.gz QEWFPIMDIQQQGI-KSSFIOAISA-N 2 1 349.931 4.156 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(NC[C@]3(C)CCCS3)cc2)CC1 ZINC000862261605 1055040647 /nfs/dbraw/zinc/04/06/47/1055040647.db2.gz BEHREGPDXTTXQB-FQEVSTJZSA-N 2 1 347.572 4.162 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000474710960 1055997690 /nfs/dbraw/zinc/99/76/90/1055997690.db2.gz JZUPHWQZICZLLK-XNIRIUNOSA-N 2 1 334.470 4.454 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CC2(CC)CCOCC2)CC1)CC1CC1 ZINC000542860295 1056335086 /nfs/dbraw/zinc/33/50/86/1056335086.db2.gz YEXZHTHAYZNDLJ-UHFFFAOYSA-N 2 1 336.564 4.027 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)sc1C ZINC000743497190 1059031047 /nfs/dbraw/zinc/03/10/47/1059031047.db2.gz DNCUNSGUBAYNEM-UHFFFAOYSA-N 2 1 329.513 4.036 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000188148670 1060133522 /nfs/dbraw/zinc/13/35/22/1060133522.db2.gz UNCDKBBRJUTRME-XOKHGSTOSA-N 2 1 326.406 4.025 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CCCc3cc(Br)ccc31)C2 ZINC001169101518 1060636664 /nfs/dbraw/zinc/63/66/64/1060636664.db2.gz TZEYQEIFWNTAQB-XLMAVXFVSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCCc1ccc(Cl)cc1Cl)C2 ZINC001169101881 1060638134 /nfs/dbraw/zinc/63/81/34/1060638134.db2.gz VXDDJCCFSFWRMG-MUJYYYPQSA-N 2 1 327.299 4.141 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1[C@@H]3Cc4ccccc4[C@@]1(C)c1ccccc13)C2 ZINC001169155254 1060671533 /nfs/dbraw/zinc/67/15/33/1060671533.db2.gz LSVGZMBRQYCCKN-PCVLGWKGSA-N 2 1 344.502 4.488 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1[C@@H]3Cc4ccccc4[C@@]1(C)c1ccccc13)C2 ZINC001169155254 1060671536 /nfs/dbraw/zinc/67/15/36/1060671536.db2.gz LSVGZMBRQYCCKN-PCVLGWKGSA-N 2 1 344.502 4.488 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1[C@@H]3Cc4ccccc4[C@@]1(C)c1ccccc13)C2 ZINC001169155254 1060671540 /nfs/dbraw/zinc/67/15/40/1060671540.db2.gz LSVGZMBRQYCCKN-PCVLGWKGSA-N 2 1 344.502 4.488 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1[C@@H]3Cc4ccccc4[C@@]1(C)c1ccccc13)C2 ZINC001169155254 1060671543 /nfs/dbraw/zinc/67/15/43/1060671543.db2.gz LSVGZMBRQYCCKN-PCVLGWKGSA-N 2 1 344.502 4.488 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154261 1060671626 /nfs/dbraw/zinc/67/16/26/1060671626.db2.gz PCDDHHYQTQGNMG-MLHJIOFPSA-N 2 1 338.417 4.468 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154261 1060671629 /nfs/dbraw/zinc/67/16/29/1060671629.db2.gz PCDDHHYQTQGNMG-MLHJIOFPSA-N 2 1 338.417 4.468 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154261 1060671633 /nfs/dbraw/zinc/67/16/33/1060671633.db2.gz PCDDHHYQTQGNMG-MLHJIOFPSA-N 2 1 338.417 4.468 20 0 EIADMP CC[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccc(OC(F)(F)F)cc2)CC1 ZINC001169264705 1060708000 /nfs/dbraw/zinc/70/80/00/1060708000.db2.gz RLVYMNFUIFUQND-QGZVFWFLSA-N 2 1 342.405 4.206 20 0 EIADMP CC[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccc(OC(F)(F)F)cc2)CC1 ZINC001169264705 1060708040 /nfs/dbraw/zinc/70/80/40/1060708040.db2.gz RLVYMNFUIFUQND-QGZVFWFLSA-N 2 1 342.405 4.206 20 0 EIADMP C[N@H+]1CCC[C@@H]1CCN1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370731 1061213945 /nfs/dbraw/zinc/21/39/45/1061213945.db2.gz DTVZWJPXPHGDJA-PBHICJAKSA-N 2 1 326.406 4.327 20 0 EIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370731 1061213968 /nfs/dbraw/zinc/21/39/68/1061213968.db2.gz DTVZWJPXPHGDJA-PBHICJAKSA-N 2 1 326.406 4.327 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370731 1061213993 /nfs/dbraw/zinc/21/39/93/1061213993.db2.gz DTVZWJPXPHGDJA-PBHICJAKSA-N 2 1 326.406 4.327 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370731 1061214015 /nfs/dbraw/zinc/21/40/15/1061214015.db2.gz DTVZWJPXPHGDJA-PBHICJAKSA-N 2 1 326.406 4.327 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370731 1061214039 /nfs/dbraw/zinc/21/40/39/1061214039.db2.gz DTVZWJPXPHGDJA-PBHICJAKSA-N 2 1 326.406 4.327 20 0 EIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1sccc1Br ZINC000037232544 213136389 /nfs/dbraw/zinc/13/63/89/213136389.db2.gz KJVQUYPXLMEUFW-SNVBAGLBSA-N 2 1 345.350 4.470 20 0 EIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Br)cc1 ZINC000036991667 522562391 /nfs/dbraw/zinc/56/23/91/522562391.db2.gz LVSRREZYZJLHHH-HMQMGEFJSA-N 2 1 337.305 4.115 20 0 EIADMP C[C@H]([NH3+])[C@H](C)[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000415014151 1023394314 /nfs/dbraw/zinc/39/43/14/1023394314.db2.gz LMDKTYVZBLAIPK-QWRGUYRKSA-N 2 1 339.302 4.003 20 0 EIADMP Cc1cc(C)c2c(c1)[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)CCCO2 ZINC000532198167 1032083531 /nfs/dbraw/zinc/08/35/31/1032083531.db2.gz KJSQLKGZMYBWHP-FQEVSTJZSA-N 2 1 330.516 4.227 20 0 EIADMP C[N@@H+](CC1CCN(c2cc[nH+]cc2)CC1)CC1CCC(F)(F)CC1 ZINC000459379964 1032156258 /nfs/dbraw/zinc/15/62/58/1032156258.db2.gz YTCSPPQSXWATEM-UHFFFAOYSA-N 2 1 337.458 4.055 20 0 EIADMP COc1cc(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)ccc1C ZINC000194238605 1032248231 /nfs/dbraw/zinc/24/82/31/1032248231.db2.gz WXVXFPFSZGGODW-UHFFFAOYSA-N 2 1 326.484 4.134 20 0 EIADMP c1cc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cs1 ZINC000245690704 1032378278 /nfs/dbraw/zinc/37/82/78/1032378278.db2.gz KERXFEVETHJNSK-ACDBMABISA-N 2 1 326.509 4.076 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)CC1 ZINC000245843430 1032509585 /nfs/dbraw/zinc/50/95/85/1032509585.db2.gz DYFJUGFOXTUDQY-OTNPHJDUSA-N 2 1 342.527 4.005 20 0 EIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C[C@@H]1CCCCC1(F)F ZINC000450455630 1032511461 /nfs/dbraw/zinc/51/14/61/1032511461.db2.gz OFYUOHGZROAWRC-OALUTQOASA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C[C@@H]1CCCCC1(F)F ZINC000450455630 1032511463 /nfs/dbraw/zinc/51/14/63/1032511463.db2.gz OFYUOHGZROAWRC-OALUTQOASA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C[C@@H]1CCCCC1(F)F ZINC000450455630 1032511469 /nfs/dbraw/zinc/51/14/69/1032511469.db2.gz OFYUOHGZROAWRC-OALUTQOASA-N 2 1 336.470 4.266 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3ccc4ccccc4n3)CC2)[nH+]c1 ZINC000178755687 1032539781 /nfs/dbraw/zinc/53/97/81/1032539781.db2.gz PGQJQFOFSFHDJL-KRWDZBQOSA-N 2 1 346.478 4.258 20 0 EIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000178704085 1032544884 /nfs/dbraw/zinc/54/48/84/1032544884.db2.gz MAJNGMHTKGTTQP-STQMWFEESA-N 2 1 334.533 4.241 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cccc(C(C)=O)c2)CC1)CC1CC1 ZINC000450656145 1032623881 /nfs/dbraw/zinc/62/38/81/1032623881.db2.gz UWRXHULVDCCLKD-UHFFFAOYSA-N 2 1 342.527 4.223 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(Oc2ccccc2)o1 ZINC000180872000 1032626479 /nfs/dbraw/zinc/62/64/79/1032626479.db2.gz ZFKJWDKKXJFBRA-HNNXBMFYSA-N 2 1 325.412 4.003 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512391650 1032634049 /nfs/dbraw/zinc/63/40/49/1032634049.db2.gz OQRMBXGTHIMDQY-LPHOPBHVSA-N 2 1 342.527 4.143 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512391650 1032634069 /nfs/dbraw/zinc/63/40/69/1032634069.db2.gz OQRMBXGTHIMDQY-LPHOPBHVSA-N 2 1 342.527 4.143 20 0 EIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000430163194 1018933803 /nfs/dbraw/zinc/93/38/03/1018933803.db2.gz LDBWNLWXCLRQRV-IBGZPJMESA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000430163194 1018933815 /nfs/dbraw/zinc/93/38/15/1018933815.db2.gz LDBWNLWXCLRQRV-IBGZPJMESA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000430163194 1018933836 /nfs/dbraw/zinc/93/38/36/1018933836.db2.gz LDBWNLWXCLRQRV-IBGZPJMESA-N 2 1 330.472 4.082 20 0 EIADMP CC[C@H](N[C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1nc(C)cs1 ZINC000274895909 1019841918 /nfs/dbraw/zinc/84/19/18/1019841918.db2.gz KEXFROIPLNLWLA-QRQLOZEOSA-N 2 1 343.540 4.403 20 0 EIADMP Cc1cc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)ccc1Oc1cccnc1 ZINC000432814798 1032860863 /nfs/dbraw/zinc/86/08/63/1032860863.db2.gz BFSMJELDIOAVAA-IBGZPJMESA-N 2 1 339.483 4.098 20 0 EIADMP Cc1cc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)ccc1Oc1cccnc1 ZINC000432814798 1032860867 /nfs/dbraw/zinc/86/08/67/1032860867.db2.gz BFSMJELDIOAVAA-IBGZPJMESA-N 2 1 339.483 4.098 20 0 EIADMP c1ccc(CSCCC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000535627061 1020011594 /nfs/dbraw/zinc/01/15/94/1020011594.db2.gz RPBWSOVUWQQMQL-CTNGQTDRSA-N 2 1 344.568 4.259 20 0 EIADMP c1ccc(CSCCC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000535627061 1020011603 /nfs/dbraw/zinc/01/16/03/1020011603.db2.gz RPBWSOVUWQQMQL-CTNGQTDRSA-N 2 1 344.568 4.259 20 0 EIADMP c1ccc(CSCCC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000535627061 1020011614 /nfs/dbraw/zinc/01/16/14/1020011614.db2.gz RPBWSOVUWQQMQL-CTNGQTDRSA-N 2 1 344.568 4.259 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(OC)cc2)C1 ZINC000180206612 1020079996 /nfs/dbraw/zinc/07/99/96/1020079996.db2.gz LNQZOYFYNILALM-GCJKJVERSA-N 2 1 338.495 4.106 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(OC)cc2)C1 ZINC000180206612 1020080009 /nfs/dbraw/zinc/08/00/09/1020080009.db2.gz LNQZOYFYNILALM-GCJKJVERSA-N 2 1 338.495 4.106 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000398172925 1020515288 /nfs/dbraw/zinc/51/52/88/1020515288.db2.gz IGWVBDGHPDVTFL-NPPFBWRTSA-N 2 1 338.495 4.256 20 0 EIADMP CC[NH+]1CCN(CCCC[NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000683471425 1020849457 /nfs/dbraw/zinc/84/94/57/1020849457.db2.gz JCLYHQKBFAZCOD-UHFFFAOYSA-N 2 1 349.607 4.133 20 0 EIADMP Cc1cnc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c(C)c1 ZINC000655806799 1020977817 /nfs/dbraw/zinc/97/78/17/1020977817.db2.gz FBUWTRCFOGBUBR-KOUNCHBCSA-N 2 1 349.522 4.026 20 0 EIADMP COc1ccc2cc([C@@H](C)[NH2+]C[C@@H](C)Cn3cc[nH+]c3C)ccc2c1 ZINC000121520090 1020999344 /nfs/dbraw/zinc/99/93/44/1020999344.db2.gz OFWHVGGCMSMGMI-HZPDHXFCSA-N 2 1 337.467 4.340 20 0 EIADMP Cc1cc([C@@H](C)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)no1 ZINC000340469565 1021074103 /nfs/dbraw/zinc/07/41/03/1021074103.db2.gz KUUGVSOTNDOMBY-DOTOQJQBSA-N 2 1 327.472 4.066 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)cc1 ZINC000340521902 1021184356 /nfs/dbraw/zinc/18/43/56/1021184356.db2.gz XESKBYAAOSXDJA-QVKFZJNVSA-N 2 1 333.435 4.103 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000272354307 1021641635 /nfs/dbraw/zinc/64/16/35/1021641635.db2.gz RCBQXHMQMONGAC-YZVOILCLSA-N 2 1 343.540 4.321 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1csc(-c2ccccc2)n1 ZINC000414085169 1021824219 /nfs/dbraw/zinc/82/42/19/1021824219.db2.gz YCHDIZMNQGUJPL-LSDHHAIUSA-N 2 1 340.496 4.302 20 0 EIADMP Brc1cccc(C2([NH2+]C3CC[NH+](C4CC4)CC3)CCC2)c1 ZINC000414092689 1021839687 /nfs/dbraw/zinc/83/96/87/1021839687.db2.gz GGWQXCPGCXAODB-UHFFFAOYSA-N 2 1 349.316 4.045 20 0 EIADMP Brc1ccc(C2([NH2+]C3CC[NH+](C4CC4)CC3)CCC2)cc1 ZINC000414093306 1021839701 /nfs/dbraw/zinc/83/97/01/1021839701.db2.gz HEZMZXUUIQLJGL-UHFFFAOYSA-N 2 1 349.316 4.045 20 0 EIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CCCc1cncn1C ZINC000584537606 1022013070 /nfs/dbraw/zinc/01/30/70/1022013070.db2.gz NNNJCZVGHXJZKO-CYBMUJFWSA-N 2 1 325.378 4.065 20 0 EIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CCCc1c[nH+]cn1C ZINC000584537606 1022013090 /nfs/dbraw/zinc/01/30/90/1022013090.db2.gz NNNJCZVGHXJZKO-CYBMUJFWSA-N 2 1 325.378 4.065 20 0 EIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CCCc1c[nH+]cn1C ZINC000584537606 1022013111 /nfs/dbraw/zinc/01/31/11/1022013111.db2.gz NNNJCZVGHXJZKO-CYBMUJFWSA-N 2 1 325.378 4.065 20 0 EIADMP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3ccc4nc[nH]c4c3)c2)CC1 ZINC000518775988 1022022395 /nfs/dbraw/zinc/02/23/95/1022022395.db2.gz PAODBEPEFRRIRC-UHFFFAOYSA-N 2 1 348.494 4.085 20 0 EIADMP CC[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccccc1OC(F)F ZINC000414172934 1022028121 /nfs/dbraw/zinc/02/81/21/1022028121.db2.gz FUCDELJDGFKITB-ZBFHGGJFSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@H](c1ccccn1)[NH+](C)CCCCC[N@H+](C)[C@H](C)c1ccccn1 ZINC000245549918 1033030703 /nfs/dbraw/zinc/03/07/03/1033030703.db2.gz ZQYBDWGAHIUQIV-RTBURBONSA-N 2 1 340.515 4.333 20 0 EIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1nccs1 ZINC000414219422 1022190043 /nfs/dbraw/zinc/19/00/43/1022190043.db2.gz HGLICUNTTHPDFQ-ZLPCBKJTSA-N 2 1 329.513 4.237 20 0 EIADMP c1ccc(CC2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CCCCC2)cc1 ZINC000471592361 1022201132 /nfs/dbraw/zinc/20/11/32/1022201132.db2.gz DJPQTPURGMURLR-RTWAWAEBSA-N 2 1 326.528 4.396 20 0 EIADMP CSc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)s1 ZINC000580604567 1022296049 /nfs/dbraw/zinc/29/60/49/1022296049.db2.gz XPCYEPKKAHWCOO-KRWDZBQOSA-N 2 1 346.565 4.124 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000892579527 1022301158 /nfs/dbraw/zinc/30/11/58/1022301158.db2.gz AIHPTHHCQLWKIZ-INIZCTEOSA-N 2 1 341.499 4.210 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000892579527 1022301174 /nfs/dbraw/zinc/30/11/74/1022301174.db2.gz AIHPTHHCQLWKIZ-INIZCTEOSA-N 2 1 341.499 4.210 20 0 EIADMP CC(C)[NH+]1CCC([NH2+]Cc2cc(Cl)cc(Br)c2)CC1 ZINC000414246313 1022305237 /nfs/dbraw/zinc/30/52/37/1022305237.db2.gz SCGDIJTXCXNDRZ-UHFFFAOYSA-N 2 1 345.712 4.065 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)sc1C ZINC000892580727 1022307488 /nfs/dbraw/zinc/30/74/88/1022307488.db2.gz NWUNVWPNYAEVSM-OAHLLOKOSA-N 2 1 343.540 4.282 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)sc1C ZINC000892580727 1022307504 /nfs/dbraw/zinc/30/75/04/1022307504.db2.gz NWUNVWPNYAEVSM-OAHLLOKOSA-N 2 1 343.540 4.282 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000471602661 1022308086 /nfs/dbraw/zinc/30/80/86/1022308086.db2.gz CTHLLGUDIXOTHK-SOLBZPMBSA-N 2 1 344.524 4.318 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)cnc1F ZINC000892580206 1022311902 /nfs/dbraw/zinc/31/19/02/1022311902.db2.gz HZBCECIVGMFNNI-QGZVFWFLSA-N 2 1 341.474 4.193 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424512 1022319982 /nfs/dbraw/zinc/31/99/82/1022319982.db2.gz KUTWADINFHPBPO-CEXWTWQISA-N 2 1 336.564 4.167 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424512 1022320002 /nfs/dbraw/zinc/32/00/02/1022320002.db2.gz KUTWADINFHPBPO-CEXWTWQISA-N 2 1 336.564 4.167 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424512 1022320022 /nfs/dbraw/zinc/32/00/22/1022320022.db2.gz KUTWADINFHPBPO-CEXWTWQISA-N 2 1 336.564 4.167 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+](C)CCCn3ccnc3)s2)cc1C ZINC000656262369 1022322419 /nfs/dbraw/zinc/32/24/19/1022322419.db2.gz SLFIAHMXFJGLAP-UHFFFAOYSA-N 2 1 340.496 4.146 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3nccc4ccccc43)CC2)n2c1CCCC2 ZINC000684026911 1022372223 /nfs/dbraw/zinc/37/22/23/1022372223.db2.gz ZMKXJXPNVFTURM-UHFFFAOYSA-N 2 1 346.478 4.147 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000275971701 1022469796 /nfs/dbraw/zinc/46/97/96/1022469796.db2.gz WZQRNMNSCJUHCH-OAHLLOKOSA-N 2 1 343.334 4.036 20 0 EIADMP c1ccc2c(c1)ccc1c2OCCC[C@@H]1[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000378192779 1022503851 /nfs/dbraw/zinc/50/38/51/1022503851.db2.gz PHWUFYPVUIJGTR-NRFANRHFSA-N 2 1 336.479 4.270 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Br)s1 ZINC000088163909 1022548685 /nfs/dbraw/zinc/54/86/85/1022548685.db2.gz XDUHJBGCTDZDSX-ODWCKFRGSA-N 2 1 343.334 4.177 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310891194 1022680605 /nfs/dbraw/zinc/68/06/05/1022680605.db2.gz KPYVCGHXNWWOMP-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP CC[C@@H](OCC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001167443277 1022807449 /nfs/dbraw/zinc/80/74/49/1022807449.db2.gz RDSJKIJLSZJUQM-LEWJYISDSA-N 2 1 330.516 4.105 20 0 EIADMP CC[C@@H](OCC[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001167443277 1022807450 /nfs/dbraw/zinc/80/74/50/1022807450.db2.gz RDSJKIJLSZJUQM-LEWJYISDSA-N 2 1 330.516 4.105 20 0 EIADMP CC[C@H](NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022517 1022815046 /nfs/dbraw/zinc/81/50/46/1022815046.db2.gz OMNLSDIEGRCWDH-ICSRJNTNSA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022517 1022815050 /nfs/dbraw/zinc/81/50/50/1022815050.db2.gz OMNLSDIEGRCWDH-ICSRJNTNSA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022517 1022815051 /nfs/dbraw/zinc/81/50/51/1022815051.db2.gz OMNLSDIEGRCWDH-ICSRJNTNSA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022517 1022815058 /nfs/dbraw/zinc/81/50/58/1022815058.db2.gz OMNLSDIEGRCWDH-ICSRJNTNSA-N 2 1 341.474 4.174 20 0 EIADMP CC[NH+](CC)CCCC1CC[NH+](Cc2cnc(Cl)s2)CC1 ZINC000182792111 1022828844 /nfs/dbraw/zinc/82/88/44/1022828844.db2.gz OULWWXVMDKKSAN-UHFFFAOYSA-N 2 1 329.941 4.131 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)ccc1Br ZINC000378489589 1022843613 /nfs/dbraw/zinc/84/36/13/1022843613.db2.gz CTXBTYNBLSYSPU-BPUTZDHNSA-N 2 1 337.305 4.035 20 0 EIADMP CSc1ccc2c(c1)[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)CCC2 ZINC000581251196 1022914941 /nfs/dbraw/zinc/91/49/41/1022914941.db2.gz HHKCZWIUHFFVPU-KUHUBIRLSA-N 2 1 329.513 4.217 20 0 EIADMP CC(C)[C@@H]([NH2+]CCCc1c[nH+]cn1C)c1cccc(C(F)(F)F)c1 ZINC000581258308 1022923372 /nfs/dbraw/zinc/92/33/72/1022923372.db2.gz AIFLLSFTIIQKJE-QGZVFWFLSA-N 2 1 339.405 4.358 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1 ZINC000164647308 1022941563 /nfs/dbraw/zinc/94/15/63/1022941563.db2.gz SWNPEPBWACMYPL-GJZGRUSLSA-N 2 1 342.512 4.363 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1cnn(C)c1 ZINC000156181738 1023092699 /nfs/dbraw/zinc/09/26/99/1023092699.db2.gz UJLZUMHKENOZQR-UWJYYQICSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)[C@@H]1C[C@H]1c1cccs1 ZINC000417302006 1023248485 /nfs/dbraw/zinc/24/84/85/1023248485.db2.gz QJLJUFDNKBTTNM-FFZOFVMBSA-N 2 1 340.536 4.494 20 0 EIADMP CC[N@@H+](CCC[NH+]1CCCC1)Cc1ccc(Cl)c2cccnc12 ZINC000584808406 1023333876 /nfs/dbraw/zinc/33/38/76/1023333876.db2.gz PKQFXGPCHPUGIN-UHFFFAOYSA-N 2 1 331.891 4.196 20 0 EIADMP Brc1cccc2c1CCC[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000341188590 1023340934 /nfs/dbraw/zinc/34/09/34/1023340934.db2.gz MWPJBJJWRZJEBD-GLJUWKHASA-N 2 1 349.316 4.043 20 0 EIADMP FC(F)(F)c1ccccc1C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415090225 1023434999 /nfs/dbraw/zinc/43/49/99/1023434999.db2.gz XRRFONWZUVSFFI-AEFFLSMTSA-N 2 1 334.385 4.288 20 0 EIADMP FC(F)(F)c1ccccc1CC[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415087160 1023438290 /nfs/dbraw/zinc/43/82/90/1023438290.db2.gz VMJLSIWNOHDVOU-PKOBYXMFSA-N 2 1 348.412 4.331 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+]CCOc3cccc4ccccc43)CC[NH2+]2)cc1 ZINC000415093827 1023438735 /nfs/dbraw/zinc/43/87/35/1023438735.db2.gz WEZHASLTYYDVHJ-IFMALSPDSA-N 2 1 346.474 4.302 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075194 1023485206 /nfs/dbraw/zinc/48/52/06/1023485206.db2.gz OOSYAWYCRPPOLI-GJZGRUSLSA-N 2 1 328.422 4.083 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075194 1023485214 /nfs/dbraw/zinc/48/52/14/1023485214.db2.gz OOSYAWYCRPPOLI-GJZGRUSLSA-N 2 1 328.422 4.083 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075194 1023485228 /nfs/dbraw/zinc/48/52/28/1023485228.db2.gz OOSYAWYCRPPOLI-GJZGRUSLSA-N 2 1 328.422 4.083 20 0 EIADMP C[C@H](C[N@@H+](C)[C@@H]1CCN(C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097665 1023499612 /nfs/dbraw/zinc/49/96/12/1023499612.db2.gz MWQQZHXQQMZTDO-CKEIUWERSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[N@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097665 1023499615 /nfs/dbraw/zinc/49/96/15/1023499615.db2.gz MWQQZHXQQMZTDO-CKEIUWERSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[N@@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097665 1023499619 /nfs/dbraw/zinc/49/96/19/1023499619.db2.gz MWQQZHXQQMZTDO-CKEIUWERSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[NH+](C)[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097665 1023499627 /nfs/dbraw/zinc/49/96/27/1023499627.db2.gz MWQQZHXQQMZTDO-CKEIUWERSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[NH+](C)[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097665 1023499631 /nfs/dbraw/zinc/49/96/31/1023499631.db2.gz MWQQZHXQQMZTDO-CKEIUWERSA-N 2 1 328.422 4.223 20 0 EIADMP Clc1ccc(C[N@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c2ncccc12 ZINC000656786258 1023526180 /nfs/dbraw/zinc/52/61/80/1023526180.db2.gz QZGBFCIHRSXHGD-INIZCTEOSA-N 2 1 343.902 4.100 20 0 EIADMP c1sc(-c2ccccc2)nc1C[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656786256 1023526267 /nfs/dbraw/zinc/52/62/67/1023526267.db2.gz QYYUKPQVPIYOAI-GOSISDBHSA-N 2 1 341.524 4.022 20 0 EIADMP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)C1 ZINC000684370480 1023544715 /nfs/dbraw/zinc/54/47/15/1023544715.db2.gz VLQINWURUKZIDY-JRGCBEDISA-N 2 1 330.516 4.108 20 0 EIADMP C[C@@H]1CC(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C[C@@H](C)O1 ZINC000558975632 1023625869 /nfs/dbraw/zinc/62/58/69/1023625869.db2.gz YPGRUFQDSGAUDD-JPAWQOSXSA-N 2 1 344.543 4.080 20 0 EIADMP C[C@@H]1CC(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C[C@@H](C)O1 ZINC000558975632 1023625873 /nfs/dbraw/zinc/62/58/73/1023625873.db2.gz YPGRUFQDSGAUDD-JPAWQOSXSA-N 2 1 344.543 4.080 20 0 EIADMP C[N@@H+](CCCNCc1ccccc1Br)Cc1ccccc1 ZINC000019913286 1023632287 /nfs/dbraw/zinc/63/22/87/1023632287.db2.gz SMGMUDAJIJKLPJ-UHFFFAOYSA-N 2 1 347.300 4.061 20 0 EIADMP C[NH2+]C[C@H]1CCC[N@H+](Cc2cnc(-c3ccc(C(C)C)cc3)s2)C1 ZINC000430650540 1023653320 /nfs/dbraw/zinc/65/33/20/1023653320.db2.gz KCYRCFVOWYPZPE-MRXNPFEDSA-N 2 1 343.540 4.365 20 0 EIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2cnc(-c3ccc(C(C)C)cc3)s2)C1 ZINC000430650540 1023653324 /nfs/dbraw/zinc/65/33/24/1023653324.db2.gz KCYRCFVOWYPZPE-MRXNPFEDSA-N 2 1 343.540 4.365 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[N@@H+]2CCC[C@@H]2c2cnn(C)c2C)cc1 ZINC000377694838 1023687898 /nfs/dbraw/zinc/68/78/98/1023687898.db2.gz FJIRYSDDHXCGJB-YCRPNKLZSA-N 2 1 349.482 4.121 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[N@H+]2CCC[C@@H]2c2cnn(C)c2C)cc1 ZINC000377694838 1023687904 /nfs/dbraw/zinc/68/79/04/1023687904.db2.gz FJIRYSDDHXCGJB-YCRPNKLZSA-N 2 1 349.482 4.121 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cccnc1Cl ZINC000163768265 1023702931 /nfs/dbraw/zinc/70/29/31/1023702931.db2.gz KREZQLBWTDDULD-OAHLLOKOSA-N 2 1 331.891 4.428 20 0 EIADMP CCc1nc2cc(C[NH2+][C@@H]3C[C@@H]([NH3+])c4ccccc43)ccc2n1C1CC1 ZINC000581800390 1023723524 /nfs/dbraw/zinc/72/35/24/1023723524.db2.gz GNXNFYUHOAQDOJ-RTBURBONSA-N 2 1 346.478 4.168 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000390625718 1023736062 /nfs/dbraw/zinc/73/60/62/1023736062.db2.gz HXFSLUXDESUTEZ-FSSWDIPSSA-N 2 1 349.522 4.022 20 0 EIADMP C[C@H]1C[N@@H+](C[C@@H](C[NH+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483569 1023740064 /nfs/dbraw/zinc/74/00/64/1023740064.db2.gz XGHBKCQKOSKYBZ-ZRCGQRJVSA-N 2 1 336.523 4.490 20 0 EIADMP C[C@H]1C[NH+](C[C@@H](C[N@H+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483569 1023740072 /nfs/dbraw/zinc/74/00/72/1023740072.db2.gz XGHBKCQKOSKYBZ-ZRCGQRJVSA-N 2 1 336.523 4.490 20 0 EIADMP C[C@H]1C[NH+](C[C@@H](C[N@@H+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483569 1023740077 /nfs/dbraw/zinc/74/00/77/1023740077.db2.gz XGHBKCQKOSKYBZ-ZRCGQRJVSA-N 2 1 336.523 4.490 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000581847177 1023762340 /nfs/dbraw/zinc/76/23/40/1023762340.db2.gz XUMGTXUDNDRSLE-IHWMJMDHSA-N 2 1 326.406 4.040 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000581847176 1023762748 /nfs/dbraw/zinc/76/27/48/1023762748.db2.gz XUMGTXUDNDRSLE-IDJPSDCMSA-N 2 1 326.406 4.040 20 0 EIADMP COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]CCc1c[nH+]cn1C ZINC000471765855 1023820649 /nfs/dbraw/zinc/82/06/49/1023820649.db2.gz DAFVKQYYPYCZPD-QGZVFWFLSA-N 2 1 335.879 4.002 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]CCC[C@H]3CCCCO3)CC23CC3)cc1 ZINC000647201801 1023885559 /nfs/dbraw/zinc/88/55/59/1023885559.db2.gz ANVBJSKPENWUDH-NHCUHLMSSA-N 2 1 342.527 4.123 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]CCC[C@H]3CCCCO3)CC23CC3)cc1 ZINC000647201801 1023885560 /nfs/dbraw/zinc/88/55/60/1023885560.db2.gz ANVBJSKPENWUDH-NHCUHLMSSA-N 2 1 342.527 4.123 20 0 EIADMP C[C@@H]([NH2+]CC1(C(F)(F)F)CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000367698117 1023886392 /nfs/dbraw/zinc/88/63/92/1023886392.db2.gz NRSJTAUFTYPQCW-WBVHZDCISA-N 2 1 340.433 4.219 20 0 EIADMP Cc1nc(C)c(CC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)s1 ZINC000157950653 1023913925 /nfs/dbraw/zinc/91/39/25/1023913925.db2.gz SROFGPFYLLLXSY-ZDUSSCGKSA-N 2 1 340.496 4.147 20 0 EIADMP Cc1cc(C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)c2ccccc2n1 ZINC000660679406 1024011172 /nfs/dbraw/zinc/01/11/72/1024011172.db2.gz PFBCHMDNQFAKBY-UHFFFAOYSA-N 2 1 345.490 4.297 20 0 EIADMP c1ccc(CSCC[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000430768289 1024021825 /nfs/dbraw/zinc/02/18/25/1024021825.db2.gz YODNPWGZJBPNBL-NRFANRHFSA-N 2 1 340.536 4.032 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cc3cnccc3o2)CC1 ZINC000651631489 1024058815 /nfs/dbraw/zinc/05/88/15/1024058815.db2.gz PORBNUADZUPDRO-UHFFFAOYSA-N 2 1 349.478 4.172 20 0 EIADMP Fc1ccccc1Oc1cccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000651864451 1024118557 /nfs/dbraw/zinc/11/85/57/1024118557.db2.gz UKNSQBRUIZTJEY-ZWKOTPCHSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1ccccc1Oc1cccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000651864451 1024118588 /nfs/dbraw/zinc/11/85/88/1024118588.db2.gz UKNSQBRUIZTJEY-ZWKOTPCHSA-N 2 1 340.442 4.334 20 0 EIADMP CCCC[NH+]1CCC([NH2+]Cc2ccc(Br)c(C)c2)CC1 ZINC000091469505 1024273265 /nfs/dbraw/zinc/27/32/65/1024273265.db2.gz UJXSKVMQHPDYIN-UHFFFAOYSA-N 2 1 339.321 4.112 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NCc1cc2cnccc2o1 ZINC000651731092 1024285999 /nfs/dbraw/zinc/28/59/99/1024285999.db2.gz GAHVVLHOYRHHRS-YPGOJHLTSA-N 2 1 349.478 4.074 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cc2cnccc2o1 ZINC000651731092 1024286019 /nfs/dbraw/zinc/28/60/19/1024286019.db2.gz GAHVVLHOYRHHRS-YPGOJHLTSA-N 2 1 349.478 4.074 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H]2CCOc3c(-c4ccccc4)cccc32)CC1 ZINC000341685012 1024320137 /nfs/dbraw/zinc/32/01/37/1024320137.db2.gz CJBVTBYWAPQQRO-NRFANRHFSA-N 2 1 336.479 4.251 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000341818570 1024778043 /nfs/dbraw/zinc/77/80/43/1024778043.db2.gz VUFUOPOGQZTOBV-QGZVFWFLSA-N 2 1 336.907 4.406 20 0 EIADMP CC(C)c1ccc(C[C@H](C)[NH2+]Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000511924620 1024802036 /nfs/dbraw/zinc/80/20/36/1024802036.db2.gz DUQYSUXJFYEWOA-HNNXBMFYSA-N 2 1 331.529 4.049 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](CCc1ccc(Cl)cc1)C(C)C ZINC000510948530 1024863356 /nfs/dbraw/zinc/86/33/56/1024863356.db2.gz TVCXBBJGGAGXBC-LJQANCHMSA-N 2 1 333.907 4.482 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510969978 1024872138 /nfs/dbraw/zinc/87/21/38/1024872138.db2.gz SRHPQNOYKMWVIL-HBMCJLEFSA-N 2 1 344.543 4.082 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510969978 1024872140 /nfs/dbraw/zinc/87/21/40/1024872140.db2.gz SRHPQNOYKMWVIL-HBMCJLEFSA-N 2 1 344.543 4.082 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2nc3ccccc3o2)CC1 ZINC000180981523 1025026547 /nfs/dbraw/zinc/02/65/47/1025026547.db2.gz BEOVRMWFSCDYQM-INIZCTEOSA-N 2 1 329.488 4.333 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3csc(C)n3)CC2)s1 ZINC000161694248 1025062108 /nfs/dbraw/zinc/06/21/08/1025062108.db2.gz BDGLZLBQQRTXLL-CQSZACIVSA-N 2 1 349.569 4.384 20 0 EIADMP COCC[C@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(Cl)c(Cl)c1 ZINC000342056376 1025079275 /nfs/dbraw/zinc/07/92/75/1025079275.db2.gz HOIVARJXZMWINM-YOEHRIQHSA-N 2 1 345.314 4.145 20 0 EIADMP CCC[C@@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)c1ccccc1 ZINC000162220278 1025109303 /nfs/dbraw/zinc/10/93/03/1025109303.db2.gz BTMGNMQJKZSWOO-HXUWFJFHSA-N 2 1 338.499 4.193 20 0 EIADMP C[C@@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000663478480 1025467485 /nfs/dbraw/zinc/46/74/85/1025467485.db2.gz RENAFAOTWRLTKD-NVXWUHKLSA-N 2 1 342.449 4.465 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H](Sc2ccncc2)C1 ZINC001167826940 1025628616 /nfs/dbraw/zinc/62/86/16/1025628616.db2.gz SDMRAAGPEFDRGV-IEBWSBKVSA-N 2 1 335.561 4.149 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC001167833356 1025783372 /nfs/dbraw/zinc/78/33/72/1025783372.db2.gz APSSOASVHKWFRF-UNMCSNQZSA-N 2 1 345.575 4.093 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCSC[C@H]1c1ccc(F)cc1 ZINC001167833328 1025790631 /nfs/dbraw/zinc/79/06/31/1025790631.db2.gz AFRDRCNGTCXCIM-LPHOPBHVSA-N 2 1 338.536 4.426 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)n1ccc([C@H](C)[NH2+]Cc2ccccc2)n1 ZINC001167833535 1025795246 /nfs/dbraw/zinc/79/52/46/1025795246.db2.gz CFBREMRMJUJQIE-MOPGFXCFSA-N 2 1 342.531 4.417 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000390891447 1025837617 /nfs/dbraw/zinc/83/76/17/1025837617.db2.gz ZJWWJSKSEMXASF-ROUUACIJSA-N 2 1 336.470 4.312 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000390891447 1025837619 /nfs/dbraw/zinc/83/76/19/1025837619.db2.gz ZJWWJSKSEMXASF-ROUUACIJSA-N 2 1 336.470 4.312 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H](c2cccc(OC)c2)C1 ZINC001167839553 1025853908 /nfs/dbraw/zinc/85/39/08/1025853908.db2.gz ABJCKCYVLTVXBF-AZUAARDMSA-N 2 1 332.532 4.385 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(SC(F)F)cc1 ZINC000278943180 1025855790 /nfs/dbraw/zinc/85/57/90/1025855790.db2.gz KJZVIACXTKNKGS-CHWSQXEVSA-N 2 1 337.439 4.111 20 0 EIADMP CC(C)n1ccnc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000657309596 1025875562 /nfs/dbraw/zinc/87/55/62/1025875562.db2.gz DJPGGHNZYGGZQR-GOSISDBHSA-N 2 1 340.515 4.128 20 0 EIADMP CC(C)n1ccnc1C[NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000657309596 1025875565 /nfs/dbraw/zinc/87/55/65/1025875565.db2.gz DJPGGHNZYGGZQR-GOSISDBHSA-N 2 1 340.515 4.128 20 0 EIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)CC2 ZINC001167967947 1025888470 /nfs/dbraw/zinc/88/84/70/1025888470.db2.gz MCNNUEVTRQXSQF-DLZDZTESSA-N 2 1 330.903 4.322 20 0 EIADMP C[C@H]1C[N@H+](CCC[NH2+][C@H](c2cccs2)C2CCCC2)CCCO1 ZINC000432418665 1025892597 /nfs/dbraw/zinc/89/25/97/1025892597.db2.gz UIBJZMVKKCLDMT-LPHOPBHVSA-N 2 1 336.545 4.070 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+][C@H](c2cccs2)C2CCCC2)CCCO1 ZINC000432418665 1025892602 /nfs/dbraw/zinc/89/26/02/1025892602.db2.gz UIBJZMVKKCLDMT-LPHOPBHVSA-N 2 1 336.545 4.070 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+][C@H](c2ccccc2F)C2CCCC2)CCCO1 ZINC000432420126 1025899194 /nfs/dbraw/zinc/89/91/94/1025899194.db2.gz IYVIVNZMTWAMQW-UWJYYQICSA-N 2 1 348.506 4.148 20 0 EIADMP Clc1cccc([C@@H]2C[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167968565 1025907617 /nfs/dbraw/zinc/90/76/17/1025907617.db2.gz RNEQODQCZMQXSI-HLKUOHOZSA-N 2 1 330.903 4.191 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1cc2ccccc2o1 ZINC000432424949 1025915399 /nfs/dbraw/zinc/91/53/99/1025915399.db2.gz KODMTGGKFFCYTP-UTKZUKDTSA-N 2 1 344.499 4.220 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1cc2ccccc2o1 ZINC000432424949 1025915424 /nfs/dbraw/zinc/91/54/24/1025915424.db2.gz KODMTGGKFFCYTP-UTKZUKDTSA-N 2 1 344.499 4.220 20 0 EIADMP CC(C)([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1cc(F)cc(F)c1 ZINC001167968797 1025922465 /nfs/dbraw/zinc/92/24/65/1025922465.db2.gz VLWFEBVUFHHIRT-YQQQUEKLSA-N 2 1 334.454 4.195 20 0 EIADMP CC(C)([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cc(F)cc(F)c1 ZINC001167968797 1025922503 /nfs/dbraw/zinc/92/25/03/1025922503.db2.gz VLWFEBVUFHHIRT-YQQQUEKLSA-N 2 1 334.454 4.195 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccncc1 ZINC000638718844 1026033423 /nfs/dbraw/zinc/03/34/23/1026033423.db2.gz MMLXTZDIKYUINP-AGHHOFFYSA-N 2 1 335.495 4.143 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccncc1 ZINC000638718844 1026033441 /nfs/dbraw/zinc/03/34/41/1026033441.db2.gz MMLXTZDIKYUINP-AGHHOFFYSA-N 2 1 335.495 4.143 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1cc(F)cc(Br)c1 ZINC000344175752 1026095385 /nfs/dbraw/zinc/09/53/85/1026095385.db2.gz SSSQEXPQHGNLOW-UVBJJODRSA-N 2 1 343.284 4.112 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc(F)cc(Br)c1 ZINC000344175752 1026095411 /nfs/dbraw/zinc/09/54/11/1026095411.db2.gz SSSQEXPQHGNLOW-UVBJJODRSA-N 2 1 343.284 4.112 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000511075255 1026187235 /nfs/dbraw/zinc/18/72/35/1026187235.db2.gz RGDCFJQBNDXMSG-YLJYHZDGSA-N 2 1 336.470 4.423 20 0 EIADMP Fc1ccc(CC2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CCC2)cc1 ZINC001167975142 1026223339 /nfs/dbraw/zinc/22/33/39/1026223339.db2.gz IMOVQGMIUXRQRK-SEJPIABJSA-N 2 1 342.502 4.286 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC2([C@@H](C)CCO)CCC2)cc1 ZINC000344301522 1026229157 /nfs/dbraw/zinc/22/91/57/1026229157.db2.gz JNUMHOOVUSUWAS-IRXDYDNUSA-N 2 1 341.499 4.020 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167979196 1026343073 /nfs/dbraw/zinc/34/30/73/1026343073.db2.gz XTYRIQFXJIOSSJ-UXDRXVOSSA-N 2 1 328.500 4.141 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167979196 1026343090 /nfs/dbraw/zinc/34/30/90/1026343090.db2.gz XTYRIQFXJIOSSJ-UXDRXVOSSA-N 2 1 328.500 4.141 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(CC2=Cc3ccccc3OC2)C1 ZINC000512192738 1026344084 /nfs/dbraw/zinc/34/40/84/1026344084.db2.gz BUEFTMLBGBGJEH-MOPGFXCFSA-N 2 1 340.511 4.049 20 0 EIADMP Fc1cc(F)c2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)CCC2 ZINC001167981776 1026369627 /nfs/dbraw/zinc/36/96/27/1026369627.db2.gz JQDDEAPOSTWEQS-IMOOIFFWSA-N 2 1 346.465 4.337 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000657374456 1026378141 /nfs/dbraw/zinc/37/81/41/1026378141.db2.gz LODKZPUEMPDUPR-UHFFFAOYSA-N 2 1 340.496 4.193 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cccc3cc[nH]c32)C1 ZINC000512214511 1026476602 /nfs/dbraw/zinc/47/66/02/1026476602.db2.gz WOIPRMWVYADPDZ-MSOLQXFVSA-N 2 1 325.500 4.254 20 0 EIADMP C[N@H+]1C[C@@H](C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)[C@H](c2ccccc2)C1 ZINC000647249290 1026494846 /nfs/dbraw/zinc/49/48/46/1026494846.db2.gz PRQVQXNUXQPPBY-LGKPFJOYSA-N 2 1 349.522 4.043 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CCC[C@H]([NH+](C)C)CC3)s2)cc1 ZINC000277561209 1026504947 /nfs/dbraw/zinc/50/49/47/1026504947.db2.gz RUECZOWWTFDNEY-KRWDZBQOSA-N 2 1 329.513 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CCC[C@H]([NH+](C)C)CC3)s2)cc1 ZINC000277561209 1026504960 /nfs/dbraw/zinc/50/49/60/1026504960.db2.gz RUECZOWWTFDNEY-KRWDZBQOSA-N 2 1 329.513 4.035 20 0 EIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CCCS2 ZINC000152450255 1026575467 /nfs/dbraw/zinc/57/54/67/1026575467.db2.gz ZOTYRNXZXXDPND-GUYCJALGSA-N 2 1 336.932 4.341 20 0 EIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CCCS2 ZINC000152450413 1026576519 /nfs/dbraw/zinc/57/65/19/1026576519.db2.gz ZOTYRNXZXXDPND-DYVFJYSZSA-N 2 1 336.932 4.341 20 0 EIADMP CO[C@H](CC(C)C)C[N@@H+](C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC001167571828 1026584502 /nfs/dbraw/zinc/58/45/02/1026584502.db2.gz BAVWZTYANQEMTE-HMXCVIKNSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001167571828 1026584512 /nfs/dbraw/zinc/58/45/12/1026584512.db2.gz BAVWZTYANQEMTE-HMXCVIKNSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001167571828 1026584515 /nfs/dbraw/zinc/58/45/15/1026584515.db2.gz BAVWZTYANQEMTE-HMXCVIKNSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001167571828 1026584523 /nfs/dbraw/zinc/58/45/23/1026584523.db2.gz BAVWZTYANQEMTE-HMXCVIKNSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001167571828 1026584534 /nfs/dbraw/zinc/58/45/34/1026584534.db2.gz BAVWZTYANQEMTE-HMXCVIKNSA-N 2 1 332.532 4.032 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000507097393 1026638282 /nfs/dbraw/zinc/63/82/82/1026638282.db2.gz GKCAVCKWNHQNCI-NBVRZTHBSA-N 2 1 330.516 4.041 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC(C)(c2nc3ccccc3s2)CC1 ZINC000511128568 1026658048 /nfs/dbraw/zinc/65/80/48/1026658048.db2.gz XLDQWOPHMLTJSY-MRXNPFEDSA-N 2 1 343.540 4.134 20 0 EIADMP CC(C)n1nccc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000279798839 1026698664 /nfs/dbraw/zinc/69/86/64/1026698664.db2.gz DMNZYIMEHSYESB-SFHVURJKSA-N 2 1 340.515 4.128 20 0 EIADMP CC(C)n1nccc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000279798839 1026698669 /nfs/dbraw/zinc/69/86/69/1026698669.db2.gz DMNZYIMEHSYESB-SFHVURJKSA-N 2 1 340.515 4.128 20 0 EIADMP Fc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1-c1cccs1 ZINC000391397337 1026752541 /nfs/dbraw/zinc/75/25/41/1026752541.db2.gz NGACIKXWBJKFLW-CVEARBPZSA-N 2 1 330.472 4.271 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@H]1CCCOC1 ZINC000507491683 1026816605 /nfs/dbraw/zinc/81/66/05/1026816605.db2.gz CERWUDJOKKPDPX-WEMPKCCASA-N 2 1 344.543 4.069 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000507507626 1026821523 /nfs/dbraw/zinc/82/15/23/1026821523.db2.gz IOOLLBJQJRQTIL-INDMIFKZSA-N 2 1 334.454 4.065 20 0 EIADMP C[C@H](Cc1ccsc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000582586271 1026834818 /nfs/dbraw/zinc/83/48/18/1026834818.db2.gz LHWAMJVGWAAZDD-RZXSNQJFSA-N 2 1 340.536 4.464 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)cc1 ZINC000152819393 1026852779 /nfs/dbraw/zinc/85/27/79/1026852779.db2.gz LWEHMNCYMCCGOW-SFHVURJKSA-N 2 1 337.511 4.002 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000582664315 1026914627 /nfs/dbraw/zinc/91/46/27/1026914627.db2.gz FDQUZWJIMDBVBR-LEWJYISDSA-N 2 1 344.543 4.224 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000582664315 1026914633 /nfs/dbraw/zinc/91/46/33/1026914633.db2.gz FDQUZWJIMDBVBR-LEWJYISDSA-N 2 1 344.543 4.224 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cc1OC ZINC000474476297 1027105492 /nfs/dbraw/zinc/10/54/92/1027105492.db2.gz WXGBPMYDZGKMPK-KURKYZTESA-N 2 1 348.531 4.050 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC000474481610 1027116518 /nfs/dbraw/zinc/11/65/18/1027116518.db2.gz YJTDCRICZLBETR-IPMKNSEASA-N 2 1 332.532 4.289 20 0 EIADMP Cc1cccc(N[C@@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)n1 ZINC000301892069 1027133763 /nfs/dbraw/zinc/13/37/63/1027133763.db2.gz VMXMZBZOIRSHCR-MRXNPFEDSA-N 2 1 335.373 4.095 20 0 EIADMP CCc1c(C)[nH+]c2ccccc2c1N1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000302073045 1027206645 /nfs/dbraw/zinc/20/66/45/1027206645.db2.gz WMJZLPMXMBHXSA-QGZVFWFLSA-N 2 1 348.494 4.298 20 0 EIADMP Cc1ccc2[nH+]ccc(NC3CCN(c4cc(C)[nH+]c(C)n4)CC3)c2c1 ZINC000302155853 1027233786 /nfs/dbraw/zinc/23/37/86/1027233786.db2.gz MRDRIDQPSXCRJX-UHFFFAOYSA-N 2 1 347.466 4.031 20 0 EIADMP CS[C@@H]1CCCC[NH+](CC[C@@H](C)[N@@H+]2CCCC[C@H](SC)C2)C1 ZINC000441107025 1027279022 /nfs/dbraw/zinc/27/90/22/1027279022.db2.gz WNMUZKYXZQAXDA-KURKYZTESA-N 2 1 344.634 4.200 20 0 EIADMP CS[C@@H]1CCCC[NH+](CC[C@@H](C)[N@H+]2CCCC[C@H](SC)C2)C1 ZINC000441107025 1027279059 /nfs/dbraw/zinc/27/90/59/1027279059.db2.gz WNMUZKYXZQAXDA-KURKYZTESA-N 2 1 344.634 4.200 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(OC(F)F)c(Cl)c1 ZINC000520208411 1027316148 /nfs/dbraw/zinc/31/61/48/1027316148.db2.gz SOOMTRJJBFMDPG-CYBMUJFWSA-N 2 1 346.849 4.296 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc(OC(F)F)c(Cl)c1 ZINC000520208411 1027316172 /nfs/dbraw/zinc/31/61/72/1027316172.db2.gz SOOMTRJJBFMDPG-CYBMUJFWSA-N 2 1 346.849 4.296 20 0 EIADMP CC(C)c1ccccc1NC(=O)[C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000116396414 1027350474 /nfs/dbraw/zinc/35/04/74/1027350474.db2.gz HNFXJUTZHDBPAI-VQIMIIECSA-N 2 1 347.547 4.093 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)o1 ZINC000582813754 1027402942 /nfs/dbraw/zinc/40/29/42/1027402942.db2.gz SWHKJKAPHLQRNX-JWTNVVGKSA-N 2 1 342.458 4.451 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)o1 ZINC000582813754 1027402957 /nfs/dbraw/zinc/40/29/57/1027402957.db2.gz SWHKJKAPHLQRNX-JWTNVVGKSA-N 2 1 342.458 4.451 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)o1 ZINC000582813754 1027402968 /nfs/dbraw/zinc/40/29/68/1027402968.db2.gz SWHKJKAPHLQRNX-JWTNVVGKSA-N 2 1 342.458 4.451 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)o1 ZINC000582813754 1027402981 /nfs/dbraw/zinc/40/29/81/1027402981.db2.gz SWHKJKAPHLQRNX-JWTNVVGKSA-N 2 1 342.458 4.451 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CCC(F)(F)[C@H](C)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168041210 1027432826 /nfs/dbraw/zinc/43/28/26/1027432826.db2.gz QZIAUKFOONSEBV-VXIBKDFQSA-N 2 1 336.470 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC(F)(F)[C@H](C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168041210 1027432839 /nfs/dbraw/zinc/43/28/39/1027432839.db2.gz QZIAUKFOONSEBV-VXIBKDFQSA-N 2 1 336.470 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CCC(F)(F)[C@H](C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168041210 1027432842 /nfs/dbraw/zinc/43/28/42/1027432842.db2.gz QZIAUKFOONSEBV-VXIBKDFQSA-N 2 1 336.470 4.405 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2ccc3c(n2)CCC3)cc1 ZINC000582830971 1027449757 /nfs/dbraw/zinc/44/97/57/1027449757.db2.gz APKKUZPSHJWDOY-GOSISDBHSA-N 2 1 349.522 4.235 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000441331231 1027469455 /nfs/dbraw/zinc/46/94/55/1027469455.db2.gz NMXPITKARPHRJM-GDBMZVCRSA-N 2 1 326.431 4.155 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC000441331231 1027469465 /nfs/dbraw/zinc/46/94/65/1027469465.db2.gz NMXPITKARPHRJM-GDBMZVCRSA-N 2 1 326.431 4.155 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC000441331231 1027469470 /nfs/dbraw/zinc/46/94/70/1027469470.db2.gz NMXPITKARPHRJM-GDBMZVCRSA-N 2 1 326.431 4.155 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1)c1ccccc1 ZINC000153465424 1027473973 /nfs/dbraw/zinc/47/39/73/1027473973.db2.gz GQXFIXXRVNQOTE-XMSQKQJNSA-N 2 1 338.495 4.148 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@H](C)C2)c1)c1ccccc1 ZINC000153465424 1027473985 /nfs/dbraw/zinc/47/39/85/1027473985.db2.gz GQXFIXXRVNQOTE-XMSQKQJNSA-N 2 1 338.495 4.148 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CCC2 ZINC000475499276 1027496879 /nfs/dbraw/zinc/49/68/79/1027496879.db2.gz SWPOJLNNGOQCJC-JOCHJYFZSA-N 2 1 338.470 4.457 20 0 EIADMP Cc1ccc(C)c(OCCC[N@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c1 ZINC000441399026 1027521783 /nfs/dbraw/zinc/52/17/83/1027521783.db2.gz UEJKRHDGQKEZTK-FPOVZHCZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441399026 1027521801 /nfs/dbraw/zinc/52/18/01/1027521801.db2.gz UEJKRHDGQKEZTK-FPOVZHCZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441399026 1027521818 /nfs/dbraw/zinc/52/18/18/1027521818.db2.gz UEJKRHDGQKEZTK-FPOVZHCZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441399026 1027521830 /nfs/dbraw/zinc/52/18/30/1027521830.db2.gz UEJKRHDGQKEZTK-FPOVZHCZSA-N 2 1 342.527 4.021 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC[N@H+]1C ZINC000474813337 1027538360 /nfs/dbraw/zinc/53/83/60/1027538360.db2.gz GVCJIMONCACQAH-UKRRQHHQSA-N 2 1 329.315 4.388 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000320915254 1027562359 /nfs/dbraw/zinc/56/23/59/1027562359.db2.gz DOOGLPPWFUVPDY-KMFMINBZSA-N 2 1 326.406 4.230 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000112517444 1027579958 /nfs/dbraw/zinc/57/99/58/1027579958.db2.gz HTADKICGZWLZHS-MRXNPFEDSA-N 2 1 344.886 4.023 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1OC ZINC000161645125 1027658544 /nfs/dbraw/zinc/65/85/44/1027658544.db2.gz OOXBZTWUIMARJD-YTQUADARSA-N 2 1 346.515 4.152 20 0 EIADMP COc1cccc([C@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167995088 1027742715 /nfs/dbraw/zinc/74/27/15/1027742715.db2.gz VOKSIDVKSHPBSP-XQXKNUKBSA-N 2 1 340.511 4.238 20 0 EIADMP COc1cccc([C@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167995088 1027742739 /nfs/dbraw/zinc/74/27/39/1027742739.db2.gz VOKSIDVKSHPBSP-XQXKNUKBSA-N 2 1 340.511 4.238 20 0 EIADMP COc1cccc([C@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167995088 1027742760 /nfs/dbraw/zinc/74/27/60/1027742760.db2.gz VOKSIDVKSHPBSP-XQXKNUKBSA-N 2 1 340.511 4.238 20 0 EIADMP c1csc(C2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)c1 ZINC001167995624 1027785233 /nfs/dbraw/zinc/78/52/33/1027785233.db2.gz LQHQOLXINBWFPI-DFNIBXOVSA-N 2 1 330.541 4.333 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@@H]3c3ccccc3)CC2)cc1 ZINC000657717384 1027847062 /nfs/dbraw/zinc/84/70/62/1027847062.db2.gz YPYCKNLCIXQMIM-DHIUTWEWSA-N 2 1 334.507 4.229 20 0 EIADMP CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cs1 ZINC000162277692 1027847474 /nfs/dbraw/zinc/84/74/74/1027847474.db2.gz BTLFIKJAQQSQFF-LSDHHAIUSA-N 2 1 347.528 4.058 20 0 EIADMP CCc1nc([C@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cs1 ZINC000162321738 1027856128 /nfs/dbraw/zinc/85/61/28/1027856128.db2.gz DOTLMCVMHDGIHE-CABCVRRESA-N 2 1 347.528 4.058 20 0 EIADMP CCOc1ccc(C2=CC[N@H+](CCC[NH+]3CCCCC3)CC2)cc1 ZINC000444616093 1027891134 /nfs/dbraw/zinc/89/11/34/1027891134.db2.gz BVPYXGPJODFWHM-UHFFFAOYSA-N 2 1 328.500 4.050 20 0 EIADMP CCOc1ccc(C2=CC[N@@H+](CCC[NH+]3CCCCC3)CC2)cc1 ZINC000444616093 1027891136 /nfs/dbraw/zinc/89/11/36/1027891136.db2.gz BVPYXGPJODFWHM-UHFFFAOYSA-N 2 1 328.500 4.050 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)cc1 ZINC000153726726 1027893766 /nfs/dbraw/zinc/89/37/66/1027893766.db2.gz RFWXRQPXHFWZJE-CQSZACIVSA-N 2 1 339.414 4.179 20 0 EIADMP COc1ccc([C@H](C)[NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)cc1 ZINC000153726614 1027894213 /nfs/dbraw/zinc/89/42/13/1027894213.db2.gz RFWXRQPXHFWZJE-AWEZNQCLSA-N 2 1 339.414 4.179 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cnc(C3CC3)o2)cc1 ZINC000628202151 1027950385 /nfs/dbraw/zinc/95/03/85/1027950385.db2.gz JEEVRVODQSHIPF-MRXNPFEDSA-N 2 1 339.483 4.216 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2cnc(C3CC3)o2)cc1 ZINC000628202151 1027950405 /nfs/dbraw/zinc/95/04/05/1027950405.db2.gz JEEVRVODQSHIPF-MRXNPFEDSA-N 2 1 339.483 4.216 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(-c2ccsc2)cc1 ZINC000444672754 1027958779 /nfs/dbraw/zinc/95/87/79/1027958779.db2.gz ZYPWWRXENIHKTI-UHFFFAOYSA-N 2 1 325.481 4.442 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(-c2ccsc2)cc1 ZINC000444672754 1027958797 /nfs/dbraw/zinc/95/87/97/1027958797.db2.gz ZYPWWRXENIHKTI-UHFFFAOYSA-N 2 1 325.481 4.442 20 0 EIADMP Cc1ccc2cc(C[NH2+]CCCC[N@@H+]3CCCC[C@H]3C)ccc2n1 ZINC000189256245 1028110416 /nfs/dbraw/zinc/11/04/16/1028110416.db2.gz FNVCEOSNCRIFOS-GOSISDBHSA-N 2 1 325.500 4.287 20 0 EIADMP CCC[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@@H]1CCc2ccccc21 ZINC000346136970 1028293352 /nfs/dbraw/zinc/29/33/52/1028293352.db2.gz QBDKBGWUPDVCEZ-JOCHJYFZSA-N 2 1 346.478 4.475 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000346167434 1028301622 /nfs/dbraw/zinc/30/16/22/1028301622.db2.gz KIIBVDIJZRESEY-KXBFYZLASA-N 2 1 336.439 4.142 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H]1c1ccccc1C ZINC000346174505 1028306337 /nfs/dbraw/zinc/30/63/37/1028306337.db2.gz MKHOEAHRPZOMIO-NRFANRHFSA-N 2 1 332.451 4.221 20 0 EIADMP Cc1ccsc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000162749352 1028328072 /nfs/dbraw/zinc/32/80/72/1028328072.db2.gz OTQWVDPDVXVDGJ-OAHLLOKOSA-N 2 1 347.528 4.224 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(C(C)(C)C)cc2)[C@H](C)C1 ZINC000523733321 1028341173 /nfs/dbraw/zinc/34/11/73/1028341173.db2.gz VVRWNXYVOJKGRP-NQIIRXRSSA-N 2 1 346.559 4.211 20 0 EIADMP CC[N@H+](CCn1cc[nH+]c1C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000346273755 1028346052 /nfs/dbraw/zinc/34/60/52/1028346052.db2.gz HXNHYPCKAWLITH-ZDUSSCGKSA-N 2 1 325.378 4.293 20 0 EIADMP CC[N@@H+](CCn1cc[nH+]c1C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000346273755 1028346071 /nfs/dbraw/zinc/34/60/71/1028346071.db2.gz HXNHYPCKAWLITH-ZDUSSCGKSA-N 2 1 325.378 4.293 20 0 EIADMP CC[N@H+](CCn1cc[nH+]c1C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000346273748 1028347125 /nfs/dbraw/zinc/34/71/25/1028347125.db2.gz HXNHYPCKAWLITH-CYBMUJFWSA-N 2 1 325.378 4.293 20 0 EIADMP CC[N@@H+](CCn1cc[nH+]c1C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000346273748 1028347140 /nfs/dbraw/zinc/34/71/40/1028347140.db2.gz HXNHYPCKAWLITH-CYBMUJFWSA-N 2 1 325.378 4.293 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)o1 ZINC000162793950 1028364907 /nfs/dbraw/zinc/36/49/07/1028364907.db2.gz TWGSPEIBIKSJHP-OAHLLOKOSA-N 2 1 345.487 4.010 20 0 EIADMP FC1(F)CC[C@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000281080515 1028377763 /nfs/dbraw/zinc/37/77/63/1028377763.db2.gz JGEPWXACDHOWRX-CADBVGFASA-N 2 1 334.454 4.207 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000583395825 1028656534 /nfs/dbraw/zinc/65/65/34/1028656534.db2.gz NZPPOTNBWWOBQX-ZILJWTLNSA-N 2 1 327.299 4.027 20 0 EIADMP Cc1cc(C[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)cc(C)c1O ZINC000583408122 1028669864 /nfs/dbraw/zinc/66/98/64/1028669864.db2.gz IYGRYYCDYREIEM-SFHVURJKSA-N 2 1 338.495 4.324 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CCC12CCOCC2 ZINC000548794490 1028696300 /nfs/dbraw/zinc/69/63/00/1028696300.db2.gz HYECITHUGVEMOS-WIYYLYMNSA-N 2 1 342.527 4.110 20 0 EIADMP CC(C)C[C@H](C[N@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1)c1ccccc1 ZINC000650707699 1028833862 /nfs/dbraw/zinc/83/38/62/1028833862.db2.gz LAIKJXQJALFBMG-LNRXMEIDSA-N 2 1 344.543 4.035 20 0 EIADMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000347001249 1028836838 /nfs/dbraw/zinc/83/68/38/1028836838.db2.gz GVNOGJMJNKQWEU-HIFRSBDPSA-N 2 1 334.410 4.000 20 0 EIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC000384105339 1028914655 /nfs/dbraw/zinc/91/46/55/1028914655.db2.gz XDIZUUDMUHNYBD-FQEVSTJZSA-N 2 1 326.459 4.136 20 0 EIADMP Clc1ccc2cccnc2c1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157106059 1028948026 /nfs/dbraw/zinc/94/80/26/1028948026.db2.gz CBFDJLHFXUMIPJ-KRWDZBQOSA-N 2 1 343.902 4.339 20 0 EIADMP Clc1ccc2cccnc2c1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157106059 1028948056 /nfs/dbraw/zinc/94/80/56/1028948056.db2.gz CBFDJLHFXUMIPJ-KRWDZBQOSA-N 2 1 343.902 4.339 20 0 EIADMP Cc1nc(C(C)C)oc1CN[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000428430028 1029125857 /nfs/dbraw/zinc/12/58/57/1029125857.db2.gz GUEYEGXSAWATCT-QFBILLFUSA-N 2 1 341.499 4.107 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000524728160 1029193944 /nfs/dbraw/zinc/19/39/44/1029193944.db2.gz UOVPIPUGJVRPSG-LEWJYISDSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+][C@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000524728160 1029193950 /nfs/dbraw/zinc/19/39/50/1029193950.db2.gz UOVPIPUGJVRPSG-LEWJYISDSA-N 2 1 336.479 4.079 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000475110733 1029267809 /nfs/dbraw/zinc/26/78/09/1029267809.db2.gz AFLGWGLINFKBEU-UHFFFAOYSA-N 2 1 346.421 4.285 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)CCS2 ZINC000343470730 1029315764 /nfs/dbraw/zinc/31/57/64/1029315764.db2.gz XRXOUYKVQUUTCJ-MAUKXSAKSA-N 2 1 334.529 4.086 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)CCS2 ZINC000343494396 1029369779 /nfs/dbraw/zinc/36/97/79/1029369779.db2.gz FIHMCEFVRORSJR-VQIMIIECSA-N 2 1 348.556 4.334 20 0 EIADMP COC(C)(C)[C@@H]1CCC[N@@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168058678 1029371472 /nfs/dbraw/zinc/37/14/72/1029371472.db2.gz BQXZDKBPOOBKGM-YHELAOLJSA-N 2 1 344.543 4.317 20 0 EIADMP COC(C)(C)[C@@H]1CCC[N@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168058678 1029371495 /nfs/dbraw/zinc/37/14/95/1029371495.db2.gz BQXZDKBPOOBKGM-YHELAOLJSA-N 2 1 344.543 4.317 20 0 EIADMP COC(C)(C)[C@@H]1CCC[NH+]1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168058678 1029371510 /nfs/dbraw/zinc/37/15/10/1029371510.db2.gz BQXZDKBPOOBKGM-YHELAOLJSA-N 2 1 344.543 4.317 20 0 EIADMP COC(C)(C)[C@@H]1CCC[NH+]1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168058678 1029371524 /nfs/dbraw/zinc/37/15/24/1029371524.db2.gz BQXZDKBPOOBKGM-YHELAOLJSA-N 2 1 344.543 4.317 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000475212398 1029443180 /nfs/dbraw/zinc/44/31/80/1029443180.db2.gz UQQQGHYKWUEKTB-SFHVURJKSA-N 2 1 342.449 4.444 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@H]3c3ccccc3)C2)cc1 ZINC000475274048 1029479454 /nfs/dbraw/zinc/47/94/54/1029479454.db2.gz HKAOSXPXPKMLRO-PUHATCMVSA-N 2 1 334.507 4.434 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2nc(C3CC3)cs2)CC1 ZINC000343548141 1029480480 /nfs/dbraw/zinc/48/04/80/1029480480.db2.gz IEHWXYHCYVRJII-MRXNPFEDSA-N 2 1 347.572 4.497 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2nc(C3CC3)cs2)CC1 ZINC000343548141 1029480489 /nfs/dbraw/zinc/48/04/89/1029480489.db2.gz IEHWXYHCYVRJII-MRXNPFEDSA-N 2 1 347.572 4.497 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CC[C@H](c4ccccc4)C3)C2)cc1 ZINC000475276620 1029481712 /nfs/dbraw/zinc/48/17/12/1029481712.db2.gz PHGFMRLCTISBTC-PUHATCMVSA-N 2 1 334.507 4.434 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)CCS2 ZINC000343571150 1029518708 /nfs/dbraw/zinc/51/87/08/1029518708.db2.gz LCVTVUSGYRIWOX-QAPCUYQASA-N 2 1 334.529 4.086 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)CCS2 ZINC000343571150 1029518723 /nfs/dbraw/zinc/51/87/23/1029518723.db2.gz LCVTVUSGYRIWOX-QAPCUYQASA-N 2 1 334.529 4.086 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)CCS2 ZINC000343571151 1029519340 /nfs/dbraw/zinc/51/93/40/1029519340.db2.gz LCVTVUSGYRIWOX-YJBOKZPZSA-N 2 1 334.529 4.086 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)CCS2 ZINC000343571151 1029519351 /nfs/dbraw/zinc/51/93/51/1029519351.db2.gz LCVTVUSGYRIWOX-YJBOKZPZSA-N 2 1 334.529 4.086 20 0 EIADMP CC(C)[N@H+](C1CCOCC1)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168063618 1029613666 /nfs/dbraw/zinc/61/36/66/1029613666.db2.gz DARLQSCIEDFXRE-HATOLVCRSA-N 2 1 344.543 4.317 20 0 EIADMP CC(C)[N@@H+](C1CCOCC1)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168063618 1029613671 /nfs/dbraw/zinc/61/36/71/1029613671.db2.gz DARLQSCIEDFXRE-HATOLVCRSA-N 2 1 344.543 4.317 20 0 EIADMP CC(C)[NH+](C1CCOCC1)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168063618 1029613673 /nfs/dbraw/zinc/61/36/73/1029613673.db2.gz DARLQSCIEDFXRE-HATOLVCRSA-N 2 1 344.543 4.317 20 0 EIADMP CC(C)[NH+](C1CCOCC1)[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168063618 1029613678 /nfs/dbraw/zinc/61/36/78/1029613678.db2.gz DARLQSCIEDFXRE-HATOLVCRSA-N 2 1 344.543 4.317 20 0 EIADMP CC1(C)CCC[C@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)O1 ZINC000714342890 1029627554 /nfs/dbraw/zinc/62/75/54/1029627554.db2.gz FOEVQODATGRZDI-UXHICEINSA-N 2 1 344.543 4.224 20 0 EIADMP CC1(C)CCC[C@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)O1 ZINC000714342890 1029627559 /nfs/dbraw/zinc/62/75/59/1029627559.db2.gz FOEVQODATGRZDI-UXHICEINSA-N 2 1 344.543 4.224 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccn1 ZINC000158990614 1029636059 /nfs/dbraw/zinc/63/60/59/1029636059.db2.gz VAUBDZYTUBWTSU-SFTDATJTSA-N 2 1 337.511 4.077 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccn1 ZINC000158990614 1029636060 /nfs/dbraw/zinc/63/60/60/1029636060.db2.gz VAUBDZYTUBWTSU-SFTDATJTSA-N 2 1 337.511 4.077 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Br)cc1F ZINC000446938966 1029646310 /nfs/dbraw/zinc/64/63/10/1029646310.db2.gz YSRODOJNOGTRRN-FPMFFAJLSA-N 2 1 343.284 4.112 20 0 EIADMP Cc1cnccc1OC1CCN(Cc2ccc([C@@H]3C[C@@H]3C)o2)CC1 ZINC000447099343 1029694292 /nfs/dbraw/zinc/69/42/92/1029694292.db2.gz RANBUOBLXUGPIG-KBXCAEBGSA-N 2 1 326.440 4.150 20 0 EIADMP COc1cccc([C@H](CNc2cc[nH+]c3ccsc32)[NH+](C)C)c1 ZINC000301349979 1029714432 /nfs/dbraw/zinc/71/44/32/1029714432.db2.gz JMIMPSGIEJIGEH-KRWDZBQOSA-N 2 1 327.453 4.020 20 0 EIADMP C[C@H]1c2ccccc2C[NH+]1CCOCC[N@H+]1Cc2ccccc2[C@@H]1C ZINC000343738207 1029731964 /nfs/dbraw/zinc/73/19/64/1029731964.db2.gz JKKYDOKJLAARFX-ROUUACIJSA-N 2 1 336.479 4.157 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657839225 1029740510 /nfs/dbraw/zinc/74/05/10/1029740510.db2.gz PLEIZMJYRLJVNW-OWCLPIDISA-N 2 1 339.474 4.428 20 0 EIADMP Cc1cc(C)c(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)cc1C ZINC000708511635 1029743340 /nfs/dbraw/zinc/74/33/40/1029743340.db2.gz DYLZFMPNCLCKFL-NFBKMPQASA-N 2 1 336.523 4.470 20 0 EIADMP C[C@@H]([NH2+]C1(CNc2cc[nH+]cc2Cl)CCOCC1)c1ccccc1 ZINC000080984166 1029768203 /nfs/dbraw/zinc/76/82/03/1029768203.db2.gz QNUUIAIDWVOFKP-OAHLLOKOSA-N 2 1 345.874 4.047 20 0 EIADMP COc1cccc2c(N3CCC[C@H]([NH+]4CCCC4)CC3)cc(C)[nH+]c12 ZINC000301652879 1029783061 /nfs/dbraw/zinc/78/30/61/1029783061.db2.gz GYUKUASYLQLQDR-KRWDZBQOSA-N 2 1 339.483 4.007 20 0 EIADMP CC1(C)CC([NH2+]Cc2cnc(-c3ccsc3)s2)CC(C)(C)[NH2+]1 ZINC000084650755 1029830546 /nfs/dbraw/zinc/83/05/46/1029830546.db2.gz DFNUWZQHFFNAEV-UHFFFAOYSA-N 2 1 335.542 4.270 20 0 EIADMP COCc1ccc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000086279076 1029838991 /nfs/dbraw/zinc/83/89/91/1029838991.db2.gz SIYNOSDVGNRFOH-MRXNPFEDSA-N 2 1 335.451 4.178 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657859385 1029846093 /nfs/dbraw/zinc/84/60/93/1029846093.db2.gz TVMMZSVJNQWDIS-IEBWSBKVSA-N 2 1 349.478 4.391 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657859385 1029846094 /nfs/dbraw/zinc/84/60/94/1029846094.db2.gz TVMMZSVJNQWDIS-IEBWSBKVSA-N 2 1 349.478 4.391 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cc3ccccc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000090577301 1029867685 /nfs/dbraw/zinc/86/76/85/1029867685.db2.gz ZCWWCQNRPHHISF-NQIIRXRSSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000090577301 1029867687 /nfs/dbraw/zinc/86/76/87/1029867687.db2.gz ZCWWCQNRPHHISF-NQIIRXRSSA-N 2 1 347.506 4.353 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccc(OC)c(OC)c1 ZINC000090586274 1029867903 /nfs/dbraw/zinc/86/79/03/1029867903.db2.gz ZLTFGVIRUJHFKJ-PKOBYXMFSA-N 2 1 348.531 4.113 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccc(OC)c(OC)c1 ZINC000090586289 1029867951 /nfs/dbraw/zinc/86/79/51/1029867951.db2.gz ZLTFGVIRUJHFKJ-IEBWSBKVSA-N 2 1 348.531 4.113 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](c2cccnc2)C(C)C)cc1F ZINC000091307388 1029883256 /nfs/dbraw/zinc/88/32/56/1029883256.db2.gz JGABHJHQRIDHOE-HXUWFJFHSA-N 2 1 338.430 4.202 20 0 EIADMP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1OC ZINC000183187523 1029991618 /nfs/dbraw/zinc/99/16/18/1029991618.db2.gz UNTAPTLJWLZMII-HLIPFELVSA-N 2 1 330.516 4.389 20 0 EIADMP Cc1nc(C(F)(F)F)c(C[NH+]2CCC(CCC[NH+](C)C)CC2)s1 ZINC000183636361 1030026216 /nfs/dbraw/zinc/02/62/16/1030026216.db2.gz FMQQRVMVWIOLOR-UHFFFAOYSA-N 2 1 349.466 4.024 20 0 EIADMP FC1(F)CCCC[C@H]1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000450874914 1030066457 /nfs/dbraw/zinc/06/64/57/1030066457.db2.gz HLOOODGRZNCQNA-INIZCTEOSA-N 2 1 337.458 4.224 20 0 EIADMP Cc1cncc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1 ZINC000184366929 1030069277 /nfs/dbraw/zinc/06/92/77/1030069277.db2.gz XWSXSZJHONLGCA-BXWFABGCSA-N 2 1 329.513 4.185 20 0 EIADMP Cc1cncc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000184366929 1030069298 /nfs/dbraw/zinc/06/92/98/1030069298.db2.gz XWSXSZJHONLGCA-BXWFABGCSA-N 2 1 329.513 4.185 20 0 EIADMP Cc1ccc(C)c([C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000392266656 1030079203 /nfs/dbraw/zinc/07/92/03/1030079203.db2.gz OQQNUZCYDRYQMX-XXBNENTESA-N 2 1 334.507 4.467 20 0 EIADMP CCc1cnccc1[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447579677 1030207812 /nfs/dbraw/zinc/20/78/12/1030207812.db2.gz LIYQORLFAAVAOQ-CIQXWFTPSA-N 2 1 349.522 4.490 20 0 EIADMP C[C@@H](c1ccc(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1)C(F)(F)F ZINC000451066191 1030221157 /nfs/dbraw/zinc/22/11/57/1030221157.db2.gz BTWDZOIDUNLJKO-MAUKXSAKSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)cc1)C(F)(F)F ZINC000451066191 1030221179 /nfs/dbraw/zinc/22/11/79/1030221179.db2.gz BTWDZOIDUNLJKO-MAUKXSAKSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1)C(F)(F)F ZINC000451066191 1030221202 /nfs/dbraw/zinc/22/12/02/1030221202.db2.gz BTWDZOIDUNLJKO-MAUKXSAKSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(F)c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000526050076 1030231340 /nfs/dbraw/zinc/23/13/40/1030231340.db2.gz KGDHETITUATNCM-APWZRJJASA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(F)c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000526050076 1030231347 /nfs/dbraw/zinc/23/13/47/1030231347.db2.gz KGDHETITUATNCM-APWZRJJASA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccc(F)c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000526050079 1030233820 /nfs/dbraw/zinc/23/38/20/1030233820.db2.gz KGDHETITUATNCM-VQIMIIECSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccc(F)c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000526050079 1030233829 /nfs/dbraw/zinc/23/38/29/1030233829.db2.gz KGDHETITUATNCM-VQIMIIECSA-N 2 1 344.449 4.150 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2c(F)cccc2Cl)C[C@H]1C ZINC000447723518 1030310325 /nfs/dbraw/zinc/31/03/25/1030310325.db2.gz PQHSWZYRNMKCGF-HUUCEWRRSA-N 2 1 326.887 4.216 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2c(F)cccc2Cl)C[C@H]1C ZINC000447723518 1030310347 /nfs/dbraw/zinc/31/03/47/1030310347.db2.gz PQHSWZYRNMKCGF-HUUCEWRRSA-N 2 1 326.887 4.216 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2c(F)cccc2Cl)C[C@H]1C ZINC000447723518 1030310367 /nfs/dbraw/zinc/31/03/67/1030310367.db2.gz PQHSWZYRNMKCGF-HUUCEWRRSA-N 2 1 326.887 4.216 20 0 EIADMP CCc1ccc(-c2ccc(C[N@H+]3CC[C@H](c4nccn4C)C3)o2)cc1 ZINC000685463268 1030344581 /nfs/dbraw/zinc/34/45/81/1030344581.db2.gz NCEAJZXDRDQHBE-SFHVURJKSA-N 2 1 335.451 4.232 20 0 EIADMP Fc1cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1Cl ZINC000062426537 1030427675 /nfs/dbraw/zinc/42/76/75/1030427675.db2.gz NTLLKXVKSFFIDG-GOSISDBHSA-N 2 1 346.877 4.481 20 0 EIADMP Cc1cc(C(C)(C)C)cc2c1OCCC[C@H]2[NH2+]CCc1c[nH+]cn1C ZINC000530460423 1030438063 /nfs/dbraw/zinc/43/80/63/1030438063.db2.gz TVVSXBRCBKBHAZ-LJQANCHMSA-N 2 1 341.499 4.072 20 0 EIADMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cnn1C(C)(C)C ZINC000191238429 1030611060 /nfs/dbraw/zinc/61/10/60/1030611060.db2.gz OJLGNRGDBBXALL-MRXNPFEDSA-N 2 1 346.563 4.252 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCOc2cccc3ccccc32)CCN1C ZINC000530666367 1030619203 /nfs/dbraw/zinc/61/92/03/1030619203.db2.gz UVVGMLFIWSWFHE-IEBWSBKVSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCOc2cccc3ccccc32)CC[N@@H+]1C ZINC000530666367 1030619214 /nfs/dbraw/zinc/61/92/14/1030619214.db2.gz UVVGMLFIWSWFHE-IEBWSBKVSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCOc2cccc3ccccc32)CC[N@H+]1C ZINC000530666367 1030619226 /nfs/dbraw/zinc/61/92/26/1030619226.db2.gz UVVGMLFIWSWFHE-IEBWSBKVSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)CCCOc2cccc3ccccc32)CC[NH+]1C ZINC000530666367 1030619234 /nfs/dbraw/zinc/61/92/34/1030619234.db2.gz UVVGMLFIWSWFHE-IEBWSBKVSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCOc2cccc3ccccc32)CC[NH+]1C ZINC000530666367 1030619240 /nfs/dbraw/zinc/61/92/40/1030619240.db2.gz UVVGMLFIWSWFHE-IEBWSBKVSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Br)c(Cl)c1 ZINC000657939434 1030644651 /nfs/dbraw/zinc/64/46/51/1030644651.db2.gz YBZFAGOCFBEEOL-NSHDSACASA-N 2 1 343.696 4.015 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCCSCC2)C[N@H+]1Cc1ccccc1 ZINC000657934214 1030633234 /nfs/dbraw/zinc/63/32/34/1030633234.db2.gz ZZRLTWMYIHHYPQ-HOJAQTOUSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1cc[n+](C[C@@H]2CCC3(CCCCC3)O2)cc1 ZINC000191699549 1030654291 /nfs/dbraw/zinc/65/42/91/1030654291.db2.gz UEPZIYZFRQBTPZ-CTNGQTDRSA-N 2 1 343.535 4.230 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000398107408 1030696406 /nfs/dbraw/zinc/69/64/06/1030696406.db2.gz BYHHGMZJGWHUQN-XGRCMKMKSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000398107408 1030696433 /nfs/dbraw/zinc/69/64/33/1030696433.db2.gz BYHHGMZJGWHUQN-XGRCMKMKSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1coc2ccccc12 ZINC000398108256 1030698734 /nfs/dbraw/zinc/69/87/34/1030698734.db2.gz CDZZNAMKPLQJRD-UWJYYQICSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1coc2ccccc12 ZINC000398108256 1030698742 /nfs/dbraw/zinc/69/87/42/1030698742.db2.gz CDZZNAMKPLQJRD-UWJYYQICSA-N 2 1 334.463 4.433 20 0 EIADMP Cc1oc(-c2cccs2)nc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000193081206 1030732642 /nfs/dbraw/zinc/73/26/42/1030732642.db2.gz YXFMIKXCGFWCCP-UHFFFAOYSA-N 2 1 345.512 4.019 20 0 EIADMP Brc1ccc(/C=C\CC[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000527741681 1030839193 /nfs/dbraw/zinc/83/91/93/1030839193.db2.gz AEKFDMYGDLWECB-CYXJYWMISA-N 2 1 349.316 4.069 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)CC[N@@H+]1C ZINC000658252953 1030923803 /nfs/dbraw/zinc/92/38/03/1030923803.db2.gz GEVRCDSEBYWXLR-PWSUYJOCSA-N 2 1 334.348 4.112 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)CC[N@H+]1C ZINC000658252953 1030923830 /nfs/dbraw/zinc/92/38/30/1030923830.db2.gz GEVRCDSEBYWXLR-PWSUYJOCSA-N 2 1 334.348 4.112 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1OCCC ZINC000392722144 1030944326 /nfs/dbraw/zinc/94/43/26/1030944326.db2.gz PTWYZTCJCPXEGI-MSOLQXFVSA-N 2 1 348.531 4.257 20 0 EIADMP Brc1ccc(/C=C/CC[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000527930531 1030972867 /nfs/dbraw/zinc/97/28/67/1030972867.db2.gz KBCNAWBBQCFFSA-HNQUOIGGSA-N 2 1 349.316 4.069 20 0 EIADMP Cc1ccncc1[C@@H](C)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658320000 1030980183 /nfs/dbraw/zinc/98/01/83/1030980183.db2.gz LPPXBLLDTCDEFJ-CTNGQTDRSA-N 2 1 349.522 4.343 20 0 EIADMP COCC[C@H](N[C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccc(C)o1 ZINC000340355243 1031202265 /nfs/dbraw/zinc/20/22/65/1031202265.db2.gz NXLSDKCHWMRPEW-UFYCRDLUSA-N 2 1 342.483 4.091 20 0 EIADMP COCC[C@H](N[C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccc(C)o1 ZINC000340355243 1031202282 /nfs/dbraw/zinc/20/22/82/1031202282.db2.gz NXLSDKCHWMRPEW-UFYCRDLUSA-N 2 1 342.483 4.091 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc3ncccc3c2)C[C@H]1c1ccccc1 ZINC000340377433 1031212223 /nfs/dbraw/zinc/21/22/23/1031212223.db2.gz ISHIMDVOQBLPKL-UNMCSNQZSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc3ncccc3c2)C[C@H]1c1ccccc1 ZINC000340377433 1031212255 /nfs/dbraw/zinc/21/22/55/1031212255.db2.gz ISHIMDVOQBLPKL-UNMCSNQZSA-N 2 1 331.463 4.160 20 0 EIADMP CC1CCC([NH+]2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)CC1 ZINC001168214718 1031299774 /nfs/dbraw/zinc/29/97/74/1031299774.db2.gz DJZFBQHXYYRALH-UHFFFAOYSA-N 2 1 341.543 4.337 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+]CCCCn1cc[nH+]c1C ZINC000531535933 1031340607 /nfs/dbraw/zinc/34/06/07/1031340607.db2.gz ZCTMNENJZUUNHF-UHFFFAOYSA-N 2 1 349.478 4.437 20 0 EIADMP COc1cc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc2ccccc21 ZINC000449036434 1031370939 /nfs/dbraw/zinc/37/09/39/1031370939.db2.gz JZHMHIJIEFCHPE-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc2ccccc21 ZINC000449036434 1031370944 /nfs/dbraw/zinc/37/09/44/1031370944.db2.gz JZHMHIJIEFCHPE-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc2ccccc21 ZINC000449036434 1031370954 /nfs/dbraw/zinc/37/09/54/1031370954.db2.gz JZHMHIJIEFCHPE-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc2ccccc21 ZINC000449036434 1031370966 /nfs/dbraw/zinc/37/09/66/1031370966.db2.gz JZHMHIJIEFCHPE-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cc3cccnc3o2)CC1)CC1CC1 ZINC000449057449 1031410282 /nfs/dbraw/zinc/41/02/82/1031410282.db2.gz CDQNGSNQHNJQCA-UHFFFAOYSA-N 2 1 341.499 4.162 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000449086973 1031418154 /nfs/dbraw/zinc/41/81/54/1031418154.db2.gz FBIRVAFSCGBBEP-LJQANCHMSA-N 2 1 329.875 4.461 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@H]3CCOC4(CCC4)C3)cc2)C1 ZINC000449074135 1031427172 /nfs/dbraw/zinc/42/71/72/1031427172.db2.gz BLRAZDRQHRYDEV-NQIIRXRSSA-N 2 1 342.527 4.110 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449076530 1031431471 /nfs/dbraw/zinc/43/14/71/1031431471.db2.gz TZDLROHNRJKMKR-QGZVFWFLSA-N 3 1 348.579 4.096 20 0 EIADMP Clc1ccc(C2=CC[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000449089120 1031450069 /nfs/dbraw/zinc/45/00/69/1031450069.db2.gz JICCKKQQTOBXDY-SLFFLAALSA-N 2 1 330.903 4.492 20 0 EIADMP CSCC1CCC([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000449128017 1031464560 /nfs/dbraw/zinc/46/45/60/1031464560.db2.gz XJKTXFMAXDXPAK-KBWCOIMZSA-N 2 1 346.584 4.062 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C2CCC(OC3CCCC3)CC2)c1 ZINC000449131746 1031465766 /nfs/dbraw/zinc/46/57/66/1031465766.db2.gz PGWLMCGAWRXOJH-UHFFFAOYSA-N 2 1 344.543 4.498 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCC(C)(C)C3)CC2)cs1 ZINC000449150480 1031483335 /nfs/dbraw/zinc/48/33/35/1031483335.db2.gz RHPOEMAAUQCNTH-MRXNPFEDSA-N 2 1 335.561 4.086 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC34CCC4)CC2)cs1 ZINC000449149866 1031485395 /nfs/dbraw/zinc/48/53/95/1031485395.db2.gz PAHXSIJKUGYPNW-GOSISDBHSA-N 2 1 347.572 4.230 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3ccc(C)cc32)c1 ZINC000123946222 1031494743 /nfs/dbraw/zinc/49/47/43/1031494743.db2.gz CXZWFBYNEISKJW-NRFANRHFSA-N 2 1 338.495 4.450 20 0 EIADMP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](c2cccnc2)C2CC2)CC1 ZINC000449202811 1031546996 /nfs/dbraw/zinc/54/69/96/1031546996.db2.gz GRKCEVGKIMDXDF-WZONZLPQSA-N 2 1 349.522 4.218 20 0 EIADMP Cc1nc2c(n1[C@@H]1CC[N@@H+](Cc3cccc4ccoc43)C1)CCCC2 ZINC000449265597 1031600729 /nfs/dbraw/zinc/60/07/29/1031600729.db2.gz SEWNUAFVENJNMY-GOSISDBHSA-N 2 1 335.451 4.264 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@H+](Cc3cccc4ccoc43)C1)CCCC2 ZINC000449265597 1031600743 /nfs/dbraw/zinc/60/07/43/1031600743.db2.gz SEWNUAFVENJNMY-GOSISDBHSA-N 2 1 335.451 4.264 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@@H+](Cc3cccc4ccoc43)C1)CCCC2 ZINC000449265597 1031600758 /nfs/dbraw/zinc/60/07/58/1031600758.db2.gz SEWNUAFVENJNMY-GOSISDBHSA-N 2 1 335.451 4.264 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccncc1 ZINC000453116540 1031607285 /nfs/dbraw/zinc/60/72/85/1031607285.db2.gz HRQXXIQHTXNLLN-LNLFQRSKSA-N 2 1 329.513 4.267 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccncc1 ZINC000453116540 1031607297 /nfs/dbraw/zinc/60/72/97/1031607297.db2.gz HRQXXIQHTXNLLN-LNLFQRSKSA-N 2 1 329.513 4.267 20 0 EIADMP C[C@H](C[N@@H+](Cc1ccco1)C1CCN(C)CC1)c1cc(F)cc(F)c1 ZINC000449331212 1031626358 /nfs/dbraw/zinc/62/63/58/1031626358.db2.gz NRPJZEYWUKJVIL-OAHLLOKOSA-N 2 1 348.437 4.258 20 0 EIADMP C=CCOc1ccccc1C[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000065982051 1031657718 /nfs/dbraw/zinc/65/77/18/1031657718.db2.gz HQPMQNFRCUIRBW-UHFFFAOYSA-N 2 1 342.527 4.386 20 0 EIADMP Cc1cccnc1CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000449484603 1031791784 /nfs/dbraw/zinc/79/17/84/1031791784.db2.gz IGAFZNYFIKOGPE-FRIKZZABSA-N 2 1 349.522 4.108 20 0 EIADMP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc3ccccc3n2)CC1 ZINC000531956066 1031873717 /nfs/dbraw/zinc/87/37/17/1031873717.db2.gz TZNLVWIMHWCYHP-HTAPYJJXSA-N 2 1 337.511 4.368 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCn1cc[nH+]c1C ZINC000531964860 1031884030 /nfs/dbraw/zinc/88/40/30/1031884030.db2.gz ZTVCVBLWTUSSMQ-AWEZNQCLSA-N 2 1 340.496 4.283 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(OCc2cccc(C)c2)cc1 ZINC000531964829 1031885383 /nfs/dbraw/zinc/88/53/83/1031885383.db2.gz UBRRZZZBJCBEMA-GOSISDBHSA-N 2 1 349.478 4.430 20 0 EIADMP C[C@H]([C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@]2(CCSC2)C1 ZINC000453356544 1031886122 /nfs/dbraw/zinc/88/61/22/1031886122.db2.gz KWGXOJFLWIXNKH-HMXCVIKNSA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]([C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000453356544 1031886130 /nfs/dbraw/zinc/88/61/30/1031886130.db2.gz KWGXOJFLWIXNKH-HMXCVIKNSA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]([C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000453356544 1031886135 /nfs/dbraw/zinc/88/61/35/1031886135.db2.gz KWGXOJFLWIXNKH-HMXCVIKNSA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]([C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@]2(CCSC2)C1 ZINC000453356540 1031886176 /nfs/dbraw/zinc/88/61/76/1031886176.db2.gz KWGXOJFLWIXNKH-GIVPXCGWSA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]([C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000453356540 1031886180 /nfs/dbraw/zinc/88/61/80/1031886180.db2.gz KWGXOJFLWIXNKH-GIVPXCGWSA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]([C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000453356540 1031886185 /nfs/dbraw/zinc/88/61/85/1031886185.db2.gz KWGXOJFLWIXNKH-GIVPXCGWSA-N 2 1 344.568 4.116 20 0 EIADMP CC[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000531967857 1031889685 /nfs/dbraw/zinc/88/96/85/1031889685.db2.gz ZJNNTKHMSBGNEZ-JLJPHGGASA-N 2 1 328.422 4.476 20 0 EIADMP CC[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000531967857 1031889690 /nfs/dbraw/zinc/88/96/90/1031889690.db2.gz ZJNNTKHMSBGNEZ-JLJPHGGASA-N 2 1 328.422 4.476 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453389398 1031898111 /nfs/dbraw/zinc/89/81/11/1031898111.db2.gz CGRHHUOIUCUYQA-CQSZACIVSA-N 2 1 328.422 4.100 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000531970873 1031903217 /nfs/dbraw/zinc/90/32/17/1031903217.db2.gz ZDINZSKSVGJXEE-IHRRRGAJSA-N 2 1 345.314 4.081 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Br)c(F)c1 ZINC000453401358 1031936883 /nfs/dbraw/zinc/93/68/83/1031936883.db2.gz MSIRZNWMLDXLNR-GFCCVEGCSA-N 2 1 343.284 4.113 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1csc(-c2ccccc2F)n1 ZINC000453416386 1031951003 /nfs/dbraw/zinc/95/10/03/1031951003.db2.gz XMMUMLIGZXHUEB-CQSZACIVSA-N 2 1 347.503 4.474 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+]C[C@H]3C(C)=CCC[C@H]3C)CC2)oc1C ZINC000134186121 1031994531 /nfs/dbraw/zinc/99/45/31/1031994531.db2.gz RDOAYLQZCNPGCZ-UZLBHIALSA-N 2 1 345.531 4.085 20 0 EIADMP C[N@@H+](CCCC[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)C1CC1 ZINC000453597546 1032019177 /nfs/dbraw/zinc/01/91/77/1032019177.db2.gz OBWUOJSRXVPOFH-UHFFFAOYSA-N 2 1 349.931 4.428 20 0 EIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(Br)c(Cl)c1)C1CC1 ZINC000453599327 1032020316 /nfs/dbraw/zinc/02/03/16/1032020316.db2.gz QPWYAEDJXVSDRJ-UHFFFAOYSA-N 2 1 345.712 4.067 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccnc3ccccc23)CC1 ZINC000536629854 1032056661 /nfs/dbraw/zinc/05/66/61/1032056661.db2.gz MBEWNXRPSYVJPJ-UHFFFAOYSA-N 2 1 325.500 4.179 20 0 EIADMP C[N@H+]1CCC[C@@]2(CC[NH+](CCCOc3ccc4ccccc4c3)C2)C1 ZINC000549840767 1033295581 /nfs/dbraw/zinc/29/55/81/1033295581.db2.gz OBDIBUULPMCUHS-JOCHJYFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[NH+]1CCC[C@@]2(CC[N@H+](CCCOc3ccc4ccccc4c3)C2)C1 ZINC000549840767 1033295590 /nfs/dbraw/zinc/29/55/90/1033295590.db2.gz OBDIBUULPMCUHS-JOCHJYFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](CCCOc3ccc4ccccc4c3)C2)C1 ZINC000549840767 1033295596 /nfs/dbraw/zinc/29/55/96/1033295596.db2.gz OBDIBUULPMCUHS-JOCHJYFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[C@@]1(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000549843332 1033298424 /nfs/dbraw/zinc/29/84/24/1033298424.db2.gz JVWWOGFVWIFXLI-ZEQRLZLVSA-N 2 1 348.534 4.477 20 0 EIADMP CSCCCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000512633897 1033572713 /nfs/dbraw/zinc/57/27/13/1033572713.db2.gz AWGPDSDOTGQSFS-VAMGGRTRSA-N 2 1 332.557 4.020 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ncc(-c3ccccc3)o2)CC1 ZINC000052209447 1034477784 /nfs/dbraw/zinc/47/77/84/1034477784.db2.gz FVJPOPZYIJTLMI-UHFFFAOYSA-N 2 1 341.499 4.286 20 0 EIADMP C[C@@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C(F)(F)F)cc1 ZINC000513147696 1034655039 /nfs/dbraw/zinc/65/50/39/1034655039.db2.gz CKKYCLOISOLWRY-BXEVVDMOSA-N 2 1 340.433 4.366 20 0 EIADMP C[C@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C(F)(F)F)cc1 ZINC000513147699 1034656226 /nfs/dbraw/zinc/65/62/26/1034656226.db2.gz CKKYCLOISOLWRY-DTWYCDNDSA-N 2 1 340.433 4.366 20 0 EIADMP FC(F)(F)c1cccc(CCC[N@H+]2CCCC3(CC[NH2+]CC3)C2)c1 ZINC001204727481 1034704636 /nfs/dbraw/zinc/70/46/36/1034704636.db2.gz ARTOXNIHTUDFOI-UHFFFAOYSA-N 2 1 340.433 4.104 20 0 EIADMP C[N@H+](Cc1c(F)cccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501023248 1035353008 /nfs/dbraw/zinc/35/30/08/1035353008.db2.gz TWNYMCBMEIVZQQ-UHFFFAOYSA-N 2 1 347.865 4.223 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1cc(Br)cs1 ZINC000226391531 1035361555 /nfs/dbraw/zinc/36/15/55/1035361555.db2.gz FXEINBNGPOUCLH-GFCCVEGCSA-N 2 1 331.323 4.037 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000501380185 1035429892 /nfs/dbraw/zinc/42/98/92/1035429892.db2.gz CUIZLRKKNOWIDT-LTBFUDJGSA-N 2 1 338.417 4.183 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000501419515 1035441551 /nfs/dbraw/zinc/44/15/51/1035441551.db2.gz GZYHKHYRHXXEET-BAAYTWLHSA-N 2 1 326.406 4.040 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@H+]1C ZINC000501465712 1035449629 /nfs/dbraw/zinc/44/96/29/1035449629.db2.gz GLQWXKQJLVHTFW-QRWLVFNGSA-N 2 1 344.449 4.169 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420420618 1035575091 /nfs/dbraw/zinc/57/50/91/1035575091.db2.gz YAWLOXHRPIZJRC-NOLJZWGESA-N 2 1 347.890 4.281 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420420618 1035575108 /nfs/dbraw/zinc/57/51/08/1035575108.db2.gz YAWLOXHRPIZJRC-NOLJZWGESA-N 2 1 347.890 4.281 20 0 EIADMP CCCCc1ccc(-c2noc([C@@H]([NH3+])CCCC[NH2+]C(C)C)n2)cc1 ZINC001212144919 1035892308 /nfs/dbraw/zinc/89/23/08/1035892308.db2.gz HBMRALWETPISOO-SFHVURJKSA-N 2 1 344.503 4.247 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090595 1035940276 /nfs/dbraw/zinc/94/02/76/1035940276.db2.gz GHUSSRTXJLVXLT-RDTXWAMCSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090595 1035940294 /nfs/dbraw/zinc/94/02/94/1035940294.db2.gz GHUSSRTXJLVXLT-RDTXWAMCSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090595 1035940321 /nfs/dbraw/zinc/94/03/21/1035940321.db2.gz GHUSSRTXJLVXLT-RDTXWAMCSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090595 1035940333 /nfs/dbraw/zinc/94/03/33/1035940333.db2.gz GHUSSRTXJLVXLT-RDTXWAMCSA-N 2 1 332.488 4.326 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000502420479 1036202477 /nfs/dbraw/zinc/20/24/77/1036202477.db2.gz YNLNPXISQLMMLZ-FKVLARQCSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC23CCSCC3)CC[N@@H+]1Cc1ccccc1 ZINC000421388012 1036346145 /nfs/dbraw/zinc/34/61/45/1036346145.db2.gz SSFNQHQDPSIPOF-HOJAQTOUSA-N 2 1 344.568 4.162 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC23CCSCC3)CC[N@H+]1Cc1ccccc1 ZINC000421388012 1036346165 /nfs/dbraw/zinc/34/61/65/1036346165.db2.gz SSFNQHQDPSIPOF-HOJAQTOUSA-N 2 1 344.568 4.162 20 0 EIADMP C[N@H+](Cc1cccc(OCc2ccccc2)c1)CC1CC[NH+](C)CC1 ZINC000513750326 1036450370 /nfs/dbraw/zinc/45/03/70/1036450370.db2.gz GNELMPDOOQVYDE-UHFFFAOYSA-N 2 1 338.495 4.039 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502688540 1036482247 /nfs/dbraw/zinc/48/22/47/1036482247.db2.gz WYVSZTGKEQXXIC-CEXWTWQISA-N 2 1 346.563 4.407 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502729035 1036591646 /nfs/dbraw/zinc/59/16/46/1036591646.db2.gz VICITSWNRADEPX-ZWKOTPCHSA-N 2 1 332.536 4.161 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000502881363 1036766722 /nfs/dbraw/zinc/76/67/22/1036766722.db2.gz QKVGLKGXSJGKQX-FQEVSTJZSA-N 2 1 331.479 4.310 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000502881363 1036766737 /nfs/dbraw/zinc/76/67/37/1036766737.db2.gz QKVGLKGXSJGKQX-FQEVSTJZSA-N 2 1 331.479 4.310 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000061016359 1036782133 /nfs/dbraw/zinc/78/21/33/1036782133.db2.gz PTQAULFXUZKCHR-UHFFFAOYSA-N 2 1 338.495 4.230 20 0 EIADMP COC1([C@@H](C)[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)CCCC1 ZINC000421828656 1036786785 /nfs/dbraw/zinc/78/67/85/1036786785.db2.gz DSAGICYHLUPHPW-QZTJIDSGSA-N 2 1 330.516 4.149 20 0 EIADMP CN(c1ccccc1)c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000589837984 1036879876 /nfs/dbraw/zinc/87/98/76/1036879876.db2.gz OEAWLNDITAQATE-FCHUYYIVSA-N 2 1 335.495 4.171 20 0 EIADMP CN(c1ccccc1)c1ccc(C[NH2+][C@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000589837984 1036879878 /nfs/dbraw/zinc/87/98/78/1036879878.db2.gz OEAWLNDITAQATE-FCHUYYIVSA-N 2 1 335.495 4.171 20 0 EIADMP FC1(F)CCC(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)CC1 ZINC000503043872 1036883399 /nfs/dbraw/zinc/88/33/99/1036883399.db2.gz AUSUJBAESDVYOR-HSALFYBXSA-N 2 1 348.481 4.312 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C/C=C/c2ccncc2)C1 ZINC000486935528 1036905365 /nfs/dbraw/zinc/90/53/65/1036905365.db2.gz JKOJRLHJEKUGPQ-ZLHKHBAESA-N 2 1 335.495 4.117 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C/C=C/c2ccncc2)cc1 ZINC000486965470 1036908571 /nfs/dbraw/zinc/90/85/71/1036908571.db2.gz JGTXQNGCAIFUJG-FHHGHWCOSA-N 2 1 335.495 4.259 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cccc3[nH]ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000503123230 1036922149 /nfs/dbraw/zinc/92/21/49/1036922149.db2.gz RMWSXKGBFUCZLY-NQIIRXRSSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cccc3[nH]ccc32)CC[N@H+]1Cc1ccccc1 ZINC000503123230 1036922170 /nfs/dbraw/zinc/92/21/70/1036922170.db2.gz RMWSXKGBFUCZLY-NQIIRXRSSA-N 2 1 347.506 4.353 20 0 EIADMP COc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1F ZINC000253355716 1036924113 /nfs/dbraw/zinc/92/41/13/1036924113.db2.gz GLQOQHJBVSAVJY-KXBFYZLASA-N 2 1 348.487 4.069 20 0 EIADMP COc1cccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1F ZINC000253355716 1036924136 /nfs/dbraw/zinc/92/41/36/1036924136.db2.gz GLQOQHJBVSAVJY-KXBFYZLASA-N 2 1 348.487 4.069 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000272048002 1037086267 /nfs/dbraw/zinc/08/62/67/1037086267.db2.gz RIUBIRWGCDJFGR-VXSCBNMQSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000272048002 1037086276 /nfs/dbraw/zinc/08/62/76/1037086276.db2.gz RIUBIRWGCDJFGR-VXSCBNMQSA-N 2 1 344.543 4.223 20 0 EIADMP CCC(CC)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168415894 1037089445 /nfs/dbraw/zinc/08/94/45/1037089445.db2.gz FXQSHNKCXMHWAT-HMXCVIKNSA-N 2 1 332.507 4.444 20 0 EIADMP Cc1ccc(-c2cc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)on2)cc1 ZINC000590786389 1037166423 /nfs/dbraw/zinc/16/64/23/1037166423.db2.gz VEDQNLXFFBBEHI-UHFFFAOYSA-N 2 1 341.499 4.202 20 0 EIADMP C[C@H](N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccnc1Cl ZINC000272355880 1037170653 /nfs/dbraw/zinc/17/06/53/1037170653.db2.gz RJMMXOBPDPJWQW-BQFCYCMXSA-N 2 1 343.902 4.296 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)o1 ZINC000604415143 1037383067 /nfs/dbraw/zinc/38/30/67/1037383067.db2.gz XWZDHVCFMWGQSF-HNNXBMFYSA-N 2 1 330.447 4.216 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)o1 ZINC000604415096 1037383305 /nfs/dbraw/zinc/38/33/05/1037383305.db2.gz OAHFDVUXJNGCQP-HNNXBMFYSA-N 2 1 330.447 4.216 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000760831236 1037449337 /nfs/dbraw/zinc/44/93/37/1037449337.db2.gz XJUJRWLDEMORDH-IBGZPJMESA-N 2 1 325.500 4.222 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488423509 1037575238 /nfs/dbraw/zinc/57/52/38/1037575238.db2.gz AZEDIPMECBQYMP-BTHPGYMESA-N 2 1 346.584 4.407 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488423509 1037575248 /nfs/dbraw/zinc/57/52/48/1037575248.db2.gz AZEDIPMECBQYMP-BTHPGYMESA-N 2 1 346.584 4.407 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CS1 ZINC000488430806 1037590257 /nfs/dbraw/zinc/59/02/57/1037590257.db2.gz ZHFNGWDYEUDJLM-LMCOJAPRSA-N 2 1 332.557 4.159 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CS1 ZINC000488430806 1037590273 /nfs/dbraw/zinc/59/02/73/1037590273.db2.gz ZHFNGWDYEUDJLM-LMCOJAPRSA-N 2 1 332.557 4.159 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000573596133 1037595777 /nfs/dbraw/zinc/59/57/77/1037595777.db2.gz CXUZOHUXCCXLCQ-MJSCBBHESA-N 2 1 340.433 4.430 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000488547748 1037659394 /nfs/dbraw/zinc/65/93/94/1037659394.db2.gz SWQCUERTPJFSGT-GTAWCEEGSA-N 2 1 332.557 4.017 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000488547754 1037659571 /nfs/dbraw/zinc/65/95/71/1037659571.db2.gz SWQCUERTPJFSGT-RNQOJCNYSA-N 2 1 332.557 4.017 20 0 EIADMP C[C@H]([NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000488551033 1037661808 /nfs/dbraw/zinc/66/18/08/1037661808.db2.gz ZOHQJIUJKFPPCB-RNQOJCNYSA-N 2 1 346.584 4.407 20 0 EIADMP Cc1cc(C)c(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c(C)c1 ZINC000488571541 1037668644 /nfs/dbraw/zinc/66/86/44/1037668644.db2.gz STTYPOQFVNSGBI-QFIPXVFZSA-N 2 1 336.523 4.266 20 0 EIADMP C[C@H]([NH3+])[C@@H]1CC[N@@H+](Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000414663836 1037722655 /nfs/dbraw/zinc/72/26/55/1037722655.db2.gz RWETVPMXQOHTNH-DOTOQJQBSA-N 2 1 344.886 4.088 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000513788215 1037740443 /nfs/dbraw/zinc/74/04/43/1037740443.db2.gz MZURTVNXXXMGTR-IEBWSBKVSA-N 2 1 328.500 4.145 20 0 EIADMP c1ccc(C[N@@H+](Cc2cccc(C3CC3)c2)[C@H]2CCC[NH2+]CC2)nc1 ZINC000422551200 1037762433 /nfs/dbraw/zinc/76/24/33/1037762433.db2.gz DDZMMTMASLSWRP-QFIPXVFZSA-N 2 1 335.495 4.103 20 0 EIADMP c1ccc(C[N@H+](Cc2cccc(C3CC3)c2)[C@H]2CCC[NH2+]CC2)nc1 ZINC000422551200 1037762453 /nfs/dbraw/zinc/76/24/53/1037762453.db2.gz DDZMMTMASLSWRP-QFIPXVFZSA-N 2 1 335.495 4.103 20 0 EIADMP CC[C@@H](C(=O)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)[NH+](CC)CC ZINC000605425137 1037778922 /nfs/dbraw/zinc/77/89/22/1037778922.db2.gz WFQOCXCEMFBPLS-PXNSSMCTSA-N 2 1 345.531 4.120 20 0 EIADMP C[C@@H]1C[C@@H](C[N@H+]2CCc3sccc3[C@H]2c2cccs2)CC[NH2+]1 ZINC000414680352 1037793428 /nfs/dbraw/zinc/79/34/28/1037793428.db2.gz MYGTWSVJFFXDLF-GLJUWKHASA-N 2 1 332.538 4.145 20 0 EIADMP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C1CCN([C@H](C)c2ccccc2)CC1 ZINC000422740252 1037822388 /nfs/dbraw/zinc/82/23/88/1037822388.db2.gz BJZHZMNFODVQQN-KNKQGSTJSA-N 2 1 343.559 4.112 20 0 EIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CCCc3cc(OC(F)F)ccc32)c2ccccc21 ZINC000422834999 1037843684 /nfs/dbraw/zinc/84/36/84/1037843684.db2.gz XWWNJRYUTBTWAG-CEXWTWQISA-N 2 1 344.405 4.400 20 0 EIADMP Cc1cc(Br)cc(C)c1C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422831103 1037843967 /nfs/dbraw/zinc/84/39/67/1037843967.db2.gz WGYRSJKZHWNHBV-QZTJIDSGSA-N 2 1 345.284 4.300 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000422874197 1037857825 /nfs/dbraw/zinc/85/78/25/1037857825.db2.gz CGFMFZGQGORYSN-NLSFWIRASA-N 2 1 349.522 4.153 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000311123374 1037858969 /nfs/dbraw/zinc/85/89/69/1037858969.db2.gz HPZJHEKDDHEXNG-PGRDOPGGSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)c1cccc(OC(F)(F)F)c1 ZINC000422928649 1037872580 /nfs/dbraw/zinc/87/25/80/1037872580.db2.gz LVGQDLNBRIVMCG-MZPVMMEZSA-N 2 1 336.357 4.381 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC000423007217 1037898893 /nfs/dbraw/zinc/89/88/93/1037898893.db2.gz XCIZUZMXZAGSDI-IQWFGDOHSA-N 3 1 349.522 4.022 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2C[C@@H](N)c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC000423007217 1037898895 /nfs/dbraw/zinc/89/88/95/1037898895.db2.gz XCIZUZMXZAGSDI-IQWFGDOHSA-N 2 1 349.522 4.022 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2C[C@@H](N)c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC000423007217 1037898902 /nfs/dbraw/zinc/89/89/02/1037898902.db2.gz XCIZUZMXZAGSDI-IQWFGDOHSA-N 2 1 349.522 4.022 20 0 EIADMP c1ccc(C[N@@H+](Cc2ccc3ccccc3c2)[C@H]2CCC[NH2+]CC2)nc1 ZINC000414714047 1037936538 /nfs/dbraw/zinc/93/65/38/1037936538.db2.gz LLVFCQSNJFIYLP-QHCPKHFHSA-N 2 1 345.490 4.379 20 0 EIADMP c1ccc(C[N@H+](Cc2ccc3ccccc3c2)[C@H]2CCC[NH2+]CC2)nc1 ZINC000414714047 1037936551 /nfs/dbraw/zinc/93/65/51/1037936551.db2.gz LLVFCQSNJFIYLP-QHCPKHFHSA-N 2 1 345.490 4.379 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000503864801 1037950282 /nfs/dbraw/zinc/95/02/82/1037950282.db2.gz WHCQLJBKTOXWRK-APWZRJJASA-N 2 1 336.470 4.312 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2OC(F)F)cc1 ZINC000503928769 1038006097 /nfs/dbraw/zinc/00/60/97/1038006097.db2.gz MUCVAZNDGQENAY-FSPWUOQZSA-N 2 1 349.425 4.382 20 0 EIADMP Clc1ccc([C@H]2CC[C@@H]([NH2+]CCC[NH2+]Cc3cccnc3)C2)cc1 ZINC000423186584 1038018256 /nfs/dbraw/zinc/01/82/56/1038018256.db2.gz LBVSDVWEWPZJBB-AZUAARDMSA-N 2 1 343.902 4.141 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cc2ccccc2o1 ZINC000423193125 1038048575 /nfs/dbraw/zinc/04/85/75/1038048575.db2.gz WOXCAMJWAYTFBU-OAQYLSRUSA-N 2 1 337.467 4.294 20 0 EIADMP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423194006 1038050353 /nfs/dbraw/zinc/05/03/53/1038050353.db2.gz XXWFMYPOADAYQJ-CWRNSKLLSA-N 2 1 349.931 4.058 20 0 EIADMP C[N@H+](Cc1ccc(OCc2ccccc2)cc1)C[C@H]1CCC[NH+](C)C1 ZINC000607358216 1038077196 /nfs/dbraw/zinc/07/71/96/1038077196.db2.gz RMRAEZMZAVFTPA-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP C[NH+](Cc1ccc(OCc2ccccc2)cc1)C[C@H]1CCC[N@H+](C)C1 ZINC000607358216 1038077217 /nfs/dbraw/zinc/07/72/17/1038077217.db2.gz RMRAEZMZAVFTPA-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP C[NH+](Cc1ccc(OCc2ccccc2)cc1)C[C@H]1CCC[N@@H+](C)C1 ZINC000607358216 1038077247 /nfs/dbraw/zinc/07/72/47/1038077247.db2.gz RMRAEZMZAVFTPA-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Br)c(F)c1 ZINC000489489139 1038080998 /nfs/dbraw/zinc/08/09/98/1038080998.db2.gz YSWKSRZVKYCRKM-YUTCNCBUSA-N 2 1 343.284 4.112 20 0 EIADMP CC(C)([NH3+])C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423287825 1038093414 /nfs/dbraw/zinc/09/34/14/1038093414.db2.gz OSYNGJGBNXETQD-CYBMUJFWSA-N 2 1 335.904 4.168 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@H]3C1)CCCO2 ZINC000489557420 1038115556 /nfs/dbraw/zinc/11/55/56/1038115556.db2.gz YMMGWIIWAFEFKI-RLFYNMQTSA-N 2 1 334.891 4.079 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CCCO2 ZINC000489557420 1038115590 /nfs/dbraw/zinc/11/55/90/1038115590.db2.gz YMMGWIIWAFEFKI-RLFYNMQTSA-N 2 1 334.891 4.079 20 0 EIADMP CCCC[C@@H](C[NH3+])[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423300563 1038130314 /nfs/dbraw/zinc/13/03/14/1038130314.db2.gz RVYXQEZZFNBWTG-OALUTQOASA-N 2 1 331.891 4.126 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCCOc3c(Cl)cc(C)cc32)C1 ZINC000489585737 1038132216 /nfs/dbraw/zinc/13/22/16/1038132216.db2.gz AXIXHKAHGGQJLD-MAUKXSAKSA-N 2 1 336.907 4.184 20 0 EIADMP FC(F)Oc1ccc([C@H]([NH2+]CC[C@H]2CCC[NH2+]2)c2ccccc2)cc1 ZINC000423364537 1038175436 /nfs/dbraw/zinc/17/54/36/1038175436.db2.gz OSJCWGXBBHXUEB-IEBWSBKVSA-N 2 1 346.421 4.109 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000423385006 1038193023 /nfs/dbraw/zinc/19/30/23/1038193023.db2.gz QTDRODSTLWSJGN-NFAWXSAZSA-N 2 1 334.410 4.232 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)CC[N@H+]1C ZINC000608061535 1038448190 /nfs/dbraw/zinc/44/81/90/1038448190.db2.gz JLQCDGZVCNUQEF-GHTZIAJQSA-N 2 1 347.506 4.262 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000608067801 1038483182 /nfs/dbraw/zinc/48/31/82/1038483182.db2.gz TVURLRNJGCECBL-XHDPSFHLSA-N 2 1 334.813 4.179 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000608067801 1038483376 /nfs/dbraw/zinc/48/33/76/1038483376.db2.gz TVURLRNJGCECBL-XHDPSFHLSA-N 2 1 334.813 4.179 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](Cc2ccncc2)c2cccs2)C1 ZINC000424311949 1038800179 /nfs/dbraw/zinc/80/01/79/1038800179.db2.gz LNZKKMFZBSLTNU-RTBURBONSA-N 2 1 343.540 4.137 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000539062196 1038807931 /nfs/dbraw/zinc/80/79/31/1038807931.db2.gz UAVTUBRMVJENGW-PBBBXTDZSA-N 2 1 346.518 4.073 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccccc2OC(F)F)C1 ZINC000539045518 1038810559 /nfs/dbraw/zinc/81/05/59/1038810559.db2.gz BCKMFSDKLOMZMP-HZPDHXFCSA-N 2 1 340.458 4.307 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccccc2OC(F)F)C1 ZINC000539045518 1038810560 /nfs/dbraw/zinc/81/05/60/1038810560.db2.gz BCKMFSDKLOMZMP-HZPDHXFCSA-N 2 1 340.458 4.307 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@H+](C)C[C@@H](C[NH3+])c1ccc(F)cc1 ZINC000424306878 1038814489 /nfs/dbraw/zinc/81/44/89/1038814489.db2.gz WESBYVAKFLBRDK-DZGCQCFKSA-N 2 1 343.471 4.171 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@@H+](C)C[C@@H](C[NH3+])c1ccc(F)cc1 ZINC000424306878 1038814493 /nfs/dbraw/zinc/81/44/93/1038814493.db2.gz WESBYVAKFLBRDK-DZGCQCFKSA-N 2 1 343.471 4.171 20 0 EIADMP Clc1ccc(SCC[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000608499830 1038839816 /nfs/dbraw/zinc/83/98/16/1038839816.db2.gz YMCXKHMUMZVUSP-INIZCTEOSA-N 2 1 338.948 4.240 20 0 EIADMP Clc1ccc(SCC[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000608499830 1038839818 /nfs/dbraw/zinc/83/98/18/1038839818.db2.gz YMCXKHMUMZVUSP-INIZCTEOSA-N 2 1 338.948 4.240 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@H](C)c3c2cccc3C)[C@@H](C)C1 ZINC000504921120 1038845010 /nfs/dbraw/zinc/84/50/10/1038845010.db2.gz QXKPVXUODWIJDB-JYAXBFRTSA-N 2 1 344.543 4.270 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000504911581 1038847871 /nfs/dbraw/zinc/84/78/71/1038847871.db2.gz IOXDDFXEJSVCAA-MDMXATFFSA-N 2 1 325.500 4.318 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)[C@H](C)c1ccccc1C(F)(F)F ZINC000504927759 1038857941 /nfs/dbraw/zinc/85/79/41/1038857941.db2.gz UESBNPCWUKTUSI-UONOGXRCSA-N 2 1 340.433 4.414 20 0 EIADMP CC(C)(C[NH2+]Cc1cnc(-c2cccs2)s1)C[NH+]1CCCC1 ZINC000480933537 1038882510 /nfs/dbraw/zinc/88/25/10/1038882510.db2.gz KYQKDXBKFNZCSQ-UHFFFAOYSA-N 2 1 335.542 4.083 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)C[C@@H]1C ZINC000537614625 1038889986 /nfs/dbraw/zinc/88/99/86/1038889986.db2.gz MKHNEXBWDIZJJS-HOTGVXAUSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)C[C@@H]1C ZINC000537614625 1038889988 /nfs/dbraw/zinc/88/99/88/1038889988.db2.gz MKHNEXBWDIZJJS-HOTGVXAUSA-N 2 1 330.447 4.390 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3ccccc3F)o2)C[C@@H]1C ZINC000537614625 1038889989 /nfs/dbraw/zinc/88/99/89/1038889989.db2.gz MKHNEXBWDIZJJS-HOTGVXAUSA-N 2 1 330.447 4.390 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)C[C@@H]1C ZINC000537614625 1038889997 /nfs/dbraw/zinc/88/99/97/1038889997.db2.gz MKHNEXBWDIZJJS-HOTGVXAUSA-N 2 1 330.447 4.390 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@H](Oc3ccc(Cl)cc3)C2)CC1 ZINC001168327415 1038916862 /nfs/dbraw/zinc/91/68/62/1038916862.db2.gz NFAUTDHWRGNZDU-TVPLGVNVSA-N 2 1 336.907 4.056 20 0 EIADMP C[NH+](C)C1CCC([N@@H+]2CC[C@H](Cc3ccccc3)C(F)(F)C2)CC1 ZINC001168328736 1038947434 /nfs/dbraw/zinc/94/74/34/1038947434.db2.gz BWMLPZGKZVAYPQ-LMDPOFIKSA-N 2 1 336.470 4.059 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CC[C@H](Cc3ccccc3)C(F)(F)C2)CC1 ZINC001168328736 1038947473 /nfs/dbraw/zinc/94/74/73/1038947473.db2.gz BWMLPZGKZVAYPQ-LMDPOFIKSA-N 2 1 336.470 4.059 20 0 EIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537622405 1038987669 /nfs/dbraw/zinc/98/76/69/1038987669.db2.gz XZRSIVPZWRWOEP-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537622405 1038987689 /nfs/dbraw/zinc/98/76/89/1038987689.db2.gz XZRSIVPZWRWOEP-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537622405 1038987707 /nfs/dbraw/zinc/98/77/07/1038987707.db2.gz XZRSIVPZWRWOEP-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537622405 1038987726 /nfs/dbraw/zinc/98/77/26/1038987726.db2.gz XZRSIVPZWRWOEP-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000481037765 1038988233 /nfs/dbraw/zinc/98/82/33/1038988233.db2.gz MXZOEKCCSCVWBB-LRDDRELGSA-N 2 1 327.299 4.302 20 0 EIADMP COc1ccc(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000537629484 1039084967 /nfs/dbraw/zinc/08/49/67/1039084967.db2.gz IVOBBHDREQHQQH-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000537629484 1039084983 /nfs/dbraw/zinc/08/49/83/1039084983.db2.gz IVOBBHDREQHQQH-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000537629484 1039085005 /nfs/dbraw/zinc/08/50/05/1039085005.db2.gz IVOBBHDREQHQQH-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000537629484 1039085024 /nfs/dbraw/zinc/08/50/24/1039085024.db2.gz IVOBBHDREQHQQH-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP CCCOc1ccc(CN(C)[C@H]2CC[N@@H+](CC)[C@H](C)C2)cc1OCC ZINC000552071108 1039098769 /nfs/dbraw/zinc/09/87/69/1039098769.db2.gz PTRQOOFOOMKJQX-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP CCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)cc1OCC ZINC000552071108 1039098787 /nfs/dbraw/zinc/09/87/87/1039098787.db2.gz PTRQOOFOOMKJQX-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP CCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)cc1OCC ZINC000552071108 1039098808 /nfs/dbraw/zinc/09/88/08/1039098808.db2.gz PTRQOOFOOMKJQX-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC[N@H+]1C ZINC000477855752 1039136665 /nfs/dbraw/zinc/13/66/65/1039136665.db2.gz IIFFFLGGDGYIIG-SMDDNHRTSA-N 2 1 340.298 4.090 20 0 EIADMP CSCc1cccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550795725 1039300785 /nfs/dbraw/zinc/30/07/85/1039300785.db2.gz XBCGODVDJSZLJG-SFTDATJTSA-N 2 1 340.536 4.475 20 0 EIADMP CSCc1cccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550795725 1039300808 /nfs/dbraw/zinc/30/08/08/1039300808.db2.gz XBCGODVDJSZLJG-SFTDATJTSA-N 2 1 340.536 4.475 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc(Cl)ccc1OC ZINC000481326135 1039301070 /nfs/dbraw/zinc/30/10/70/1039301070.db2.gz YLUKERIDCJHWMK-GOSISDBHSA-N 2 1 336.907 4.264 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)CC[N@@H+]1C ZINC000513830996 1039311022 /nfs/dbraw/zinc/31/10/22/1039311022.db2.gz IGXRHLLXUZDFMM-AOIWGVFYSA-N 2 1 328.500 4.285 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)CC[N@H+]1C ZINC000513830996 1039311037 /nfs/dbraw/zinc/31/10/37/1039311037.db2.gz IGXRHLLXUZDFMM-AOIWGVFYSA-N 2 1 328.500 4.285 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cccc(OC3CCCC3)c2)C[C@H]1C ZINC000537634896 1039340907 /nfs/dbraw/zinc/34/09/07/1039340907.db2.gz YIJWXQGPPRYHIS-MJGOQNOKSA-N 2 1 330.516 4.313 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(OC3CCCC3)c2)C[C@H]1C ZINC000537634896 1039340954 /nfs/dbraw/zinc/34/09/54/1039340954.db2.gz YIJWXQGPPRYHIS-MJGOQNOKSA-N 2 1 330.516 4.313 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(OC3CCCC3)c2)C[C@H]1C ZINC000537634896 1039340965 /nfs/dbraw/zinc/34/09/65/1039340965.db2.gz YIJWXQGPPRYHIS-MJGOQNOKSA-N 2 1 330.516 4.313 20 0 EIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000481437266 1039411272 /nfs/dbraw/zinc/41/12/72/1039411272.db2.gz PSCSWKLSIACWAN-CYBMUJFWSA-N 2 1 335.561 4.417 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)[C@@H]1CCC[NH2+]C1 ZINC000414846922 1039578786 /nfs/dbraw/zinc/57/87/86/1039578786.db2.gz FLQNREGUAAHYGH-UONOGXRCSA-N 2 1 341.480 4.034 20 0 EIADMP COc1ccc2oc(C[NH2+]CCCC[N@H+]3CCC[C@H](C)C3)cc2c1 ZINC000478349065 1039687323 /nfs/dbraw/zinc/68/73/23/1039687323.db2.gz ZJGWGKJZWZZMMZ-INIZCTEOSA-N 2 1 330.472 4.043 20 0 EIADMP c1cc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc(-c2ccncc2)c1 ZINC000093563942 1039715968 /nfs/dbraw/zinc/71/59/68/1039715968.db2.gz ALWGTUVAHBOEPX-JOCHJYFZSA-N 2 1 335.495 4.199 20 0 EIADMP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000481680173 1039720457 /nfs/dbraw/zinc/72/04/57/1039720457.db2.gz XOXBENQXUYFKLS-LNRIEFBSSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000481680173 1039720472 /nfs/dbraw/zinc/72/04/72/1039720472.db2.gz XOXBENQXUYFKLS-LNRIEFBSSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)C(c1ccccc1)c1ccccc1 ZINC000122851408 1039800220 /nfs/dbraw/zinc/80/02/20/1039800220.db2.gz QYVVJOQPVXEYNF-SFHVURJKSA-N 2 1 334.507 4.423 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCSc2ccccc2)C[C@@H]1c1ccccc1 ZINC000550999048 1039863160 /nfs/dbraw/zinc/86/31/60/1039863160.db2.gz GZWIYUXCJVPHDP-UYAOXDASSA-N 2 1 326.509 4.204 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCSc2ccccc2)C[C@@H]1c1ccccc1 ZINC000550999048 1039863158 /nfs/dbraw/zinc/86/31/58/1039863158.db2.gz GZWIYUXCJVPHDP-UYAOXDASSA-N 2 1 326.509 4.204 20 0 EIADMP CC(C)[N@@H+](C)CC1CCN(Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000535081888 1039954650 /nfs/dbraw/zinc/95/46/50/1039954650.db2.gz KMEHYOACYNGBOV-UHFFFAOYSA-N 2 1 346.412 4.397 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000535081888 1039954658 /nfs/dbraw/zinc/95/46/58/1039954658.db2.gz KMEHYOACYNGBOV-UHFFFAOYSA-N 2 1 346.412 4.397 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000535081888 1039954675 /nfs/dbraw/zinc/95/46/75/1039954675.db2.gz KMEHYOACYNGBOV-UHFFFAOYSA-N 2 1 346.412 4.397 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCO1 ZINC000551147352 1040007588 /nfs/dbraw/zinc/00/75/88/1040007588.db2.gz BWVJFXLBJGDXPS-NCYKPQTJSA-N 2 1 330.516 4.005 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCO1 ZINC000551147352 1040007606 /nfs/dbraw/zinc/00/76/06/1040007606.db2.gz BWVJFXLBJGDXPS-NCYKPQTJSA-N 2 1 330.516 4.005 20 0 EIADMP Fc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000482117256 1040017069 /nfs/dbraw/zinc/01/70/69/1040017069.db2.gz CFYYPEDEADZPKH-YWZLYKJASA-N 2 1 344.499 4.376 20 0 EIADMP Fc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000482117256 1040017091 /nfs/dbraw/zinc/01/70/91/1040017091.db2.gz CFYYPEDEADZPKH-YWZLYKJASA-N 2 1 344.499 4.376 20 0 EIADMP c1[nH+]c(C2CC[NH+](C[C@@H]3C[C@H]3c3ccccc3)CC2)n2c1CCCC2 ZINC000435059464 1040041450 /nfs/dbraw/zinc/04/14/50/1040041450.db2.gz PKHKKSPSKQUKKT-FPOVZHCZSA-N 2 1 335.495 4.203 20 0 EIADMP c1[nH+]c(C2CC[NH+](C[C@H]3C[C@H]3c3ccccc3)CC2)n2c1CCCC2 ZINC000435059463 1040041669 /nfs/dbraw/zinc/04/16/69/1040041669.db2.gz PKHKKSPSKQUKKT-CTNGQTDRSA-N 2 1 335.495 4.203 20 0 EIADMP C[C@H](C[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)C[NH+]1CCCC1 ZINC000551205971 1040061084 /nfs/dbraw/zinc/06/10/84/1040061084.db2.gz SXGNSYWAIFLHKA-CQSZACIVSA-N 2 1 349.931 4.285 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+][C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482273002 1040130597 /nfs/dbraw/zinc/13/05/97/1040130597.db2.gz VNRVPJKRKDVMGN-INIZCTEOSA-N 2 1 345.531 4.079 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H](CO)CCC(C)(C)C)CC1 ZINC000551276301 1040135360 /nfs/dbraw/zinc/13/53/60/1040135360.db2.gz BCCSGFFCIAKWLJ-NYLDSWQDSA-N 2 1 346.559 4.206 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1OC(F)F ZINC000482331043 1040181118 /nfs/dbraw/zinc/18/11/18/1040181118.db2.gz VLRHBSDHGGUXFG-RDJZCZTQSA-N 2 1 340.458 4.449 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1OC(F)F ZINC000482331043 1040181130 /nfs/dbraw/zinc/18/11/30/1040181130.db2.gz VLRHBSDHGGUXFG-RDJZCZTQSA-N 2 1 340.458 4.449 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccccc2OC(F)(F)F)C1 ZINC000482341204 1040187513 /nfs/dbraw/zinc/18/75/13/1040187513.db2.gz CWSYSTDUTCLBEU-CABCVRRESA-N 2 1 344.421 4.356 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccccc2OC(F)(F)F)C1 ZINC000482341204 1040187540 /nfs/dbraw/zinc/18/75/40/1040187540.db2.gz CWSYSTDUTCLBEU-CABCVRRESA-N 2 1 344.421 4.356 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000482360658 1040200723 /nfs/dbraw/zinc/20/07/23/1040200723.db2.gz PWNPKNDLFDULPH-CABCVRRESA-N 2 1 344.421 4.356 20 0 EIADMP C[C@@H](NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441686 1040248832 /nfs/dbraw/zinc/24/88/32/1040248832.db2.gz VPIMHNQDQPTRNK-SJLPKXTDSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441686 1040248849 /nfs/dbraw/zinc/24/88/49/1040248849.db2.gz VPIMHNQDQPTRNK-SJLPKXTDSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441686 1040248867 /nfs/dbraw/zinc/24/88/67/1040248867.db2.gz VPIMHNQDQPTRNK-SJLPKXTDSA-N 2 1 344.449 4.180 20 0 EIADMP Cc1ccc(O[C@H](C)C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000565670188 1040296565 /nfs/dbraw/zinc/29/65/65/1040296565.db2.gz JFEHZXADLMEUNC-KAGYGMCKSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1ccc(O[C@H](C)C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000565670188 1040296577 /nfs/dbraw/zinc/29/65/77/1040296577.db2.gz JFEHZXADLMEUNC-KAGYGMCKSA-N 2 1 338.495 4.187 20 0 EIADMP c1ccc(C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C2CC2)cc1 ZINC000479462205 1040369236 /nfs/dbraw/zinc/36/92/36/1040369236.db2.gz FPIKYDSQQWXYQU-JTHBVZDNSA-N 2 1 334.507 4.119 20 0 EIADMP CC(C)Oc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1Cl ZINC000551541665 1040379125 /nfs/dbraw/zinc/37/91/25/1040379125.db2.gz UONPURGBOZSWTA-AWEZNQCLSA-N 2 1 336.907 4.405 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccccc1F ZINC000479561979 1040473305 /nfs/dbraw/zinc/47/33/05/1040473305.db2.gz WIVNWVIFVDGKTB-GCJKJVERSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccccc1F ZINC000479561979 1040473319 /nfs/dbraw/zinc/47/33/19/1040473319.db2.gz WIVNWVIFVDGKTB-GCJKJVERSA-N 2 1 340.486 4.259 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCc4ccc(Cl)cc43)CC2)[nH+]c1 ZINC000479578999 1040488461 /nfs/dbraw/zinc/48/84/61/1040488461.db2.gz MTHXNZMOVUCKOK-IBGZPJMESA-N 2 1 341.886 4.289 20 0 EIADMP c1csc([C@@H]2c3ccsc3CC[N@@H+]2CCC2CC[NH2+]CC2)c1 ZINC000479683160 1040568590 /nfs/dbraw/zinc/56/85/90/1040568590.db2.gz DTEZGISEFAUEHD-SFHVURJKSA-N 2 1 332.538 4.147 20 0 EIADMP CCCOc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000553877238 1040604971 /nfs/dbraw/zinc/60/49/71/1040604971.db2.gz OGSVLKMVEOHMRY-UHFFFAOYSA-N 2 1 330.516 4.362 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cc1 ZINC000668172368 1040605591 /nfs/dbraw/zinc/60/55/91/1040605591.db2.gz MCQRXBFJLKWDCD-MOPGFXCFSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)cc1 ZINC000668172368 1040605598 /nfs/dbraw/zinc/60/55/98/1040605598.db2.gz MCQRXBFJLKWDCD-MOPGFXCFSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)cc1 ZINC000668172368 1040605607 /nfs/dbraw/zinc/60/56/07/1040605607.db2.gz MCQRXBFJLKWDCD-MOPGFXCFSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)cc1 ZINC000668194368 1040643296 /nfs/dbraw/zinc/64/32/96/1040643296.db2.gz GMMAYUGHHPIXDZ-FQEVSTJZSA-N 2 1 341.524 4.036 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1 ZINC000668194368 1040643303 /nfs/dbraw/zinc/64/33/03/1040643303.db2.gz GMMAYUGHHPIXDZ-FQEVSTJZSA-N 2 1 341.524 4.036 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1 ZINC000668194368 1040643310 /nfs/dbraw/zinc/64/33/10/1040643310.db2.gz GMMAYUGHHPIXDZ-FQEVSTJZSA-N 2 1 341.524 4.036 20 0 EIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCc2ccc(F)cc21 ZINC000483088703 1040698151 /nfs/dbraw/zinc/69/81/51/1040698151.db2.gz LILZWBICRUBQOU-PGRDOPGGSA-N 2 1 338.470 4.267 20 0 EIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CCc2ccc(F)cc21 ZINC000483088703 1040698174 /nfs/dbraw/zinc/69/81/74/1040698174.db2.gz LILZWBICRUBQOU-PGRDOPGGSA-N 2 1 338.470 4.267 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000483179005 1040746321 /nfs/dbraw/zinc/74/63/21/1040746321.db2.gz AXSOMXGPNVMJSA-IJXRJRJASA-N 2 1 332.557 4.161 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000483179005 1040746337 /nfs/dbraw/zinc/74/63/37/1040746337.db2.gz AXSOMXGPNVMJSA-IJXRJRJASA-N 2 1 332.557 4.161 20 0 EIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccccc2OC2CCCC2)C1 ZINC000539849126 1040838122 /nfs/dbraw/zinc/83/81/22/1040838122.db2.gz MKFLTZBIDNKMLE-IBGZPJMESA-N 2 1 342.527 4.172 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccccc2OC2CCCC2)C1 ZINC000539849126 1040838124 /nfs/dbraw/zinc/83/81/24/1040838124.db2.gz MKFLTZBIDNKMLE-IBGZPJMESA-N 2 1 342.527 4.172 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccccc2OC2CCCC2)C1 ZINC000539849126 1040838130 /nfs/dbraw/zinc/83/81/30/1040838130.db2.gz MKFLTZBIDNKMLE-IBGZPJMESA-N 2 1 342.527 4.172 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccccc2OC2CCCC2)C1 ZINC000539849126 1040838134 /nfs/dbraw/zinc/83/81/34/1040838134.db2.gz MKFLTZBIDNKMLE-IBGZPJMESA-N 2 1 342.527 4.172 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCOc3ccc4ccccc4c3)CC[C@H]21 ZINC000483479434 1040871696 /nfs/dbraw/zinc/87/16/96/1040871696.db2.gz DWSGJCBCXCTQIF-IFMALSPDSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCOc3ccc4ccccc4c3)CC[C@H]21 ZINC000483479434 1040871704 /nfs/dbraw/zinc/87/17/04/1040871704.db2.gz DWSGJCBCXCTQIF-IFMALSPDSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCOc3ccc4ccccc4c3)CC[C@H]21 ZINC000483479434 1040871708 /nfs/dbraw/zinc/87/17/08/1040871708.db2.gz DWSGJCBCXCTQIF-IFMALSPDSA-N 2 1 338.495 4.025 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)[C@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000480033444 1040878297 /nfs/dbraw/zinc/87/82/97/1040878297.db2.gz GBJVOFGSTVGINV-STQMWFEESA-N 2 1 345.314 4.223 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1cncs1 ZINC000537941597 1040905728 /nfs/dbraw/zinc/90/57/28/1040905728.db2.gz XLEMBIUWVDPEBJ-BQFCYCMXSA-N 2 1 329.513 4.094 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000537952084 1040920110 /nfs/dbraw/zinc/92/01/10/1040920110.db2.gz PJKBCEQAMVFONV-AVRDEDQJSA-N 2 1 338.495 4.004 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(COc2ccccc2)cc1 ZINC000537988284 1040965372 /nfs/dbraw/zinc/96/53/72/1040965372.db2.gz WHISYYCMHTXXKA-KGVIQGDOSA-N 2 1 338.495 4.084 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000483734614 1040985510 /nfs/dbraw/zinc/98/55/10/1040985510.db2.gz WERCEWPDBOMWPZ-NUEKZKHPSA-N 2 1 326.937 4.283 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000483734614 1040985534 /nfs/dbraw/zinc/98/55/34/1040985534.db2.gz WERCEWPDBOMWPZ-NUEKZKHPSA-N 2 1 326.937 4.283 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000379740223 1040990113 /nfs/dbraw/zinc/99/01/13/1040990113.db2.gz HWPIKSPXGYGELJ-WIYYLYMNSA-N 2 1 326.459 4.389 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000480173858 1041035532 /nfs/dbraw/zinc/03/55/32/1041035532.db2.gz ZUWIBXUXWPKBEV-QGZVFWFLSA-N 2 1 342.405 4.037 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436270845 1041041885 /nfs/dbraw/zinc/04/18/85/1041041885.db2.gz BZLAJGWPPLYWJC-UHFFFAOYSA-N 2 1 339.458 4.437 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@H](C)C1 ZINC000436293356 1041059367 /nfs/dbraw/zinc/05/93/67/1041059367.db2.gz CWRYXMKBPIFSNM-UWIFEVILSA-N 2 1 340.433 4.271 20 0 EIADMP FC(F)(F)C1CCC([NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)CC1 ZINC000436294414 1041061153 /nfs/dbraw/zinc/06/11/53/1041061153.db2.gz ORBPGJCXCTWBLN-VMBOVVBDSA-N 2 1 332.454 4.494 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)CCCC(F)(F)F)CC2)[nH+]1 ZINC000480227681 1041097183 /nfs/dbraw/zinc/09/71/83/1041097183.db2.gz IYIARDOEESPBMP-ZDUSSCGKSA-N 2 1 329.410 4.070 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(OCC(F)(F)F)cc1 ZINC000538163080 1041106879 /nfs/dbraw/zinc/10/68/79/1041106879.db2.gz PVHRFOXCJHKESP-ZBFHGGJFSA-N 2 1 344.421 4.153 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)[C@H](C)C1 ZINC000667666259 1041240029 /nfs/dbraw/zinc/24/00/29/1041240029.db2.gz HJKDVEFSROVGCN-DNVCBOLYSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3scnc3C)cc2)[C@H](C)C1 ZINC000667666259 1041240042 /nfs/dbraw/zinc/24/00/42/1041240042.db2.gz HJKDVEFSROVGCN-DNVCBOLYSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(-c3scnc3C)cc2)[C@H](C)C1 ZINC000667666259 1041240058 /nfs/dbraw/zinc/24/00/58/1041240058.db2.gz HJKDVEFSROVGCN-DNVCBOLYSA-N 2 1 343.540 4.281 20 0 EIADMP C[C@@H]([NH2+]C1(C[NH2+][C@@H]2CCC23CCOCC3)CCCC1)c1ccccc1 ZINC000554559549 1041245579 /nfs/dbraw/zinc/24/55/79/1041245579.db2.gz DFEYIPKKNDJOLT-UYAOXDASSA-N 2 1 342.527 4.199 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H](C)Oc2ccccc2)cc1 ZINC000540183726 1041247608 /nfs/dbraw/zinc/24/76/08/1041247608.db2.gz SWAUZAVGCZOJRE-IRXDYDNUSA-N 2 1 335.451 4.299 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccccc1OC(F)(F)F ZINC000484487181 1041258129 /nfs/dbraw/zinc/25/81/29/1041258129.db2.gz MFYLABSGJZVQQK-BFHYXJOUSA-N 2 1 330.394 4.109 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cc(F)ccc1F ZINC000484471972 1041267686 /nfs/dbraw/zinc/26/76/86/1041267686.db2.gz JAVFSMHULNLQSC-KKSFZXQISA-N 2 1 344.449 4.008 20 0 EIADMP CSc1ccccc1[C@@H](C)[NH2+]C1CCN(c2cccc(C)[nH+]2)CC1 ZINC000194894315 1041281820 /nfs/dbraw/zinc/28/18/20/1041281820.db2.gz ASMFUGKLHGBZHF-MRXNPFEDSA-N 2 1 341.524 4.432 20 0 EIADMP Cc1cccc(OCC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463072629 1041318440 /nfs/dbraw/zinc/31/84/40/1041318440.db2.gz RAKDZKVTZMFKDX-PZJWPPBQSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1cccc(OCC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463072629 1041318458 /nfs/dbraw/zinc/31/84/58/1041318458.db2.gz RAKDZKVTZMFKDX-PZJWPPBQSA-N 2 1 338.495 4.017 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)CC1 ZINC000538408323 1041324372 /nfs/dbraw/zinc/32/43/72/1041324372.db2.gz XUZLALRVQFYHCL-LJQANCHMSA-N 2 1 326.484 4.065 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)C)C1 ZINC000540261239 1041329746 /nfs/dbraw/zinc/32/97/46/1041329746.db2.gz XIANTHRQDXOUMZ-YOEHRIQHSA-N 2 1 328.422 4.334 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C[C@@H]2CCC[N@@H+](C)C2)c2cccc(F)c2)c1 ZINC000554725210 1041351982 /nfs/dbraw/zinc/35/19/82/1041351982.db2.gz PPYKYJGZXBXLJN-LAUBAEHRSA-N 2 1 326.459 4.155 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)c2cccc(F)c2)c1 ZINC000554725210 1041351994 /nfs/dbraw/zinc/35/19/94/1041351994.db2.gz PPYKYJGZXBXLJN-LAUBAEHRSA-N 2 1 326.459 4.155 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCOC2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000463140789 1041359158 /nfs/dbraw/zinc/35/91/58/1041359158.db2.gz IILQDPBXVWTRJA-TZIWHRDSSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCOC2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000463140789 1041359172 /nfs/dbraw/zinc/35/91/72/1041359172.db2.gz IILQDPBXVWTRJA-TZIWHRDSSA-N 2 1 344.543 4.369 20 0 EIADMP CCOc1cc(C)ccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000484603810 1041360872 /nfs/dbraw/zinc/36/08/72/1041360872.db2.gz IZSCAYKAWBFVJW-UHFFFAOYSA-N 2 1 330.516 4.280 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463146463 1041368525 /nfs/dbraw/zinc/36/85/25/1041368525.db2.gz BVMHKLPJZOLJGL-PGRDOPGGSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463146463 1041368539 /nfs/dbraw/zinc/36/85/39/1041368539.db2.gz BVMHKLPJZOLJGL-PGRDOPGGSA-N 2 1 340.486 4.401 20 0 EIADMP CC[NH+](CC)[C@H](C[NH2+]C1CCN(c2ccccc2)CC1)CC(C)C ZINC000463131851 1041368919 /nfs/dbraw/zinc/36/89/19/1041368919.db2.gz LQVFHKPBAPJJIE-NRFANRHFSA-N 2 1 331.548 4.002 20 0 EIADMP CC(C)[C@H](C[NH2+]C1CCN(c2ccccc2)CC1)[NH+]1CCC(C)CC1 ZINC000463136612 1041372770 /nfs/dbraw/zinc/37/27/70/1041372770.db2.gz FXHJMIYTWVIJJT-QFIPXVFZSA-N 2 1 343.559 4.002 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463138086 1041372969 /nfs/dbraw/zinc/37/29/69/1041372969.db2.gz UNOZMODIRBJRIK-UWJYYQICSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463138086 1041372976 /nfs/dbraw/zinc/37/29/76/1041372976.db2.gz UNOZMODIRBJRIK-UWJYYQICSA-N 2 1 326.459 4.011 20 0 EIADMP COc1cc([C@H](C)[NH2+]CC[C@H]2CCC[N@H+]2C)ccc1OC1CCCC1 ZINC000540352018 1041391616 /nfs/dbraw/zinc/39/16/16/1041391616.db2.gz KZDFSQHVDZVDHQ-FUHWJXTLSA-N 2 1 346.515 4.152 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]2Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463190110 1041406625 /nfs/dbraw/zinc/40/66/25/1041406625.db2.gz IADGPQJUGRINTR-HWHRFOGPSA-N 2 1 334.507 4.260 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]2Cc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000463190110 1041406628 /nfs/dbraw/zinc/40/66/28/1041406628.db2.gz IADGPQJUGRINTR-HWHRFOGPSA-N 2 1 334.507 4.260 20 0 EIADMP CCc1nc(C)c([C@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000480601801 1041412380 /nfs/dbraw/zinc/41/23/80/1041412380.db2.gz BOBDJYXHAHISHN-XHSDSOJGSA-N 2 1 337.577 4.423 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(OC)c1 ZINC000480608403 1041420643 /nfs/dbraw/zinc/42/06/43/1041420643.db2.gz KUTNPWBQVZABKY-DLBZAZTESA-N 2 1 334.504 4.009 20 0 EIADMP COc1cc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1OC ZINC000480615274 1041425889 /nfs/dbraw/zinc/42/58/89/1041425889.db2.gz RJIVUKVWIWPNBP-ZWKOTPCHSA-N 2 1 348.531 4.317 20 0 EIADMP COc1ccc(OC)c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000480617997 1041427511 /nfs/dbraw/zinc/42/75/11/1041427511.db2.gz VRBMIILHSPLWRZ-SJORKVTESA-N 2 1 334.504 4.009 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+]2C)cc1OC ZINC000540377592 1041428511 /nfs/dbraw/zinc/42/85/11/1041428511.db2.gz QHYHLNPFPKZLNH-AEFFLSMTSA-N 2 1 334.504 4.009 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc(F)c(F)c(F)c1 ZINC000480630606 1041434282 /nfs/dbraw/zinc/43/42/82/1041434282.db2.gz KOSYQUUAICONBP-ZIAGYGMSSA-N 2 1 328.422 4.409 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccccc1OC(F)F ZINC000480618610 1041435755 /nfs/dbraw/zinc/43/57/55/1041435755.db2.gz TZBGZKUIYRRMAZ-CVEARBPZSA-N 2 1 340.458 4.451 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OCC(C)C)c(OC)c2)CC1 ZINC000540406458 1041436656 /nfs/dbraw/zinc/43/66/56/1041436656.db2.gz AZSUQUWPZBELAP-QGZVFWFLSA-N 2 1 348.531 4.255 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccc(OCCC(C)C)c(OC)c2)CC1 ZINC000540409801 1041438510 /nfs/dbraw/zinc/43/85/10/1041438510.db2.gz MTKGCUBADVXYJF-QGZVFWFLSA-N 2 1 348.531 4.255 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)cc1N(C)C ZINC000480634111 1041447031 /nfs/dbraw/zinc/44/70/31/1041447031.db2.gz ZMQNUJHQHXWMSA-DLBZAZTESA-N 2 1 335.511 4.054 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1Nc1ccc2c(c1)nc(C(C)(C)C)n2C ZINC000538627242 1041459234 /nfs/dbraw/zinc/45/92/34/1041459234.db2.gz CQXJSYYYIJEEAP-YCPHGPKFSA-N 2 1 328.504 4.011 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000538627242 1041459239 /nfs/dbraw/zinc/45/92/39/1041459239.db2.gz CQXJSYYYIJEEAP-YCPHGPKFSA-N 2 1 328.504 4.011 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000538627242 1041459244 /nfs/dbraw/zinc/45/92/44/1041459244.db2.gz CQXJSYYYIJEEAP-YCPHGPKFSA-N 2 1 328.504 4.011 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(OCC3CC3)cc2)C1 ZINC000480658367 1041459306 /nfs/dbraw/zinc/45/93/06/1041459306.db2.gz CLAIATDHOARKIM-SFHVURJKSA-N 2 1 330.516 4.077 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000516214731 1041467042 /nfs/dbraw/zinc/46/70/42/1041467042.db2.gz XIOJVDBSJZGDME-UONOGXRCSA-N 2 1 339.405 4.240 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2(Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463285434 1041474466 /nfs/dbraw/zinc/47/44/66/1041474466.db2.gz XPBNQHVRSROCAS-DENIHFKCSA-N 2 1 334.507 4.404 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2(Cc3ccccc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463285434 1041474470 /nfs/dbraw/zinc/47/44/70/1041474470.db2.gz XPBNQHVRSROCAS-DENIHFKCSA-N 2 1 334.507 4.404 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(OC(F)(F)F)cc1 ZINC000484879270 1041477952 /nfs/dbraw/zinc/47/79/52/1041477952.db2.gz DTGDTFRKOHCGLF-ZFWWWQNUSA-N 2 1 330.394 4.110 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1F ZINC000195133260 1041485174 /nfs/dbraw/zinc/48/51/74/1041485174.db2.gz YIIMKTDJUNETCW-RDJZCZTQSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1F ZINC000195133260 1041485180 /nfs/dbraw/zinc/48/51/80/1041485180.db2.gz YIIMKTDJUNETCW-RDJZCZTQSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000195135352 1041486285 /nfs/dbraw/zinc/48/62/85/1041486285.db2.gz VLLZXWUJLQVAST-DOTOQJQBSA-N 2 1 330.422 4.138 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)C[C@@H]1C ZINC000538718694 1041487919 /nfs/dbraw/zinc/48/79/19/1041487919.db2.gz IGLRUKDKEUFGHL-JXFKEZNVSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc3cc(OC)ccc3c2)C[C@@H]1C ZINC000538718694 1041487923 /nfs/dbraw/zinc/48/79/23/1041487923.db2.gz IGLRUKDKEUFGHL-JXFKEZNVSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc3cc(OC)ccc3c2)C[C@@H]1C ZINC000538718694 1041487930 /nfs/dbraw/zinc/48/79/30/1041487930.db2.gz IGLRUKDKEUFGHL-JXFKEZNVSA-N 2 1 326.484 4.153 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463289561 1041488282 /nfs/dbraw/zinc/48/82/82/1041488282.db2.gz QEXRHVADPOCVGX-MJGOQNOKSA-N 2 1 328.525 4.242 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463289561 1041488287 /nfs/dbraw/zinc/48/82/87/1041488287.db2.gz QEXRHVADPOCVGX-MJGOQNOKSA-N 2 1 328.525 4.242 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@@H]1C ZINC000538719071 1041491158 /nfs/dbraw/zinc/49/11/58/1041491158.db2.gz JPKJEUARIVNSLD-KSSFIOAISA-N 2 1 346.906 4.035 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@@H]1C ZINC000538719071 1041491163 /nfs/dbraw/zinc/49/11/63/1041491163.db2.gz JPKJEUARIVNSLD-KSSFIOAISA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@@H]1C ZINC000538719071 1041491165 /nfs/dbraw/zinc/49/11/65/1041491165.db2.gz JPKJEUARIVNSLD-KSSFIOAISA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@@H]1C ZINC000538719071 1041491168 /nfs/dbraw/zinc/49/11/68/1041491168.db2.gz JPKJEUARIVNSLD-KSSFIOAISA-N 2 1 346.906 4.035 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2c[nH]nc2C(C)(C)C)CC1 ZINC000538721709 1041493264 /nfs/dbraw/zinc/49/32/64/1041493264.db2.gz YWYFATFWPYQESG-KRWDZBQOSA-N 2 1 346.563 4.184 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@H](C)C1 ZINC000538738082 1041510640 /nfs/dbraw/zinc/51/06/40/1041510640.db2.gz XIQIWUQQKYQSQO-NVXWUHKLSA-N 2 1 340.458 4.067 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@H](C)C1 ZINC000538738082 1041510649 /nfs/dbraw/zinc/51/06/49/1041510649.db2.gz XIQIWUQQKYQSQO-NVXWUHKLSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@H](C)C1 ZINC000538738082 1041510657 /nfs/dbraw/zinc/51/06/57/1041510657.db2.gz XIQIWUQQKYQSQO-NVXWUHKLSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@H](C)C1 ZINC000538738082 1041510664 /nfs/dbraw/zinc/51/06/64/1041510664.db2.gz XIQIWUQQKYQSQO-NVXWUHKLSA-N 2 1 340.458 4.067 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000540607297 1041559402 /nfs/dbraw/zinc/55/94/02/1041559402.db2.gz MCPBMULMMGNOMV-YJBOKZPZSA-N 2 1 339.310 4.481 20 0 EIADMP CCC[C@H](C[NH2+]CC1([NH+]2CCCCC2)CCOCC1)c1ccccc1 ZINC000540630159 1041571266 /nfs/dbraw/zinc/57/12/66/1041571266.db2.gz VNKXRCXOASKTDX-OAQYLSRUSA-N 2 1 344.543 4.195 20 0 EIADMP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000540708398 1041607833 /nfs/dbraw/zinc/60/78/33/1041607833.db2.gz WMIAPMCCSXQCHM-OFCAXSSNSA-N 2 1 330.516 4.182 20 0 EIADMP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000540708398 1041607839 /nfs/dbraw/zinc/60/78/39/1041607839.db2.gz WMIAPMCCSXQCHM-OFCAXSSNSA-N 2 1 330.516 4.182 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000539040716 1041616696 /nfs/dbraw/zinc/61/66/96/1041616696.db2.gz PLDSAIMJORKVFZ-SVFBPWRDSA-N 2 1 337.511 4.341 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000539040715 1041616931 /nfs/dbraw/zinc/61/69/31/1041616931.db2.gz PLDSAIMJORKVFZ-IRFCIJBXSA-N 2 1 337.511 4.341 20 0 EIADMP CC(C)(C)[C@@H]1CCC[NH+]1CC1(C[N@@H+]2CCC[C@H]2C(C)(C)C)COC1 ZINC000541071931 1041797571 /nfs/dbraw/zinc/79/75/71/1041797571.db2.gz RDLDVISRDQIQPI-ROUUACIJSA-N 2 1 336.564 4.024 20 0 EIADMP Cc1ccc2c(c1)c(CC[NH3+])cn2C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167962161 1041846844 /nfs/dbraw/zinc/84/68/44/1041846844.db2.gz UIKOWRLXHUIMEU-YOFSQIOKSA-N 2 1 337.511 4.029 20 0 EIADMP Cc1cc(NC2CC[NH+](C(C)C)CC2)c[nH+]c1N1CCCC[C@H]1C ZINC000541254553 1041869441 /nfs/dbraw/zinc/86/94/41/1041869441.db2.gz CGRZUWWYBYFOMM-QGZVFWFLSA-N 2 1 330.520 4.054 20 0 EIADMP C[C@@H]([NH2+]CCCCCOc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000437784861 1041909113 /nfs/dbraw/zinc/90/91/13/1041909113.db2.gz KZZOXKLAYQHDDO-UXHICEINSA-N 2 1 344.543 4.478 20 0 EIADMP c1c(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)onc1C1CC1 ZINC000638444450 1041909309 /nfs/dbraw/zinc/90/93/09/1041909309.db2.gz CQWMLPYXITTYFO-UHFFFAOYSA-N 2 1 339.483 4.218 20 0 EIADMP CCc1cnc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)s1 ZINC000541536924 1042001197 /nfs/dbraw/zinc/00/11/97/1042001197.db2.gz DWKZJHUEZRQZAC-INIZCTEOSA-N 2 1 335.561 4.182 20 0 EIADMP CCc1cnc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)s1 ZINC000541536924 1042001207 /nfs/dbraw/zinc/00/12/07/1042001207.db2.gz DWKZJHUEZRQZAC-INIZCTEOSA-N 2 1 335.561 4.182 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)CC(F)(F)F ZINC000402779449 1042029814 /nfs/dbraw/zinc/02/98/14/1042029814.db2.gz OPTRCZYNELXCEZ-ZMSDIMECSA-N 2 1 328.422 4.075 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)CC(F)(F)F ZINC000402779449 1042029820 /nfs/dbraw/zinc/02/98/20/1042029820.db2.gz OPTRCZYNELXCEZ-ZMSDIMECSA-N 2 1 328.422 4.075 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000438087602 1042040679 /nfs/dbraw/zinc/04/06/79/1042040679.db2.gz LXNMXOLEXHIJNW-YYIAUSFCSA-N 2 1 334.470 4.455 20 0 EIADMP c1ccc(OCCCCC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000438121445 1042061781 /nfs/dbraw/zinc/06/17/81/1042061781.db2.gz PKEDYNLRPXFFJI-UGKGYDQZSA-N 2 1 342.527 4.184 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000438201639 1042078755 /nfs/dbraw/zinc/07/87/55/1042078755.db2.gz QIIFDCGFVRMQPE-WRWLIDTKSA-N 2 1 346.515 4.491 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000438201639 1042078764 /nfs/dbraw/zinc/07/87/64/1042078764.db2.gz QIIFDCGFVRMQPE-WRWLIDTKSA-N 2 1 346.515 4.491 20 0 EIADMP CSc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC000623137140 1042119207 /nfs/dbraw/zinc/11/92/07/1042119207.db2.gz KKKXMDAHIVYREK-LJQANCHMSA-N 2 1 332.557 4.352 20 0 EIADMP CSc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC000623137140 1042119213 /nfs/dbraw/zinc/11/92/13/1042119213.db2.gz KKKXMDAHIVYREK-LJQANCHMSA-N 2 1 332.557 4.352 20 0 EIADMP CSC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000541915437 1042169693 /nfs/dbraw/zinc/16/96/93/1042169693.db2.gz MJLOMSYDHFPVGA-BBRMVZONSA-N 2 1 346.462 4.041 20 0 EIADMP CSC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000541915437 1042169695 /nfs/dbraw/zinc/16/96/95/1042169695.db2.gz MJLOMSYDHFPVGA-BBRMVZONSA-N 2 1 346.462 4.041 20 0 EIADMP C[C@@H](c1cccc(F)c1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464836215 1042181314 /nfs/dbraw/zinc/18/13/14/1042181314.db2.gz JNMBOWHEOLUMBR-PKOBYXMFSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@@H](c1cccc(F)c1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464836215 1042181319 /nfs/dbraw/zinc/18/13/19/1042181319.db2.gz JNMBOWHEOLUMBR-PKOBYXMFSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@@H](c1cccc(F)c1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464836215 1042181323 /nfs/dbraw/zinc/18/13/23/1042181323.db2.gz JNMBOWHEOLUMBR-PKOBYXMFSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@H](c1cccc(F)c1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464836214 1042181707 /nfs/dbraw/zinc/18/17/07/1042181707.db2.gz JNMBOWHEOLUMBR-MJGOQNOKSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@H](c1cccc(F)c1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464836214 1042181710 /nfs/dbraw/zinc/18/17/10/1042181710.db2.gz JNMBOWHEOLUMBR-MJGOQNOKSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@H](c1cccc(F)c1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464836214 1042181713 /nfs/dbraw/zinc/18/17/13/1042181713.db2.gz JNMBOWHEOLUMBR-MJGOQNOKSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC[N@@H+]1C ZINC000426063893 1042246538 /nfs/dbraw/zinc/24/65/38/1042246538.db2.gz VTFZVTSWWVFMGN-UIAACRFSSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC[N@H+]1C ZINC000426063893 1042246550 /nfs/dbraw/zinc/24/65/50/1042246550.db2.gz VTFZVTSWWVFMGN-UIAACRFSSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3cc(N)ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000414937349 1042285746 /nfs/dbraw/zinc/28/57/46/1042285746.db2.gz VMTFYKCDXCIJNY-FHZYATBESA-N 2 1 349.522 4.289 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3cc(N)ccc32)CC[N@H+]1Cc1ccccc1 ZINC000414937349 1042285754 /nfs/dbraw/zinc/28/57/54/1042285754.db2.gz VMTFYKCDXCIJNY-FHZYATBESA-N 2 1 349.522 4.289 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000542164965 1042312314 /nfs/dbraw/zinc/31/23/14/1042312314.db2.gz HIEWKDVYUVNJLF-PLMTUMEDSA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000542164965 1042312316 /nfs/dbraw/zinc/31/23/16/1042312316.db2.gz HIEWKDVYUVNJLF-PLMTUMEDSA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000542164965 1042312324 /nfs/dbraw/zinc/31/23/24/1042312324.db2.gz HIEWKDVYUVNJLF-PLMTUMEDSA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000542164965 1042312328 /nfs/dbraw/zinc/31/23/28/1042312328.db2.gz HIEWKDVYUVNJLF-PLMTUMEDSA-N 2 1 330.491 4.096 20 0 EIADMP c1cc(C[NH+]2CCC([NH+]3CCCCC3)CC2)cc(-c2ccncc2)c1 ZINC000506324758 1042315711 /nfs/dbraw/zinc/31/57/11/1042315711.db2.gz FXPFCBLPGMFYTM-UHFFFAOYSA-N 2 1 335.495 4.199 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CC[C@@H]3[C@@H](CCCN3C3CC3)C1)CC2 ZINC000542212122 1042339218 /nfs/dbraw/zinc/33/92/18/1042339218.db2.gz FQGRZSJWVBXBRT-CWFSZBLJSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@@H+]1CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C1)CC2 ZINC000542212122 1042339224 /nfs/dbraw/zinc/33/92/24/1042339224.db2.gz FQGRZSJWVBXBRT-CWFSZBLJSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C1)CC2 ZINC000542212122 1042339233 /nfs/dbraw/zinc/33/92/33/1042339233.db2.gz FQGRZSJWVBXBRT-CWFSZBLJSA-N 2 1 330.903 4.276 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000506379000 1042366711 /nfs/dbraw/zinc/36/67/11/1042366711.db2.gz DFJKCBNWZKYQSJ-UHFFFAOYSA-N 2 1 330.447 4.390 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000506379000 1042366718 /nfs/dbraw/zinc/36/67/18/1042366718.db2.gz DFJKCBNWZKYQSJ-UHFFFAOYSA-N 2 1 330.447 4.390 20 0 EIADMP Cc1cc(Br)ccc1C[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000506380286 1042367979 /nfs/dbraw/zinc/36/79/79/1042367979.db2.gz IWMBESOESXLUDS-UHFFFAOYSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)CC1 ZINC000173319605 1042564105 /nfs/dbraw/zinc/56/41/05/1042564105.db2.gz OVVIVKUNAYHPEQ-LJQANCHMSA-N 2 1 345.575 4.052 20 0 EIADMP CC(C)CSCCC[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492426623 1042649699 /nfs/dbraw/zinc/64/96/99/1042649699.db2.gz WLTOBZDNXVIREY-ICSRJNTNSA-N 2 1 334.573 4.266 20 0 EIADMP Fc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000309682201 1042818966 /nfs/dbraw/zinc/81/89/66/1042818966.db2.gz BESKXQBWUIXEOG-INIZCTEOSA-N 2 1 332.850 4.091 20 0 EIADMP CCc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000309707875 1042818977 /nfs/dbraw/zinc/81/89/77/1042818977.db2.gz IMPNKUCFLQEITC-AEFFLSMTSA-N 2 1 328.525 4.311 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000310067876 1042827428 /nfs/dbraw/zinc/82/74/28/1042827428.db2.gz CCUIKCVOFUJRII-WBVHZDCISA-N 2 1 330.422 4.138 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000310067876 1042827431 /nfs/dbraw/zinc/82/74/31/1042827431.db2.gz CCUIKCVOFUJRII-WBVHZDCISA-N 2 1 330.422 4.138 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OCc3ccccc3)cc2)CC1 ZINC000310322396 1042834177 /nfs/dbraw/zinc/83/41/77/1042834177.db2.gz FZZNQZVZCSCTJT-SFHVURJKSA-N 2 1 338.495 4.401 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000177370582 1042835869 /nfs/dbraw/zinc/83/58/69/1042835869.db2.gz UGAZVXOKESAQLD-NRFANRHFSA-N 2 1 337.442 4.490 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310496025 1042838808 /nfs/dbraw/zinc/83/88/08/1042838808.db2.gz IGVQSMDGTQGHOW-AOIWGVFYSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccccc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310496025 1042838809 /nfs/dbraw/zinc/83/88/09/1042838809.db2.gz IGVQSMDGTQGHOW-AOIWGVFYSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310496026 1042838914 /nfs/dbraw/zinc/83/89/14/1042838914.db2.gz IGVQSMDGTQGHOW-JENIJYKNSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310496026 1042838915 /nfs/dbraw/zinc/83/89/15/1042838915.db2.gz IGVQSMDGTQGHOW-JENIJYKNSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(Br)cc1 ZINC000157477095 1042844122 /nfs/dbraw/zinc/84/41/22/1042844122.db2.gz LXWMPXBOUSZSKG-LQAWEQHXSA-N 2 1 331.257 4.245 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2[nH]ccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310902526 1042847502 /nfs/dbraw/zinc/84/75/02/1042847502.db2.gz BIVARKOEYZDMIA-XLIONFOSSA-N 2 1 333.479 4.168 20 0 EIADMP Cc1ccccc1C1CC([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000310925271 1042847935 /nfs/dbraw/zinc/84/79/35/1042847935.db2.gz RXZTWUCSTIKZMT-ITAUSPCMSA-N 2 1 334.507 4.353 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1OC ZINC000310985595 1042849486 /nfs/dbraw/zinc/84/94/86/1042849486.db2.gz GTHDBFODEHWHDM-FPOVZHCZSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000311016330 1042850735 /nfs/dbraw/zinc/85/07/35/1042850735.db2.gz NADWJIPWPYTHFU-KGVIQGDOSA-N 2 1 338.495 4.084 20 0 EIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168448843 1042859946 /nfs/dbraw/zinc/85/99/46/1042859946.db2.gz QGSQIIBYUBMARV-JOCHJYFZSA-N 2 1 344.518 4.412 20 0 EIADMP CC[C@H]1C[C@@H](C[NH+]2CCC(CC[N@@H+](CC)CC3CC3)CC2)CCO1 ZINC000507774390 1042876100 /nfs/dbraw/zinc/87/61/00/1042876100.db2.gz KAIQIBJWPBKJSN-SFTDATJTSA-N 2 1 336.564 4.026 20 0 EIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000536486508 1043038063 /nfs/dbraw/zinc/03/80/63/1043038063.db2.gz WVTZUAICHFRYKS-UHFFFAOYSA-N 2 1 349.931 4.492 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(F)c1 ZINC000183192723 1043039286 /nfs/dbraw/zinc/03/92/86/1043039286.db2.gz AQHHZEJOJDKOLQ-OWCLPIDISA-N 2 1 334.479 4.138 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(F)c1 ZINC000183192723 1043039295 /nfs/dbraw/zinc/03/92/95/1043039295.db2.gz AQHHZEJOJDKOLQ-OWCLPIDISA-N 2 1 334.479 4.138 20 0 EIADMP Cc1cncc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)c1 ZINC000184280801 1043087040 /nfs/dbraw/zinc/08/70/40/1043087040.db2.gz JZALDHCWWVLQOK-HKUYNNGSSA-N 2 1 337.511 4.473 20 0 EIADMP COc1cccc(C[NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168009154 1043091531 /nfs/dbraw/zinc/09/15/31/1043091531.db2.gz YWFYCMQZUMKAHG-RMFSNUHRSA-N 2 1 338.495 4.226 20 0 EIADMP Cc1cnc([C@@H](C)NCc2ccccc2C[N@H+]2CCCC[C@@H]2C)cn1 ZINC000427821007 1043214303 /nfs/dbraw/zinc/21/43/03/1043214303.db2.gz AVIGCRHPHMTYTR-ZWKOTPCHSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1cnc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)cn1 ZINC000427821007 1043214316 /nfs/dbraw/zinc/21/43/16/1043214316.db2.gz AVIGCRHPHMTYTR-ZWKOTPCHSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1cnc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)cn1 ZINC000427821007 1043214328 /nfs/dbraw/zinc/21/43/28/1043214328.db2.gz AVIGCRHPHMTYTR-ZWKOTPCHSA-N 2 1 338.499 4.010 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)F)nc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000657969677 1043232918 /nfs/dbraw/zinc/23/29/18/1043232918.db2.gz SXQAHJCPXGNHDC-SQWLQELKSA-N 2 1 337.458 4.323 20 0 EIADMP Brc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CCC2 ZINC000356682447 1043253046 /nfs/dbraw/zinc/25/30/46/1043253046.db2.gz SDWNQWRLVNSSAD-XYJFISCASA-N 2 1 349.316 4.043 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)C3CCC(F)(F)CC3)CC2)[nH+]c1 ZINC000474023128 1043264972 /nfs/dbraw/zinc/26/49/72/1043264972.db2.gz LXENTVAEONPYTJ-HNNXBMFYSA-N 2 1 337.458 4.162 20 0 EIADMP Cc1nccn1CCCC[N@H+]1CCC[C@@H](c2ccc(F)c(F)c2)C1 ZINC000625658428 1043320673 /nfs/dbraw/zinc/32/06/73/1043320673.db2.gz YYTYHBFDNTXYLD-QGZVFWFLSA-N 2 1 333.426 4.130 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H](c2ccc(F)c(F)c2)C1 ZINC000625658428 1043320681 /nfs/dbraw/zinc/32/06/81/1043320681.db2.gz YYTYHBFDNTXYLD-QGZVFWFLSA-N 2 1 333.426 4.130 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H](c2ccc(F)c(F)c2)C1 ZINC000625658428 1043320695 /nfs/dbraw/zinc/32/06/95/1043320695.db2.gz YYTYHBFDNTXYLD-QGZVFWFLSA-N 2 1 333.426 4.130 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)C2CCSCC2)CC1 ZINC000187020595 1043322283 /nfs/dbraw/zinc/32/22/83/1043322283.db2.gz KTEDZLFQIYAVDJ-QGZVFWFLSA-N 2 1 332.557 4.081 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)C2CCSCC2)CC1 ZINC000187215525 1043336646 /nfs/dbraw/zinc/33/66/46/1043336646.db2.gz FYRRGBXZXGBERM-DLBZAZTESA-N 2 1 332.557 4.333 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2cccnc2c1 ZINC000674067645 1043386785 /nfs/dbraw/zinc/38/67/85/1043386785.db2.gz MRFXEFYUGRPDEB-GCJKJVERSA-N 2 1 345.490 4.235 20 0 EIADMP CC[NH+](CC)CCCC[NH2+]C1C[C@H](C)N(Cc2ccccc2)[C@@H](C)C1 ZINC001168012056 1043422216 /nfs/dbraw/zinc/42/22/16/1043422216.db2.gz VIRBCXOXTHATHH-PMACEKPBSA-N 2 1 345.575 4.140 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccnn1-c1ccccc1 ZINC000467364160 1043582620 /nfs/dbraw/zinc/58/26/20/1043582620.db2.gz JIHAYROLHMUBSG-RTBURBONSA-N 2 1 340.515 4.178 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccccn1 ZINC000639219172 1043654625 /nfs/dbraw/zinc/65/46/25/1043654625.db2.gz QBVWCDXCMANZTK-TZIWHRDSSA-N 2 1 349.522 4.317 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccccn1 ZINC000639219172 1043654642 /nfs/dbraw/zinc/65/46/42/1043654642.db2.gz QBVWCDXCMANZTK-TZIWHRDSSA-N 2 1 349.522 4.317 20 0 EIADMP COCCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000521477539 1043785686 /nfs/dbraw/zinc/78/56/86/1043785686.db2.gz RLFSCTLNDBHCCU-BHIFYINESA-N 2 1 344.543 4.084 20 0 EIADMP CC(C)[C@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccccn1 ZINC000766080314 1043906556 /nfs/dbraw/zinc/90/65/56/1043906556.db2.gz CYUSSCXNYZJADG-NRFANRHFSA-N 2 1 329.532 4.413 20 0 EIADMP COc1ccc([C@@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@H]2CCC[NH2+]2)cc1 ZINC000665300689 1043927150 /nfs/dbraw/zinc/92/71/50/1043927150.db2.gz HRCMLPPHLWLDJI-HZPDHXFCSA-N 2 1 344.421 4.057 20 0 EIADMP CC(C)C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195132343 1044024816 /nfs/dbraw/zinc/02/48/16/1044024816.db2.gz ADCNEPBONVTYFK-RBBKRZOGSA-N 2 1 337.511 4.281 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cc(Br)cs2)CC1 ZINC000226394325 1044176636 /nfs/dbraw/zinc/17/66/36/1044176636.db2.gz ZJDWMFJGCJRSQB-LBPRGKRZSA-N 2 1 345.350 4.426 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](COC)c2ccc(Cl)cc2)c1 ZINC000194027280 1044245228 /nfs/dbraw/zinc/24/52/28/1044245228.db2.gz FLSOMWIQRYKOFG-FQEVSTJZSA-N 2 1 346.902 4.269 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319484 1044305656 /nfs/dbraw/zinc/30/56/56/1044305656.db2.gz CHDFHURGPJGCHJ-NQIIRXRSSA-N 2 1 335.495 4.035 20 0 EIADMP Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000733797889 1044316847 /nfs/dbraw/zinc/31/68/47/1044316847.db2.gz CAFLJSQFQRLDDT-OAHLLOKOSA-N 2 1 327.472 4.128 20 0 EIADMP COCC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000347930244 1044330031 /nfs/dbraw/zinc/33/00/31/1044330031.db2.gz KOMGPTOIUAIAAY-LMNJBCLMSA-N 2 1 330.516 4.007 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000675489078 1044358150 /nfs/dbraw/zinc/35/81/50/1044358150.db2.gz FTWITTOWMBUAKI-OALUTQOASA-N 2 1 325.500 4.222 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000675489078 1044358162 /nfs/dbraw/zinc/35/81/62/1044358162.db2.gz FTWITTOWMBUAKI-OALUTQOASA-N 2 1 325.500 4.222 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000675489078 1044358176 /nfs/dbraw/zinc/35/81/76/1044358176.db2.gz FTWITTOWMBUAKI-OALUTQOASA-N 2 1 325.500 4.222 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)C1CCC(F)(F)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000474079416 1044358371 /nfs/dbraw/zinc/35/83/71/1044358371.db2.gz IXISZHDEECMEMO-ZMSDIMECSA-N 2 1 328.491 4.443 20 0 EIADMP C[C@@H]1C[C@@H](n2cnc3ccc(C[NH3+])cc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168020130 1044367806 /nfs/dbraw/zinc/36/78/06/1044367806.db2.gz KQOIHXPYFPWLHH-XEMDLRDOSA-N 2 1 348.494 4.109 20 0 EIADMP CC(C)n1nccc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000280854278 1044421164 /nfs/dbraw/zinc/42/11/64/1044421164.db2.gz LNCFXRPXNVBRRF-UHFFFAOYSA-N 2 1 340.515 4.130 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCc2c(Cl)cccc2Cl)CC[N@@H+]1C ZINC000428283427 1044474916 /nfs/dbraw/zinc/47/49/16/1044474916.db2.gz HXJKOPJKQAHWEV-ZIAGYGMSSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCc2c(Cl)cccc2Cl)CC[N@H+]1C ZINC000428283427 1044474922 /nfs/dbraw/zinc/47/49/22/1044474922.db2.gz HXJKOPJKQAHWEV-ZIAGYGMSSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)CCCc2c(Cl)cccc2Cl)CC[NH+]1C ZINC000428283427 1044474931 /nfs/dbraw/zinc/47/49/31/1044474931.db2.gz HXJKOPJKQAHWEV-ZIAGYGMSSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCc2c(Cl)cccc2Cl)CC[NH+]1C ZINC000428283427 1044474940 /nfs/dbraw/zinc/47/49/40/1044474940.db2.gz HXJKOPJKQAHWEV-ZIAGYGMSSA-N 2 1 329.315 4.341 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCc2c1ccc(Cl)c2Cl ZINC000675817269 1044515542 /nfs/dbraw/zinc/51/55/42/1044515542.db2.gz ULLDFHUHNVPPDL-BZNIZROVSA-N 2 1 338.282 4.412 20 0 EIADMP CCC(CC)(C[NH2+][C@@H](C)C1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000675894940 1044543144 /nfs/dbraw/zinc/54/31/44/1044543144.db2.gz WFGUGAQOFCUOOK-RBUKOAKNSA-N 3 1 345.575 4.216 20 0 EIADMP CCC(CC)n1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)n1 ZINC000443606684 1044544119 /nfs/dbraw/zinc/54/41/19/1044544119.db2.gz SCNAPGZVZFCAHO-UHFFFAOYSA-N 2 1 346.563 4.332 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(Cl)s1 ZINC000675880107 1044552316 /nfs/dbraw/zinc/55/23/16/1044552316.db2.gz BFKIJGVEYVYTMH-HUUCEWRRSA-N 2 1 342.936 4.086 20 0 EIADMP CS[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C ZINC000543411859 1044553634 /nfs/dbraw/zinc/55/36/34/1044553634.db2.gz BZWRZFFEHJLASS-NZSAHSFTSA-N 2 1 334.573 4.407 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(c2ccccc2Cl)CC1 ZINC001168474659 1044554837 /nfs/dbraw/zinc/55/48/37/1044554837.db2.gz TYQGLRCCRJPHOU-HNNXBMFYSA-N 2 1 346.877 4.360 20 0 EIADMP CC(C)[C@@H](O)[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000657744022 1044565217 /nfs/dbraw/zinc/56/52/17/1044565217.db2.gz CSRMBIHSQYFTGT-FCHUYYIVSA-N 2 1 344.543 4.131 20 0 EIADMP C(=C/c1ccncc1)\C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000494995294 1044583933 /nfs/dbraw/zinc/58/39/33/1044583933.db2.gz MCYNXSLYNLJONX-QPJJXVBHSA-N 2 1 347.506 4.083 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000543461465 1044651893 /nfs/dbraw/zinc/65/18/93/1044651893.db2.gz GYLWTVOGIWUTRG-RTBURBONSA-N 2 1 330.516 4.007 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000359943103 1044652225 /nfs/dbraw/zinc/65/22/25/1044652225.db2.gz PSPRUQWKDFYUCS-MAUKXSAKSA-N 2 1 336.520 4.464 20 0 EIADMP Clc1cccc2c1SCC[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000360434018 1044714515 /nfs/dbraw/zinc/71/45/15/1044714515.db2.gz REBJESFCTWZBRT-KRWDZBQOSA-N 2 1 336.932 4.341 20 0 EIADMP FC(F)(F)c1ccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000676712968 1044827585 /nfs/dbraw/zinc/82/75/85/1044827585.db2.gz VLCNDTOISKYXAR-YJBOKZPZSA-N 2 1 338.417 4.154 20 0 EIADMP FC(F)(F)c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000676712968 1044827589 /nfs/dbraw/zinc/82/75/89/1044827589.db2.gz VLCNDTOISKYXAR-YJBOKZPZSA-N 2 1 338.417 4.154 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861472 1044833217 /nfs/dbraw/zinc/83/32/17/1044833217.db2.gz TVGCUDSIDLIMQX-KBPBESRZSA-N 2 1 330.488 4.230 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861472 1044833218 /nfs/dbraw/zinc/83/32/18/1044833218.db2.gz TVGCUDSIDLIMQX-KBPBESRZSA-N 2 1 330.488 4.230 20 0 EIADMP C[C@H](F)CC[NH+]1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000508976991 1044862399 /nfs/dbraw/zinc/86/23/99/1044862399.db2.gz HZOBQDZJOKUCHU-AWEZNQCLSA-N 2 1 346.412 4.350 20 0 EIADMP C[C@H](F)CC[NH+]1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000508976991 1044862401 /nfs/dbraw/zinc/86/24/01/1044862401.db2.gz HZOBQDZJOKUCHU-AWEZNQCLSA-N 2 1 346.412 4.350 20 0 EIADMP Cc1nc(C(C)C)oc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000428960567 1044906551 /nfs/dbraw/zinc/90/65/51/1044906551.db2.gz CJNUPLPHGNMPPS-UHFFFAOYSA-N 2 1 342.487 4.019 20 0 EIADMP FC(F)Sc1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000738335971 1045052873 /nfs/dbraw/zinc/05/28/73/1045052873.db2.gz WWIHKIHWOYMEKW-INIZCTEOSA-N 2 1 340.483 4.452 20 0 EIADMP FC(F)Sc1ccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000738335971 1045052886 /nfs/dbraw/zinc/05/28/86/1045052886.db2.gz WWIHKIHWOYMEKW-INIZCTEOSA-N 2 1 340.483 4.452 20 0 EIADMP COC1(C[C@@H](C)[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000429402539 1045084750 /nfs/dbraw/zinc/08/47/50/1045084750.db2.gz IZBZQAHCIDPFQL-HDAAZOAOSA-N 2 1 344.543 4.080 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(Br)c(Cl)c2)CC1 ZINC000233020311 1045087828 /nfs/dbraw/zinc/08/78/28/1045087828.db2.gz FTLGSVSNXWJUJO-UHFFFAOYSA-N 2 1 345.712 4.067 20 0 EIADMP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000495420198 1045090857 /nfs/dbraw/zinc/09/08/57/1045090857.db2.gz FZFPDNDAYGPXHJ-JENIJYKNSA-N 2 1 326.484 4.403 20 0 EIADMP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000495420198 1045090869 /nfs/dbraw/zinc/09/08/69/1045090869.db2.gz FZFPDNDAYGPXHJ-JENIJYKNSA-N 2 1 326.484 4.403 20 0 EIADMP COC1(C[C@@H](C)[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCC1 ZINC000429432487 1045133619 /nfs/dbraw/zinc/13/36/19/1045133619.db2.gz XHPNMCZOAMYBFU-CVEARBPZSA-N 2 1 327.472 4.179 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001168492901 1045324572 /nfs/dbraw/zinc/32/45/72/1045324572.db2.gz ZTXBKIFHWPXWEI-SFHVURJKSA-N 2 1 340.486 4.353 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001168492901 1045324580 /nfs/dbraw/zinc/32/45/80/1045324580.db2.gz ZTXBKIFHWPXWEI-SFHVURJKSA-N 2 1 340.486 4.353 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H](c3ccccc3)C3CC3)CC2)cc1 ZINC000236729164 1045364845 /nfs/dbraw/zinc/36/48/45/1045364845.db2.gz PWTKXZIIUPVYHU-QHCPKHFHSA-N 2 1 334.507 4.434 20 0 EIADMP C[N@@H+](CCC[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)Cc1ccccc1 ZINC000237095012 1045374672 /nfs/dbraw/zinc/37/46/72/1045374672.db2.gz BUXAZRPSNGJMET-IAGOWNOFSA-N 2 1 328.422 4.219 20 0 EIADMP C[C@@H](CCc1ccccc1)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000237334744 1045382855 /nfs/dbraw/zinc/38/28/55/1045382855.db2.gz RAPJSSCWXSOMTP-FQEVSTJZSA-N 2 1 336.523 4.304 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874482 1045667367 /nfs/dbraw/zinc/66/73/67/1045667367.db2.gz FUWBUTWZHJRUHT-FUHWJXTLSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874482 1045667383 /nfs/dbraw/zinc/66/73/83/1045667383.db2.gz FUWBUTWZHJRUHT-FUHWJXTLSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874482 1045667403 /nfs/dbraw/zinc/66/74/03/1045667403.db2.gz FUWBUTWZHJRUHT-FUHWJXTLSA-N 2 1 340.433 4.369 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C[C@H](C)C(C)(C)C)CC2)cs1 ZINC000670267609 1045760237 /nfs/dbraw/zinc/76/02/37/1045760237.db2.gz LYRISBUEXCMNMW-HNNXBMFYSA-N 2 1 337.577 4.189 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000768234160 1045764859 /nfs/dbraw/zinc/76/48/59/1045764859.db2.gz UQXXTRKKCMJCJH-UHFFFAOYSA-N 2 1 332.435 4.215 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000768234160 1045764875 /nfs/dbraw/zinc/76/48/75/1045764875.db2.gz UQXXTRKKCMJCJH-UHFFFAOYSA-N 2 1 332.435 4.215 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1 ZINC000246868591 1045833432 /nfs/dbraw/zinc/83/34/32/1045833432.db2.gz CJEHZSJWGWLJNW-ILXRZTDVSA-N 2 1 342.512 4.219 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1)c1ccccc1 ZINC000246919787 1045834601 /nfs/dbraw/zinc/83/46/01/1045834601.db2.gz GQXFIXXRVNQOTE-PGRDOPGGSA-N 2 1 338.495 4.148 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1)c1ccccc1 ZINC000246919787 1045834604 /nfs/dbraw/zinc/83/46/04/1045834604.db2.gz GQXFIXXRVNQOTE-PGRDOPGGSA-N 2 1 338.495 4.148 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1cncc(F)c1 ZINC000247057831 1045839854 /nfs/dbraw/zinc/83/98/54/1045839854.db2.gz NQYXKBRCQLZBMB-IAGOWNOFSA-N 2 1 341.474 4.303 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCC[C@@H]2CCCCO2)C3)cc1 ZINC000248887153 1045887218 /nfs/dbraw/zinc/88/72/18/1045887218.db2.gz MKPOAEWZMZTNDP-KJJMTIBFSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001170262322 1045958469 /nfs/dbraw/zinc/95/84/69/1045958469.db2.gz WWTWXTDXUNAOOR-OAHLLOKOSA-N 2 1 346.877 4.360 20 0 EIADMP C[C@@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(c2ccc(F)cc2)CC1 ZINC001170260372 1045959826 /nfs/dbraw/zinc/95/98/26/1045959826.db2.gz JHHTXZZSUNMJDC-HNNXBMFYSA-N 2 1 346.877 4.360 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc3c(c2)COC3)CC1 ZINC000769544473 1046016140 /nfs/dbraw/zinc/01/61/40/1046016140.db2.gz XGZDMEIYABLGKF-GOSISDBHSA-N 2 1 342.527 4.193 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@H](CC(C)C)c2ccccc2)cn1 ZINC000792923557 1046107877 /nfs/dbraw/zinc/10/78/77/1046107877.db2.gz VTGYAGMUCUCCCU-NRFANRHFSA-N 2 1 348.494 4.495 20 0 EIADMP Cc1cc(C[NH2+]C2CC([NH+]3CCCCC3)C2)cc(C)c1OC(F)F ZINC000793338338 1046210835 /nfs/dbraw/zinc/21/08/35/1046210835.db2.gz WJZXNOOKFJBCPX-UHFFFAOYSA-N 2 1 338.442 4.011 20 0 EIADMP Cc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H](Cc4nccn4C)C3)o2)cc1 ZINC000508682423 1046316799 /nfs/dbraw/zinc/31/67/99/1046316799.db2.gz YCCAIVXCLMRFIB-SFHVURJKSA-N 2 1 349.478 4.443 20 0 EIADMP COCCC1(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCCC1 ZINC000508699637 1046329194 /nfs/dbraw/zinc/32/91/94/1046329194.db2.gz OYYMIPPBIMEFEE-CTNGQTDRSA-N 2 1 344.543 4.084 20 0 EIADMP COc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1C ZINC000508698033 1046329402 /nfs/dbraw/zinc/32/94/02/1046329402.db2.gz KSTQEXQRXZCKPL-RXVVDRJESA-N 2 1 338.495 4.004 20 0 EIADMP C[C@H]([NH2+]CCc1cc2ccccc2o1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508701212 1046333991 /nfs/dbraw/zinc/33/39/91/1046333991.db2.gz SHLPOKPKYKPLSH-RXVVDRJESA-N 2 1 348.490 4.476 20 0 EIADMP C[C@@H]([NH2+]CCc1cc2ccccc2o1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508701215 1046334042 /nfs/dbraw/zinc/33/40/42/1046334042.db2.gz SHLPOKPKYKPLSH-WIYYLYMNSA-N 2 1 348.490 4.476 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CCC[C@H](C(F)(F)F)C3)CC2)[nH+]1 ZINC000127051397 1046601035 /nfs/dbraw/zinc/60/10/35/1046601035.db2.gz HBAFSUPOFUUDQL-GOEBONIOSA-N 2 1 341.421 4.070 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@H](c1cccc(C(F)(F)F)c1)C(C)(C)C ZINC000459397690 1046615422 /nfs/dbraw/zinc/61/54/22/1046615422.db2.gz SIHFAHRWMHWFOM-MRXNPFEDSA-N 2 1 339.405 4.358 20 0 EIADMP Fc1ccccc1-c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)o1 ZINC000536662758 1046637099 /nfs/dbraw/zinc/63/70/99/1046637099.db2.gz XORVGCOWJOTPAL-MRXNPFEDSA-N 2 1 328.431 4.003 20 0 EIADMP Fc1ccccc1-c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)o1 ZINC000536662758 1046637108 /nfs/dbraw/zinc/63/71/08/1046637108.db2.gz XORVGCOWJOTPAL-MRXNPFEDSA-N 2 1 328.431 4.003 20 0 EIADMP Cn1cncc1CC[N@H+]1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000459418308 1046641576 /nfs/dbraw/zinc/64/15/76/1046641576.db2.gz ZSJDYKPRIAUGMC-QGZVFWFLSA-N 2 1 337.389 4.209 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379625309 1046713728 /nfs/dbraw/zinc/71/37/28/1046713728.db2.gz KPWJNFOUVJPFLV-OPYAIIAOSA-N 2 1 340.486 4.399 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379625309 1046713746 /nfs/dbraw/zinc/71/37/46/1046713746.db2.gz KPWJNFOUVJPFLV-OPYAIIAOSA-N 2 1 340.486 4.399 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3F)CC[N@@H+]1Cc1ccccc1 ZINC000379655812 1046759266 /nfs/dbraw/zinc/75/92/66/1046759266.db2.gz NEORSYVVVRCJQZ-NRJQMVOHSA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3F)CC[N@H+]1Cc1ccccc1 ZINC000379655812 1046759279 /nfs/dbraw/zinc/75/92/79/1046759279.db2.gz NEORSYVVVRCJQZ-NRJQMVOHSA-N 2 1 338.470 4.456 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3cccc(Cl)c3)CC2)[nH+]1 ZINC000128161612 1046772291 /nfs/dbraw/zinc/77/22/91/1046772291.db2.gz UYHHXOHZYKJRGF-HNNXBMFYSA-N 2 1 329.875 4.363 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)CCc3ccsc3)CC2)[nH+]1 ZINC000497398324 1046786060 /nfs/dbraw/zinc/78/60/60/1046786060.db2.gz BBDXAELFFVHHQD-INIZCTEOSA-N 2 1 329.513 4.031 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2OCc2ccccc2)[C@H](C)C1 ZINC000536853817 1046819398 /nfs/dbraw/zinc/81/93/98/1046819398.db2.gz VKXIFJNBZJUDMT-WIYYLYMNSA-N 2 1 338.495 4.086 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccccc2OCc2ccccc2)[C@H](C)C1 ZINC000536853817 1046819402 /nfs/dbraw/zinc/81/94/02/1046819402.db2.gz VKXIFJNBZJUDMT-WIYYLYMNSA-N 2 1 338.495 4.086 20 0 EIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000536860657 1046828627 /nfs/dbraw/zinc/82/86/27/1046828627.db2.gz ZWJDLMMTJZEWTK-JZXOWHBKSA-N 2 1 344.499 4.281 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@@H](c3ccccc3)C(C)C)CCCC2)CC1 ZINC000537000968 1046891759 /nfs/dbraw/zinc/89/17/59/1046891759.db2.gz YLZMDQWYFCGGQE-OAQYLSRUSA-N 2 1 344.543 4.397 20 0 EIADMP CC(C)CCC[C@H](C)[NH2+][C@@H](CCCC[NH3+])C(=O)OCc1ccccc1 ZINC001170070212 1046920556 /nfs/dbraw/zinc/92/05/56/1046920556.db2.gz ULKAGSAXOGISQV-ICSRJNTNSA-N 2 1 348.531 4.032 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@H]3CCC[C@H]([NH+](C)C)C3)oc21 ZINC000537293519 1047075425 /nfs/dbraw/zinc/07/54/25/1047075425.db2.gz VQTBQIKVVMLHRM-XIRDDKMYSA-N 2 1 330.472 4.355 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3nc(Cl)ccc32)c1 ZINC000806134322 1047133049 /nfs/dbraw/zinc/13/30/49/1047133049.db2.gz JMDSWACYQSNAKM-GOSISDBHSA-N 2 1 343.902 4.352 20 0 EIADMP CC(C)[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(F)cn1 ZINC000497868101 1047140923 /nfs/dbraw/zinc/14/09/23/1047140923.db2.gz NCHZGTDXJKDSPA-QKLQHJQFSA-N 2 1 335.511 4.266 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccccc3)CC2)cs1 ZINC000129497399 1047405076 /nfs/dbraw/zinc/40/50/76/1047405076.db2.gz CWEGELGJVVUHKQ-MRXNPFEDSA-N 2 1 343.540 4.268 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(SC(F)F)cc2)CC1 ZINC000789559653 1047442676 /nfs/dbraw/zinc/44/26/76/1047442676.db2.gz SXPBLLLGJARCJL-UHFFFAOYSA-N 2 1 326.456 4.062 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000556103323 1047453981 /nfs/dbraw/zinc/45/39/81/1047453981.db2.gz MMPJNUJPYYWOOR-NHCUHLMSSA-N 2 1 344.543 4.399 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000556103323 1047453995 /nfs/dbraw/zinc/45/39/95/1047453995.db2.gz MMPJNUJPYYWOOR-NHCUHLMSSA-N 2 1 344.543 4.399 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1F ZINC000556119578 1047472585 /nfs/dbraw/zinc/47/25/85/1047472585.db2.gz AMKZVECWNUIPEJ-ZIFCJYIRSA-N 2 1 341.474 4.172 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)C[C@H](C)O1 ZINC000556155045 1047498401 /nfs/dbraw/zinc/49/84/01/1047498401.db2.gz QLBQZJBMKKFWHH-UGNRZPKXSA-N 2 1 330.516 4.107 20 0 EIADMP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000129803743 1047510377 /nfs/dbraw/zinc/51/03/77/1047510377.db2.gz OOAHYCYVKPMSAQ-HZSPNIEDSA-N 2 1 327.299 4.141 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+](C)C2CCCCC2)CC[N@H+]1C ZINC000129862000 1047517184 /nfs/dbraw/zinc/51/71/84/1047517184.db2.gz RWYWXPRYSIXQFK-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862000 1047517198 /nfs/dbraw/zinc/51/71/98/1047517198.db2.gz RWYWXPRYSIXQFK-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862000 1047517211 /nfs/dbraw/zinc/51/72/11/1047517211.db2.gz RWYWXPRYSIXQFK-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCN1C ZINC000129862000 1047517223 /nfs/dbraw/zinc/51/72/23/1047517223.db2.gz RWYWXPRYSIXQFK-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCN1C ZINC000129862000 1047517243 /nfs/dbraw/zinc/51/72/43/1047517243.db2.gz RWYWXPRYSIXQFK-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@H](NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000129862000 1047517258 /nfs/dbraw/zinc/51/72/58/1047517258.db2.gz RWYWXPRYSIXQFK-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@H](NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@H+]1C ZINC000129862000 1047517270 /nfs/dbraw/zinc/51/72/70/1047517270.db2.gz RWYWXPRYSIXQFK-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@H](NCc2ccccc2C[N@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862000 1047517285 /nfs/dbraw/zinc/51/72/85/1047517285.db2.gz RWYWXPRYSIXQFK-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1C[C@H](NCc2ccccc2C[N@@H+](C)C2CCCCC2)CC[NH+]1C ZINC000129862000 1047517301 /nfs/dbraw/zinc/51/73/01/1047517301.db2.gz RWYWXPRYSIXQFK-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)[C@@]1(C)CCCO1 ZINC000556235958 1047600237 /nfs/dbraw/zinc/60/02/37/1047600237.db2.gz KQPARIKCOFEPCD-LVCYWYKZSA-N 2 1 330.516 4.108 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1ccncc1F ZINC000556235736 1047601283 /nfs/dbraw/zinc/60/12/83/1047601283.db2.gz GTDFTCVXINKQGG-DLBZAZTESA-N 2 1 341.474 4.446 20 0 EIADMP 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 1047603621 /nfs/dbraw/zinc/60/36/21/1047603621.db2.gz IJXZORJHTHZLMA-OAVNBELGSA-N 2 1 341.326 4.415 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccncc1F ZINC000556241201 1047622029 /nfs/dbraw/zinc/62/20/29/1047622029.db2.gz YSBDEDSIXPVPCS-QGZVFWFLSA-N 2 1 341.474 4.448 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCc4c3cccc4O)CC2)C1 ZINC000130428016 1047707455 /nfs/dbraw/zinc/70/74/55/1047707455.db2.gz PPRWTDXVBFBIID-OXFYSEKESA-N 2 1 328.500 4.012 20 0 EIADMP Oc1cccc2c1CCC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000191639557 1047713310 /nfs/dbraw/zinc/71/33/10/1047713310.db2.gz JQHUCIJFTWXORW-FQEVSTJZSA-N 2 1 328.500 4.156 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccnc(Cl)c1 ZINC000154865925 1047719117 /nfs/dbraw/zinc/71/91/17/1047719117.db2.gz KQSBAGITBSRBSH-HNNXBMFYSA-N 2 1 331.891 4.426 20 0 EIADMP CC(C)[NH2+]C1CC[NH+](CCCSc2ccccc2Cl)CC1 ZINC000108370459 1047800023 /nfs/dbraw/zinc/80/00/23/1047800023.db2.gz NEUHSEZPTYYGST-UHFFFAOYSA-N 2 1 326.937 4.285 20 0 EIADMP COCCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000550678093 1047813457 /nfs/dbraw/zinc/81/34/57/1047813457.db2.gz AOWJHMLBTHXDJP-UXHICEINSA-N 2 1 330.516 4.008 20 0 EIADMP COCCC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000550678093 1047813459 /nfs/dbraw/zinc/81/34/59/1047813459.db2.gz AOWJHMLBTHXDJP-UXHICEINSA-N 2 1 330.516 4.008 20 0 EIADMP Cc1cc(F)ccc1CC[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550680214 1047814068 /nfs/dbraw/zinc/81/40/68/1047814068.db2.gz JFRGNXJXGSXPGI-SFTDATJTSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1cc(F)ccc1CC[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550680214 1047814070 /nfs/dbraw/zinc/81/40/70/1047814070.db2.gz JFRGNXJXGSXPGI-SFTDATJTSA-N 2 1 326.459 4.102 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000131295204 1047860811 /nfs/dbraw/zinc/86/08/11/1047860811.db2.gz YUTBIOTUFKSOFJ-ZWKOTPCHSA-N 3 1 342.531 4.342 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000556857800 1048067455 /nfs/dbraw/zinc/06/74/55/1048067455.db2.gz HMYRKBIAFRQBKG-DYVFJYSZSA-N 2 1 342.405 4.110 20 0 EIADMP Cc1cncc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000556884242 1048100927 /nfs/dbraw/zinc/10/09/27/1048100927.db2.gz HNESLWXSUKDJBL-XPWALMASSA-N 2 1 349.522 4.170 20 0 EIADMP CCCC(C[NH3+])(CCC)[NH2+][C@@H](C)Cc1ccccc1Br ZINC001246494175 1048166622 /nfs/dbraw/zinc/16/66/22/1048166622.db2.gz FYSBTIZJJPPEJU-AWEZNQCLSA-N 2 1 341.337 4.267 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(F)c(Cl)c2F)CC1 ZINC001143626390 1048134530 /nfs/dbraw/zinc/13/45/30/1048134530.db2.gz SZBXPIAYEZCBMO-UHFFFAOYSA-N 2 1 330.850 4.170 20 0 EIADMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170759203 1048135163 /nfs/dbraw/zinc/13/51/63/1048135163.db2.gz AFOLIYWRKALMJP-MZADTFQBSA-N 2 1 326.528 4.265 20 0 EIADMP C[N@@H+](Cc1c(Cl)cc(Cl)cc1Cl)CC1CC[NH+](C)CC1 ZINC001143798431 1048212759 /nfs/dbraw/zinc/21/27/59/1048212759.db2.gz OOLNBXXVKQWRFF-UHFFFAOYSA-N 2 1 335.706 4.420 20 0 EIADMP C[N@H+](Cc1c(Cl)cc(Cl)cc1Cl)CC1CC[NH+](C)CC1 ZINC001143798431 1048212765 /nfs/dbraw/zinc/21/27/65/1048212765.db2.gz OOLNBXXVKQWRFF-UHFFFAOYSA-N 2 1 335.706 4.420 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171109745 1048217826 /nfs/dbraw/zinc/21/78/26/1048217826.db2.gz MCSROUJQFMEFDG-MISYRCLQSA-N 2 1 332.919 4.322 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171109744 1048219043 /nfs/dbraw/zinc/21/90/43/1048219043.db2.gz MCSROUJQFMEFDG-IHPCNDPISA-N 2 1 332.919 4.322 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(C)nc(Cl)c1 ZINC000809739184 1048511136 /nfs/dbraw/zinc/51/11/36/1048511136.db2.gz AHXNJBGCUNDDOQ-UHFFFAOYSA-N 2 1 331.891 4.127 20 0 EIADMP Cc1cc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc2cccnc12 ZINC000809738834 1048512208 /nfs/dbraw/zinc/51/22/08/1048512208.db2.gz MCDAUUYZJXRDKD-UHFFFAOYSA-N 2 1 333.479 4.237 20 0 EIADMP CC(C)Oc1ccccc1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000809738764 1048512806 /nfs/dbraw/zinc/51/28/06/1048512806.db2.gz IRMLGNXEMCXKGC-UHFFFAOYSA-N 2 1 326.484 4.167 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1c[nH]c2nc(Cl)ccc12 ZINC001144415866 1048651222 /nfs/dbraw/zinc/65/12/22/1048651222.db2.gz OQBDGSFXXMHGPJ-JKSUJKDBSA-N 2 1 346.906 4.055 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1c[nH]c2nc(Cl)ccc12 ZINC001144415866 1048651227 /nfs/dbraw/zinc/65/12/27/1048651227.db2.gz OQBDGSFXXMHGPJ-JKSUJKDBSA-N 2 1 346.906 4.055 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1c[nH]c2nc(Cl)ccc12 ZINC001144415866 1048651235 /nfs/dbraw/zinc/65/12/35/1048651235.db2.gz OQBDGSFXXMHGPJ-JKSUJKDBSA-N 2 1 346.906 4.055 20 0 EIADMP Cc1cc2cc(C[NH2+]CCCC[N@H+]3C[C@@H](C)O[C@@H](C)C3)oc2cc1C ZINC000237609297 1048968931 /nfs/dbraw/zinc/96/89/31/1048968931.db2.gz ZBQHAZJUHAPWKJ-HDICACEKSA-N 2 1 344.499 4.029 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C[C@@H](O)c1cccc(Cl)c1 ZINC000818962350 1049215998 /nfs/dbraw/zinc/21/59/98/1049215998.db2.gz PENBANIVHAUBQA-HXUWFJFHSA-N 2 1 346.902 4.003 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)C[C@@H]1c1ccccc1 ZINC000517045140 1049375133 /nfs/dbraw/zinc/37/51/33/1049375133.db2.gz UQDGZIRZQCGVKR-JKLQHZFJSA-N 2 1 338.470 4.497 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)C[C@@H]1c1ccccc1 ZINC000517045140 1049375147 /nfs/dbraw/zinc/37/51/47/1049375147.db2.gz UQDGZIRZQCGVKR-JKLQHZFJSA-N 2 1 338.470 4.497 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H](c2ccccc2)N(C)C)cc1 ZINC000348130214 1049435258 /nfs/dbraw/zinc/43/52/58/1049435258.db2.gz KFVCIDKKHZTKJJ-HTAPYJJXSA-N 2 1 348.494 4.134 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCO[C@@H]2CC(C)C)cc1 ZINC000348195760 1049467040 /nfs/dbraw/zinc/46/70/40/1049467040.db2.gz YHEDXTFPPFFMPP-ORYQWCPZSA-N 2 1 341.499 4.425 20 0 EIADMP C[N@H+]1CCC[C@H](CN[C@@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809855 1049554451 /nfs/dbraw/zinc/55/44/51/1049554451.db2.gz JKVFQGSTGJAMRY-BEFAXECRSA-N 2 1 332.875 4.148 20 0 EIADMP CN1CCC[C@H](C[NH2+][C@@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809855 1049554467 /nfs/dbraw/zinc/55/44/67/1049554467.db2.gz JKVFQGSTGJAMRY-BEFAXECRSA-N 2 1 332.875 4.148 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809855 1049554484 /nfs/dbraw/zinc/55/44/84/1049554484.db2.gz JKVFQGSTGJAMRY-BEFAXECRSA-N 2 1 332.875 4.148 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809855 1049554501 /nfs/dbraw/zinc/55/45/01/1049554501.db2.gz JKVFQGSTGJAMRY-BEFAXECRSA-N 2 1 332.875 4.148 20 0 EIADMP CC(C)COC[C@H]([NH2+][C@H](C)c1cccc(C[NH+](C)C)c1)c1ccco1 ZINC000820808375 1049555864 /nfs/dbraw/zinc/55/58/64/1049555864.db2.gz DPIXASSLUBGTHB-XLIONFOSSA-N 2 1 344.499 4.406 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@@H]2CCc3c(F)cccc3C2)CC1 ZINC001171413608 1049644133 /nfs/dbraw/zinc/64/41/33/1049644133.db2.gz HWOLOUXLANFNET-BHIYHBOVSA-N 2 1 330.491 4.198 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2c(F)cccc2C1 ZINC001171439394 1049691709 /nfs/dbraw/zinc/69/17/09/1049691709.db2.gz YKEDZPQBCRVPBI-FHWLQOOXSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@H]1CCc2c(F)cccc2C1 ZINC001171439394 1049691729 /nfs/dbraw/zinc/69/17/29/1049691729.db2.gz YKEDZPQBCRVPBI-FHWLQOOXSA-N 2 1 330.491 4.022 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1OC ZINC000245419587 1049715385 /nfs/dbraw/zinc/71/53/85/1049715385.db2.gz BQCANOFDKOKIMO-DLBZAZTESA-N 2 1 334.504 4.009 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171472723 1049728345 /nfs/dbraw/zinc/72/83/45/1049728345.db2.gz QHJWBIUZTVOHLM-WDSOQIARSA-N 2 1 348.481 4.337 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](CCc3ccccc3)CC1)C2 ZINC001171555990 1049753770 /nfs/dbraw/zinc/75/37/70/1049753770.db2.gz GGVJHBZDKIOJRO-QHCPKHFHSA-N 2 1 348.534 4.149 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000245510982 1049758432 /nfs/dbraw/zinc/75/84/32/1049758432.db2.gz XJQHXCPXLJSKJB-CBBWQLFWSA-N 2 1 328.422 4.270 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000245510982 1049758440 /nfs/dbraw/zinc/75/84/40/1049758440.db2.gz XJQHXCPXLJSKJB-CBBWQLFWSA-N 2 1 328.422 4.270 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001171567392 1049758843 /nfs/dbraw/zinc/75/88/43/1049758843.db2.gz PRBKHBYUEUAVKZ-NRFANRHFSA-N 2 1 338.539 4.193 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2ccccc2N2CCCCC2)CC1(C)C ZINC001171625330 1049768709 /nfs/dbraw/zinc/76/87/09/1049768709.db2.gz HPONQRPEBLUBHE-UHFFFAOYSA-N 2 1 343.559 4.418 20 0 EIADMP Cc1ccc(CC[C@H](C)[N@@H+](C2CCOCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001171666488 1049772368 /nfs/dbraw/zinc/77/23/68/1049772368.db2.gz YBVCCKNMIKVGNG-JBACZVJFSA-N 2 1 344.543 4.067 20 0 EIADMP C[N@@H+](CC[C@H]1CC1(Cl)Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000822654605 1049781708 /nfs/dbraw/zinc/78/17/08/1049781708.db2.gz NTGAGONNOWMHJP-SJORKVTESA-N 2 1 341.326 4.024 20 0 EIADMP Cc1ccc2c(c1)c(CC[NH3+])cn2[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727766 1049785266 /nfs/dbraw/zinc/78/52/66/1049785266.db2.gz XPSVBZMJBISYAB-RXVVDRJESA-N 2 1 347.506 4.286 20 0 EIADMP C[C@H]([NH3+])c1ccc2c(ccn2[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC001171726746 1049785689 /nfs/dbraw/zinc/78/56/89/1049785689.db2.gz HYUKEBSYGJXHJT-WWMYMODYSA-N 2 1 333.479 4.497 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)[C@@H]2Cc3cccc(F)c3C2)CC1 ZINC001171785435 1049803651 /nfs/dbraw/zinc/80/36/51/1049803651.db2.gz NIHHWFMPKBQFKI-VAMGGRTRSA-N 2 1 344.518 4.445 20 0 EIADMP C[C@H]1CC([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C[C@H](C)O1 ZINC000813789098 1049816269 /nfs/dbraw/zinc/81/62/69/1049816269.db2.gz IWJKEGUIUDKHAG-BJVIOOSJSA-N 2 1 342.527 4.118 20 0 EIADMP CCC[NH+](CCC)CCN[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964712 1049826288 /nfs/dbraw/zinc/82/62/88/1049826288.db2.gz HGELNKDAIZLUNH-NRFANRHFSA-N 2 1 345.575 4.141 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+](C2CCCC2)C1 ZINC001171967335 1049827642 /nfs/dbraw/zinc/82/76/42/1049827642.db2.gz ZVWQDBMYADEMCK-WMLDXEAASA-N 2 1 340.433 4.243 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+](C2CCCC2)C1 ZINC001171967335 1049827643 /nfs/dbraw/zinc/82/76/43/1049827643.db2.gz ZVWQDBMYADEMCK-WMLDXEAASA-N 2 1 340.433 4.243 20 0 EIADMP CC1(C)C[C@@H](Nc2cccc(F)c2C[NH3+])CC[N@H+]1Cc1ccccc1 ZINC001171967704 1049827939 /nfs/dbraw/zinc/82/79/39/1049827939.db2.gz MWUVPQVTWSFRPQ-KRWDZBQOSA-N 2 1 341.474 4.140 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cccc(O)c1 ZINC001171967891 1049828282 /nfs/dbraw/zinc/82/82/82/1049828282.db2.gz NXPATKNCGAOEEB-YLJYHZDGSA-N 2 1 338.495 4.486 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccc(O)c1 ZINC001171967891 1049828284 /nfs/dbraw/zinc/82/82/84/1049828284.db2.gz NXPATKNCGAOEEB-YLJYHZDGSA-N 2 1 338.495 4.486 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccn1 ZINC000813881273 1049830331 /nfs/dbraw/zinc/83/03/31/1049830331.db2.gz NELUWNOIFSTXJW-LBFURVHYSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC000813881273 1049830332 /nfs/dbraw/zinc/83/03/32/1049830332.db2.gz NELUWNOIFSTXJW-LBFURVHYSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@@H](NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cncs1 ZINC000813881354 1049830901 /nfs/dbraw/zinc/83/09/01/1049830901.db2.gz OXOAUVKFXLQOGL-BPIHKTFHSA-N 2 1 341.524 4.379 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cncs1 ZINC000813881354 1049830907 /nfs/dbraw/zinc/83/09/07/1049830907.db2.gz OXOAUVKFXLQOGL-BPIHKTFHSA-N 2 1 341.524 4.379 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCC2(O)CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001171969747 1049833820 /nfs/dbraw/zinc/83/38/20/1049833820.db2.gz WHPGEHBALYKVJW-FQEVSTJZSA-N 2 1 344.543 4.105 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCCC(F)(F)F)CC[N@H+]1Cc1ccccc1 ZINC001171974157 1049835542 /nfs/dbraw/zinc/83/55/42/1049835542.db2.gz CLRKUUYUIZJXLX-INIZCTEOSA-N 2 1 328.422 4.362 20 0 EIADMP CC1(C)C[C@@H](n2c(C[NH3+])cc3ccncc32)CC[N@H+]1Cc1ccccc1 ZINC001171974576 1049836347 /nfs/dbraw/zinc/83/63/47/1049836347.db2.gz HSSYHOBXOXGMRZ-IBGZPJMESA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2ccc3ocnc3c2)CC[N@H+]1Cc1ccccc1 ZINC001171976893 1049837887 /nfs/dbraw/zinc/83/78/87/1049837887.db2.gz VBULHLRRURBDPW-LJQANCHMSA-N 2 1 349.478 4.361 20 0 EIADMP CC1(C)C[C@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CCO1 ZINC001171978673 1049838456 /nfs/dbraw/zinc/83/84/56/1049838456.db2.gz IJPMVEBTECYQFG-UXHICEINSA-N 2 1 344.543 4.224 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CCCc3cnccc32)CC[N@H+]1Cc1ccccc1 ZINC001171980485 1049838660 /nfs/dbraw/zinc/83/86/60/1049838660.db2.gz VNXRCFCSOBXWHF-RBBKRZOGSA-N 2 1 349.522 4.492 20 0 EIADMP CC(C)OC1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980398 1049838982 /nfs/dbraw/zinc/83/89/82/1049838982.db2.gz DZYYRLCIRDPVHH-HXUWFJFHSA-N 2 1 344.543 4.319 20 0 EIADMP Cc1cc2c(cn1)[C@@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)C(C)(C)C1)CC2 ZINC001171980594 1049839061 /nfs/dbraw/zinc/83/90/61/1049839061.db2.gz RTFVZJFWPPLRQZ-UNMCSNQZSA-N 2 1 349.522 4.410 20 0 EIADMP CC1(C)C[C@H](N2CC[C@H]([NH3+])c3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC001171984473 1049839931 /nfs/dbraw/zinc/83/99/31/1049839931.db2.gz WBDLPIVSTRLZID-CTNGQTDRSA-N 2 1 349.522 4.340 20 0 EIADMP FC[C@H]1CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172074129 1049844003 /nfs/dbraw/zinc/84/40/03/1049844003.db2.gz FURMTDYIBZZTPI-CGXNFDGLSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@H]1CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172074129 1049844005 /nfs/dbraw/zinc/84/40/05/1049844005.db2.gz FURMTDYIBZZTPI-CGXNFDGLSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172074129 1049844010 /nfs/dbraw/zinc/84/40/10/1049844010.db2.gz FURMTDYIBZZTPI-CGXNFDGLSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172074129 1049844013 /nfs/dbraw/zinc/84/40/13/1049844013.db2.gz FURMTDYIBZZTPI-CGXNFDGLSA-N 2 1 330.491 4.254 20 0 EIADMP CCCO[C@H]1CC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076486 1049845030 /nfs/dbraw/zinc/84/50/30/1049845030.db2.gz ZOQFPJVFVLRDEC-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP CCCO[C@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172076486 1049845032 /nfs/dbraw/zinc/84/50/32/1049845032.db2.gz ZOQFPJVFVLRDEC-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP CCCO[C@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172076486 1049845035 /nfs/dbraw/zinc/84/50/35/1049845035.db2.gz ZOQFPJVFVLRDEC-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP CC[N@H+](C1CCOCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172073874 1049845183 /nfs/dbraw/zinc/84/51/83/1049845183.db2.gz DRAPAZPAALLZJG-KOUNCHBCSA-N 2 1 342.527 4.073 20 0 EIADMP CC[N@@H+](C1CCOCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172073874 1049845187 /nfs/dbraw/zinc/84/51/87/1049845187.db2.gz DRAPAZPAALLZJG-KOUNCHBCSA-N 2 1 342.527 4.073 20 0 EIADMP CC[NH+](C1CCOCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172073874 1049845191 /nfs/dbraw/zinc/84/51/91/1049845191.db2.gz DRAPAZPAALLZJG-KOUNCHBCSA-N 2 1 342.527 4.073 20 0 EIADMP CC[NH+](C1CCOCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172073874 1049845195 /nfs/dbraw/zinc/84/51/95/1049845195.db2.gz DRAPAZPAALLZJG-KOUNCHBCSA-N 2 1 342.527 4.073 20 0 EIADMP Oc1cccc(CN[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172063326 1049849760 /nfs/dbraw/zinc/84/97/60/1049849760.db2.gz YAQXKGLSUKHFPH-WKCHPHFGSA-N 2 1 336.479 4.068 20 0 EIADMP Oc1cccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172063326 1049849767 /nfs/dbraw/zinc/84/97/67/1049849767.db2.gz YAQXKGLSUKHFPH-WKCHPHFGSA-N 2 1 336.479 4.068 20 0 EIADMP C[C@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062338 1049849907 /nfs/dbraw/zinc/84/99/07/1049849907.db2.gz NELUWNOIFSTXJW-WJMWBRGCSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062338 1049849910 /nfs/dbraw/zinc/84/99/10/1049849910.db2.gz NELUWNOIFSTXJW-WJMWBRGCSA-N 2 1 335.495 4.318 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CC[C@@H]2CCCCO2)C3)cc1 ZINC001172062534 1049849944 /nfs/dbraw/zinc/84/99/44/1049849944.db2.gz OZDJKRIVBBWXFB-KJJMTIBFSA-N 2 1 342.527 4.121 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CCCc2cccnc2)C3)cc1 ZINC001172063741 1049850918 /nfs/dbraw/zinc/85/09/18/1049850918.db2.gz CWSBTIQIPJKTLN-WBDAEOGXSA-N 2 1 349.522 4.190 20 0 EIADMP Cc1ncc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC001172067849 1049851110 /nfs/dbraw/zinc/85/11/10/1049851110.db2.gz OEVCUOHGJHPKPO-LDLYASANSA-N 2 1 341.524 4.127 20 0 EIADMP Cc1ncc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)s1 ZINC001172067849 1049851113 /nfs/dbraw/zinc/85/11/13/1049851113.db2.gz OEVCUOHGJHPKPO-LDLYASANSA-N 2 1 341.524 4.127 20 0 EIADMP FC(F)(F)CC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067234 1049851218 /nfs/dbraw/zinc/85/12/18/1049851218.db2.gz LXXQMCHYXBVDFG-OSYLJGHBSA-N 2 1 326.406 4.114 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1c3ccccc3nc1[C@H]1CCCC[NH2+]1)C2 ZINC001172127733 1049852504 /nfs/dbraw/zinc/85/25/04/1049852504.db2.gz LFFHMQPUOPSZTD-VUHPKUFZSA-N 2 1 338.499 4.039 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1c3ccccc3nc1[C@@H]1CCCC[NH2+]1)C2 ZINC001172127729 1049852946 /nfs/dbraw/zinc/85/29/46/1049852946.db2.gz LFFHMQPUOPSZTD-FAJBIJEISA-N 2 1 338.499 4.039 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCCOC2CCCC2)C3)cc1 ZINC000245778289 1049854549 /nfs/dbraw/zinc/85/45/49/1049854549.db2.gz YLGQGXSELFQXNX-MZADTFQBSA-N 2 1 342.527 4.121 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C2 ZINC001172102628 1049855566 /nfs/dbraw/zinc/85/55/66/1049855566.db2.gz NRERYFLMFYSSFN-BTTYYORXSA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C2 ZINC001172102629 1049856060 /nfs/dbraw/zinc/85/60/60/1049856060.db2.gz NRERYFLMFYSSFN-ZSOGYDGISA-N 2 1 346.824 4.464 20 0 EIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1C(F)(F)F ZINC001172106007 1049857507 /nfs/dbraw/zinc/85/75/07/1049857507.db2.gz MDTDWHUTXURRPI-MUJYYYPQSA-N 2 1 326.406 4.119 20 0 EIADMP Cc1c(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cccc1C(F)(F)F ZINC001172106225 1049857698 /nfs/dbraw/zinc/85/76/98/1049857698.db2.gz NREYQCFCLXXIJD-MUJYYYPQSA-N 2 1 326.406 4.119 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(c3ccc(F)cc3F)CC1)C2 ZINC001172129479 1049857979 /nfs/dbraw/zinc/85/79/79/1049857979.db2.gz AWGCJPVHDUXAMC-BCDXTJNWSA-N 2 1 334.454 4.160 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(c3ccc(F)cc3F)CC1)C2 ZINC001172129479 1049857980 /nfs/dbraw/zinc/85/79/80/1049857980.db2.gz AWGCJPVHDUXAMC-BCDXTJNWSA-N 2 1 334.454 4.160 20 0 EIADMP C[N@H+](Cc1cccc(Cl)c1Cl)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172120958 1049858264 /nfs/dbraw/zinc/85/82/64/1049858264.db2.gz AKRGHTMYBPZFPY-QDMKHBRRSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@@H+](Cc1cccc(Cl)c1Cl)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172120958 1049858268 /nfs/dbraw/zinc/85/82/68/1049858268.db2.gz AKRGHTMYBPZFPY-QDMKHBRRSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1cccc(Cl)c1Cl)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172120958 1049858271 /nfs/dbraw/zinc/85/82/71/1049858271.db2.gz AKRGHTMYBPZFPY-QDMKHBRRSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1cccc(Cl)c1Cl)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172120958 1049858273 /nfs/dbraw/zinc/85/82/73/1049858273.db2.gz AKRGHTMYBPZFPY-QDMKHBRRSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Oc3ccccc3Cl)CC1)C2 ZINC001172123143 1049859281 /nfs/dbraw/zinc/85/92/81/1049859281.db2.gz YMKVJIAIJJPDDP-FVQHAEBGSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Oc3ccccc3Cl)CC1)C2 ZINC001172123143 1049859285 /nfs/dbraw/zinc/85/92/85/1049859285.db2.gz YMKVJIAIJJPDDP-FVQHAEBGSA-N 2 1 348.918 4.199 20 0 EIADMP COc1cccc([C@H]2CCCC[N@@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172124242 1049859640 /nfs/dbraw/zinc/85/96/40/1049859640.db2.gz JTGJLQZFFFBPMS-RCLSDMTESA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@H]2CCCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172124242 1049859646 /nfs/dbraw/zinc/85/96/46/1049859646.db2.gz JTGJLQZFFFBPMS-RCLSDMTESA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@H]2CCCC[NH+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172124242 1049859650 /nfs/dbraw/zinc/85/96/50/1049859650.db2.gz JTGJLQZFFFBPMS-RCLSDMTESA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@H]2CCCC[NH+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172124242 1049859652 /nfs/dbraw/zinc/85/96/52/1049859652.db2.gz JTGJLQZFFFBPMS-RCLSDMTESA-N 2 1 328.500 4.238 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccccn1 ZINC000245836548 1049859667 /nfs/dbraw/zinc/85/96/67/1049859667.db2.gz AQWCYSGSEPENMI-GUDVDZBRSA-N 2 1 337.511 4.410 20 0 EIADMP CCOc1ccc([C@@H]2CCC[N@@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)cc1 ZINC001172124109 1049859834 /nfs/dbraw/zinc/85/98/34/1049859834.db2.gz JMLRWYHYHBEQJV-PXCRPINLSA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@@H]2CCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)cc1 ZINC001172124109 1049859837 /nfs/dbraw/zinc/85/98/37/1049859837.db2.gz JMLRWYHYHBEQJV-PXCRPINLSA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@@H]2CCC[NH+]2[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172124109 1049859840 /nfs/dbraw/zinc/85/98/40/1049859840.db2.gz JMLRWYHYHBEQJV-PXCRPINLSA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@@H]2CCC[NH+]2[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172124109 1049859843 /nfs/dbraw/zinc/85/98/43/1049859843.db2.gz JMLRWYHYHBEQJV-PXCRPINLSA-N 2 1 328.500 4.238 20 0 EIADMP C[C@@H](Cc1ccoc1)Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000823555624 1049860522 /nfs/dbraw/zinc/86/05/22/1049860522.db2.gz ZHXCXMUYLHNMFN-KRWDZBQOSA-N 2 1 341.499 4.101 20 0 EIADMP CC(C)(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CSc2ccccc2C1 ZINC001172199243 1049869838 /nfs/dbraw/zinc/86/98/38/1049869838.db2.gz UEWMTECKUXQVBA-BZSNNMDCSA-N 2 1 332.557 4.321 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)C[C@@H]1C ZINC001172381011 1049886219 /nfs/dbraw/zinc/88/62/19/1049886219.db2.gz ZSPZFTBVVNIWFL-DYXWJJEUSA-N 2 1 341.543 4.194 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC([NH3+])(c2ccc(Cl)cc2)CC1 ZINC001172335059 1049886739 /nfs/dbraw/zinc/88/67/39/1049886739.db2.gz NVNNWPKZVPFNRE-HZPDHXFCSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC([NH3+])(c2ccc(Cl)cc2)CC1 ZINC001172335053 1049886756 /nfs/dbraw/zinc/88/67/56/1049886756.db2.gz NVNNWPKZVPFNRE-CVEARBPZSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001172352510 1049892488 /nfs/dbraw/zinc/89/24/88/1049892488.db2.gz ICKJDOXABLYJDN-MOPGFXCFSA-N 2 1 344.543 4.103 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001172352510 1049892490 /nfs/dbraw/zinc/89/24/90/1049892490.db2.gz ICKJDOXABLYJDN-MOPGFXCFSA-N 2 1 344.543 4.103 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001172352503 1049892522 /nfs/dbraw/zinc/89/25/22/1049892522.db2.gz RMBMFKDIESEKDC-RBUKOAKNSA-N 2 1 332.532 4.224 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C ZINC001172353462 1049893379 /nfs/dbraw/zinc/89/33/79/1049893379.db2.gz XAHPKWRBVBHRPK-VMBXEPDQSA-N 2 1 346.559 4.328 20 0 EIADMP CCOCC[C@@H](C)[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001172427495 1049901496 /nfs/dbraw/zinc/90/14/96/1049901496.db2.gz OXTMPMIBXBNNMO-MRXNPFEDSA-N 2 1 338.923 4.051 20 0 EIADMP CCOCC[C@@H](C)[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001172427495 1049901504 /nfs/dbraw/zinc/90/15/04/1049901504.db2.gz OXTMPMIBXBNNMO-MRXNPFEDSA-N 2 1 338.923 4.051 20 0 EIADMP CC(C)OCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172436702 1049912373 /nfs/dbraw/zinc/91/23/73/1049912373.db2.gz HHVGBJKSTISEAM-ICSRJNTNSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)OCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172436702 1049912379 /nfs/dbraw/zinc/91/23/79/1049912379.db2.gz HHVGBJKSTISEAM-ICSRJNTNSA-N 2 1 332.532 4.080 20 0 EIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccc3ccc(-c4ccccc4)nc3c2)CC[C@H]1F ZINC001206164551 1049918256 /nfs/dbraw/zinc/91/82/56/1049918256.db2.gz KJNRYCBRSYEWMW-UXHICEINSA-N 2 1 349.453 4.163 20 0 EIADMP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@@H]1CCC[N@@H+](C)CC1 ZINC001172576991 1049931196 /nfs/dbraw/zinc/93/11/96/1049931196.db2.gz QLAKXGGTKDLWKQ-GXTWGEPZSA-N 2 1 330.850 4.013 20 0 EIADMP [NH3+]C1(c2ccccc2F)CC[NH+]([C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172557508 1049931872 /nfs/dbraw/zinc/93/18/72/1049931872.db2.gz PWBPRDQEFURMET-MOPGFXCFSA-N 2 1 338.470 4.412 20 0 EIADMP Cc1nccn1CCCC[N@@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000246257028 1049938478 /nfs/dbraw/zinc/93/84/78/1049938478.db2.gz KHBSFDVAOVQCHZ-LPHOPBHVSA-N 2 1 329.513 4.150 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000246257028 1049938484 /nfs/dbraw/zinc/93/84/84/1049938484.db2.gz KHBSFDVAOVQCHZ-LPHOPBHVSA-N 2 1 329.513 4.150 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000246257028 1049938495 /nfs/dbraw/zinc/93/84/95/1049938495.db2.gz KHBSFDVAOVQCHZ-LPHOPBHVSA-N 2 1 329.513 4.150 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](c2cc(C)ccc2C)OC[C@@H]1C ZINC000246270495 1049943007 /nfs/dbraw/zinc/94/30/07/1049943007.db2.gz MIXYFZLFKMLBDK-RXVVDRJESA-N 2 1 341.499 4.051 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](c2cc(C)ccc2C)OC[C@@H]1C ZINC000246270495 1049943014 /nfs/dbraw/zinc/94/30/14/1049943014.db2.gz MIXYFZLFKMLBDK-RXVVDRJESA-N 2 1 341.499 4.051 20 0 EIADMP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+](C2CCC3(CCCC3)CC2)CC1 ZINC001172729938 1049968965 /nfs/dbraw/zinc/96/89/65/1049968965.db2.gz OHGNATILXHKHMS-FQEVSTJZSA-N 2 1 334.548 4.065 20 0 EIADMP [NH3+][C@@H]1CC[N@H+](Cc2ccccc2Oc2cccc(Cl)c2)CC[C@@H]1F ZINC001206174477 1049971492 /nfs/dbraw/zinc/97/14/92/1049971492.db2.gz NFBYGAVVGAUBSW-ZWKOTPCHSA-N 2 1 348.849 4.394 20 0 EIADMP [NH3+][C@@H]1CC[N@@H+](Cc2ccccc2Oc2cccc(Cl)c2)CC[C@@H]1F ZINC001206174477 1049971497 /nfs/dbraw/zinc/97/14/97/1049971497.db2.gz NFBYGAVVGAUBSW-ZWKOTPCHSA-N 2 1 348.849 4.394 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)[C@H](C)c2nc3ccccc3s2)C1 ZINC000246968517 1050007399 /nfs/dbraw/zinc/00/73/99/1050007399.db2.gz JGIVLSNKGKSIEI-ULQDDVLXSA-N 2 1 345.556 4.498 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1cncc(F)c1 ZINC000246959030 1050008150 /nfs/dbraw/zinc/00/81/50/1050008150.db2.gz ILVWQLCTZKDODH-DLBZAZTESA-N 2 1 341.474 4.446 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)C1 ZINC000247003921 1050010121 /nfs/dbraw/zinc/01/01/21/1050010121.db2.gz LUAGKWYTEXZGFO-KGLIPLIRSA-N 2 1 344.421 4.198 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)C1 ZINC000247003921 1050010123 /nfs/dbraw/zinc/01/01/23/1050010123.db2.gz LUAGKWYTEXZGFO-KGLIPLIRSA-N 2 1 344.421 4.198 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)cc1 ZINC000247217224 1050017083 /nfs/dbraw/zinc/01/70/83/1050017083.db2.gz XJIZVPYKWWMANL-RBUKOAKNSA-N 2 1 338.495 4.067 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)cc1 ZINC000247217224 1050017093 /nfs/dbraw/zinc/01/70/93/1050017093.db2.gz XJIZVPYKWWMANL-RBUKOAKNSA-N 2 1 338.495 4.067 20 0 EIADMP CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000247236887 1050017958 /nfs/dbraw/zinc/01/79/58/1050017958.db2.gz WPOSIRPPBIMXRY-CWFSZBLJSA-N 2 1 347.547 4.308 20 0 EIADMP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000247236876 1050018501 /nfs/dbraw/zinc/01/85/01/1050018501.db2.gz WPOSIRPPBIMXRY-CDHQVMDDSA-N 2 1 347.547 4.308 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cnn1C(C)(C)C ZINC000248713472 1050074343 /nfs/dbraw/zinc/07/43/43/1050074343.db2.gz QVAHCMPZCNMFOT-IAGOWNOFSA-N 2 1 334.552 4.252 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1cccc(O)c1 ZINC000249380537 1050097209 /nfs/dbraw/zinc/09/72/09/1050097209.db2.gz BECWMRSHCLBGMU-QZTJIDSGSA-N 2 1 338.495 4.475 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](CCc3ccccc3)CC1)CC2 ZINC001172833638 1050168554 /nfs/dbraw/zinc/16/85/54/1050168554.db2.gz AFGYWHOHZIIRCK-XMMPIXPASA-N 2 1 348.534 4.149 20 0 EIADMP Fc1ccc(/C=C/C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)c(F)c1 ZINC001177245028 1050172892 /nfs/dbraw/zinc/17/28/92/1050172892.db2.gz KROOOTLWXJDBBK-XVNBXDOJSA-N 2 1 342.433 4.016 20 0 EIADMP Fc1ccc(/C=C/C[NH2+]CCC[N@H+]2CCc3ccccc3C2)c(F)c1 ZINC001177245028 1050172895 /nfs/dbraw/zinc/17/28/95/1050172895.db2.gz KROOOTLWXJDBBK-XVNBXDOJSA-N 2 1 342.433 4.016 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)C[C@@H]1C)CC2 ZINC001172837772 1050173038 /nfs/dbraw/zinc/17/30/38/1050173038.db2.gz MWUAHBKSJWLZRK-IEXUWNMDSA-N 2 1 348.534 4.353 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)C[C@@H]1C)CC2 ZINC001172837772 1050173043 /nfs/dbraw/zinc/17/30/43/1050173043.db2.gz MWUAHBKSJWLZRK-IEXUWNMDSA-N 2 1 348.534 4.353 20 0 EIADMP CCc1cnc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)s1 ZINC001177267019 1050183270 /nfs/dbraw/zinc/18/32/70/1050183270.db2.gz GUAHZBNLVQKQLP-MRXNPFEDSA-N 2 1 343.540 4.370 20 0 EIADMP CCc1cnc(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)s1 ZINC001177267019 1050183277 /nfs/dbraw/zinc/18/32/77/1050183277.db2.gz GUAHZBNLVQKQLP-MRXNPFEDSA-N 2 1 343.540 4.370 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H](C)Cc2c(F)cccc2Cl)CC1 ZINC001172851563 1050190040 /nfs/dbraw/zinc/19/00/40/1050190040.db2.gz APWSMVTYBKLFAF-OAHLLOKOSA-N 2 1 340.914 4.462 20 0 EIADMP C[C@H](Cc1ccc(F)cc1Cl)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001172860344 1050199259 /nfs/dbraw/zinc/19/92/59/1050199259.db2.gz CMWHILMRNJKCCY-HUUCEWRRSA-N 2 1 326.887 4.251 20 0 EIADMP CO[C@@H]1CCC[C@H]([N@@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928124 1050238892 /nfs/dbraw/zinc/23/88/92/1050238892.db2.gz IXZRQQUZHITUAG-XSDIEEQYSA-N 2 1 330.516 4.025 20 0 EIADMP CO[C@H]1CCC[C@H]([N@@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172927987 1050239072 /nfs/dbraw/zinc/23/90/72/1050239072.db2.gz IETBPSYETATTOD-TUFLPTIASA-N 2 1 330.516 4.025 20 0 EIADMP CC(C)[C@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)c1ccccc1 ZINC000091265858 1050245040 /nfs/dbraw/zinc/24/50/40/1050245040.db2.gz SCLNWOKDKGKXOA-QFIPXVFZSA-N 2 1 338.495 4.006 20 0 EIADMP CCCC[N@H+]1CCCC[C@H]1CNC1CC[NH+](C2CCCCC2)CC1 ZINC001177744126 1050291985 /nfs/dbraw/zinc/29/19/85/1050291985.db2.gz RSXMYEQMKFCAPP-NRFANRHFSA-N 2 1 335.580 4.028 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@H](C)CC2CCCCC2)[C@@H](C)C1 ZINC001177843946 1050312019 /nfs/dbraw/zinc/31/20/19/1050312019.db2.gz ICRPCABPNQPXQC-DYXWJJEUSA-N 2 1 338.580 4.320 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@@H](C)CC2CCCCC2)[C@H](C)C1 ZINC001177843949 1050313492 /nfs/dbraw/zinc/31/34/92/1050313492.db2.gz ICRPCABPNQPXQC-ZVDOUQERSA-N 2 1 338.580 4.320 20 0 EIADMP C[C@@H]1CCCC[C@H]1CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001177860131 1050316763 /nfs/dbraw/zinc/31/67/63/1050316763.db2.gz RMLREGNFDYWCCW-CTNGQTDRSA-N 2 1 328.544 4.500 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)[C@H]2CCc3ncsc3C2)CC1 ZINC001173125806 1050318890 /nfs/dbraw/zinc/31/88/90/1050318890.db2.gz HZYZFERAWHBGOJ-BZSNNMDCSA-N 2 1 347.572 4.153 20 0 EIADMP Cc1cc(C[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cnc1Cl ZINC001177963303 1050332349 /nfs/dbraw/zinc/33/23/49/1050332349.db2.gz ZUWIWGJWDCZTJE-INIZCTEOSA-N 2 1 331.891 4.044 20 0 EIADMP Cc1cc(C[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)cnc1Cl ZINC001177963303 1050332353 /nfs/dbraw/zinc/33/23/53/1050332353.db2.gz ZUWIWGJWDCZTJE-INIZCTEOSA-N 2 1 331.891 4.044 20 0 EIADMP Cc1ccc(C[NH2+]CCC[NH+](C(C)C)C(C)C)cc1Br ZINC001177948603 1050346601 /nfs/dbraw/zinc/34/66/01/1050346601.db2.gz KPNGZWMXKJZESR-UHFFFAOYSA-N 2 1 341.337 4.356 20 0 EIADMP Cc1ccc(C[N@@H+](CCc2ccccc2)CCn2cc[nH+]c2C)s1 ZINC000618481559 1050390444 /nfs/dbraw/zinc/39/04/44/1050390444.db2.gz JXBIBIUCQDKCEC-UHFFFAOYSA-N 2 1 339.508 4.306 20 0 EIADMP Cc1ccc(C[N@H+](CCc2ccccc2)CCn2cc[nH+]c2C)s1 ZINC000618481559 1050390458 /nfs/dbraw/zinc/39/04/58/1050390458.db2.gz JXBIBIUCQDKCEC-UHFFFAOYSA-N 2 1 339.508 4.306 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2(C)Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001178188072 1050399880 /nfs/dbraw/zinc/39/98/80/1050399880.db2.gz JRCDUFRZGGKXRE-AUSIDOKSSA-N 2 1 348.534 4.434 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2(C)Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001178188072 1050399890 /nfs/dbraw/zinc/39/98/90/1050399890.db2.gz JRCDUFRZGGKXRE-AUSIDOKSSA-N 2 1 348.534 4.434 20 0 EIADMP CCSC[C@@H](C)[N@@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001173306100 1050404495 /nfs/dbraw/zinc/40/44/95/1050404495.db2.gz LLOWNZHHAGHMCY-TTYHFUOFSA-N 2 1 332.557 4.239 20 0 EIADMP CCSC[C@@H](C)[NH+]1C[C@H]2c3ccccc3[C@H]([N@H+](C)C(C)C)[C@H]2C1 ZINC001173306100 1050404505 /nfs/dbraw/zinc/40/45/05/1050404505.db2.gz LLOWNZHHAGHMCY-TTYHFUOFSA-N 2 1 332.557 4.239 20 0 EIADMP CCSC[C@@H](C)[NH+]1C[C@H]2c3ccccc3[C@H]([N@@H+](C)C(C)C)[C@H]2C1 ZINC001173306100 1050404512 /nfs/dbraw/zinc/40/45/12/1050404512.db2.gz LLOWNZHHAGHMCY-TTYHFUOFSA-N 2 1 332.557 4.239 20 0 EIADMP CCOc1ccc(Cl)cc1C[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC001178248842 1050410684 /nfs/dbraw/zinc/41/06/84/1050410684.db2.gz FWYDZVOWGKAJDZ-INIZCTEOSA-N 2 1 338.923 4.196 20 0 EIADMP CCOc1ccc(Cl)cc1C[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC001178248842 1050410697 /nfs/dbraw/zinc/41/06/97/1050410697.db2.gz FWYDZVOWGKAJDZ-INIZCTEOSA-N 2 1 338.923 4.196 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(Cl)nc2)CC1)CC(C)C ZINC000773731776 1050415743 /nfs/dbraw/zinc/41/57/43/1050415743.db2.gz CLVVFGYPFKESAJ-UHFFFAOYSA-N 2 1 337.939 4.315 20 0 EIADMP CSCc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001178458101 1050474984 /nfs/dbraw/zinc/47/49/84/1050474984.db2.gz PTDPNSDNBIBCTM-APWZRJJASA-N 2 1 332.557 4.292 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)CCc2ccc(Cl)c(Cl)c2)CC1 ZINC001173545213 1050477960 /nfs/dbraw/zinc/47/79/60/1050477960.db2.gz XGTRZFUZIBDUMG-ZDUSSCGKSA-N 2 1 329.315 4.388 20 0 EIADMP C[N@H+]1CCCC[C@H]1C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001178701277 1050533935 /nfs/dbraw/zinc/53/39/35/1050533935.db2.gz HOZCDCFYTDHOSK-HNNXBMFYSA-N 2 1 328.481 4.056 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cccc3c[nH]nc32)CC[N@@H+]1Cc1ccccc1 ZINC000093318226 1050560732 /nfs/dbraw/zinc/56/07/32/1050560732.db2.gz HDEIUPFRWFGURN-UWJYYQICSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cccc3c[nH]nc32)CC[N@H+]1Cc1ccccc1 ZINC000093318226 1050560741 /nfs/dbraw/zinc/56/07/41/1050560741.db2.gz HDEIUPFRWFGURN-UWJYYQICSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2cccc3c[nH]nc32)CC[NH+]1Cc1ccccc1 ZINC000093318226 1050560749 /nfs/dbraw/zinc/56/07/49/1050560749.db2.gz HDEIUPFRWFGURN-UWJYYQICSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cccc3c[nH]nc32)CC[NH+]1Cc1ccccc1 ZINC000093318226 1050560761 /nfs/dbraw/zinc/56/07/61/1050560761.db2.gz HDEIUPFRWFGURN-UWJYYQICSA-N 2 1 348.494 4.048 20 0 EIADMP CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001178932290 1050584539 /nfs/dbraw/zinc/58/45/39/1050584539.db2.gz YHIUAQCCBZWWJF-RTWAWAEBSA-N 2 1 328.544 4.498 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001179024655 1050603363 /nfs/dbraw/zinc/60/33/63/1050603363.db2.gz OAXCISMVKFWALT-TWHAJKEOSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001179024655 1050603368 /nfs/dbraw/zinc/60/33/68/1050603368.db2.gz OAXCISMVKFWALT-TWHAJKEOSA-N 2 1 334.507 4.433 20 0 EIADMP COc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1C ZINC001179205094 1050649104 /nfs/dbraw/zinc/64/91/04/1050649104.db2.gz JHIUIRRSTJJVLO-DYESRHJHSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1C ZINC001179205094 1050649117 /nfs/dbraw/zinc/64/91/17/1050649117.db2.gz JHIUIRRSTJJVLO-DYESRHJHSA-N 2 1 338.495 4.146 20 0 EIADMP C[C@@H](CC[NH2+]Cc1cccc(OCc2ccccc2Cl)c1)[NH+](C)C ZINC001179265856 1050663014 /nfs/dbraw/zinc/66/30/14/1050663014.db2.gz DDQWNXAIWYILQC-INIZCTEOSA-N 2 1 346.902 4.349 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2([C@@H]3CCCCO3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001179429680 1050688524 /nfs/dbraw/zinc/68/85/24/1050688524.db2.gz GIJGPHRLTMCELO-NRSPTQNISA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2([C@@H]3CCCCO3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC001179429680 1050688535 /nfs/dbraw/zinc/68/85/35/1050688535.db2.gz GIJGPHRLTMCELO-NRSPTQNISA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2([C@H]3CCCCO3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001179429678 1050689641 /nfs/dbraw/zinc/68/96/41/1050689641.db2.gz GIJGPHRLTMCELO-HLAWJBBLSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2([C@H]3CCCCO3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC001179429678 1050689645 /nfs/dbraw/zinc/68/96/45/1050689645.db2.gz GIJGPHRLTMCELO-HLAWJBBLSA-N 2 1 342.527 4.121 20 0 EIADMP C[NH+]1CCC(COc2ccccc2Nc2cc[nH+]c3ccccc23)CC1 ZINC001174039433 1050715473 /nfs/dbraw/zinc/71/54/73/1050715473.db2.gz PSUOUJXTIVSXLT-UHFFFAOYSA-N 2 1 347.462 4.121 20 0 EIADMP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3cc(Cl)ccc3OC3CCCC3)[C@H]2C1 ZINC001179817680 1050785152 /nfs/dbraw/zinc/78/51/52/1050785152.db2.gz RMUITMBGBZKFRQ-ZOCIIQOWSA-N 2 1 348.918 4.091 20 0 EIADMP C[N@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3cc(Cl)ccc3OC3CCCC3)[C@H]2C1 ZINC001179817680 1050785164 /nfs/dbraw/zinc/78/51/64/1050785164.db2.gz RMUITMBGBZKFRQ-ZOCIIQOWSA-N 2 1 348.918 4.091 20 0 EIADMP C[N@@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3cc(Cl)ccc3OC3CCCC3)[C@@H]2C1 ZINC001179817677 1050785377 /nfs/dbraw/zinc/78/53/77/1050785377.db2.gz RMUITMBGBZKFRQ-GDIGMMSISA-N 2 1 348.918 4.091 20 0 EIADMP C[N@H+]1C[C@@H]2CC[C@@H]([NH2+]Cc3cc(Cl)ccc3OC3CCCC3)[C@@H]2C1 ZINC001179817677 1050785387 /nfs/dbraw/zinc/78/53/87/1050785387.db2.gz RMUITMBGBZKFRQ-GDIGMMSISA-N 2 1 348.918 4.091 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1 ZINC001179816797 1050786022 /nfs/dbraw/zinc/78/60/22/1050786022.db2.gz NTXGFHPXNHPHEP-SESVDKBCSA-N 2 1 330.516 4.076 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc3ccnc(Cl)c3s2)C[C@@H]1C ZINC001179899195 1050806349 /nfs/dbraw/zinc/80/63/49/1050806349.db2.gz ZIUJLKSTQUOODP-GXTWGEPZSA-N 2 1 337.920 4.254 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3ccnc(Cl)c3s2)C[C@@H]1C ZINC001179899195 1050806350 /nfs/dbraw/zinc/80/63/50/1050806350.db2.gz ZIUJLKSTQUOODP-GXTWGEPZSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc3ccnc(Cl)c3s2)C[C@@H]1C ZINC001179899195 1050806353 /nfs/dbraw/zinc/80/63/53/1050806353.db2.gz ZIUJLKSTQUOODP-GXTWGEPZSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc3ccnc(Cl)c3s2)C[C@@H]1C ZINC001179899195 1050806359 /nfs/dbraw/zinc/80/63/59/1050806359.db2.gz ZIUJLKSTQUOODP-GXTWGEPZSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CCC(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)CC1 ZINC001179942047 1050825959 /nfs/dbraw/zinc/82/59/59/1050825959.db2.gz KZQAUCSQGFTXOY-UHFFFAOYSA-N 2 1 326.484 4.322 20 0 EIADMP CC[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1CCC(OC)CC1 ZINC001179945234 1050828119 /nfs/dbraw/zinc/82/81/19/1050828119.db2.gz GFLSUABDPQGTIF-ORFBVSJDSA-N 2 1 344.543 4.036 20 0 EIADMP CC[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC1CCC(OC)CC1 ZINC001179945234 1050828124 /nfs/dbraw/zinc/82/81/24/1050828124.db2.gz GFLSUABDPQGTIF-ORFBVSJDSA-N 2 1 344.543 4.036 20 0 EIADMP CC[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC1CCC(OC)CC1 ZINC001179945234 1050828128 /nfs/dbraw/zinc/82/81/28/1050828128.db2.gz GFLSUABDPQGTIF-ORFBVSJDSA-N 2 1 344.543 4.036 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+](C)CC3CC[NH+](C)CC3)s2)cc1C ZINC001180001581 1050844040 /nfs/dbraw/zinc/84/40/40/1050844040.db2.gz ARCBGUSGNHIZRR-UHFFFAOYSA-N 2 1 343.540 4.201 20 0 EIADMP CC[NH+]1CCC(C[N@@H+]2Cc3ccccc3[C@@H](c3ccccc3)C2)CC1 ZINC001179969296 1050850630 /nfs/dbraw/zinc/85/06/30/1050850630.db2.gz AFLRUMXUSJPAKG-HSZRJFAPSA-N 2 1 334.507 4.366 20 0 EIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000261895237 1050871521 /nfs/dbraw/zinc/87/15/21/1050871521.db2.gz OFRPEUBQQFGASB-UONOGXRCSA-N 2 1 326.406 4.230 20 0 EIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000261895233 1050871991 /nfs/dbraw/zinc/87/19/91/1050871991.db2.gz OFRPEUBQQFGASB-KGLIPLIRSA-N 2 1 326.406 4.230 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000619772491 1050909940 /nfs/dbraw/zinc/90/99/40/1050909940.db2.gz ICBSSGNXZLPLCN-HNNXBMFYSA-N 2 1 332.875 4.422 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000619772491 1050909955 /nfs/dbraw/zinc/90/99/55/1050909955.db2.gz ICBSSGNXZLPLCN-HNNXBMFYSA-N 2 1 332.875 4.422 20 0 EIADMP Cc1cc(C)cc(CC[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001180267396 1050940552 /nfs/dbraw/zinc/94/05/52/1050940552.db2.gz VMXUOQCPDWMLPG-HSZRJFAPSA-N 2 1 336.523 4.300 20 0 EIADMP Cc1cc(C)cc(CC[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001180267396 1050940557 /nfs/dbraw/zinc/94/05/57/1050940557.db2.gz VMXUOQCPDWMLPG-HSZRJFAPSA-N 2 1 336.523 4.300 20 0 EIADMP Cc1cc(C)cc(CC[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001180267396 1050940569 /nfs/dbraw/zinc/94/05/69/1050940569.db2.gz VMXUOQCPDWMLPG-HSZRJFAPSA-N 2 1 336.523 4.300 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(NCc3cccs3)cc2)CC1 ZINC000151375860 1051127466 /nfs/dbraw/zinc/12/74/66/1051127466.db2.gz FDTDGCCVCOLEOX-UHFFFAOYSA-N 2 1 329.513 4.138 20 0 EIADMP Cc1ccc(CC[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC001181314042 1051204510 /nfs/dbraw/zinc/20/45/10/1051204510.db2.gz BWGZBRFXRXATBA-QHCPKHFHSA-N 2 1 336.523 4.348 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)C1 ZINC000163218472 1051239893 /nfs/dbraw/zinc/23/98/93/1051239893.db2.gz COIYEYQSBOTCQA-RDJZCZTQSA-N 2 1 343.540 4.419 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(-c4ccc(F)cc4)o3)C2)CC1 ZINC001181514241 1051246428 /nfs/dbraw/zinc/24/64/28/1051246428.db2.gz BXLBHPKMTJJIQN-GOSISDBHSA-N 2 1 342.458 4.249 20 0 EIADMP CC(C)C[N@@H+](CC[C@H]1CCC[NH+]1C)Cc1ccc(F)c(Cl)c1 ZINC001174916077 1051247614 /nfs/dbraw/zinc/24/76/14/1051247614.db2.gz OCJGGDMBIDVXRE-MRXNPFEDSA-N 2 1 326.887 4.421 20 0 EIADMP CC(C)C[NH+](CC[C@H]1CCC[N@@H+]1C)Cc1ccc(F)c(Cl)c1 ZINC001174916077 1051247626 /nfs/dbraw/zinc/24/76/26/1051247626.db2.gz OCJGGDMBIDVXRE-MRXNPFEDSA-N 2 1 326.887 4.421 20 0 EIADMP CC(C)C[NH+](CC[C@H]1CCC[N@H+]1C)Cc1ccc(F)c(Cl)c1 ZINC001174916077 1051247637 /nfs/dbraw/zinc/24/76/37/1051247637.db2.gz OCJGGDMBIDVXRE-MRXNPFEDSA-N 2 1 326.887 4.421 20 0 EIADMP Cc1ccc(CC[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1C ZINC001181698600 1051290583 /nfs/dbraw/zinc/29/05/83/1051290583.db2.gz SYIQSSFCRDRLBB-XMMPIXPASA-N 2 1 348.534 4.444 20 0 EIADMP Cc1ccc(CC[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)cc1C ZINC001181698600 1051290596 /nfs/dbraw/zinc/29/05/96/1051290596.db2.gz SYIQSSFCRDRLBB-XMMPIXPASA-N 2 1 348.534 4.444 20 0 EIADMP Cc1ccc(CC[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1C ZINC001181698600 1051290608 /nfs/dbraw/zinc/29/06/08/1051290608.db2.gz SYIQSSFCRDRLBB-XMMPIXPASA-N 2 1 348.534 4.444 20 0 EIADMP CC[N@@H+](CCc1ccc(F)c(F)c1)Cc1ccc(C[NH+](C)C)cc1 ZINC001175061596 1051313294 /nfs/dbraw/zinc/31/32/94/1051313294.db2.gz INHDFFBPZYDQRY-UHFFFAOYSA-N 2 1 332.438 4.091 20 0 EIADMP C([C@@H]1CCC2(CCCCCC2)O1)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001191069964 1051338901 /nfs/dbraw/zinc/33/89/01/1051338901.db2.gz JDXLWRBGTDZLKN-PMACEKPBSA-N 2 1 334.548 4.066 20 0 EIADMP CSc1ccccc1C[C@H](C)[NH2+][C@@H](CC(C)C)C[NH+]1CCCC1 ZINC001181935516 1051356597 /nfs/dbraw/zinc/35/65/97/1051356597.db2.gz ZJABCXMNFISGMQ-HKUYNNGSSA-N 2 1 334.573 4.440 20 0 EIADMP CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001191164593 1051370614 /nfs/dbraw/zinc/37/06/14/1051370614.db2.gz GXDZCEVPIBNRIG-NHCUHLMSSA-N 2 1 344.543 4.308 20 0 EIADMP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc(Oc4ccccc4)c(F)c3)C[C@@H]2C1 ZINC001175203860 1051420953 /nfs/dbraw/zinc/42/09/53/1051420953.db2.gz WKGAMSCYBJOYET-MSOLQXFVSA-N 2 1 340.442 4.002 20 0 EIADMP C[N@H+]1CC[C@@H]2C[NH+](Cc3ccc(Oc4ccccc4)c(F)c3)C[C@@H]2C1 ZINC001175203860 1051420972 /nfs/dbraw/zinc/42/09/72/1051420972.db2.gz WKGAMSCYBJOYET-MSOLQXFVSA-N 2 1 340.442 4.002 20 0 EIADMP C[NH+]1CC[C@@H]2C[N@H+](Cc3ccc(Oc4ccccc4)c(F)c3)C[C@@H]2C1 ZINC001175203860 1051420981 /nfs/dbraw/zinc/42/09/81/1051420981.db2.gz WKGAMSCYBJOYET-MSOLQXFVSA-N 2 1 340.442 4.002 20 0 EIADMP C[NH+]1CC[C@@H]2C[N@@H+](Cc3ccc(Oc4ccccc4)c(F)c3)C[C@@H]2C1 ZINC001175203860 1051420991 /nfs/dbraw/zinc/42/09/91/1051420991.db2.gz WKGAMSCYBJOYET-MSOLQXFVSA-N 2 1 340.442 4.002 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000155862867 1051469649 /nfs/dbraw/zinc/46/96/49/1051469649.db2.gz NEGOSMYXOVFGLO-JKIFEVAISA-N 2 1 328.422 4.271 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cncc(Cl)c2)CC1 ZINC001191549272 1051485658 /nfs/dbraw/zinc/48/56/58/1051485658.db2.gz ADZQKXSYCHUOFM-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cncc(Cl)c2)CC1 ZINC001191549272 1051485667 /nfs/dbraw/zinc/48/56/67/1051485667.db2.gz ADZQKXSYCHUOFM-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1ccc2cc(OC)ccc2c1 ZINC000163255882 1051558605 /nfs/dbraw/zinc/55/86/05/1051558605.db2.gz FLZBKIBHOAJHLJ-IERDGZPVSA-N 2 1 326.484 4.231 20 0 EIADMP CC(F)(F)CCC[NH+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175381763 1051563288 /nfs/dbraw/zinc/56/32/88/1051563288.db2.gz JRSSWBMLNQBFGO-RTBURBONSA-N 2 1 336.470 4.266 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000774402555 1051580295 /nfs/dbraw/zinc/58/02/95/1051580295.db2.gz CDWXCHVDDQPNFT-LLVKDONJSA-N 2 1 342.314 4.243 20 0 EIADMP C[N@H+]1C[C@@H](C[NH2+][C@@H]2CC[C@](C)(c3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC001182542186 1051635626 /nfs/dbraw/zinc/63/56/26/1051635626.db2.gz CKLFNZKYPJBNHJ-AZOUXBGGSA-N 2 1 348.534 4.432 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000775507542 1051648943 /nfs/dbraw/zinc/64/89/43/1051648943.db2.gz AFCGZGZPAULTTK-PKOBYXMFSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000775507542 1051648947 /nfs/dbraw/zinc/64/89/47/1051648947.db2.gz AFCGZGZPAULTTK-PKOBYXMFSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158218616 1051726506 /nfs/dbraw/zinc/72/65/06/1051726506.db2.gz GATLDIWAESYHMD-HOCLYGCPSA-N 2 1 329.513 4.111 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000158218616 1051726520 /nfs/dbraw/zinc/72/65/20/1051726520.db2.gz GATLDIWAESYHMD-HOCLYGCPSA-N 2 1 329.513 4.111 20 0 EIADMP C[C@@H]([NH2+]CC1CCC2(CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001183122657 1051783758 /nfs/dbraw/zinc/78/37/58/1051783758.db2.gz MAUSWJWGQOHIHZ-NQIIRXRSSA-N 2 1 326.528 4.457 20 0 EIADMP COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]CCCc1c[nH+]cn1C ZINC001192690052 1051791659 /nfs/dbraw/zinc/79/16/59/1051791659.db2.gz ORCBORHRLOPCBI-GOSISDBHSA-N 2 1 349.906 4.392 20 0 EIADMP Cn1c[nH+]cc1CCC[NH2+]C1(c2ccc(C(F)(F)F)cc2)CCC1 ZINC000621351113 1051838366 /nfs/dbraw/zinc/83/83/66/1051838366.db2.gz FTVDVIGZJAQKCI-UHFFFAOYSA-N 2 1 337.389 4.041 20 0 EIADMP CC(C)Cc1ccc(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)cn1 ZINC001183463421 1051846343 /nfs/dbraw/zinc/84/63/43/1051846343.db2.gz DYTQYOCWBNJTFP-UHFFFAOYSA-N 2 1 331.548 4.080 20 0 EIADMP CC(C)C[N@H+](Cc1cc(F)cc(Cl)c1)CC1CC[NH+](C)CC1 ZINC001183464313 1051848696 /nfs/dbraw/zinc/84/86/96/1051848696.db2.gz RCGMCXVOENBXCY-UHFFFAOYSA-N 2 1 326.887 4.279 20 0 EIADMP CCCOc1cccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC001193251618 1051891995 /nfs/dbraw/zinc/89/19/95/1051891995.db2.gz VFFRQDNUKCHGGU-MJGOQNOKSA-N 2 1 330.516 4.218 20 0 EIADMP C[C@@H](CC(C)(C)c1ccccc1)[NH2+][C@@H](CC[NH+](C)C)c1cccnc1 ZINC001183919776 1051927508 /nfs/dbraw/zinc/92/75/08/1051927508.db2.gz PKMRJJOYQIAOBX-RXVVDRJESA-N 2 1 339.527 4.420 20 0 EIADMP Cc1ccc(C)c(C2CC[NH+](Cc3ccnn3-c3cc[nH+]cc3)CC2)c1 ZINC001184187603 1051958106 /nfs/dbraw/zinc/95/81/06/1051958106.db2.gz HIPVCYFPUYAIKA-UHFFFAOYSA-N 2 1 346.478 4.264 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](CC)CC1)c1ccc2cc(OC)ccc2c1 ZINC000159288427 1051971832 /nfs/dbraw/zinc/97/18/32/1051971832.db2.gz VGFCCAMAYVTGNS-OAQYLSRUSA-N 2 1 326.484 4.373 20 0 EIADMP CC(C)c1cc(Br)cc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205296542 1052000368 /nfs/dbraw/zinc/00/03/68/1052000368.db2.gz QXSFYKYXPOBXCE-QGZVFWFLSA-N 2 1 339.321 4.276 20 0 EIADMP CC(C)c1cc(Br)cc(C[N@H+]2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205296542 1052000373 /nfs/dbraw/zinc/00/03/73/1052000373.db2.gz QXSFYKYXPOBXCE-QGZVFWFLSA-N 2 1 339.321 4.276 20 0 EIADMP CC1(C)CC[N@@H+](Cc2ccccc2N2CCCCC2)CC(C)(C)[NH2+]1 ZINC001184375519 1052000476 /nfs/dbraw/zinc/00/04/76/1052000476.db2.gz UPNJWXVDBYMZJH-UHFFFAOYSA-N 2 1 329.532 4.029 20 0 EIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[C@H]2C[N@@H+](C)C[C@@H]21 ZINC001184386271 1052002411 /nfs/dbraw/zinc/00/24/11/1052002411.db2.gz AMWFWTLGJPVKGC-LMDOGRNLSA-N 2 1 334.507 4.214 20 0 EIADMP C[C@@H]1CC[N@H+](Cc2ccc(Br)c3ccccc23)C[C@H]1C[NH3+] ZINC001205303514 1052054675 /nfs/dbraw/zinc/05/46/75/1052054675.db2.gz GTROHKBGYHPAIO-UKRRQHHQSA-N 2 1 347.300 4.019 20 0 EIADMP C[C@@H]1CC[N@@H+](Cc2ccc(Br)c3ccccc23)C[C@H]1C[NH3+] ZINC001205303514 1052054694 /nfs/dbraw/zinc/05/46/94/1052054694.db2.gz GTROHKBGYHPAIO-UKRRQHHQSA-N 2 1 347.300 4.019 20 0 EIADMP CN1CCC([N@@H+](Cc2ccc(F)cc2)Cc2cccc(F)c2)CC1 ZINC001203789465 1052085705 /nfs/dbraw/zinc/08/57/05/1052085705.db2.gz ZIXZBPSSNHDGAC-UHFFFAOYSA-N 2 1 330.422 4.061 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623382630 1052640683 /nfs/dbraw/zinc/64/06/83/1052640683.db2.gz NQGYSOUHKZLTGJ-CZUORRHYSA-N 2 1 328.422 4.099 20 0 EIADMP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623487711 1052663851 /nfs/dbraw/zinc/66/38/51/1052663851.db2.gz NVIMUUGRBODESG-ZFWWWQNUSA-N 2 1 328.422 4.099 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)CC1(C)C ZINC000623502763 1052668218 /nfs/dbraw/zinc/66/82/18/1052668218.db2.gz ZROXQPHMMZGAQL-INIZCTEOSA-N 2 1 340.433 4.199 20 0 EIADMP C[C@@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Br)cc1F ZINC000623524425 1052671866 /nfs/dbraw/zinc/67/18/66/1052671866.db2.gz SMNNQWURSWOCOW-YPMHNXCESA-N 2 1 343.284 4.112 20 0 EIADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2nc(C)cs2)cc1 ZINC000623865488 1052825191 /nfs/dbraw/zinc/82/51/91/1052825191.db2.gz SQLPZRDTOJUTIQ-INIZCTEOSA-N 2 1 347.528 4.023 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC1 ZINC000623927976 1052837474 /nfs/dbraw/zinc/83/74/74/1052837474.db2.gz AGABNKNWSRUFHS-GOSISDBHSA-N 2 1 329.875 4.050 20 0 EIADMP CC(C)c1nccn1Cc1cccc(N[C@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000623932403 1052837529 /nfs/dbraw/zinc/83/75/29/1052837529.db2.gz MOKWKEHRIMXZHF-IBGZPJMESA-N 2 1 340.515 4.340 20 0 EIADMP CC(C)c1[nH+]ccn1Cc1cccc(N[C@H]2CC[N@H+](C)C(C)(C)C2)c1 ZINC000623932403 1052837532 /nfs/dbraw/zinc/83/75/32/1052837532.db2.gz MOKWKEHRIMXZHF-IBGZPJMESA-N 2 1 340.515 4.340 20 0 EIADMP CC(C)c1[nH+]ccn1Cc1cccc(N[C@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000623932403 1052837533 /nfs/dbraw/zinc/83/75/33/1052837533.db2.gz MOKWKEHRIMXZHF-IBGZPJMESA-N 2 1 340.515 4.340 20 0 EIADMP Cc1ccc(Br)cc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000623996145 1052849002 /nfs/dbraw/zinc/84/90/02/1052849002.db2.gz VBDZNAGGGPLBGI-OHRKKDJYSA-N 2 1 337.305 4.033 20 0 EIADMP COc1ccc2cc([C@H](C)[NH2+]C[C@H]3CCCC[N@@H+](C)C3)ccc2c1 ZINC000624120024 1052867811 /nfs/dbraw/zinc/86/78/11/1052867811.db2.gz PROHRKJMUXKSMJ-DLBZAZTESA-N 2 1 326.484 4.231 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@@H+]1C ZINC000182332296 1052926891 /nfs/dbraw/zinc/92/68/91/1052926891.db2.gz JGYFHJDQNDAZQV-BBRMVZONSA-N 2 1 326.406 4.157 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@H+]1C ZINC000182332296 1052926896 /nfs/dbraw/zinc/92/68/96/1052926896.db2.gz JGYFHJDQNDAZQV-BBRMVZONSA-N 2 1 326.406 4.157 20 0 EIADMP CC[NH+](CC)CCCC1CC[NH+](Cc2nc(C3CCCC3)no2)CC1 ZINC000182790294 1052950469 /nfs/dbraw/zinc/95/04/69/1052950469.db2.gz JEOOVSNBKRMGPO-UHFFFAOYSA-N 2 1 348.535 4.061 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000381131097 1053054780 /nfs/dbraw/zinc/05/47/80/1053054780.db2.gz KHCIPDQMARXAJU-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCCO2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000850457047 1053232713 /nfs/dbraw/zinc/23/27/13/1053232713.db2.gz FPPOJNVWOYMCJC-SQGPQFPESA-N 2 1 342.527 4.315 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccccc1)[C@@H](O)c1ccccc1 ZINC000794670063 1053243334 /nfs/dbraw/zinc/24/33/34/1053243334.db2.gz YTTGECOGUVXYEO-YADHBBJMSA-N 2 1 349.478 4.036 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC000764961014 1053398445 /nfs/dbraw/zinc/39/84/45/1053398445.db2.gz GJEVUWXMXUFTJL-OALUTQOASA-N 2 1 332.532 4.118 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cnn(-c2ccccc2)c1 ZINC000764960054 1053399029 /nfs/dbraw/zinc/39/90/29/1053399029.db2.gz CBYBRKQUXZKJQA-MOPGFXCFSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cc(Cl)c(N)c(Cl)c1 ZINC000794832584 1053443910 /nfs/dbraw/zinc/44/39/10/1053443910.db2.gz AHJQFORUNBMLRG-XGNXJENSSA-N 2 1 342.314 4.243 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(F)c1 ZINC000765361058 1053516643 /nfs/dbraw/zinc/51/66/43/1053516643.db2.gz VDLWRZFSXBFLNH-KGVIQGDOSA-N 2 1 340.486 4.429 20 0 EIADMP CC(C)([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)[C@@H]1CCCCO1 ZINC000865743934 1053583855 /nfs/dbraw/zinc/58/38/55/1053583855.db2.gz KERHMOIRVNPYTN-PMACEKPBSA-N 2 1 342.527 4.121 20 0 EIADMP CC(C)([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)[C@@H]1CCCCO1 ZINC000865743934 1053583869 /nfs/dbraw/zinc/58/38/69/1053583869.db2.gz KERHMOIRVNPYTN-PMACEKPBSA-N 2 1 342.527 4.121 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)CC1(C)C ZINC000865830357 1053601513 /nfs/dbraw/zinc/60/15/13/1053601513.db2.gz MAVYYFBEUVWZIV-KSZLIROESA-N 2 1 336.907 4.023 20 0 EIADMP C[C@H]([NH2+]Cc1cc2ccccc2o1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386238404 1053644421 /nfs/dbraw/zinc/64/44/21/1053644421.db2.gz BOAPTJQWEWMOHV-FXAWDEMLSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H]([NH2+]Cc1cc2ccccc2o1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386238404 1053644429 /nfs/dbraw/zinc/64/44/29/1053644429.db2.gz BOAPTJQWEWMOHV-FXAWDEMLSA-N 2 1 334.463 4.433 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866241123 1053660903 /nfs/dbraw/zinc/66/09/03/1053660903.db2.gz WPVWLVDNSSWZHI-UNMCSNQZSA-N 2 1 337.511 4.077 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866241123 1053660907 /nfs/dbraw/zinc/66/09/07/1053660907.db2.gz WPVWLVDNSSWZHI-UNMCSNQZSA-N 2 1 337.511 4.077 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](CCc1ccccc1)c1ccccn1 ZINC000866258947 1053666287 /nfs/dbraw/zinc/66/62/87/1053666287.db2.gz DQHDGMBGKDRLAH-GCJKJVERSA-N 2 1 348.494 4.186 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cc2c(ccnc2Cl)o1 ZINC000866272427 1053672640 /nfs/dbraw/zinc/67/26/40/1053672640.db2.gz OCCMETLZZVFYEW-GFCCVEGCSA-N 2 1 332.835 4.117 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CC[C@H]2CCCS2)C3)cc1 ZINC000866482257 1053746819 /nfs/dbraw/zinc/74/68/19/1053746819.db2.gz ZJEXLENRIZOXDD-IYWMVGAKSA-N 2 1 330.541 4.057 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386612540 1053803124 /nfs/dbraw/zinc/80/31/24/1053803124.db2.gz KQHGRCAASPCOBQ-UYAOXDASSA-N 2 1 338.495 4.004 20 0 EIADMP C[NH+](C)C1(C)CC[NH+](CCCOc2ccc3ccccc3c2)CC1 ZINC001196981908 1053817417 /nfs/dbraw/zinc/81/74/17/1053817417.db2.gz LHOYSANGYSUDOW-UHFFFAOYSA-N 2 1 326.484 4.025 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000386686407 1053819984 /nfs/dbraw/zinc/81/99/84/1053819984.db2.gz ZCRDBFWRGGDAMF-DBXWQHBBSA-N 2 1 338.495 4.084 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000386686407 1053819987 /nfs/dbraw/zinc/81/99/87/1053819987.db2.gz ZCRDBFWRGGDAMF-DBXWQHBBSA-N 2 1 338.495 4.084 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCC[C@]1(C)Cc1ccc(Cl)c(F)c1 ZINC001197002434 1053820372 /nfs/dbraw/zinc/82/03/72/1053820372.db2.gz AERMPVKAKTYMQQ-GOSISDBHSA-N 2 1 335.854 4.081 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCC[C@]1(C)Cc1ccc(Cl)c(F)c1 ZINC001197002434 1053820374 /nfs/dbraw/zinc/82/03/74/1053820374.db2.gz AERMPVKAKTYMQQ-GOSISDBHSA-N 2 1 335.854 4.081 20 0 EIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1CC[C@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026247 1054059916 /nfs/dbraw/zinc/05/99/16/1054059916.db2.gz BPFQQULXDYHFPO-HUUCEWRRSA-N 2 1 340.433 4.156 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CC[C@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026247 1054059935 /nfs/dbraw/zinc/05/99/35/1054059935.db2.gz BPFQQULXDYHFPO-HUUCEWRRSA-N 2 1 340.433 4.156 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CC[C@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026247 1054059946 /nfs/dbraw/zinc/05/99/46/1054059946.db2.gz BPFQQULXDYHFPO-HUUCEWRRSA-N 2 1 340.433 4.156 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CC[C@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026247 1054059962 /nfs/dbraw/zinc/05/99/62/1054059962.db2.gz BPFQQULXDYHFPO-HUUCEWRRSA-N 2 1 340.433 4.156 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@H]3CCOC4(CCCC4)C3)C2)c1 ZINC000872029977 1054346985 /nfs/dbraw/zinc/34/69/85/1054346985.db2.gz WWNGNPLBLLIJAM-MSOLQXFVSA-N 2 1 348.556 4.042 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CCOC4(CCCC4)C3)C2)c1 ZINC000872029977 1054347010 /nfs/dbraw/zinc/34/70/10/1054347010.db2.gz WWNGNPLBLLIJAM-MSOLQXFVSA-N 2 1 348.556 4.042 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccc(O)c2F)c1 ZINC000872028802 1054347938 /nfs/dbraw/zinc/34/79/38/1054347938.db2.gz RSTIEKDLIUNRJM-HNNXBMFYSA-N 2 1 330.447 4.222 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccc(O)c2F)c1 ZINC000872028802 1054347954 /nfs/dbraw/zinc/34/79/54/1054347954.db2.gz RSTIEKDLIUNRJM-HNNXBMFYSA-N 2 1 330.447 4.222 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccc2c(c1)CCO2 ZINC000123922048 1054361241 /nfs/dbraw/zinc/36/12/41/1054361241.db2.gz IZIISVGUCJNCKH-OAQYLSRUSA-N 2 1 338.495 4.314 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC001199198678 1054361626 /nfs/dbraw/zinc/36/16/26/1054361626.db2.gz QZEXLOSXODNXNF-QGZVFWFLSA-N 2 1 347.522 4.026 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC001199198678 1054361639 /nfs/dbraw/zinc/36/16/39/1054361639.db2.gz QZEXLOSXODNXNF-QGZVFWFLSA-N 2 1 347.522 4.026 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)[C@H]1CCCOC1 ZINC000872068494 1054377416 /nfs/dbraw/zinc/37/74/16/1054377416.db2.gz GVBHATRFRANPIW-PCCBWWKXSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)[C@H]1CCCOC1 ZINC000872068494 1054377424 /nfs/dbraw/zinc/37/74/24/1054377424.db2.gz GVBHATRFRANPIW-PCCBWWKXSA-N 2 1 344.543 4.082 20 0 EIADMP Fc1cccc2c(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c[nH]c21 ZINC001137056579 1054388845 /nfs/dbraw/zinc/38/88/45/1054388845.db2.gz YYEMTDFQVWARMD-KRWDZBQOSA-N 2 1 329.463 4.147 20 0 EIADMP Fc1cccc2c(C[N@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c[nH]c21 ZINC001137056579 1054388856 /nfs/dbraw/zinc/38/88/56/1054388856.db2.gz YYEMTDFQVWARMD-KRWDZBQOSA-N 2 1 329.463 4.147 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCO1 ZINC001199629669 1054435926 /nfs/dbraw/zinc/43/59/26/1054435926.db2.gz LRCRXIZUNPPZKK-FXAWDEMLSA-N 2 1 330.516 4.108 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+]Cc1cccc(-c2ccc(Cl)cc2)c1 ZINC001199874392 1054489786 /nfs/dbraw/zinc/48/97/86/1054489786.db2.gz HLPBROKECLFHLV-UHFFFAOYSA-N 2 1 325.843 4.302 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[NH+](CC3CCCCC3)C[C@@H]21 ZINC001201397860 1054774641 /nfs/dbraw/zinc/77/46/41/1054774641.db2.gz VITGYLMICPSTTD-ILWGZMRPSA-N 2 1 341.543 4.194 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[NH+](CC3CCCCC3)C[C@@H]21 ZINC001201397860 1054774658 /nfs/dbraw/zinc/77/46/58/1054774658.db2.gz VITGYLMICPSTTD-ILWGZMRPSA-N 2 1 341.543 4.194 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[N@H+](CC3CCCCC3)C[C@@H]21 ZINC001201397860 1054774674 /nfs/dbraw/zinc/77/46/74/1054774674.db2.gz VITGYLMICPSTTD-ILWGZMRPSA-N 2 1 341.543 4.194 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[N@@H+](CC3CCCCC3)C[C@@H]21 ZINC001201397860 1054774690 /nfs/dbraw/zinc/77/46/90/1054774690.db2.gz VITGYLMICPSTTD-ILWGZMRPSA-N 2 1 341.543 4.194 20 0 EIADMP C[N@@H+](CCCc1ccc(C(F)(F)F)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000671724920 1054789654 /nfs/dbraw/zinc/78/96/54/1054789654.db2.gz JNIUZBMGZLKEOZ-JWTNVVGKSA-N 2 1 340.433 4.195 20 0 EIADMP C[NH+](CCCc1ccc(C(F)(F)F)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000671724920 1054789670 /nfs/dbraw/zinc/78/96/70/1054789670.db2.gz JNIUZBMGZLKEOZ-JWTNVVGKSA-N 2 1 340.433 4.195 20 0 EIADMP C[NH+](CCCc1ccc(C(F)(F)F)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000671724920 1054789682 /nfs/dbraw/zinc/78/96/82/1054789682.db2.gz JNIUZBMGZLKEOZ-JWTNVVGKSA-N 2 1 340.433 4.195 20 0 EIADMP COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](C[C@@H](C)CCC=C(C)C)C2 ZINC001201486253 1054814929 /nfs/dbraw/zinc/81/49/29/1054814929.db2.gz HWJDCUUUPYLZGV-BVSLBCMMSA-N 2 1 348.575 4.049 20 0 EIADMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](C[C@@H](C)CCC=C(C)C)C2 ZINC001201486253 1054814940 /nfs/dbraw/zinc/81/49/40/1054814940.db2.gz HWJDCUUUPYLZGV-BVSLBCMMSA-N 2 1 348.575 4.049 20 0 EIADMP COC[C@@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](C[C@@H](C)CCC=C(C)C)C2 ZINC001201486253 1054814943 /nfs/dbraw/zinc/81/49/43/1054814943.db2.gz HWJDCUUUPYLZGV-BVSLBCMMSA-N 2 1 348.575 4.049 20 0 EIADMP CCC[C@H](C)C[NH+]1CCC2(CCC[N@H+]2Cc2c(C)noc2C)CC1 ZINC001201542836 1054836025 /nfs/dbraw/zinc/83/60/25/1054836025.db2.gz MBKIDMCAEUYYGY-INIZCTEOSA-N 2 1 333.520 4.158 20 0 EIADMP CCC(CC)C[NH+]1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201525632 1054843623 /nfs/dbraw/zinc/84/36/23/1054843623.db2.gz IGBXOONESOEJPU-OAQYLSRUSA-N 2 1 344.543 4.178 20 0 EIADMP Cc1cc(C)cc(C[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000064615883 1054867666 /nfs/dbraw/zinc/86/76/66/1054867666.db2.gz KYQQVVDJPHCPTD-GOSISDBHSA-N 2 1 328.525 4.367 20 0 EIADMP Cc1cc(C)cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000064615883 1054867671 /nfs/dbraw/zinc/86/76/71/1054867671.db2.gz KYQQVVDJPHCPTD-GOSISDBHSA-N 2 1 328.525 4.367 20 0 EIADMP CCCCCC[NH+]1CCC2(CCC[N@H+]2Cc2c(C)noc2C)CC1 ZINC001201746345 1054893465 /nfs/dbraw/zinc/89/34/65/1054893465.db2.gz DYSVXLCZFRVVLP-UHFFFAOYSA-N 2 1 333.520 4.302 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(-c2cccnc2)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001201946720 1054962961 /nfs/dbraw/zinc/96/29/61/1054962961.db2.gz KTXXNFWZQKJBLR-GCJKJVERSA-N 2 1 349.522 4.491 20 0 EIADMP Cc1ccncc1[C@@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000671750913 1054978851 /nfs/dbraw/zinc/97/88/51/1054978851.db2.gz CJCNDNLGKPFXNE-KMFTYDHNSA-N 2 1 337.511 4.484 20 0 EIADMP COCCC1(C[NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)CCCCC1 ZINC001202185180 1055073371 /nfs/dbraw/zinc/07/33/71/1055073371.db2.gz ZHKWOSDFBULDCF-FQEVSTJZSA-N 2 1 336.564 4.360 20 0 EIADMP FC(F)(F)CCC[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001202415990 1055162041 /nfs/dbraw/zinc/16/20/41/1055162041.db2.gz QKVSRTXRERZFJH-UHFFFAOYSA-N 2 1 340.433 4.317 20 0 EIADMP c1ccc([C@H]2CCC[C@@H](C[NH+]3CCC([NH+]4CCCCC4)CC3)O2)cc1 ZINC000877971076 1055165922 /nfs/dbraw/zinc/16/59/22/1055165922.db2.gz GQMIYOLYYKLZLX-FCHUYYIVSA-N 2 1 342.527 4.247 20 0 EIADMP C[C@H]([NH2+]C1CCC(C(F)F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000282300146 1055792928 /nfs/dbraw/zinc/79/29/28/1055792928.db2.gz MGAHYHHSXLHRKX-BARLLCKDSA-N 2 1 336.470 4.311 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000542840190 1056204056 /nfs/dbraw/zinc/20/40/56/1056204056.db2.gz LJBUOVSIZLILQA-INIZCTEOSA-N 2 1 346.421 4.141 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000542840190 1056204075 /nfs/dbraw/zinc/20/40/75/1056204075.db2.gz LJBUOVSIZLILQA-INIZCTEOSA-N 2 1 346.421 4.141 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccccc1N1CCCCC1 ZINC000743763381 1059112863 /nfs/dbraw/zinc/11/28/63/1059112863.db2.gz GWJREWCNMHSDIA-IBGZPJMESA-N 2 1 329.532 4.031 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccccc1N1CCCCC1 ZINC000743763381 1059112886 /nfs/dbraw/zinc/11/28/86/1059112886.db2.gz GWJREWCNMHSDIA-IBGZPJMESA-N 2 1 329.532 4.031 20 0 EIADMP CC[N@H+](C[C@H]1CC1(Cl)Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000743873773 1059193728 /nfs/dbraw/zinc/19/37/28/1059193728.db2.gz VCRGOBKRBQMJMO-DLBZAZTESA-N 2 1 341.326 4.024 20 0 EIADMP CC[N@@H+](C[C@H]1CC1(Cl)Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000743873773 1059193754 /nfs/dbraw/zinc/19/37/54/1059193754.db2.gz VCRGOBKRBQMJMO-DLBZAZTESA-N 2 1 341.326 4.024 20 0 EIADMP CC[NH+](C[C@H]1CC1(Cl)Cl)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000743873773 1059193776 /nfs/dbraw/zinc/19/37/76/1059193776.db2.gz VCRGOBKRBQMJMO-DLBZAZTESA-N 2 1 341.326 4.024 20 0 EIADMP CC[NH+](C[C@H]1CC1(Cl)Cl)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000743873773 1059193803 /nfs/dbraw/zinc/19/38/03/1059193803.db2.gz VCRGOBKRBQMJMO-DLBZAZTESA-N 2 1 341.326 4.024 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000383343407 1060247263 /nfs/dbraw/zinc/24/72/63/1060247263.db2.gz LNEFHQLOZUKONT-KXBFYZLASA-N 2 1 343.540 4.323 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000766460878 1060366447 /nfs/dbraw/zinc/36/64/47/1060366447.db2.gz HVGUYIKLKULYRY-ZHALLVOQSA-N 2 1 334.573 4.407 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000766460878 1060366463 /nfs/dbraw/zinc/36/64/63/1060366463.db2.gz HVGUYIKLKULYRY-ZHALLVOQSA-N 2 1 334.573 4.407 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cc(F)cc(F)c1 ZINC001168991195 1060586714 /nfs/dbraw/zinc/58/67/14/1060586714.db2.gz BBYMRWLMASCFDN-JIPZTSHUSA-N 2 1 344.449 4.211 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cc(F)cc(F)c1 ZINC001168991195 1060586745 /nfs/dbraw/zinc/58/67/45/1060586745.db2.gz BBYMRWLMASCFDN-JIPZTSHUSA-N 2 1 344.449 4.211 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)C2 ZINC001169099428 1060635544 /nfs/dbraw/zinc/63/55/44/1060635544.db2.gz RLAWXEYOWGXSOI-QKDCVEJESA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)C2 ZINC001169099428 1060635563 /nfs/dbraw/zinc/63/55/63/1060635563.db2.gz RLAWXEYOWGXSOI-QKDCVEJESA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3cccc(Br)c3)CCC1)C2 ZINC001169099762 1060637105 /nfs/dbraw/zinc/63/71/05/1060637105.db2.gz VGTIXYAQLYVBTH-BJWYYQGGSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](n1cc(C3CC[NH2+]CC3)c3c1cccc3F)C2 ZINC001169154748 1060671486 /nfs/dbraw/zinc/67/14/86/1060671486.db2.gz UDYQRYKLEYSFEY-BJWYYQGGSA-N 2 1 341.474 4.045 20 0 EIADMP C[C@H]1C[N@@H+](Cc2sccc2Oc2ccccc2)CCC[C@@H]1C[NH3+] ZINC001206003737 1060688048 /nfs/dbraw/zinc/68/80/48/1060688048.db2.gz LYSYUHUFUGITRA-JKSUJKDBSA-N 2 1 330.497 4.347 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC[C@H]1CCc2ccccc21 ZINC001169224363 1060701950 /nfs/dbraw/zinc/70/19/50/1060701950.db2.gz IEEGWIDBGFGGEU-LJQANCHMSA-N 2 1 325.500 4.278 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC[C@H]1CCc2ccccc21 ZINC001169224363 1060701967 /nfs/dbraw/zinc/70/19/67/1060701967.db2.gz IEEGWIDBGFGGEU-LJQANCHMSA-N 2 1 325.500 4.278 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]C1CC[NH+](CC)CC1 ZINC001169233078 1060705045 /nfs/dbraw/zinc/70/50/45/1060705045.db2.gz JNGXFUSFDWWMFU-OAHLLOKOSA-N 2 1 329.315 4.388 20 0 EIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3ccc(Cl)cc3Cl)C2)CC1 ZINC001169780474 1060962831 /nfs/dbraw/zinc/96/28/31/1060962831.db2.gz LJXFZFBRUJLXPG-UHFFFAOYSA-N 2 1 327.299 4.301 20 0 EIADMP C[N@@H+]1CC[C@@H](C[NH2+]Cc2csc3ccccc23)[C@@H]1c1cccnc1 ZINC000328626028 258032906 /nfs/dbraw/zinc/03/29/06/258032906.db2.gz DSODAMCNHFYPDT-JXFKEZNVSA-N 2 1 337.492 4.079 20 0 EIADMP C[N@H+]1CC[C@@H](C[NH2+]Cc2csc3ccccc23)[C@@H]1c1cccnc1 ZINC000328626028 258032908 /nfs/dbraw/zinc/03/29/08/258032908.db2.gz DSODAMCNHFYPDT-JXFKEZNVSA-N 2 1 337.492 4.079 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000729678863 1032128653 /nfs/dbraw/zinc/12/86/53/1032128653.db2.gz UFNRBILCZJXEEV-QGZVFWFLSA-N 2 1 330.516 4.144 20 0 EIADMP Clc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cn1 ZINC000245643844 1032361553 /nfs/dbraw/zinc/36/15/53/1032361553.db2.gz BGQXUBZTGBVVHI-REPLKXPHSA-N 2 1 341.886 4.020 20 0 EIADMP Clc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cn1 ZINC000245643844 1032361562 /nfs/dbraw/zinc/36/15/62/1032361562.db2.gz BGQXUBZTGBVVHI-REPLKXPHSA-N 2 1 341.886 4.020 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccsc2Br)CC1 ZINC000529528221 1032416573 /nfs/dbraw/zinc/41/65/73/1032416573.db2.gz XDTDHCROTFQSHM-UHFFFAOYSA-N 2 1 345.350 4.063 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccsc2Br)CC1 ZINC000529528221 1032416584 /nfs/dbraw/zinc/41/65/84/1032416584.db2.gz XDTDHCROTFQSHM-UHFFFAOYSA-N 2 1 345.350 4.063 20 0 EIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccncc1 ZINC000245750729 1032459659 /nfs/dbraw/zinc/45/96/59/1032459659.db2.gz TZBIKJDSJZDLTG-YUMYIRISSA-N 2 1 335.495 4.318 20 0 EIADMP Clc1ccc(OCCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533077435 1032475848 /nfs/dbraw/zinc/47/58/48/1032475848.db2.gz BMXLLAHCDCNYPG-JXFKEZNVSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533077435 1032475856 /nfs/dbraw/zinc/47/58/56/1032475856.db2.gz BMXLLAHCDCNYPG-JXFKEZNVSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000533077435 1032475866 /nfs/dbraw/zinc/47/58/66/1032475866.db2.gz BMXLLAHCDCNYPG-JXFKEZNVSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000533077435 1032475881 /nfs/dbraw/zinc/47/58/81/1032475881.db2.gz BMXLLAHCDCNYPG-JXFKEZNVSA-N 2 1 348.918 4.058 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccsc3)CC2)cs1 ZINC000178092771 1032518605 /nfs/dbraw/zinc/51/86/05/1032518605.db2.gz BQHOPXBPDKPFQP-AWEZNQCLSA-N 2 1 349.569 4.330 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000760169509 1032543002 /nfs/dbraw/zinc/54/30/02/1032543002.db2.gz FTABMJUJTZZBEF-LBPRGKRZSA-N 2 1 344.330 4.491 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)cc1 ZINC000347353628 1032546617 /nfs/dbraw/zinc/54/66/17/1032546617.db2.gz ZKHRTCHYNOIGPT-LRQRDZAKSA-N 2 1 341.499 4.425 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccc(Cl)nc2)cc1F ZINC000179112617 1032554426 /nfs/dbraw/zinc/55/44/26/1032554426.db2.gz OBJXLBBCMGUEIC-LBPRGKRZSA-N 2 1 344.821 4.219 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000760174782 1032570596 /nfs/dbraw/zinc/57/05/96/1032570596.db2.gz ZCJCNBODKRODBJ-AEFFLSMTSA-N 2 1 343.902 4.298 20 0 EIADMP FC(F)(F)c1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)s1 ZINC000432742927 1032662812 /nfs/dbraw/zinc/66/28/12/1032662812.db2.gz WCXXYSGXGVXELC-UHFFFAOYSA-N 2 1 332.435 4.075 20 0 EIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCCO2 ZINC000643545834 1018892595 /nfs/dbraw/zinc/89/25/95/1018892595.db2.gz CWRVWNJJMULTJC-MJGOQNOKSA-N 2 1 328.500 4.288 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000643545771 1018896100 /nfs/dbraw/zinc/89/61/00/1018896100.db2.gz CDSFLOQCVWTDTL-YPMHNXCESA-N 2 1 344.833 4.267 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000643545768 1018896171 /nfs/dbraw/zinc/89/61/71/1018896171.db2.gz CDSFLOQCVWTDTL-AAEUAGOBSA-N 2 1 344.833 4.267 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CC2 ZINC000643548720 1018932242 /nfs/dbraw/zinc/93/22/42/1018932242.db2.gz UGEKDKYELZGSIK-HIFRSBDPSA-N 2 1 325.283 4.245 20 0 EIADMP C[C@H](C[NH2+][C@H](C)c1cc2cc(Br)ccc2o1)C[NH+](C)C ZINC000312443916 1019092325 /nfs/dbraw/zinc/09/23/25/1019092325.db2.gz CKIDJDLFEHGRHS-VXGBXAGGSA-N 2 1 339.277 4.044 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000274765447 1019410428 /nfs/dbraw/zinc/41/04/28/1019410428.db2.gz LECKHYPHVZWILZ-BDKRGJGYSA-N 2 1 344.543 4.080 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000432801953 1032831996 /nfs/dbraw/zinc/83/19/96/1032831996.db2.gz YMMFTPCOSUWKFC-MRXNPFEDSA-N 2 1 348.437 4.357 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000432801953 1032831997 /nfs/dbraw/zinc/83/19/97/1032831997.db2.gz YMMFTPCOSUWKFC-MRXNPFEDSA-N 2 1 348.437 4.357 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@](C)(c2ccccc2)CC1 ZINC000510139036 1019875486 /nfs/dbraw/zinc/87/54/86/1019875486.db2.gz HDZKAJRRQIHUTK-OAQYLSRUSA-N 2 1 325.500 4.416 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@](C)(c2ccccc2)CC1 ZINC000510139036 1019875488 /nfs/dbraw/zinc/87/54/88/1019875488.db2.gz HDZKAJRRQIHUTK-OAQYLSRUSA-N 2 1 325.500 4.416 20 0 EIADMP CCCCCOc1cc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)ccc1OC ZINC000432815980 1032859268 /nfs/dbraw/zinc/85/92/68/1032859268.db2.gz LWXGQXDROYOUHF-IBGZPJMESA-N 2 1 348.531 4.180 20 0 EIADMP CCCCCOc1cc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)ccc1OC ZINC000432815980 1032859276 /nfs/dbraw/zinc/85/92/76/1032859276.db2.gz LWXGQXDROYOUHF-IBGZPJMESA-N 2 1 348.531 4.180 20 0 EIADMP c1ccc(CSCCC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000535627064 1020013902 /nfs/dbraw/zinc/01/39/02/1020013902.db2.gz RPBWSOVUWQQMQL-PZJWPPBQSA-N 2 1 344.568 4.259 20 0 EIADMP c1ccc(CSCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000535627064 1020013918 /nfs/dbraw/zinc/01/39/18/1020013918.db2.gz RPBWSOVUWQQMQL-PZJWPPBQSA-N 2 1 344.568 4.259 20 0 EIADMP c1ccc(CSCCC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000535627064 1020013931 /nfs/dbraw/zinc/01/39/31/1020013931.db2.gz RPBWSOVUWQQMQL-PZJWPPBQSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@]1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCS1 ZINC000180158573 1020077283 /nfs/dbraw/zinc/07/72/83/1020077283.db2.gz JQRNVYDRXVKTCH-RAFMOHDBSA-N 2 1 330.541 4.057 20 0 EIADMP COc1ccc([C@H]([NH2+]CCCCn2cc[nH+]c2C)c2ccccc2)cc1 ZINC000180626613 1020157206 /nfs/dbraw/zinc/15/72/06/1020157206.db2.gz PTXQMTOPBSOJBN-JOCHJYFZSA-N 2 1 349.478 4.360 20 0 EIADMP C[C@H](c1cccc(Br)c1)[N@@H+](C)CCC[NH+]1CCCCC1 ZINC001209452987 1020362773 /nfs/dbraw/zinc/36/27/73/1020362773.db2.gz BHAOPFMVHLUCJN-OAHLLOKOSA-N 2 1 339.321 4.318 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C3CC[NH+](C(C)C)CC3)s2)cc1C ZINC000655705131 1020905691 /nfs/dbraw/zinc/90/56/91/1020905691.db2.gz WRGNNBPRRMIUNV-UHFFFAOYSA-N 2 1 343.540 4.389 20 0 EIADMP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)CS1 ZINC000655714691 1020911761 /nfs/dbraw/zinc/91/17/61/1020911761.db2.gz AMQNEZATMXAVIC-APWZRJJASA-N 2 1 344.524 4.285 20 0 EIADMP CCOC1(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCCC1 ZINC000340465531 1021069295 /nfs/dbraw/zinc/06/92/95/1021069295.db2.gz NYQCDIUDRPHYQX-MRXNPFEDSA-N 2 1 327.472 4.181 20 0 EIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccncc1F ZINC000340529767 1021203524 /nfs/dbraw/zinc/20/35/24/1021203524.db2.gz CYUAWLWYHWAPDO-IVMQYODDSA-N 2 1 341.474 4.315 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc3cnccc3c2)C1 ZINC000683827228 1021724873 /nfs/dbraw/zinc/72/48/73/1021724873.db2.gz ADAVNNOGCLNGDG-ICSRJNTNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc3cnccc3c2)C1 ZINC000683827228 1021724895 /nfs/dbraw/zinc/72/48/95/1021724895.db2.gz ADAVNNOGCLNGDG-ICSRJNTNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc3cnccc3c2)C1 ZINC000683827228 1021724914 /nfs/dbraw/zinc/72/49/14/1021724914.db2.gz ADAVNNOGCLNGDG-ICSRJNTNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc3cnccc3c2)C1 ZINC000683827228 1021724933 /nfs/dbraw/zinc/72/49/33/1021724933.db2.gz ADAVNNOGCLNGDG-ICSRJNTNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc3cnccc3c2)C1 ZINC000683827228 1021724957 /nfs/dbraw/zinc/72/49/57/1021724957.db2.gz ADAVNNOGCLNGDG-ICSRJNTNSA-N 2 1 337.511 4.321 20 0 EIADMP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179091 1021744027 /nfs/dbraw/zinc/74/40/27/1021744027.db2.gz CKWMODOIKKCNBH-FUHWJXTLSA-N 2 1 333.545 4.107 20 0 EIADMP C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179091 1021744048 /nfs/dbraw/zinc/74/40/48/1021744048.db2.gz CKWMODOIKKCNBH-FUHWJXTLSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179091 1021744075 /nfs/dbraw/zinc/74/40/75/1021744075.db2.gz CKWMODOIKKCNBH-FUHWJXTLSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179091 1021744094 /nfs/dbraw/zinc/74/40/94/1021744094.db2.gz CKWMODOIKKCNBH-FUHWJXTLSA-N 2 1 333.545 4.107 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(OC)cc2C)c1 ZINC000414083592 1021822088 /nfs/dbraw/zinc/82/20/88/1021822088.db2.gz WIZMHSLHFNHTTI-KRWDZBQOSA-N 2 1 326.484 4.306 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC000398017875 1021898462 /nfs/dbraw/zinc/89/84/62/1021898462.db2.gz IIXQUYISKOXQAP-WZONZLPQSA-N 2 1 334.507 4.176 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000398019228 1021898632 /nfs/dbraw/zinc/89/86/32/1021898632.db2.gz JDWYDUWUNOQQJA-YWZLYKJASA-N 2 1 346.877 4.479 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000398019228 1021898638 /nfs/dbraw/zinc/89/86/38/1021898638.db2.gz JDWYDUWUNOQQJA-YWZLYKJASA-N 2 1 346.877 4.479 20 0 EIADMP CC(C)[N@@H+](C)CCCNCc1cccc(OCc2ccccc2)c1 ZINC000394441924 1022032821 /nfs/dbraw/zinc/03/28/21/1022032821.db2.gz GWVQQHWRUZSWNF-UHFFFAOYSA-N 2 1 326.484 4.086 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000394441924 1022032841 /nfs/dbraw/zinc/03/28/41/1022032841.db2.gz GWVQQHWRUZSWNF-UHFFFAOYSA-N 2 1 326.484 4.086 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000394441924 1022032862 /nfs/dbraw/zinc/03/28/62/1022032862.db2.gz GWVQQHWRUZSWNF-UHFFFAOYSA-N 2 1 326.484 4.086 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1nc(-c2ccccc2)cs1 ZINC000414184745 1022061403 /nfs/dbraw/zinc/06/14/03/1022061403.db2.gz OGHHKRXIAGNJHC-HZPDHXFCSA-N 2 1 329.513 4.193 20 0 EIADMP COc1ccc([C@@H]([NH2+]CC[C@@H]2CCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000414199427 1022104990 /nfs/dbraw/zinc/10/49/90/1022104990.db2.gz XAUHQFMPDFKMPA-AVRDEDQJSA-N 2 1 338.495 4.106 20 0 EIADMP C([NH2+]C1CCC2(CCCO2)CC1)[C@H]1CCC[N@H+]1CC1CCCCC1 ZINC000580501682 1022121765 /nfs/dbraw/zinc/12/17/65/1022121765.db2.gz KZWJVFBYYQPSCA-NYLDSWQDSA-N 2 1 334.548 4.113 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000414202828 1022123525 /nfs/dbraw/zinc/12/35/25/1022123525.db2.gz ZGTPHSNWUGHIHE-LSDHHAIUSA-N 2 1 344.421 4.010 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)C(F)(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000549032161 1022159133 /nfs/dbraw/zinc/15/91/33/1022159133.db2.gz LNPKMDUPMZZCSE-HOCLYGCPSA-N 2 1 328.422 4.075 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)C(F)(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000549032160 1022161082 /nfs/dbraw/zinc/16/10/82/1022161082.db2.gz LNPKMDUPMZZCSE-GOEBONIOSA-N 2 1 328.422 4.075 20 0 EIADMP CC[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCOCC1 ZINC000549037996 1022205780 /nfs/dbraw/zinc/20/57/80/1022205780.db2.gz ZBQWMHLBFXJFPM-RTWAWAEBSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCOCC1 ZINC000549037996 1022205800 /nfs/dbraw/zinc/20/58/00/1022205800.db2.gz ZBQWMHLBFXJFPM-RTWAWAEBSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000398097551 1022219251 /nfs/dbraw/zinc/21/92/51/1022219251.db2.gz KWUSLTALRXMGNE-UZLBHIALSA-N 2 1 328.887 4.340 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000892579529 1022299866 /nfs/dbraw/zinc/29/98/66/1022299866.db2.gz AIHPTHHCQLWKIZ-MRXNPFEDSA-N 2 1 341.499 4.210 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000892579529 1022299873 /nfs/dbraw/zinc/29/98/73/1022299873.db2.gz AIHPTHHCQLWKIZ-MRXNPFEDSA-N 2 1 341.499 4.210 20 0 EIADMP Cc1cc(F)ncc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000892581019 1022310213 /nfs/dbraw/zinc/31/02/13/1022310213.db2.gz SDGPPBPBRAYFFD-INIZCTEOSA-N 2 1 341.474 4.051 20 0 EIADMP CO[C@@](C)([C@@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000414249795 1022311461 /nfs/dbraw/zinc/31/14/61/1022311461.db2.gz XINUBNHKNBESPJ-BBGBUTGUSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@H]2CCCC23CCOCC3)C1 ZINC001167424094 1022314655 /nfs/dbraw/zinc/31/46/55/1022314655.db2.gz AXNRWPIMZJTFCO-QHAWAJNXSA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@H]2CCCC23CCOCC3)C1 ZINC001167424094 1022314674 /nfs/dbraw/zinc/31/46/74/1022314674.db2.gz AXNRWPIMZJTFCO-QHAWAJNXSA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@H]2CCCC23CCOCC3)C1 ZINC001167424094 1022314688 /nfs/dbraw/zinc/31/46/88/1022314688.db2.gz AXNRWPIMZJTFCO-QHAWAJNXSA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424515 1022320363 /nfs/dbraw/zinc/32/03/63/1022320363.db2.gz KUTWADINFHPBPO-QYZOEREBSA-N 2 1 336.564 4.167 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424515 1022320381 /nfs/dbraw/zinc/32/03/81/1022320381.db2.gz KUTWADINFHPBPO-QYZOEREBSA-N 2 1 336.564 4.167 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424515 1022320399 /nfs/dbraw/zinc/32/03/99/1022320399.db2.gz KUTWADINFHPBPO-QYZOEREBSA-N 2 1 336.564 4.167 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCc2ccccc2[C@H]1c1ccccc1 ZINC000580783409 1022498988 /nfs/dbraw/zinc/49/89/88/1022498988.db2.gz QONTUKLTJOXGOA-JOCHJYFZSA-N 2 1 331.463 4.000 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+]1CCc2ccccc2[C@H]1c1ccccc1 ZINC000580783409 1022498995 /nfs/dbraw/zinc/49/89/95/1022498995.db2.gz QONTUKLTJOXGOA-JOCHJYFZSA-N 2 1 331.463 4.000 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310891196 1022681048 /nfs/dbraw/zinc/68/10/48/1022681048.db2.gz KPYVCGHXNWWOMP-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP c1cc(-c2nc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cs2)cs1 ZINC000647542796 1022778833 /nfs/dbraw/zinc/77/88/33/1022778833.db2.gz BXMMMHGZBCDVMS-LSDHHAIUSA-N 2 1 347.553 4.083 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000311058169 1022819377 /nfs/dbraw/zinc/81/93/77/1022819377.db2.gz WIHIIKPSQURYFO-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310081718 1023100742 /nfs/dbraw/zinc/10/07/42/1023100742.db2.gz JTWWQSHTFVIRIJ-DYESRHJHSA-N 2 1 326.459 4.389 20 0 EIADMP CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000473307872 1033107603 /nfs/dbraw/zinc/10/76/03/1033107603.db2.gz DVVWSWSNVBESKL-FXAWDEMLSA-N 2 1 345.531 4.024 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C1CC(C(F)(F)F)C1 ZINC000581511235 1023317052 /nfs/dbraw/zinc/31/70/52/1023317052.db2.gz CGDGAFBGJAQGOJ-UHFFFAOYSA-N 2 1 328.422 4.075 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+]C2C[C@H]3CC[C@@H](C2)S3)C[N@H+]1Cc1ccccc1 ZINC000925617565 1023411291 /nfs/dbraw/zinc/41/12/91/1023411291.db2.gz XGNRCHOAPCEBGI-HHXCZETCSA-N 2 1 344.568 4.303 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075195 1023484115 /nfs/dbraw/zinc/48/41/15/1023484115.db2.gz OOSYAWYCRPPOLI-HUUCEWRRSA-N 2 1 328.422 4.083 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075195 1023484120 /nfs/dbraw/zinc/48/41/20/1023484120.db2.gz OOSYAWYCRPPOLI-HUUCEWRRSA-N 2 1 328.422 4.083 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075195 1023484124 /nfs/dbraw/zinc/48/41/24/1023484124.db2.gz OOSYAWYCRPPOLI-HUUCEWRRSA-N 2 1 328.422 4.083 20 0 EIADMP C[N@@H+]1CC[C@H](C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)[C@H]1c1cccs1 ZINC000377386048 1023503592 /nfs/dbraw/zinc/50/35/92/1023503592.db2.gz LWZHUUPMJVUIDJ-OHFALNGGSA-N 2 1 338.586 4.251 20 0 EIADMP C[N@H+]1CC[C@H](C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)[C@H]1c1cccs1 ZINC000377386048 1023503596 /nfs/dbraw/zinc/50/35/96/1023503596.db2.gz LWZHUUPMJVUIDJ-OHFALNGGSA-N 2 1 338.586 4.251 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(CC(C)C)nc2)c1 ZINC000892937203 1023527417 /nfs/dbraw/zinc/52/74/17/1023527417.db2.gz AJDJBWSSVZKTKI-UHFFFAOYSA-N 2 1 325.500 4.022 20 0 EIADMP c1csc(-c2ncc(C[N@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)s2)c1 ZINC000656786407 1023527761 /nfs/dbraw/zinc/52/77/61/1023527761.db2.gz SFRIPJHBTBWQRJ-HNNXBMFYSA-N 2 1 347.553 4.083 20 0 EIADMP c1cc(-c2nc(C[N@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cs2)cs1 ZINC000656786980 1023535915 /nfs/dbraw/zinc/53/59/15/1023535915.db2.gz YVOKIOBOSAQASP-OAHLLOKOSA-N 2 1 347.553 4.083 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(OC)c3ccccc23)CC1 ZINC000510449839 1023597463 /nfs/dbraw/zinc/59/74/63/1023597463.db2.gz PBQOROZWXFICJE-UHFFFAOYSA-N 2 1 326.484 4.155 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1Cc2ccccc2C1 ZINC000390540733 1023657981 /nfs/dbraw/zinc/65/79/81/1023657981.db2.gz HHPKEWDPRFIHQZ-JOCHJYFZSA-N 2 1 334.507 4.044 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1Cc2ccccc2C1 ZINC000390540733 1023657984 /nfs/dbraw/zinc/65/79/84/1023657984.db2.gz HHPKEWDPRFIHQZ-JOCHJYFZSA-N 2 1 334.507 4.044 20 0 EIADMP CC[C@H](Cc1cccs1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000684410403 1023660524 /nfs/dbraw/zinc/66/05/24/1023660524.db2.gz XPGGXCXUAWJJDX-RBUKOAKNSA-N 2 1 328.525 4.181 20 0 EIADMP CC[C@@H](c1ccccc1F)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000377688605 1023687706 /nfs/dbraw/zinc/68/77/06/1023687706.db2.gz ACOOSTXBSHGQQG-YYWHXJBOSA-N 2 1 341.474 4.297 20 0 EIADMP CC[C@@H](c1ccccc1F)N(C)C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1 ZINC000377688605 1023687709 /nfs/dbraw/zinc/68/77/09/1023687709.db2.gz ACOOSTXBSHGQQG-YYWHXJBOSA-N 2 1 341.474 4.297 20 0 EIADMP CC[C@@H](c1ccccc1F)N(C)C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1 ZINC000377688605 1023687723 /nfs/dbraw/zinc/68/77/23/1023687723.db2.gz ACOOSTXBSHGQQG-YYWHXJBOSA-N 2 1 341.474 4.297 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[NH+]([C@@H]2CCc3ccccc32)CC1 ZINC000377699657 1023694931 /nfs/dbraw/zinc/69/49/31/1023694931.db2.gz QIAUNHSTPBERPR-IFMALSPDSA-N 2 1 335.495 4.055 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[NH+]([C@@H]2CCc3ccccc32)CC1 ZINC000377699657 1023694937 /nfs/dbraw/zinc/69/49/37/1023694937.db2.gz QIAUNHSTPBERPR-IFMALSPDSA-N 2 1 335.495 4.055 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)CC1 ZINC000377699657 1023694942 /nfs/dbraw/zinc/69/49/42/1023694942.db2.gz QIAUNHSTPBERPR-IFMALSPDSA-N 2 1 335.495 4.055 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)CC1 ZINC000377699657 1023694944 /nfs/dbraw/zinc/69/49/44/1023694944.db2.gz QIAUNHSTPBERPR-IFMALSPDSA-N 2 1 335.495 4.055 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1cccc(O)c1 ZINC000390676019 1023768480 /nfs/dbraw/zinc/76/84/80/1023768480.db2.gz UHQVIHYVWRMCSU-LAUBAEHRSA-N 2 1 338.495 4.344 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1cccc(O)c1 ZINC000390676019 1023768485 /nfs/dbraw/zinc/76/84/85/1023768485.db2.gz UHQVIHYVWRMCSU-LAUBAEHRSA-N 2 1 338.495 4.344 20 0 EIADMP CC/C=C\CC[N@@H+]1CCC[C@]2(CC[NH+](Cc3scnc3C)C2)C1 ZINC001279522487 1023844865 /nfs/dbraw/zinc/84/48/65/1023844865.db2.gz YUVMSDKPBALANN-HMECNJMJSA-N 2 1 333.545 4.096 20 0 EIADMP CC/C=C\CC[N@H+]1CCC[C@]2(CC[NH+](Cc3scnc3C)C2)C1 ZINC001279522487 1023844869 /nfs/dbraw/zinc/84/48/69/1023844869.db2.gz YUVMSDKPBALANN-HMECNJMJSA-N 2 1 333.545 4.096 20 0 EIADMP CC/C=C\CC[NH+]1CCC[C@]2(CC[N@H+](Cc3scnc3C)C2)C1 ZINC001279522487 1023844873 /nfs/dbraw/zinc/84/48/73/1023844873.db2.gz YUVMSDKPBALANN-HMECNJMJSA-N 2 1 333.545 4.096 20 0 EIADMP CC/C=C\CC[NH+]1CCC[C@]2(CC[N@@H+](Cc3scnc3C)C2)C1 ZINC001279522487 1023844879 /nfs/dbraw/zinc/84/48/79/1023844879.db2.gz YUVMSDKPBALANN-HMECNJMJSA-N 2 1 333.545 4.096 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1 ZINC000130244938 1023932570 /nfs/dbraw/zinc/93/25/70/1023932570.db2.gz TXOITUSPGAUTNC-ZACQAIPSSA-N 2 1 337.305 4.117 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660710092 1024024218 /nfs/dbraw/zinc/02/42/18/1024024218.db2.gz JUNXZQWMCCRIRD-CYBMUJFWSA-N 2 1 345.878 4.194 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660710092 1024024242 /nfs/dbraw/zinc/02/42/42/1024024242.db2.gz JUNXZQWMCCRIRD-CYBMUJFWSA-N 2 1 345.878 4.194 20 0 EIADMP Cc1cccc([C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000510696132 1024243056 /nfs/dbraw/zinc/24/30/56/1024243056.db2.gz QALCQHGTNWGAMP-JTSKRJEESA-N 2 1 338.470 4.297 20 0 EIADMP Cc1cccc([C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000510696132 1024243072 /nfs/dbraw/zinc/24/30/72/1024243072.db2.gz QALCQHGTNWGAMP-JTSKRJEESA-N 2 1 338.470 4.297 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000510735405 1024371334 /nfs/dbraw/zinc/37/13/34/1024371334.db2.gz ONUHUSMTAVQWHW-FHLIZLRMSA-N 2 1 340.433 4.243 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCC[C@H]2CCCF)CC1 ZINC000510756706 1024402831 /nfs/dbraw/zinc/40/28/31/1024402831.db2.gz SGXWXNMYNUTMPD-GHTZIAJQSA-N 2 1 332.507 4.467 20 0 EIADMP FC(F)(F)c1ccc(C2([NH2+]C3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC000652330057 1024616726 /nfs/dbraw/zinc/61/67/26/1024616726.db2.gz SBWATWXRIKMDNE-UHFFFAOYSA-N 2 1 338.417 4.159 20 0 EIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652347475 1024699869 /nfs/dbraw/zinc/69/98/69/1024699869.db2.gz BLQMXDKCZYWXMM-TXXUCJGISA-N 2 1 338.495 4.119 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000164667916 1024773504 /nfs/dbraw/zinc/77/35/04/1024773504.db2.gz WOUNACCQCQWRGC-ZDUSSCGKSA-N 2 1 325.378 4.341 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000548483979 1024831462 /nfs/dbraw/zinc/83/14/62/1024831462.db2.gz RGRSLFXTVNAJIW-FRYIKTPZSA-N 2 1 332.557 4.161 20 0 EIADMP COC1(C[C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000510937503 1024849776 /nfs/dbraw/zinc/84/97/76/1024849776.db2.gz YDNHPOCWMOPHTQ-ICSRJNTNSA-N 2 1 344.543 4.224 20 0 EIADMP COC1(C[C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000510937503 1024849777 /nfs/dbraw/zinc/84/97/77/1024849777.db2.gz YDNHPOCWMOPHTQ-ICSRJNTNSA-N 2 1 344.543 4.224 20 0 EIADMP Cc1cncc([C@@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000510964032 1024870482 /nfs/dbraw/zinc/87/04/82/1024870482.db2.gz BOZXZBADFBZVRP-WIYYLYMNSA-N 2 1 337.511 4.341 20 0 EIADMP Cc1cncc([C@@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000510964032 1024870484 /nfs/dbraw/zinc/87/04/84/1024870484.db2.gz BOZXZBADFBZVRP-WIYYLYMNSA-N 2 1 337.511 4.341 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000249059200 1024875611 /nfs/dbraw/zinc/87/56/11/1024875611.db2.gz ZLRGILIFJDQZNB-REWPJTCUSA-N 2 1 349.522 4.088 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1cscn1 ZINC000535777389 1024936177 /nfs/dbraw/zinc/93/61/77/1024936177.db2.gz FGNCJOQWENFDDQ-BBWFWOEESA-N 2 1 343.540 4.472 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1cscn1 ZINC000535777389 1024936183 /nfs/dbraw/zinc/93/61/83/1024936183.db2.gz FGNCJOQWENFDDQ-BBWFWOEESA-N 2 1 343.540 4.472 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000684611407 1025056912 /nfs/dbraw/zinc/05/69/12/1025056912.db2.gz GLMNPPYBBXFDNC-NZQKXSOJSA-N 2 1 349.522 4.425 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2csc(-c3ccsc3)n2)[C@@H]1CCC[NH3+] ZINC000662313011 1025061891 /nfs/dbraw/zinc/06/18/91/1025061891.db2.gz JLZCKDYPRSNKKP-CZUORRHYSA-N 2 1 335.542 4.211 20 0 EIADMP COCC[C@@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(Cl)c(Cl)c1 ZINC000342056375 1025078902 /nfs/dbraw/zinc/07/89/02/1025078902.db2.gz HOIVARJXZMWINM-WMLDXEAASA-N 2 1 345.314 4.145 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CCCc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000684613739 1025087422 /nfs/dbraw/zinc/08/74/22/1025087422.db2.gz KWQZEZWWMMSKHA-SUMWQHHRSA-N 2 1 329.315 4.246 20 0 EIADMP COCC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000510994272 1025332877 /nfs/dbraw/zinc/33/28/77/1025332877.db2.gz GEZQVOSMCFXMIE-WOZUAGRISA-N 2 1 344.543 4.223 20 0 EIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663470231 1025411901 /nfs/dbraw/zinc/41/19/01/1025411901.db2.gz TWWIHJDOQUGEGP-YOEHRIQHSA-N 2 1 335.561 4.348 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(OCCC(C)C)cc1 ZINC000511002465 1025414596 /nfs/dbraw/zinc/41/45/96/1025414596.db2.gz SPUZWEYSXJBWBO-KRWDZBQOSA-N 2 1 329.488 4.357 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(Cl)c(Cl)c1 ZINC000925781076 1025526739 /nfs/dbraw/zinc/52/67/39/1025526739.db2.gz WLUMVVCSIFQRPF-FZMZJTMJSA-N 2 1 337.241 4.279 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(Cl)c(Cl)c1 ZINC000925781077 1025528996 /nfs/dbraw/zinc/52/89/96/1025528996.db2.gz WLUMVVCSIFQRPF-RISCZKNCSA-N 2 1 337.241 4.279 20 0 EIADMP C[C@H]([NH3+])C[NH2+][C@@H](C)c1ccc(-c2ccccc2Br)s1 ZINC000643527112 1025693977 /nfs/dbraw/zinc/69/39/77/1025693977.db2.gz DDOAXZNROGSVQG-QWRGUYRKSA-N 2 1 339.302 4.175 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCc3[nH+]ccn3C1)CCCS2 ZINC000278933304 1025724342 /nfs/dbraw/zinc/72/43/42/1025724342.db2.gz JKFFDRZDYKGTDT-CZUORRHYSA-N 2 1 347.915 4.316 20 0 EIADMP C[N@@H+](CCc1c(Cl)cccc1Cl)CC[C@@H]1CCCC[NH+]1C ZINC001167508306 1025750531 /nfs/dbraw/zinc/75/05/31/1025750531.db2.gz GBZSJHUEMGAIIH-AWEZNQCLSA-N 2 1 329.315 4.342 20 0 EIADMP C[N@H+](CCc1c(Cl)cccc1Cl)CC[C@@H]1CCCC[NH+]1C ZINC001167508306 1025750551 /nfs/dbraw/zinc/75/05/51/1025750551.db2.gz GBZSJHUEMGAIIH-AWEZNQCLSA-N 2 1 329.315 4.342 20 0 EIADMP C[NH+](CCc1c(Cl)cccc1Cl)CC[C@@H]1CCCC[N@@H+]1C ZINC001167508306 1025750570 /nfs/dbraw/zinc/75/05/70/1025750570.db2.gz GBZSJHUEMGAIIH-AWEZNQCLSA-N 2 1 329.315 4.342 20 0 EIADMP C[NH+](CCc1c(Cl)cccc1Cl)CC[C@@H]1CCCC[N@H+]1C ZINC001167508306 1025750590 /nfs/dbraw/zinc/75/05/90/1025750590.db2.gz GBZSJHUEMGAIIH-AWEZNQCLSA-N 2 1 329.315 4.342 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001167836223 1025846165 /nfs/dbraw/zinc/84/61/65/1025846165.db2.gz XUJIZKVZKPHALS-IBGZPJMESA-N 2 1 337.596 4.226 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001167836223 1025846170 /nfs/dbraw/zinc/84/61/70/1025846170.db2.gz XUJIZKVZKPHALS-IBGZPJMESA-N 2 1 337.596 4.226 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001167836223 1025846176 /nfs/dbraw/zinc/84/61/76/1025846176.db2.gz XUJIZKVZKPHALS-IBGZPJMESA-N 2 1 337.596 4.226 20 0 EIADMP C[N@H+](CCCCC(F)(F)F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000157379053 1025851366 /nfs/dbraw/zinc/85/13/66/1025851366.db2.gz JSTRIDRAUAAEBR-UHFFFAOYSA-N 2 1 328.422 4.315 20 0 EIADMP C[N@@H+](CCCCC(F)(F)F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000157379053 1025851371 /nfs/dbraw/zinc/85/13/71/1025851371.db2.gz JSTRIDRAUAAEBR-UHFFFAOYSA-N 2 1 328.422 4.315 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C2CC(OC(C)(C)C)C2)CC1)CC(C)C ZINC000450655428 1025867825 /nfs/dbraw/zinc/86/78/25/1025867825.db2.gz XDLMWKVFFFSVKJ-UHFFFAOYSA-N 2 1 338.580 4.413 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H](Cc2cccc(OC)c2)C1 ZINC001167841620 1025886939 /nfs/dbraw/zinc/88/69/39/1025886939.db2.gz NEKYNVCMKZZVFX-CTNGQTDRSA-N 2 1 346.559 4.460 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)sc1Br ZINC000375660400 1025907031 /nfs/dbraw/zinc/90/70/31/1025907031.db2.gz MWZQNBKVLIKFDE-RWMBFGLXSA-N 2 1 343.334 4.096 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)sc1Br ZINC000375660400 1025907087 /nfs/dbraw/zinc/90/70/87/1025907087.db2.gz MWZQNBKVLIKFDE-RWMBFGLXSA-N 2 1 343.334 4.096 20 0 EIADMP CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C12CCC2 ZINC000344082708 1025976165 /nfs/dbraw/zinc/97/61/65/1025976165.db2.gz ZOMYSKSZMRPCKW-CDHQVMDDSA-N 2 1 339.483 4.179 20 0 EIADMP Clc1ccc2c(c1)C[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)CC2 ZINC001167969823 1026029825 /nfs/dbraw/zinc/02/98/25/1026029825.db2.gz FDJXMIGJBSBOMY-WVVQBRDUSA-N 2 1 344.930 4.192 20 0 EIADMP CC(C)(Cc1ccccc1F)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167969935 1026042398 /nfs/dbraw/zinc/04/23/98/1026042398.db2.gz IEXBTMLNQOOYGS-YQQQUEKLSA-N 2 1 330.491 4.142 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCCc4ccc(F)cc43)CC2)[nH+]c1 ZINC000344165225 1026082084 /nfs/dbraw/zinc/08/20/84/1026082084.db2.gz JIFRLUUBGJVDIM-FQEVSTJZSA-N 2 1 339.458 4.165 20 0 EIADMP CC(C)n1ccnc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000657337165 1026157065 /nfs/dbraw/zinc/15/70/65/1026157065.db2.gz KWAGJYCWYFTYJN-UHFFFAOYSA-N 2 1 340.515 4.130 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCSc2cc(C)c(C)cc21 ZINC000187160684 1026341473 /nfs/dbraw/zinc/34/14/73/1026341473.db2.gz BTLAWAKNEWQIJU-UGSOOPFHSA-N 2 1 329.513 4.271 20 0 EIADMP COc1ccc(CC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000342475438 1026408196 /nfs/dbraw/zinc/40/81/96/1026408196.db2.gz SJADNFBFWLXVRJ-MRXNPFEDSA-N 2 1 335.451 4.083 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc3ncccc3c2)C1 ZINC000512196601 1026409131 /nfs/dbraw/zinc/40/91/31/1026409131.db2.gz OROIQBPFEBFNTK-AZUAARDMSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc3ncccc3c2)C1 ZINC000512196601 1026409137 /nfs/dbraw/zinc/40/91/37/1026409137.db2.gz OROIQBPFEBFNTK-AZUAARDMSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc3ncccc3c2)C1 ZINC000512196601 1026409141 /nfs/dbraw/zinc/40/91/41/1026409141.db2.gz OROIQBPFEBFNTK-AZUAARDMSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc3ncccc3c2)C1 ZINC000512196601 1026409145 /nfs/dbraw/zinc/40/91/45/1026409145.db2.gz OROIQBPFEBFNTK-AZUAARDMSA-N 2 1 337.511 4.321 20 0 EIADMP CSc1ccccc1C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000511109684 1026552160 /nfs/dbraw/zinc/55/21/60/1026552160.db2.gz KTUOCXYYNOQGPZ-IBGZPJMESA-N 2 1 340.536 4.362 20 0 EIADMP CSc1ccccc1C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000511109684 1026552168 /nfs/dbraw/zinc/55/21/68/1026552168.db2.gz KTUOCXYYNOQGPZ-IBGZPJMESA-N 2 1 340.536 4.362 20 0 EIADMP CSc1ccccc1C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511109684 1026552177 /nfs/dbraw/zinc/55/21/77/1026552177.db2.gz KTUOCXYYNOQGPZ-IBGZPJMESA-N 2 1 340.536 4.362 20 0 EIADMP CSc1ccccc1C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511109684 1026552187 /nfs/dbraw/zinc/55/21/87/1026552187.db2.gz KTUOCXYYNOQGPZ-IBGZPJMESA-N 2 1 340.536 4.362 20 0 EIADMP Fc1cccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c1F ZINC000432667612 1026694835 /nfs/dbraw/zinc/69/48/35/1026694835.db2.gz UOWMWWQVJBVPOY-QGZVFWFLSA-N 2 1 348.462 4.171 20 0 EIADMP Fc1cccc(C[N@@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c1F ZINC000432667612 1026694850 /nfs/dbraw/zinc/69/48/50/1026694850.db2.gz UOWMWWQVJBVPOY-QGZVFWFLSA-N 2 1 348.462 4.171 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148323 1026751095 /nfs/dbraw/zinc/75/10/95/1026751095.db2.gz XOKFCLNKPINFAN-SJLPKXTDSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148323 1026751108 /nfs/dbraw/zinc/75/11/08/1026751108.db2.gz XOKFCLNKPINFAN-SJLPKXTDSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148323 1026751117 /nfs/dbraw/zinc/75/11/17/1026751117.db2.gz XOKFCLNKPINFAN-SJLPKXTDSA-N 2 1 340.433 4.369 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+][C@H](c4cccnc4)C4CC4)[C@@H]3C2)cc1 ZINC000507463485 1026804632 /nfs/dbraw/zinc/80/46/32/1026804632.db2.gz UCGSBTBJCOGUAY-BJESRGMDSA-N 2 1 347.506 4.033 20 0 EIADMP CCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000582560156 1026805625 /nfs/dbraw/zinc/80/56/25/1026805625.db2.gz CWFFKGAYMQIECV-IFMALSPDSA-N 2 1 338.495 4.401 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC000507498292 1026812910 /nfs/dbraw/zinc/81/29/10/1026812910.db2.gz UXBRHBDLRBXQHR-RMVZNSSTSA-N 2 1 349.522 4.205 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000507498291 1026813152 /nfs/dbraw/zinc/81/31/52/1026813152.db2.gz UXBRHBDLRBXQHR-RBQRNVLBSA-N 2 1 349.522 4.205 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000507517124 1026818030 /nfs/dbraw/zinc/81/80/30/1026818030.db2.gz XLFOYABFFNAZKR-IRFPFTSISA-N 2 1 349.522 4.490 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000507517124 1026818032 /nfs/dbraw/zinc/81/80/32/1026818032.db2.gz XLFOYABFFNAZKR-IRFPFTSISA-N 2 1 349.522 4.490 20 0 EIADMP CCc1cccnc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000507517123 1026818238 /nfs/dbraw/zinc/81/82/38/1026818238.db2.gz XLFOYABFFNAZKR-AMZGXZFVSA-N 2 1 349.522 4.490 20 0 EIADMP CCc1cccnc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000507517123 1026818241 /nfs/dbraw/zinc/81/82/41/1026818241.db2.gz XLFOYABFFNAZKR-AMZGXZFVSA-N 2 1 349.522 4.490 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCCOC1 ZINC000507513045 1026822865 /nfs/dbraw/zinc/82/28/65/1026822865.db2.gz QNKHQFOOXBDKMS-VQQMMKBISA-N 2 1 344.543 4.069 20 0 EIADMP CCSCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000507532122 1026828690 /nfs/dbraw/zinc/82/86/90/1026828690.db2.gz RKMVCTMSPFKVBF-OJAHFUOMSA-N 2 1 332.557 4.018 20 0 EIADMP CCSCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000507531757 1026829008 /nfs/dbraw/zinc/82/90/08/1026829008.db2.gz RKMVCTMSPFKVBF-IJXRJRJASA-N 2 1 332.557 4.018 20 0 EIADMP CCSCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000507531755 1026829336 /nfs/dbraw/zinc/82/93/36/1026829336.db2.gz RKMVCTMSPFKVBF-FRYIKTPZSA-N 2 1 332.557 4.018 20 0 EIADMP Cc1ccccc1SC[C@@H](C)C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC001167599045 1026943040 /nfs/dbraw/zinc/94/30/40/1026943040.db2.gz NWSPWVTUTKYFDW-PXNSSMCTSA-N 2 1 346.584 4.387 20 0 EIADMP Cc1ccccc1SC[C@@H](C)C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC001167599045 1026943045 /nfs/dbraw/zinc/94/30/45/1026943045.db2.gz NWSPWVTUTKYFDW-PXNSSMCTSA-N 2 1 346.584 4.387 20 0 EIADMP Cc1ccccc1SC[C@@H](C)C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC001167599045 1026943050 /nfs/dbraw/zinc/94/30/50/1026943050.db2.gz NWSPWVTUTKYFDW-PXNSSMCTSA-N 2 1 346.584 4.387 20 0 EIADMP Cc1ccccc1SC[C@H](C)C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC001167599046 1026943198 /nfs/dbraw/zinc/94/31/98/1026943198.db2.gz NWSPWVTUTKYFDW-XLIONFOSSA-N 2 1 346.584 4.387 20 0 EIADMP Cc1ccccc1SC[C@H](C)C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC001167599046 1026943203 /nfs/dbraw/zinc/94/32/03/1026943203.db2.gz NWSPWVTUTKYFDW-XLIONFOSSA-N 2 1 346.584 4.387 20 0 EIADMP Cc1ccccc1SC[C@H](C)C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC001167599046 1026943210 /nfs/dbraw/zinc/94/32/10/1026943210.db2.gz NWSPWVTUTKYFDW-XLIONFOSSA-N 2 1 346.584 4.387 20 0 EIADMP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000164624892 1027067097 /nfs/dbraw/zinc/06/70/97/1027067097.db2.gz DBOVEOCUWGQUSC-AWEZNQCLSA-N 2 1 335.879 4.375 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000474484969 1027122855 /nfs/dbraw/zinc/12/28/55/1027122855.db2.gz BWUCKXSDKXVMCA-HNNXBMFYSA-N 2 1 329.315 4.248 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000261663805 1027219016 /nfs/dbraw/zinc/21/90/16/1027219016.db2.gz GNPNKYVHNWTVHR-CYBMUJFWSA-N 2 1 326.406 4.230 20 0 EIADMP CS[C@H]1CCCC[NH+](CC(C)C[N@@H+]2CCCC[C@H](SC)C2)C1 ZINC000441136045 1027301262 /nfs/dbraw/zinc/30/12/62/1027301262.db2.gz UXTYYTNSAHFJQD-ROUUACIJSA-N 2 1 344.634 4.058 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccccc1)Cc1ccccc1F ZINC000342861284 1027334864 /nfs/dbraw/zinc/33/48/64/1027334864.db2.gz VZDKHFXWTLSQCR-UHFFFAOYSA-N 2 1 337.442 4.423 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC000342861284 1027334879 /nfs/dbraw/zinc/33/48/79/1027334879.db2.gz VZDKHFXWTLSQCR-UHFFFAOYSA-N 2 1 337.442 4.423 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000474628559 1027336446 /nfs/dbraw/zinc/33/64/46/1027336446.db2.gz LBXKIXAXRKKFOX-LJISPDSOSA-N 2 1 326.937 4.215 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cccc3[nH]ccc32)CC1 ZINC000116368060 1027337560 /nfs/dbraw/zinc/33/75/60/1027337560.db2.gz ARDHGMAIYFSVLS-QGZVFWFLSA-N 2 1 333.479 4.483 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC000342863682 1027352163 /nfs/dbraw/zinc/35/21/63/1027352163.db2.gz IOMFLFQRTLBMBT-UHFFFAOYSA-N 2 1 333.426 4.305 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC000342863682 1027352183 /nfs/dbraw/zinc/35/21/83/1027352183.db2.gz IOMFLFQRTLBMBT-UHFFFAOYSA-N 2 1 333.426 4.305 20 0 EIADMP Cc1ccc(CCC[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)cn1 ZINC000474730327 1027448646 /nfs/dbraw/zinc/44/86/46/1027448646.db2.gz PCRCGSJJFZSXJS-LJQANCHMSA-N 2 1 337.511 4.138 20 0 EIADMP CO[C@@]1(C)CCC[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC000475552717 1027591768 /nfs/dbraw/zinc/59/17/68/1027591768.db2.gz DFGWHBQNNFBYNC-NRFANRHFSA-N 2 1 332.532 4.036 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@@H](C)[C@H](C)C3CCCCC3)CC2)nc(C)[nH+]1 ZINC000474879752 1027709793 /nfs/dbraw/zinc/70/97/93/1027709793.db2.gz ODQWTICHOQYCLA-IRXDYDNUSA-N 2 1 344.547 4.257 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150769390 1028051808 /nfs/dbraw/zinc/05/18/08/1028051808.db2.gz WKDZRVQOBNPRSP-HUUCEWRRSA-N 2 1 326.406 4.184 20 0 EIADMP CSCC1CCC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC000395342839 1028170646 /nfs/dbraw/zinc/17/06/46/1028170646.db2.gz CKBFHCFJOGUZRC-UHFFFAOYSA-N 2 1 346.584 4.205 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)Cc1cccs1 ZINC000583194604 1028218461 /nfs/dbraw/zinc/21/84/61/1028218461.db2.gz LUOJUAJMOQDQJI-HQRMLTQVSA-N 2 1 328.525 4.352 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)Cc1cccs1 ZINC000583194604 1028218475 /nfs/dbraw/zinc/21/84/75/1028218475.db2.gz LUOJUAJMOQDQJI-HQRMLTQVSA-N 2 1 328.525 4.352 20 0 EIADMP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1 ZINC000280963618 1028312208 /nfs/dbraw/zinc/31/22/08/1028312208.db2.gz ZGTUYTMNSFGFMK-DDBAPUKQSA-N 2 1 338.417 4.168 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000346225045 1028333909 /nfs/dbraw/zinc/33/39/09/1028333909.db2.gz VNBFPQDQCMTRRJ-SFHVURJKSA-N 2 1 346.478 4.376 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(C(C)(C)C)cc2)[C@@H](C)C1 ZINC000523733320 1028342310 /nfs/dbraw/zinc/34/23/10/1028342310.db2.gz VVRWNXYVOJKGRP-GHTZIAJQSA-N 2 1 346.559 4.211 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000346350243 1028385799 /nfs/dbraw/zinc/38/57/99/1028385799.db2.gz JTRFTWXYTDLOFE-LCCNJJIFSA-N 2 1 344.462 4.254 20 0 EIADMP COc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)ccc1SC ZINC000125918147 1028496129 /nfs/dbraw/zinc/49/61/29/1028496129.db2.gz DHNDXJXUWVLVFG-JKSUJKDBSA-N 2 1 336.545 4.188 20 0 EIADMP Clc1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000347080656 1028872117 /nfs/dbraw/zinc/87/21/17/1028872117.db2.gz FXFVCFHPYIHUDP-UHFFFAOYSA-N 2 1 329.875 4.252 20 0 EIADMP CCOC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCCC1 ZINC000583692768 1029043177 /nfs/dbraw/zinc/04/31/77/1029043177.db2.gz CHIMNFDPWQROOD-FQEVSTJZSA-N 2 1 342.527 4.123 20 0 EIADMP CCOC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCCC1 ZINC000583692768 1029043197 /nfs/dbraw/zinc/04/31/97/1029043197.db2.gz CHIMNFDPWQROOD-FQEVSTJZSA-N 2 1 342.527 4.123 20 0 EIADMP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000278396765 1029101258 /nfs/dbraw/zinc/10/12/58/1029101258.db2.gz NDTVDHNOTOLAGP-INIZCTEOSA-N 2 1 341.474 4.051 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CNc3ccccc3C2)CC1 ZINC000650749562 1029111634 /nfs/dbraw/zinc/11/16/34/1029111634.db2.gz PXMVNOZYPUPPAG-ATKRNPRHSA-N 2 1 349.522 4.056 20 0 EIADMP CCc1cccc(Cl)c1C[N@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000475089051 1029234343 /nfs/dbraw/zinc/23/43/43/1029234343.db2.gz NQNQTXGQINBMIK-HNNXBMFYSA-N 2 1 331.891 4.091 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCC[NH+](C(C)C)C(C)C)CCS2 ZINC000343467297 1029307836 /nfs/dbraw/zinc/30/78/36/1029307836.db2.gz LZANOGCDXILVFY-GOSISDBHSA-N 2 1 336.545 4.331 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[N@H+]2C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168057922 1029354245 /nfs/dbraw/zinc/35/42/45/1029354245.db2.gz OPOKHMVJPAKWFO-SCLXUNQDSA-N 2 1 342.527 4.070 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[N@@H+]2C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168057922 1029354259 /nfs/dbraw/zinc/35/42/59/1029354259.db2.gz OPOKHMVJPAKWFO-SCLXUNQDSA-N 2 1 342.527 4.070 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)CCS2 ZINC000343493598 1029357402 /nfs/dbraw/zinc/35/74/02/1029357402.db2.gz DCBDPCXJCHHLIS-VQIMIIECSA-N 2 1 348.556 4.476 20 0 EIADMP COC(C)(C)[C@@H]1CCC[N@@H+]1C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168058674 1029373010 /nfs/dbraw/zinc/37/30/10/1029373010.db2.gz BQXZDKBPOOBKGM-OPYAIIAOSA-N 2 1 344.543 4.317 20 0 EIADMP COC(C)(C)[C@@H]1CCC[N@H+]1C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168058674 1029373030 /nfs/dbraw/zinc/37/30/30/1029373030.db2.gz BQXZDKBPOOBKGM-OPYAIIAOSA-N 2 1 344.543 4.317 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@]3(CC3(F)F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168058834 1029376530 /nfs/dbraw/zinc/37/65/30/1029376530.db2.gz CPEDYAHEHKEJCY-NBMJBFSESA-N 2 1 334.454 4.159 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@]3(CC3(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168058834 1029376546 /nfs/dbraw/zinc/37/65/46/1029376546.db2.gz CPEDYAHEHKEJCY-NBMJBFSESA-N 2 1 334.454 4.159 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@]3(CC3(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168058834 1029376563 /nfs/dbraw/zinc/37/65/63/1029376563.db2.gz CPEDYAHEHKEJCY-NBMJBFSESA-N 2 1 334.454 4.159 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ncc(-c3ccccc3F)o2)CC1 ZINC000525126679 1029467050 /nfs/dbraw/zinc/46/70/50/1029467050.db2.gz JIHKWDAXDLXUGW-UHFFFAOYSA-N 2 1 345.462 4.033 20 0 EIADMP C[C@@H]1C[C@H](NCc2cc(Cl)ccc2OC2CCCC2)CC[N@H+]1C ZINC000525207851 1029514655 /nfs/dbraw/zinc/51/46/55/1029514655.db2.gz RFDBKVYVIQJXKK-RHSMWYFYSA-N 2 1 336.907 4.234 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@@H](C(F)(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168061380 1029541324 /nfs/dbraw/zinc/54/13/24/1029541324.db2.gz IFESMEYCIUAQKE-BFYDXBDKSA-N 2 1 340.433 4.312 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)CC1(C)C ZINC000623377635 1029605232 /nfs/dbraw/zinc/60/52/32/1029605232.db2.gz DJVMMLADFFFEBO-INIZCTEOSA-N 2 1 328.422 4.100 20 0 EIADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2ccc3occc3c2)CC1 ZINC000584105551 1029624018 /nfs/dbraw/zinc/62/40/18/1029624018.db2.gz DZECDCNGRLJKPX-UHFFFAOYSA-N 2 1 344.499 4.003 20 0 EIADMP Cc1cc(NCCc2[nH+]ccn2Cc2ccccc2)c2ccccc2[nH+]1 ZINC000301085605 1029666027 /nfs/dbraw/zinc/66/60/27/1029666027.db2.gz PPHLQDHCOLXARY-UHFFFAOYSA-N 2 1 342.446 4.443 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CCC[C@@H]([NH+]4CCCC4)CC3)c2c1 ZINC000301362332 1029717531 /nfs/dbraw/zinc/71/75/31/1029717531.db2.gz MONZZPICWWWJQV-MRXNPFEDSA-N 2 1 329.875 4.343 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(C(F)F)nc1 ZINC000657838546 1029721745 /nfs/dbraw/zinc/72/17/45/1029721745.db2.gz VOJBHEFZJPIAHQ-HUUCEWRRSA-N 2 1 325.447 4.324 20 0 EIADMP Cc1cc(C)c(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)cc1C ZINC000708511636 1029742830 /nfs/dbraw/zinc/74/28/30/1029742830.db2.gz DYLZFMPNCLCKFL-NZQKXSOJSA-N 2 1 336.523 4.470 20 0 EIADMP Cc1cc(C)c(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)cc1C ZINC000708511638 1029743279 /nfs/dbraw/zinc/74/32/79/1029743279.db2.gz DYLZFMPNCLCKFL-REWPJTCUSA-N 2 1 336.523 4.470 20 0 EIADMP Cc1cc(C)c(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)cc1C ZINC000708511637 1029743604 /nfs/dbraw/zinc/74/36/04/1029743604.db2.gz DYLZFMPNCLCKFL-OFNKIYASSA-N 2 1 336.523 4.470 20 0 EIADMP CC[NH+](CC)CCCC1CC[NH+](Cc2nc(C3CC3)cs2)CC1 ZINC000343761742 1029777374 /nfs/dbraw/zinc/77/73/74/1029777374.db2.gz TXUHDLNBCDQZIZ-UHFFFAOYSA-N 2 1 335.561 4.355 20 0 EIADMP CCc1cc(NCc2ccc(-n3cc[nH+]c3C)nc2)c2ccccc2[nH+]1 ZINC000301780080 1029807683 /nfs/dbraw/zinc/80/76/83/1029807683.db2.gz ILPURQNLHDAQCB-UHFFFAOYSA-N 2 1 343.434 4.298 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1nc2ccccc2n1C(F)F ZINC000091346685 1029884161 /nfs/dbraw/zinc/88/41/61/1029884161.db2.gz GRRWAQHRFOUTQH-ZDUSSCGKSA-N 2 1 347.413 4.067 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1nc2ccccc2n1C(F)F ZINC000091346686 1029884299 /nfs/dbraw/zinc/88/42/99/1029884299.db2.gz GRRWAQHRFOUTQH-CYBMUJFWSA-N 2 1 347.413 4.067 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)o1 ZINC000092072515 1029899220 /nfs/dbraw/zinc/89/92/20/1029899220.db2.gz ZPQHQZNHRNACNO-HNNXBMFYSA-N 2 1 339.414 4.497 20 0 EIADMP Cc1cc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)ccc1Oc1cccnc1 ZINC000092072959 1029899776 /nfs/dbraw/zinc/89/97/76/1029899776.db2.gz SQRBVBWPQOOVLG-SFHVURJKSA-N 2 1 348.450 4.285 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CCSc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183183497 1029987073 /nfs/dbraw/zinc/98/70/73/1029987073.db2.gz UDTWLPJFSYPALN-GPMSIDNRSA-N 2 1 330.541 4.466 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000525786793 1030001821 /nfs/dbraw/zinc/00/18/21/1030001821.db2.gz OGDVIPIGJGNITI-LSDHHAIUSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000525786793 1030001841 /nfs/dbraw/zinc/00/18/41/1030001841.db2.gz OGDVIPIGJGNITI-LSDHHAIUSA-N 2 1 342.405 4.064 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657877300 1030154179 /nfs/dbraw/zinc/15/41/79/1030154179.db2.gz PUYOODWCPKWMGA-RYUDHWBXSA-N 2 1 345.712 4.095 20 0 EIADMP Cn1cc[nH+]c1CC1CC[NH+](CC2CCC(C(F)(F)F)CC2)CC1 ZINC000185511327 1030200277 /nfs/dbraw/zinc/20/02/77/1030200277.db2.gz PFMFCFSOVZLKOS-UHFFFAOYSA-N 2 1 343.437 4.043 20 0 EIADMP CCc1cnccc1[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447579678 1030206680 /nfs/dbraw/zinc/20/66/80/1030206680.db2.gz LIYQORLFAAVAOQ-HLRQEUIKSA-N 2 1 349.522 4.490 20 0 EIADMP c1c2ccccc2[nH]c1C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000685443056 1030321230 /nfs/dbraw/zinc/32/12/30/1030321230.db2.gz NIDKSDYQFJRBAO-QHCPKHFHSA-N 2 1 345.490 4.266 20 0 EIADMP c1c2ccccc2[nH]c1C[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000685443056 1030321241 /nfs/dbraw/zinc/32/12/41/1030321241.db2.gz NIDKSDYQFJRBAO-QHCPKHFHSA-N 2 1 345.490 4.266 20 0 EIADMP c1c2ccccc2[nH]c1C[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000685443056 1030321247 /nfs/dbraw/zinc/32/12/47/1030321247.db2.gz NIDKSDYQFJRBAO-QHCPKHFHSA-N 2 1 345.490 4.266 20 0 EIADMP c1c2ccccc2[nH]c1C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000685443056 1030321255 /nfs/dbraw/zinc/32/12/55/1030321255.db2.gz NIDKSDYQFJRBAO-QHCPKHFHSA-N 2 1 345.490 4.266 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cc(F)cc(C(F)(F)F)c3)C2)CC1 ZINC000685463174 1030342187 /nfs/dbraw/zinc/34/21/87/1030342187.db2.gz XDZAADOWVRDWDS-HNNXBMFYSA-N 2 1 344.396 4.008 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000657893069 1030390176 /nfs/dbraw/zinc/39/01/76/1030390176.db2.gz ZSXOBQNORMPBTL-YRGRVCCFSA-N 2 1 348.840 4.362 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000657893069 1030390195 /nfs/dbraw/zinc/39/01/95/1030390195.db2.gz ZSXOBQNORMPBTL-YRGRVCCFSA-N 2 1 348.840 4.362 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(OCc3ccccc3)cc2)CC[N@@H+]1C ZINC000530666078 1030624175 /nfs/dbraw/zinc/62/41/75/1030624175.db2.gz SANQCXAFOLTDLP-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(OCc3ccccc3)cc2)CC[N@H+]1C ZINC000530666078 1030624176 /nfs/dbraw/zinc/62/41/76/1030624176.db2.gz SANQCXAFOLTDLP-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(OCc3ccccc3)cc2)CC[NH+]1C ZINC000530666078 1030624179 /nfs/dbraw/zinc/62/41/79/1030624179.db2.gz SANQCXAFOLTDLP-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(OCc3ccccc3)cc2)CC[NH+]1C ZINC000530666078 1030624182 /nfs/dbraw/zinc/62/41/82/1030624182.db2.gz SANQCXAFOLTDLP-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000530667405 1030624452 /nfs/dbraw/zinc/62/44/52/1030624452.db2.gz FBFSYDDUSNYGRV-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000530667405 1030624463 /nfs/dbraw/zinc/62/44/63/1030624463.db2.gz FBFSYDDUSNYGRV-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000530667405 1030624471 /nfs/dbraw/zinc/62/44/71/1030624471.db2.gz FBFSYDDUSNYGRV-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000530667405 1030624488 /nfs/dbraw/zinc/62/44/88/1030624488.db2.gz FBFSYDDUSNYGRV-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000685665176 1030663494 /nfs/dbraw/zinc/66/34/94/1030663494.db2.gz HDQIYFLOXYCNAU-QFBILLFUSA-N 2 1 343.540 4.404 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000685665176 1030663505 /nfs/dbraw/zinc/66/35/05/1030663505.db2.gz HDQIYFLOXYCNAU-QFBILLFUSA-N 2 1 343.540 4.404 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc2cnccc2o1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657968525 1030711604 /nfs/dbraw/zinc/71/16/04/1030711604.db2.gz AVYDFSDXBNKYKE-PMPSAXMXSA-N 2 1 327.472 4.131 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc2cnccc2o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000657968525 1030711631 /nfs/dbraw/zinc/71/16/31/1030711631.db2.gz AVYDFSDXBNKYKE-PMPSAXMXSA-N 2 1 327.472 4.131 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657998976 1030769195 /nfs/dbraw/zinc/76/91/95/1030769195.db2.gz QHTMWQXWFPMAPL-WMZOPIPTSA-N 2 1 335.451 4.001 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657998976 1030769214 /nfs/dbraw/zinc/76/92/14/1030769214.db2.gz QHTMWQXWFPMAPL-WMZOPIPTSA-N 2 1 335.451 4.001 20 0 EIADMP CCOC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000658002440 1030769683 /nfs/dbraw/zinc/76/96/83/1030769683.db2.gz CMWNTDKEHJUUNP-XVAXZDLZSA-N 2 1 344.543 4.224 20 0 EIADMP CCOC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000658002440 1030769700 /nfs/dbraw/zinc/76/97/00/1030769700.db2.gz CMWNTDKEHJUUNP-XVAXZDLZSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@H](NC[C@H]1CC[N@@H+]1C1CCCCC1)c1cnc2ccsc2c1 ZINC000527949020 1030965600 /nfs/dbraw/zinc/96/56/00/1030965600.db2.gz NQICBPAWJMESSN-WMLDXEAASA-N 2 1 329.513 4.354 20 0 EIADMP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccccn1 ZINC000658320160 1030981067 /nfs/dbraw/zinc/98/10/67/1030981067.db2.gz OVZJZDZZTIAJMU-ICSRJNTNSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccccn1 ZINC000658320160 1030981087 /nfs/dbraw/zinc/98/10/87/1030981087.db2.gz OVZJZDZZTIAJMU-ICSRJNTNSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCOc2ccc3ccccc3c2)CC[N@@H+]1C ZINC000531381782 1031177496 /nfs/dbraw/zinc/17/74/96/1031177496.db2.gz IKENAGHTTQFRTO-YLJYHZDGSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCOc2ccc3ccccc3c2)CC[N@H+]1C ZINC000531381782 1031177504 /nfs/dbraw/zinc/17/75/04/1031177504.db2.gz IKENAGHTTQFRTO-YLJYHZDGSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)CCCOc2ccc3ccccc3c2)CC[NH+]1C ZINC000531381782 1031177517 /nfs/dbraw/zinc/17/75/17/1031177517.db2.gz IKENAGHTTQFRTO-YLJYHZDGSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCOc2ccc3ccccc3c2)CC[NH+]1C ZINC000531381782 1031177530 /nfs/dbraw/zinc/17/75/30/1031177530.db2.gz IKENAGHTTQFRTO-YLJYHZDGSA-N 2 1 326.484 4.023 20 0 EIADMP C[N@H+]1CC[C@@H](NCc2cnc3ccccc3c2)C[C@@H]1c1ccccc1 ZINC000340209147 1031191007 /nfs/dbraw/zinc/19/10/07/1031191007.db2.gz IIIHEBRETUKJOW-IFMALSPDSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cnc3ccccc3c2)C[C@@H]1c1ccccc1 ZINC000340209147 1031191016 /nfs/dbraw/zinc/19/10/16/1031191016.db2.gz IIIHEBRETUKJOW-IFMALSPDSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2cnc3ccccc3c2)C[C@@H]1c1ccccc1 ZINC000340209147 1031191022 /nfs/dbraw/zinc/19/10/22/1031191022.db2.gz IIIHEBRETUKJOW-IFMALSPDSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc3ncccc3c2)C[C@H]1c1ccccc1 ZINC000340377430 1031211586 /nfs/dbraw/zinc/21/15/86/1031211586.db2.gz ISHIMDVOQBLPKL-IRLDBZIGSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc3ncccc3c2)C[C@H]1c1ccccc1 ZINC000340377430 1031211606 /nfs/dbraw/zinc/21/16/06/1031211606.db2.gz ISHIMDVOQBLPKL-IRLDBZIGSA-N 2 1 331.463 4.160 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(CO)c2)cc1 ZINC000305672205 1031217027 /nfs/dbraw/zinc/21/70/27/1031217027.db2.gz XPOIYOKZABIRBF-HZPDHXFCSA-N 2 1 335.451 4.085 20 0 EIADMP CC1CCC([N@@H+]2C[C@@H]3CCC[C@H]([NH+](C)Cc4ccccn4)[C@@H]3C2)CC1 ZINC001168216971 1031325270 /nfs/dbraw/zinc/32/52/70/1031325270.db2.gz GOVBCIWFZVIOQW-ZFWHCASKSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([N@H+]2C[C@@H]3CCC[C@H]([NH+](C)Cc4ccccn4)[C@@H]3C2)CC1 ZINC001168216971 1031325287 /nfs/dbraw/zinc/32/52/87/1031325287.db2.gz GOVBCIWFZVIOQW-ZFWHCASKSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([NH+]2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)CC1 ZINC001168216971 1031325302 /nfs/dbraw/zinc/32/53/02/1031325302.db2.gz GOVBCIWFZVIOQW-ZFWHCASKSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([NH+]2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)CC1 ZINC001168216971 1031325316 /nfs/dbraw/zinc/32/53/16/1031325316.db2.gz GOVBCIWFZVIOQW-ZFWHCASKSA-N 2 1 341.543 4.193 20 0 EIADMP COc1cc2ccccc2cc1C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000449038177 1031374485 /nfs/dbraw/zinc/37/44/85/1031374485.db2.gz SDBBRPLKDZDKNG-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc2ccccc2cc1C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000449038177 1031374505 /nfs/dbraw/zinc/37/45/05/1031374505.db2.gz SDBBRPLKDZDKNG-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc2ccccc2cc1C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000449038177 1031374524 /nfs/dbraw/zinc/37/45/24/1031374524.db2.gz SDBBRPLKDZDKNG-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc2ccccc2cc1C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000449038177 1031374546 /nfs/dbraw/zinc/37/45/46/1031374546.db2.gz SDBBRPLKDZDKNG-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000449084227 1031411552 /nfs/dbraw/zinc/41/15/52/1031411552.db2.gz XABGBPIYMUBUKX-RXVVDRJESA-N 2 1 342.527 4.252 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000532626172 1031443214 /nfs/dbraw/zinc/44/32/14/1031443214.db2.gz MCVBXDINYMBSLK-IRXDYDNUSA-N 2 1 343.540 4.350 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000532626172 1031443225 /nfs/dbraw/zinc/44/32/25/1031443225.db2.gz MCVBXDINYMBSLK-IRXDYDNUSA-N 2 1 343.540 4.350 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000532626172 1031443242 /nfs/dbraw/zinc/44/32/42/1031443242.db2.gz MCVBXDINYMBSLK-IRXDYDNUSA-N 2 1 343.540 4.350 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449131134 1031466501 /nfs/dbraw/zinc/46/65/01/1031466501.db2.gz KHIGTBUXYXMVDT-KRWDZBQOSA-N 2 1 348.412 4.333 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H](CC)C3CCC3)CC2)cs1 ZINC000449151015 1031484472 /nfs/dbraw/zinc/48/44/72/1031484472.db2.gz VEWDAFXNMYEBGE-GOSISDBHSA-N 2 1 335.561 4.086 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCC(C)(C)C3)CC2)cs1 ZINC000449150479 1031484584 /nfs/dbraw/zinc/48/45/84/1031484584.db2.gz RHPOEMAAUQCNTH-INIZCTEOSA-N 2 1 335.561 4.086 20 0 EIADMP COCC1CCC([NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)CC1 ZINC000449151114 1031485632 /nfs/dbraw/zinc/48/56/32/1031485632.db2.gz VUMKYSNXSJZLHP-ZJRDLVKKSA-N 2 1 330.516 4.007 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000531715398 1031502017 /nfs/dbraw/zinc/50/20/17/1031502017.db2.gz ZOOLAGCFLCYWSC-GOEBONIOSA-N 2 1 326.937 4.142 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(C)(C)c1ccc(F)cc1Cl ZINC000531718365 1031518893 /nfs/dbraw/zinc/51/88/93/1031518893.db2.gz WNYOXBZCPLLBQG-IIYDPXPESA-N 2 1 326.887 4.075 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccsc1 ZINC000453085616 1031576561 /nfs/dbraw/zinc/57/65/61/1031576561.db2.gz OVVZZNACMJUBBA-HXUWFJFHSA-N 2 1 328.525 4.496 20 0 EIADMP CC(C)CCn1cccc1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000236634579 1031591069 /nfs/dbraw/zinc/59/10/69/1031591069.db2.gz NCLZBIYIOUIQRA-UHFFFAOYSA-N 2 1 339.527 4.288 20 0 EIADMP Cc1nc2c(n1[C@H]1CC[N@@H+](Cc3cccc4ccoc43)C1)CCCC2 ZINC000449265598 1031602453 /nfs/dbraw/zinc/60/24/53/1031602453.db2.gz SEWNUAFVENJNMY-SFHVURJKSA-N 2 1 335.451 4.264 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@H+](Cc3cccc4ccoc43)C1)CCCC2 ZINC000449265598 1031602457 /nfs/dbraw/zinc/60/24/57/1031602457.db2.gz SEWNUAFVENJNMY-SFHVURJKSA-N 2 1 335.451 4.264 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@@H+](Cc3cccc4ccoc43)C1)CCCC2 ZINC000449265598 1031602467 /nfs/dbraw/zinc/60/24/67/1031602467.db2.gz SEWNUAFVENJNMY-SFHVURJKSA-N 2 1 335.451 4.264 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H](C3CC3)C3CCCC3)CC2)oc1C ZINC000453118586 1031611658 /nfs/dbraw/zinc/61/16/58/1031611658.db2.gz KXHWJFQWGSCZSC-OAQYLSRUSA-N 2 1 345.531 4.062 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453122749 1031615321 /nfs/dbraw/zinc/61/53/21/1031615321.db2.gz PKDYFHQYRJQBTC-RCCFBDPRSA-N 2 1 340.433 4.362 20 0 EIADMP CC(C)OCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453194482 1031701801 /nfs/dbraw/zinc/70/18/01/1031701801.db2.gz NNTVXDIWILJMOG-VSKRKVRLSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)C(F)(F)F ZINC000453207619 1031719828 /nfs/dbraw/zinc/71/98/28/1031719828.db2.gz WMJQURBRAGWVNG-VDHUWJSZSA-N 2 1 340.433 4.218 20 0 EIADMP FC1(F)CC(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)C1 ZINC000453242256 1031797378 /nfs/dbraw/zinc/79/73/78/1031797378.db2.gz PYGGRXLLNVIYBE-IPMKNSEASA-N 2 1 334.454 4.065 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449554129 1031844147 /nfs/dbraw/zinc/84/41/47/1031844147.db2.gz AOWIPWMRMXJFOF-SEJPIABJSA-N 2 1 336.479 4.077 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000449554129 1031844149 /nfs/dbraw/zinc/84/41/49/1031844149.db2.gz AOWIPWMRMXJFOF-SEJPIABJSA-N 2 1 336.479 4.077 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000449561692 1031847646 /nfs/dbraw/zinc/84/76/46/1031847646.db2.gz XHFFIDVNXQQLDE-IAJPZMCFSA-N 2 1 338.417 4.324 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(-c3csc(C)n3)cc2)CC1 ZINC000531953684 1031867223 /nfs/dbraw/zinc/86/72/23/1031867223.db2.gz YXCGTYBMPHSQEN-UHFFFAOYSA-N 2 1 329.513 4.083 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc(Br)ccc1F ZINC000453386205 1031896666 /nfs/dbraw/zinc/89/66/66/1031896666.db2.gz AHVISPUHFOUOBJ-GFCCVEGCSA-N 2 1 343.284 4.113 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc(Br)ccc1F ZINC000453386206 1031897145 /nfs/dbraw/zinc/89/71/45/1031897145.db2.gz AHVISPUHFOUOBJ-LBPRGKRZSA-N 2 1 343.284 4.113 20 0 EIADMP COc1ccc([C@H](CCC(C)C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000453363558 1031902243 /nfs/dbraw/zinc/90/22/43/1031902243.db2.gz RRFTVQNVIXLPME-QYYYHEGRSA-N 2 1 330.516 4.387 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cccc(Br)c21 ZINC000453366823 1031908672 /nfs/dbraw/zinc/90/86/72/1031908672.db2.gz SWLNWJYQITZZPD-NBAQXMRJSA-N 2 1 349.316 4.212 20 0 EIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1CCC(F)(F)CC1 ZINC000459360529 1031911804 /nfs/dbraw/zinc/91/18/04/1031911804.db2.gz OPVWCXOHGLPXGV-LJQANCHMSA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC1CCC(F)(F)CC1 ZINC000459360529 1031911814 /nfs/dbraw/zinc/91/18/14/1031911814.db2.gz OPVWCXOHGLPXGV-LJQANCHMSA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC1CCC(F)(F)CC1 ZINC000459360529 1031911831 /nfs/dbraw/zinc/91/18/31/1031911831.db2.gz OPVWCXOHGLPXGV-LJQANCHMSA-N 2 1 336.470 4.266 20 0 EIADMP CCN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000531980183 1031929059 /nfs/dbraw/zinc/92/90/59/1031929059.db2.gz AOEPSNZGRMTPHM-PGRDOPGGSA-N 2 1 337.511 4.274 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(Oc2cc(C)ccc2C)CC1 ZINC000119452513 1031936404 /nfs/dbraw/zinc/93/64/04/1031936404.db2.gz BYTDHHRZMYWHOK-UHFFFAOYSA-N 2 1 341.499 4.132 20 0 EIADMP Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1NC1CC[NH+](C2CC2)CC1 ZINC000459363925 1031947555 /nfs/dbraw/zinc/94/75/55/1031947555.db2.gz RUUZVNYZIDOYJF-KRWDZBQOSA-N 2 1 327.516 4.413 20 0 EIADMP Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1NC1CC[NH+](C2CC2)CC1 ZINC000459363925 1031947567 /nfs/dbraw/zinc/94/75/67/1031947567.db2.gz RUUZVNYZIDOYJF-KRWDZBQOSA-N 2 1 327.516 4.413 20 0 EIADMP C[N@@H+](CCCC[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)C1CC1 ZINC000453395880 1031964377 /nfs/dbraw/zinc/96/43/77/1031964377.db2.gz ICQZHQWDPUSDOO-NRFANRHFSA-N 2 1 326.459 4.379 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ncc(C(F)(F)F)s2)C1 ZINC000433336627 1034253311 /nfs/dbraw/zinc/25/33/11/1034253311.db2.gz WJMMDWJQBGJPDJ-BETUJISGSA-N 2 1 349.466 4.010 20 0 EIADMP Cc1ncoc1C[NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000894199814 1034669742 /nfs/dbraw/zinc/66/97/42/1034669742.db2.gz QTTDREZNMMDMLQ-UHFFFAOYSA-N 2 1 327.472 4.037 20 0 EIADMP Cc1ncoc1C[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000894199814 1034669751 /nfs/dbraw/zinc/66/97/51/1034669751.db2.gz QTTDREZNMMDMLQ-UHFFFAOYSA-N 2 1 327.472 4.037 20 0 EIADMP C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1cccc(C[NH+](C)C)c1 ZINC000924897258 1034803644 /nfs/dbraw/zinc/80/36/44/1034803644.db2.gz GHYLNLZQOOEPPW-INIZCTEOSA-N 2 1 335.451 4.254 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCc4c3cccc4O)CC2)C1 ZINC000513204289 1034834482 /nfs/dbraw/zinc/83/44/82/1034834482.db2.gz PPRWTDXVBFBIID-SYNHAJSKSA-N 2 1 328.500 4.012 20 0 EIADMP COCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCCC1 ZINC000513341515 1034889094 /nfs/dbraw/zinc/88/90/94/1034889094.db2.gz WCMYHAZKHGUJAR-CTNGQTDRSA-N 2 1 344.543 4.226 20 0 EIADMP COCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCCC1 ZINC000513341515 1034889101 /nfs/dbraw/zinc/88/91/01/1034889101.db2.gz WCMYHAZKHGUJAR-CTNGQTDRSA-N 2 1 344.543 4.226 20 0 EIADMP Cc1nc(C)c(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)s1 ZINC000513493699 1034984574 /nfs/dbraw/zinc/98/45/74/1034984574.db2.gz CDCMRPVIUGMDNV-DNVCBOLYSA-N 2 1 343.540 4.150 20 0 EIADMP CC(C)[NH2+]C1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000501009507 1035344181 /nfs/dbraw/zinc/34/41/81/1035344181.db2.gz CEOPUZAKQQOTBG-AWEZNQCLSA-N 2 1 328.422 4.271 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)[C@@H]2CCC[C@H]21 ZINC000513712195 1035424613 /nfs/dbraw/zinc/42/46/13/1035424613.db2.gz AJPCAEFOAIROLQ-OKZBNKHCSA-N 2 1 340.433 4.100 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000501408070 1035440040 /nfs/dbraw/zinc/44/00/40/1035440040.db2.gz TXJQPTJSMYJFAH-NMVBRADZSA-N 2 1 338.417 4.325 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2C[C@@H](C[NH3+])C[C@@H]2C)oc1-c1ccc(Cl)cc1 ZINC000420306829 1035506262 /nfs/dbraw/zinc/50/62/62/1035506262.db2.gz AWPZJLMPNYYPPQ-FPMFFAJLSA-N 2 1 333.863 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2C[C@@H](C[NH3+])C[C@@H]2C)oc1-c1ccc(Cl)cc1 ZINC000420306829 1035506273 /nfs/dbraw/zinc/50/62/73/1035506273.db2.gz AWPZJLMPNYYPPQ-FPMFFAJLSA-N 2 1 333.863 4.034 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc3sccc3c2)[C@@H](C)C1 ZINC000575222288 1035727831 /nfs/dbraw/zinc/72/78/31/1035727831.db2.gz ZMWVFJIJQRIMIX-QFBILLFUSA-N 2 1 346.540 4.128 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](CSc1ccccc1)C(C)C ZINC000491031778 1035778466 /nfs/dbraw/zinc/77/84/66/1035778466.db2.gz NWUFFEDQEJYUPS-QFBILLFUSA-N 2 1 331.529 4.234 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000570926855 1035896063 /nfs/dbraw/zinc/89/60/63/1035896063.db2.gz JGYAQUKZTHMYOQ-IBGZPJMESA-N 2 1 340.536 4.386 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000570926855 1035896072 /nfs/dbraw/zinc/89/60/72/1035896072.db2.gz JGYAQUKZTHMYOQ-IBGZPJMESA-N 2 1 340.536 4.386 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CCCC[C@H]([NH+]4CCCC4)C3)c2c1 ZINC000513739829 1036048780 /nfs/dbraw/zinc/04/87/80/1036048780.db2.gz NANULTJDFUDUKL-INIZCTEOSA-N 2 1 329.875 4.343 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cnn(C2CCCC2)c1 ZINC000502475093 1036254474 /nfs/dbraw/zinc/25/44/74/1036254474.db2.gz VDSRDTXLLKEMEM-QGZVFWFLSA-N 2 1 344.547 4.446 20 0 EIADMP COc1ccsc1C[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000513756559 1036700535 /nfs/dbraw/zinc/70/05/35/1036700535.db2.gz YVNOOXFMOFTMBY-UHFFFAOYSA-N 2 1 344.524 4.101 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165313376 1036774695 /nfs/dbraw/zinc/77/46/95/1036774695.db2.gz PINRHQNEEJFJCZ-MJGOQNOKSA-N 2 1 334.573 4.061 20 0 EIADMP COc1ccc([C@@H]([NH2+]CCCCn2cc[nH+]c2C)C(C)C)c(F)c1 ZINC000421836447 1036798308 /nfs/dbraw/zinc/79/83/08/1036798308.db2.gz QZAARKIPRZNMDW-IBGZPJMESA-N 2 1 333.451 4.106 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C/C=C/c2ccncc2)C1 ZINC000486935526 1036906590 /nfs/dbraw/zinc/90/65/90/1036906590.db2.gz JKOJRLHJEKUGPQ-QTWIXLPOSA-N 2 1 335.495 4.117 20 0 EIADMP C[N@@H+](Cc1ccccc1C[NH2+]C[C@@H]1CCSC1)C1CCCCC1 ZINC000486979778 1036930385 /nfs/dbraw/zinc/93/03/85/1036930385.db2.gz GNKBATLSYJMYPJ-KRWDZBQOSA-N 2 1 332.557 4.294 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1nccn1C ZINC000271742686 1037003539 /nfs/dbraw/zinc/00/35/39/1037003539.db2.gz VSIHOSLEWFWZNZ-YLJYHZDGSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1nccn1C ZINC000271742686 1037003567 /nfs/dbraw/zinc/00/35/67/1037003567.db2.gz VSIHOSLEWFWZNZ-YLJYHZDGSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@@H]2CCC23CCOCC3)cc1 ZINC000669698636 1037014529 /nfs/dbraw/zinc/01/45/29/1037014529.db2.gz VPQYIEAEZUJZCL-GHTZIAJQSA-N 2 1 342.527 4.110 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271842541 1037032691 /nfs/dbraw/zinc/03/26/91/1037032691.db2.gz HCSFFYORJQOBNA-AWEZNQCLSA-N 2 1 327.497 4.031 20 0 EIADMP C[C@H]1CC2(C[N@H+]1Cc1cccc(C[NH+]3CCCCC3)c1)CCOCC2 ZINC000646097541 1037070242 /nfs/dbraw/zinc/07/02/42/1037070242.db2.gz XLIXXUQNFBYVJU-IBGZPJMESA-N 2 1 342.527 4.064 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2csc(-c3cccs3)n2)CC1 ZINC000590786691 1037166015 /nfs/dbraw/zinc/16/60/15/1037166015.db2.gz MNNAYGIJPANKDF-UHFFFAOYSA-N 2 1 349.569 4.424 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2csc(-c3cccs3)n2)CC1 ZINC000590786691 1037166029 /nfs/dbraw/zinc/16/60/29/1037166029.db2.gz MNNAYGIJPANKDF-UHFFFAOYSA-N 2 1 349.569 4.424 20 0 EIADMP [NH3+][C@@H](C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C1CC1 ZINC000573082400 1037347081 /nfs/dbraw/zinc/34/70/81/1037347081.db2.gz AFPGXLCZCACSDB-LSDHHAIUSA-N 2 1 347.915 4.168 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168418235 1037402556 /nfs/dbraw/zinc/40/25/56/1037402556.db2.gz WOOAPUASKNYOKM-HMXCVIKNSA-N 2 1 330.491 4.198 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)CS1 ZINC000488420096 1037574917 /nfs/dbraw/zinc/57/49/17/1037574917.db2.gz IAGOROWBFALXAD-NUJGCVRESA-N 2 1 338.586 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)CS1 ZINC000488420096 1037574929 /nfs/dbraw/zinc/57/49/29/1037574929.db2.gz IAGOROWBFALXAD-NUJGCVRESA-N 2 1 338.586 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)CS1 ZINC000488443206 1037587842 /nfs/dbraw/zinc/58/78/42/1037587842.db2.gz GBHCYMLENCFRKE-MXSMSXNCSA-N 2 1 338.586 4.251 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CS1 ZINC000488443206 1037587856 /nfs/dbraw/zinc/58/78/56/1037587856.db2.gz GBHCYMLENCFRKE-MXSMSXNCSA-N 2 1 338.586 4.251 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CS1 ZINC000488430800 1037589182 /nfs/dbraw/zinc/58/91/82/1037589182.db2.gz ZHFNGWDYEUDJLM-LEAZDLGRSA-N 2 1 332.557 4.159 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CS1 ZINC000488430800 1037589192 /nfs/dbraw/zinc/58/91/92/1037589192.db2.gz ZHFNGWDYEUDJLM-LEAZDLGRSA-N 2 1 332.557 4.159 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)cc1F ZINC000488434018 1037591695 /nfs/dbraw/zinc/59/16/95/1037591695.db2.gz IITDCFVMKQOGRM-MAUKXSAKSA-N 2 1 347.503 4.330 20 0 EIADMP CC(C)[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000488436638 1037591868 /nfs/dbraw/zinc/59/18/68/1037591868.db2.gz YAGQONXUJIIPBB-KXMRHNKVSA-N 2 1 344.568 4.302 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CS1 ZINC000488434919 1037593291 /nfs/dbraw/zinc/59/32/91/1037593291.db2.gz UIGLUWJRYKDCER-FFGOWVMKSA-N 2 1 332.557 4.017 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CS1 ZINC000488434919 1037593306 /nfs/dbraw/zinc/59/33/06/1037593306.db2.gz UIGLUWJRYKDCER-FFGOWVMKSA-N 2 1 332.557 4.017 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CN[C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422863320 1037849367 /nfs/dbraw/zinc/84/93/67/1037849367.db2.gz OOGSDHXIGRQNMG-ZQMYSKGWSA-N 2 1 349.522 4.295 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422863320 1037849372 /nfs/dbraw/zinc/84/93/72/1037849372.db2.gz OOGSDHXIGRQNMG-ZQMYSKGWSA-N 3 1 349.522 4.295 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422863320 1037849377 /nfs/dbraw/zinc/84/93/77/1037849377.db2.gz OOGSDHXIGRQNMG-ZQMYSKGWSA-N 3 1 349.522 4.295 20 0 EIADMP Clc1cccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc2)c1 ZINC000422937754 1037874931 /nfs/dbraw/zinc/87/49/31/1037874931.db2.gz OOSZGBRDJOWGHD-JIRNRHONSA-N 2 1 326.871 4.302 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)o2)cs1 ZINC000422950917 1037886695 /nfs/dbraw/zinc/88/66/95/1037886695.db2.gz XAVXEMHNQHAYOL-YESZJQIVSA-N 2 1 345.512 4.112 20 0 EIADMP Fc1cc(-c2ccco2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423081124 1037941016 /nfs/dbraw/zinc/94/10/16/1037941016.db2.gz BFTWOTSEKXLDHW-QXAKKESOSA-N 2 1 328.431 4.096 20 0 EIADMP Fc1cc(-c2ccco2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423081123 1037941289 /nfs/dbraw/zinc/94/12/89/1037941289.db2.gz BFTWOTSEKXLDHW-NZSAHSFTSA-N 2 1 328.431 4.096 20 0 EIADMP C[C@@H]([NH2+]CC(C)(C)c1ccc(C(F)(F)F)cc1)c1c[nH+]ccc1N ZINC000423075928 1037961887 /nfs/dbraw/zinc/96/18/87/1037961887.db2.gz XYCJRLNUNKJBCL-GFCCVEGCSA-N 2 1 337.389 4.141 20 0 EIADMP C[C@@H]([NH2+]CCc1cccc2[nH]ccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000503903623 1037974855 /nfs/dbraw/zinc/97/48/55/1037974855.db2.gz RDJZNOIOIUYCQB-WIYYLYMNSA-N 2 1 347.506 4.211 20 0 EIADMP CCOc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1Cl ZINC000423110472 1037990030 /nfs/dbraw/zinc/99/00/30/1037990030.db2.gz UTPCLYPIKPRQKW-MJGOQNOKSA-N 2 1 344.886 4.322 20 0 EIADMP c1ccc(C[N@@H+](Cc2ccc(C3CC3)cc2)[C@H]2CCC[NH2+]CC2)nc1 ZINC000414720753 1038031544 /nfs/dbraw/zinc/03/15/44/1038031544.db2.gz ZQZVJARZCVLTHE-QFIPXVFZSA-N 2 1 335.495 4.103 20 0 EIADMP c1ccc(C[N@H+](Cc2ccc(C3CC3)cc2)[C@H]2CCC[NH2+]CC2)nc1 ZINC000414720753 1038031563 /nfs/dbraw/zinc/03/15/63/1038031563.db2.gz ZQZVJARZCVLTHE-QFIPXVFZSA-N 2 1 335.495 4.103 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000606469329 1038091608 /nfs/dbraw/zinc/09/16/08/1038091608.db2.gz RAJHQOIYLPYSFV-QGZVFWFLSA-N 2 1 330.516 4.144 20 0 EIADMP CCC([NH3+])(CC)C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000423288174 1038092226 /nfs/dbraw/zinc/09/22/26/1038092226.db2.gz QVLYKHGIYALKDC-SFHVURJKSA-N 2 1 331.891 4.126 20 0 EIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@@H](C[NH3+])C1CC1 ZINC000423268037 1038097594 /nfs/dbraw/zinc/09/75/94/1038097594.db2.gz DHFDXIINPPMPHN-BONVTDFDSA-N 2 1 335.904 4.160 20 0 EIADMP Cc1cc(C(C)(C)C)cc2c1OCCC[C@@H]2[NH2+]C1CC[NH+](C)CC1 ZINC000489562185 1038139278 /nfs/dbraw/zinc/13/92/78/1038139278.db2.gz UUCILHDININVKC-IBGZPJMESA-N 2 1 330.516 4.190 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@H]3C1)CCCO2 ZINC000489630266 1038176365 /nfs/dbraw/zinc/17/63/65/1038176365.db2.gz LHSSCYAGOJDHFR-WSTZPKSXSA-N 2 1 328.500 4.240 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CCCO2 ZINC000489630266 1038176409 /nfs/dbraw/zinc/17/64/09/1038176409.db2.gz LHSSCYAGOJDHFR-WSTZPKSXSA-N 2 1 328.500 4.240 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC[NH2+]1 ZINC000423371365 1038190701 /nfs/dbraw/zinc/19/07/01/1038190701.db2.gz FLMDNIIDAFPYIN-BJZITVGISA-N 2 1 346.421 4.108 20 0 EIADMP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000423391352 1038196820 /nfs/dbraw/zinc/19/68/20/1038196820.db2.gz KXJLPRFOIWLNEZ-ZNZDAUKMSA-N 2 1 332.850 4.156 20 0 EIADMP CC[C@H]([NH3+])C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423478942 1038249267 /nfs/dbraw/zinc/24/92/67/1038249267.db2.gz UYKHXSSPDUXXCQ-KBPBESRZSA-N 2 1 335.904 4.168 20 0 EIADMP c1coc([C@@H]2CC[NH+](CCCCC[N@H+]3CC[C@H](c4ccco4)C3)C2)c1 ZINC000607152481 1038394702 /nfs/dbraw/zinc/39/47/02/1038394702.db2.gz YNOXRAYMXQLHBM-KDURUIRLSA-N 2 1 342.483 4.322 20 0 EIADMP c1coc([C@@H]2CC[N@@H+](CCCCC[NH+]3CC[C@H](c4ccco4)C3)C2)c1 ZINC000607152481 1038394717 /nfs/dbraw/zinc/39/47/17/1038394717.db2.gz YNOXRAYMXQLHBM-KDURUIRLSA-N 2 1 342.483 4.322 20 0 EIADMP c1coc([C@@H]2CC[N@H+](CCCCC[NH+]3CC[C@H](c4ccco4)C3)C2)c1 ZINC000607152481 1038394730 /nfs/dbraw/zinc/39/47/30/1038394730.db2.gz YNOXRAYMXQLHBM-KDURUIRLSA-N 2 1 342.483 4.322 20 0 EIADMP CCCCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480769818 1038796627 /nfs/dbraw/zinc/79/66/27/1038796627.db2.gz MQSLKWJNMVCVTM-ROUUACIJSA-N 2 1 330.516 4.391 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)c(F)c1 ZINC000539072299 1038822011 /nfs/dbraw/zinc/82/20/11/1038822011.db2.gz PJLGDIXAFNPVBJ-QLFBSQMISA-N 2 1 342.886 4.019 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@H](C)C1 ZINC000539093781 1038834205 /nfs/dbraw/zinc/83/42/05/1038834205.db2.gz TWODIFIATSLHCX-NQIIRXRSSA-N 2 1 338.495 4.052 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CC4(C[C@@H]3C)CC[NH2+]CC4)s2)cc1 ZINC000424376285 1038837824 /nfs/dbraw/zinc/83/78/24/1038837824.db2.gz KWHWQZQYLXJXQR-INIZCTEOSA-N 2 1 341.524 4.083 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2cccc3C)[C@@H](C)C1 ZINC000504921122 1038844444 /nfs/dbraw/zinc/84/44/44/1038844444.db2.gz QXKPVXUODWIJDB-YXYSEUPNSA-N 2 1 344.543 4.270 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000539162852 1038864439 /nfs/dbraw/zinc/86/44/39/1038864439.db2.gz MLXCARWRSAMKGX-KSSFIOAISA-N 2 1 340.433 4.476 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000480898879 1038865317 /nfs/dbraw/zinc/86/53/17/1038865317.db2.gz OEVRLNLJTOIYHI-CABCVRRESA-N 2 1 348.437 4.317 20 0 EIADMP C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000480898880 1038866865 /nfs/dbraw/zinc/86/68/65/1038866865.db2.gz OEVRLNLJTOIYHI-GJZGRUSLSA-N 2 1 348.437 4.317 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1 ZINC001168324861 1038873983 /nfs/dbraw/zinc/87/39/83/1038873983.db2.gz YQRAATMDXKTNIR-ZLPCBKJTSA-N 2 1 340.433 4.368 20 0 EIADMP Fc1cccc2c1CC[C@@H]2[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000462050295 1038883766 /nfs/dbraw/zinc/88/37/66/1038883766.db2.gz QMHWLEVQOXJZMP-QFIPXVFZSA-N 2 1 338.470 4.110 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1ccccc1F)C1CCCC1 ZINC000539218458 1038888727 /nfs/dbraw/zinc/88/87/27/1038888727.db2.gz USLBIANKHZDXGM-YWZLYKJASA-N 2 1 329.463 4.488 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](COc2ccccc2)c2ccccc2)CC1 ZINC000539263488 1038920418 /nfs/dbraw/zinc/92/04/18/1038920418.db2.gz WABAANMKEWVDAR-JOCHJYFZSA-N 2 1 338.495 4.271 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)o1 ZINC000462115196 1038930113 /nfs/dbraw/zinc/93/01/13/1038930113.db2.gz DREADJAMTVNBBZ-SFHVURJKSA-N 2 1 340.511 4.206 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccsc1 ZINC000481185341 1039087388 /nfs/dbraw/zinc/08/73/88/1039087388.db2.gz GEJARYXQCORFNZ-YLJYHZDGSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccsc1 ZINC000481185341 1039087406 /nfs/dbraw/zinc/08/74/06/1039087406.db2.gz GEJARYXQCORFNZ-YLJYHZDGSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(F)(F)F ZINC000552067023 1039093150 /nfs/dbraw/zinc/09/31/50/1039093150.db2.gz YUJLUOJZLYMZBV-OOHWJJMZSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC[N@H+]1C ZINC000477855744 1039135666 /nfs/dbraw/zinc/13/56/66/1039135666.db2.gz IIFFFLGGDGYIIG-BXUZGUMPSA-N 2 1 340.298 4.090 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC2(C(F)(F)F)CC2)CC1 ZINC000552097816 1039152493 /nfs/dbraw/zinc/15/24/93/1039152493.db2.gz NOZDSWNWKHUUPN-UHFFFAOYSA-N 2 1 340.433 4.362 20 0 EIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccccc1OC(F)F ZINC000120543930 1039152683 /nfs/dbraw/zinc/15/26/83/1039152683.db2.gz LJNUSOCUFPRKTC-LBPRGKRZSA-N 2 1 326.431 4.248 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000120708789 1039209474 /nfs/dbraw/zinc/20/94/74/1039209474.db2.gz CCOSFDMZSMRWSZ-CYBMUJFWSA-N 2 1 330.394 4.110 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+]CCC[N@H+](C)Cc1ccccc1 ZINC000061556882 1039217169 /nfs/dbraw/zinc/21/71/69/1039217169.db2.gz HKKSZUZUUKQOME-UHFFFAOYSA-N 2 1 326.484 4.086 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+]CCC[N@@H+](C)Cc1ccccc1 ZINC000061556882 1039217193 /nfs/dbraw/zinc/21/71/93/1039217193.db2.gz HKKSZUZUUKQOME-UHFFFAOYSA-N 2 1 326.484 4.086 20 0 EIADMP CSCc1cccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550795722 1039300308 /nfs/dbraw/zinc/30/03/08/1039300308.db2.gz XBCGODVDJSZLJG-LEWJYISDSA-N 2 1 340.536 4.475 20 0 EIADMP CSCc1cccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550795722 1039300318 /nfs/dbraw/zinc/30/03/18/1039300318.db2.gz XBCGODVDJSZLJG-LEWJYISDSA-N 2 1 340.536 4.475 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000481334801 1039312648 /nfs/dbraw/zinc/31/26/48/1039312648.db2.gz WSZSAPQTJFVZMW-SFHVURJKSA-N 2 1 338.495 4.319 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cccc(OC3CCCC3)c2)C[C@@H]1C ZINC000537634894 1039341288 /nfs/dbraw/zinc/34/12/88/1039341288.db2.gz YIJWXQGPPRYHIS-HKUYNNGSSA-N 2 1 330.516 4.313 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(OC3CCCC3)c2)C[C@@H]1C ZINC000537634894 1039341335 /nfs/dbraw/zinc/34/13/35/1039341335.db2.gz YIJWXQGPPRYHIS-HKUYNNGSSA-N 2 1 330.516 4.313 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(OC3CCCC3)c2)C[C@@H]1C ZINC000537634894 1039341341 /nfs/dbraw/zinc/34/13/41/1039341341.db2.gz YIJWXQGPPRYHIS-HKUYNNGSSA-N 2 1 330.516 4.313 20 0 EIADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000550831439 1039512475 /nfs/dbraw/zinc/51/24/75/1039512475.db2.gz WMUCORBEYIMIIT-OAHLLOKOSA-N 2 1 332.875 4.420 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000550831439 1039512497 /nfs/dbraw/zinc/51/24/97/1039512497.db2.gz WMUCORBEYIMIIT-OAHLLOKOSA-N 2 1 332.875 4.420 20 0 EIADMP Cc1ccnc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000514087937 1039590749 /nfs/dbraw/zinc/59/07/49/1039590749.db2.gz JHRCZCHKILILQC-RBUKOAKNSA-N 2 1 337.511 4.473 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000122164245 1039603375 /nfs/dbraw/zinc/60/33/75/1039603375.db2.gz VDDUFOJCKWMKQL-YOEHRIQHSA-N 2 1 340.433 4.057 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@H+]1C ZINC000122160872 1039605600 /nfs/dbraw/zinc/60/56/00/1039605600.db2.gz QHKXXMRBHYNJQP-RHSMWYFYSA-N 2 1 340.433 4.199 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCc2cccc(Cl)c2Cl)CC1 ZINC000434543066 1039632378 /nfs/dbraw/zinc/63/23/78/1039632378.db2.gz FGFTXEFLGIGIJK-UHFFFAOYSA-N 2 1 329.315 4.341 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(CC)s2)[C@@H](C)C1 ZINC000122344079 1039655879 /nfs/dbraw/zinc/65/58/79/1039655879.db2.gz VJBVKJMUFCTYPB-BQFCYCMXSA-N 2 1 338.561 4.098 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)Cc1ccccc1C(F)(F)F ZINC000481650583 1039689737 /nfs/dbraw/zinc/68/97/37/1039689737.db2.gz BILWXBVJPOCPKZ-KGLIPLIRSA-N 2 1 339.405 4.067 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC[N@@H+]1C ZINC000481740610 1039806378 /nfs/dbraw/zinc/80/63/78/1039806378.db2.gz MUTHHPPYNRGWLB-NQERJWCQSA-N 2 1 344.449 4.321 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC[N@H+]1C ZINC000481740610 1039806380 /nfs/dbraw/zinc/80/63/80/1039806380.db2.gz MUTHHPPYNRGWLB-NQERJWCQSA-N 2 1 344.449 4.321 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000430115480 1039851234 /nfs/dbraw/zinc/85/12/34/1039851234.db2.gz BFGYMFMUZONHCK-HAZIXKIPSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000430115480 1039851237 /nfs/dbraw/zinc/85/12/37/1039851237.db2.gz BFGYMFMUZONHCK-HAZIXKIPSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000430115480 1039851239 /nfs/dbraw/zinc/85/12/39/1039851239.db2.gz BFGYMFMUZONHCK-HAZIXKIPSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000430115480 1039851241 /nfs/dbraw/zinc/85/12/41/1039851241.db2.gz BFGYMFMUZONHCK-HAZIXKIPSA-N 2 1 338.417 4.136 20 0 EIADMP Cc1cccc(OC[C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551004979 1039867885 /nfs/dbraw/zinc/86/78/85/1039867885.db2.gz CEBLAGYSNCSKAI-CZTZKLFOSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1cccc(OC[C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551004979 1039867889 /nfs/dbraw/zinc/86/78/89/1039867889.db2.gz CEBLAGYSNCSKAI-CZTZKLFOSA-N 2 1 338.495 4.187 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)s2)C[C@@H]1c1ccccc1 ZINC000551012525 1039873122 /nfs/dbraw/zinc/87/31/22/1039873122.db2.gz RPYKINXGHQDCQT-DOTOQJQBSA-N 2 1 334.916 4.369 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)s2)C[C@@H]1c1ccccc1 ZINC000551012525 1039873124 /nfs/dbraw/zinc/87/31/24/1039873124.db2.gz RPYKINXGHQDCQT-DOTOQJQBSA-N 2 1 334.916 4.369 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2cccc3cccnc32)C[C@@H]1c1ccccc1 ZINC000556050200 1039888552 /nfs/dbraw/zinc/88/85/52/1039888552.db2.gz DCGZXGVXCLYKFW-FGZHOGPDSA-N 2 1 345.490 4.202 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2cccc3cccnc32)C[C@@H]1c1ccccc1 ZINC000556050200 1039888554 /nfs/dbraw/zinc/88/85/54/1039888554.db2.gz DCGZXGVXCLYKFW-FGZHOGPDSA-N 2 1 345.490 4.202 20 0 EIADMP Cc1cccc2oc(CC[NH2+][C@@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)nc21 ZINC000551038891 1039897172 /nfs/dbraw/zinc/89/71/72/1039897172.db2.gz HAAJWKBZIUBWCU-RTBURBONSA-N 2 1 349.478 4.104 20 0 EIADMP Cc1cccc2oc(CC[NH2+][C@@H]3CC[N@H+](C)[C@@H](c4ccccc4)C3)nc21 ZINC000551038891 1039897178 /nfs/dbraw/zinc/89/71/78/1039897178.db2.gz HAAJWKBZIUBWCU-RTBURBONSA-N 2 1 349.478 4.104 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)s1 ZINC000551050748 1039915518 /nfs/dbraw/zinc/91/55/18/1039915518.db2.gz BQYDVIOAJONAQS-CVAIRZPRSA-N 2 1 328.525 4.413 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)s1 ZINC000551050748 1039915543 /nfs/dbraw/zinc/91/55/43/1039915543.db2.gz BQYDVIOAJONAQS-CVAIRZPRSA-N 2 1 328.525 4.413 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132482 1040024160 /nfs/dbraw/zinc/02/41/60/1040024160.db2.gz YHANFRQDDNUZKB-IIBYNOLFSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132482 1040024177 /nfs/dbraw/zinc/02/41/77/1040024177.db2.gz YHANFRQDDNUZKB-IIBYNOLFSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000482137202 1040031781 /nfs/dbraw/zinc/03/17/81/1040031781.db2.gz ILYPSMHDXFWQAX-MLGOLLRUSA-N 2 1 329.315 4.201 20 0 EIADMP Cc1ccc(F)c(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000435058664 1040041090 /nfs/dbraw/zinc/04/10/90/1040041090.db2.gz GCAGBZNUNCMWNY-UHFFFAOYSA-N 2 1 327.447 4.047 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)CC[N@@H+]1C ZINC000482246486 1040090428 /nfs/dbraw/zinc/09/04/28/1040090428.db2.gz SBLQQUFUWRYHIF-TYCQWZJGSA-N 2 1 326.459 4.182 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)CC[N@H+]1C ZINC000482246486 1040090449 /nfs/dbraw/zinc/09/04/49/1040090449.db2.gz SBLQQUFUWRYHIF-TYCQWZJGSA-N 2 1 326.459 4.182 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)C1 ZINC000482355199 1040194636 /nfs/dbraw/zinc/19/46/36/1040194636.db2.gz FKRXCVUQOCIMEU-HUUCEWRRSA-N 2 1 344.421 4.356 20 0 EIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1cccc(Br)c1 ZINC000479327082 1040273691 /nfs/dbraw/zinc/27/36/91/1040273691.db2.gz QMLKJNPMWGJURZ-QGZVFWFLSA-N 2 1 339.321 4.220 20 0 EIADMP C[C@H](C[N@H+]1CCC[C@@H]2C[NH+](C)CC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890643 1040328103 /nfs/dbraw/zinc/32/81/03/1040328103.db2.gz KVYNOJCNKJXPKN-QGPMSJSTSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CCC[C@@H]2C[N@H+](C)CC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890643 1040328125 /nfs/dbraw/zinc/32/81/25/1040328125.db2.gz KVYNOJCNKJXPKN-QGPMSJSTSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H](C[NH+]1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890643 1040328142 /nfs/dbraw/zinc/32/81/42/1040328142.db2.gz KVYNOJCNKJXPKN-QGPMSJSTSA-N 2 1 340.433 4.225 20 0 EIADMP Fc1ccc(F)c2c1CC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479464047 1040374904 /nfs/dbraw/zinc/37/49/04/1040374904.db2.gz KRPRPUOIOWVXOY-JXFKEZNVSA-N 2 1 342.433 4.064 20 0 EIADMP Fc1ccc(F)c2c1CC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000479464047 1040374929 /nfs/dbraw/zinc/37/49/29/1040374929.db2.gz KRPRPUOIOWVXOY-JXFKEZNVSA-N 2 1 342.433 4.064 20 0 EIADMP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000479466321 1040391709 /nfs/dbraw/zinc/39/17/09/1040391709.db2.gz RNJJXZYXLKYOIR-RADWXHQJSA-N 2 1 338.470 4.171 20 0 EIADMP CC(C)COc1ccc(C(C)(C)C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000482643058 1040402051 /nfs/dbraw/zinc/40/20/51/1040402051.db2.gz ODJBWYZZBYIQOU-HKUYNNGSSA-N 2 1 332.532 4.071 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1Sc1ccccc1 ZINC000482644971 1040405861 /nfs/dbraw/zinc/40/58/61/1040405861.db2.gz VIZZZKYHZZISFR-LPHOPBHVSA-N 2 1 326.509 4.268 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1Sc1ccccc1 ZINC000482644971 1040405867 /nfs/dbraw/zinc/40/58/67/1040405867.db2.gz VIZZZKYHZZISFR-LPHOPBHVSA-N 2 1 326.509 4.268 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000482808299 1040502979 /nfs/dbraw/zinc/50/29/79/1040502979.db2.gz CKHONPKHYUHQHQ-ZBFHGGJFSA-N 2 1 336.907 4.091 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000482808299 1040502998 /nfs/dbraw/zinc/50/29/98/1040502998.db2.gz CKHONPKHYUHQHQ-ZBFHGGJFSA-N 2 1 336.907 4.091 20 0 EIADMP CCc1[nH+]ccn1[C@@H]1CCCN(c2c(C)c[nH+]c3c(C)cccc32)C1 ZINC000462485095 1040648904 /nfs/dbraw/zinc/64/89/04/1040648904.db2.gz BUSFOUKHWZIBIZ-QGZVFWFLSA-N 2 1 334.467 4.452 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000479876335 1040739731 /nfs/dbraw/zinc/73/97/31/1040739731.db2.gz SUOZNHMUWQMDEF-CYBMUJFWSA-N 2 1 349.519 4.496 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@@H]1C ZINC000539838134 1040820015 /nfs/dbraw/zinc/82/00/15/1040820015.db2.gz LAWFABGJPQUATP-RDJZCZTQSA-N 2 1 340.458 4.209 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@@H]1C ZINC000539838134 1040820018 /nfs/dbraw/zinc/82/00/18/1040820018.db2.gz LAWFABGJPQUATP-RDJZCZTQSA-N 2 1 340.458 4.209 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@@H]1C ZINC000539838134 1040820023 /nfs/dbraw/zinc/82/00/23/1040820023.db2.gz LAWFABGJPQUATP-RDJZCZTQSA-N 2 1 340.458 4.209 20 0 EIADMP Cc1cc(C[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c(OC(F)F)cc1C ZINC000462674370 1040834150 /nfs/dbraw/zinc/83/41/50/1040834150.db2.gz HOICPWAZDOKGRQ-INIZCTEOSA-N 2 1 340.458 4.259 20 0 EIADMP Cc1cc(C[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c(OC(F)F)cc1C ZINC000462674370 1040834156 /nfs/dbraw/zinc/83/41/56/1040834156.db2.gz HOICPWAZDOKGRQ-INIZCTEOSA-N 2 1 340.458 4.259 20 0 EIADMP CC[C@H](c1ccc(F)cc1)[N@@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1 ZINC000436048982 1040840146 /nfs/dbraw/zinc/84/01/46/1040840146.db2.gz GOIZLPAJQPLRCT-CRAIPNDOSA-N 2 1 347.503 4.153 20 0 EIADMP CC[C@H](c1ccc(F)cc1)[N@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1 ZINC000436048982 1040840151 /nfs/dbraw/zinc/84/01/51/1040840151.db2.gz GOIZLPAJQPLRCT-CRAIPNDOSA-N 2 1 347.503 4.153 20 0 EIADMP CC[C@H](c1ccccc1)[N@@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1 ZINC000436056708 1040844594 /nfs/dbraw/zinc/84/45/94/1040844594.db2.gz TXHQPRQSDBGMBU-FUHWJXTLSA-N 2 1 329.513 4.014 20 0 EIADMP CC[C@H](c1ccccc1)[N@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1 ZINC000436056708 1040844600 /nfs/dbraw/zinc/84/46/00/1040844600.db2.gz TXHQPRQSDBGMBU-FUHWJXTLSA-N 2 1 329.513 4.014 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CCCc4c(O)cccc43)CC2)C1 ZINC000483430725 1040852948 /nfs/dbraw/zinc/85/29/48/1040852948.db2.gz XGORLEZUZHZQCL-BLIXFSHQSA-N 2 1 342.527 4.402 20 0 EIADMP CCC[C@H]([NH2+][C@H]1CC[N@@H+](CCCOCC)C[C@H]1C)c1ccccc1 ZINC000480034153 1040870669 /nfs/dbraw/zinc/87/06/69/1040870669.db2.gz JJSHPFSSAUJFHH-GIVPXCGWSA-N 2 1 332.532 4.254 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(COc2ccccc2)cc1 ZINC000537988275 1040967030 /nfs/dbraw/zinc/96/70/30/1040967030.db2.gz WHISYYCMHTXXKA-FGSXEWAUSA-N 2 1 338.495 4.084 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC000436241143 1040989224 /nfs/dbraw/zinc/98/92/24/1040989224.db2.gz QNCYICSGDBNDEB-GMKZXUHWSA-N 2 1 348.534 4.477 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000483741370 1040995429 /nfs/dbraw/zinc/99/54/29/1040995429.db2.gz FTAXEQCWBIEJNK-VMRPVKRXSA-N 2 1 326.484 4.372 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000483741370 1040995451 /nfs/dbraw/zinc/99/54/51/1040995451.db2.gz FTAXEQCWBIEJNK-VMRPVKRXSA-N 2 1 326.484 4.372 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1cnn(Cc2ccccc2)c1)C(C)C ZINC000483859248 1041044318 /nfs/dbraw/zinc/04/43/18/1041044318.db2.gz XOKFAKMZWIMXMP-IBGZPJMESA-N 2 1 342.531 4.091 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000436274976 1041047344 /nfs/dbraw/zinc/04/73/44/1041047344.db2.gz ODUJPJHSRAZEJV-UHFFFAOYSA-N 2 1 334.813 4.323 20 0 EIADMP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000554374162 1041059371 /nfs/dbraw/zinc/05/93/71/1041059371.db2.gz PKOFMVVZQXZXPM-CRSSMBPESA-N 2 1 330.491 4.157 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@H](C)C1 ZINC000436317363 1041085089 /nfs/dbraw/zinc/08/50/89/1041085089.db2.gz UZEUBPKAFHZRKB-MOIQIXESSA-N 2 1 340.433 4.271 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc2ccccc21 ZINC000540169049 1041211137 /nfs/dbraw/zinc/21/11/37/1041211137.db2.gz JJQUMKAGIHPQNS-OTWHNJEPSA-N 2 1 340.511 4.380 20 0 EIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000480333958 1041218885 /nfs/dbraw/zinc/21/88/85/1041218885.db2.gz MIVRAKADUOYMCP-HNNXBMFYSA-N 2 1 328.422 4.146 20 0 EIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000480333958 1041218900 /nfs/dbraw/zinc/21/89/00/1041218900.db2.gz MIVRAKADUOYMCP-HNNXBMFYSA-N 2 1 328.422 4.146 20 0 EIADMP COc1ccccc1-c1ccc([C@H](C)[NH2+]CC[C@H]2CCC[N@H+]2C)cc1 ZINC000538259732 1041221183 /nfs/dbraw/zinc/22/11/83/1041221183.db2.gz NEMQVUHNXZRIPY-FXAWDEMLSA-N 2 1 338.495 4.497 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1cccc(O)c1 ZINC000194852036 1041232959 /nfs/dbraw/zinc/23/29/59/1041232959.db2.gz OSRRLZCQGGDWCB-MSOLQXFVSA-N 2 1 338.495 4.475 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1cccc(O)c1 ZINC000194850318 1041235801 /nfs/dbraw/zinc/23/58/01/1041235801.db2.gz BECWMRSHCLBGMU-MSOLQXFVSA-N 2 1 338.495 4.475 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cc1N(C)C ZINC000484479967 1041272615 /nfs/dbraw/zinc/27/26/15/1041272615.db2.gz ZYFQBIPHCHUHGW-INIZCTEOSA-N 2 1 347.522 4.339 20 0 EIADMP COCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CCCC1 ZINC000484508609 1041291975 /nfs/dbraw/zinc/29/19/75/1041291975.db2.gz PZOPMQYWSOVDFT-CTNGQTDRSA-N 2 1 344.543 4.084 20 0 EIADMP CC[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000463070416 1041313315 /nfs/dbraw/zinc/31/33/15/1041313315.db2.gz OFLKTDJUWVDOFG-OAQYLSRUSA-N 2 1 336.523 4.477 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667677214 1041318101 /nfs/dbraw/zinc/31/81/01/1041318101.db2.gz LXTXTLJCVUNOJX-SFHVURJKSA-N 2 1 343.540 4.282 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667677214 1041318117 /nfs/dbraw/zinc/31/81/17/1041318117.db2.gz LXTXTLJCVUNOJX-SFHVURJKSA-N 2 1 343.540 4.282 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667677214 1041318133 /nfs/dbraw/zinc/31/81/33/1041318133.db2.gz LXTXTLJCVUNOJX-SFHVURJKSA-N 2 1 343.540 4.282 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccc(C(F)(F)F)cc2)C(C)C)C1 ZINC000540258962 1041325599 /nfs/dbraw/zinc/32/55/99/1041325599.db2.gz KLUZKOPAYWHPDU-PBHICJAKSA-N 2 1 328.422 4.334 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)C)C1 ZINC000540261236 1041327991 /nfs/dbraw/zinc/32/79/91/1041327991.db2.gz XIANTHRQDXOUMZ-PBHICJAKSA-N 2 1 328.422 4.334 20 0 EIADMP CCCCCOc1ccc([C@H]([NH2+]C2CC[NH+](C)CC2)C2CC2)cc1 ZINC000540261576 1041328406 /nfs/dbraw/zinc/32/84/06/1041328406.db2.gz IWHSDPRFAAMXAB-OAQYLSRUSA-N 2 1 330.516 4.391 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCSCc2ccc(Cl)cc2Cl)CC[N@H+]1C ZINC000540396773 1041440021 /nfs/dbraw/zinc/44/00/21/1041440021.db2.gz DLILSPOWAWAWBZ-IUODEOHRSA-N 2 1 347.355 4.299 20 0 EIADMP c1ccc(N2CCC([NH2+]C[C@H]3CCC[N@H+]3C3CCCCC3)CC2)cc1 ZINC000463247976 1041452946 /nfs/dbraw/zinc/45/29/46/1041452946.db2.gz LIAWPQJVVYILDE-JOCHJYFZSA-N 2 1 341.543 4.042 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000463262585 1041459124 /nfs/dbraw/zinc/45/91/24/1041459124.db2.gz ZKCOIRDQSKPOTC-PGRDOPGGSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000463262585 1041459131 /nfs/dbraw/zinc/45/91/31/1041459131.db2.gz ZKCOIRDQSKPOTC-PGRDOPGGSA-N 2 1 347.506 4.353 20 0 EIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000480692416 1041475977 /nfs/dbraw/zinc/47/59/77/1041475977.db2.gz IGUSJXWGIZQOAW-DYXWJJEUSA-N 2 1 330.516 4.389 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000195132201 1041484215 /nfs/dbraw/zinc/48/42/15/1041484215.db2.gz WJKCORPLOJQRGP-FUHWJXTLSA-N 2 1 342.458 4.007 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)s2)CC[N@@H+]1C ZINC000538717624 1041485486 /nfs/dbraw/zinc/48/54/86/1041485486.db2.gz NWAVJXOHKLSWBX-HUUCEWRRSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)s2)CC[N@H+]1C ZINC000538717624 1041485491 /nfs/dbraw/zinc/48/54/91/1041485491.db2.gz NWAVJXOHKLSWBX-HUUCEWRRSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3F)s2)CC[NH+]1C ZINC000538717624 1041485493 /nfs/dbraw/zinc/48/54/93/1041485493.db2.gz NWAVJXOHKLSWBX-HUUCEWRRSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)s2)CC[NH+]1C ZINC000538717624 1041485497 /nfs/dbraw/zinc/48/54/97/1041485497.db2.gz NWAVJXOHKLSWBX-HUUCEWRRSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000195135337 1041486651 /nfs/dbraw/zinc/48/66/51/1041486651.db2.gz VLLZXWUJLQVAST-WBVHZDCISA-N 2 1 330.422 4.138 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000480733988 1041496964 /nfs/dbraw/zinc/49/69/64/1041496964.db2.gz BLHRAZKPJLFGAW-IXDOHACOSA-N 2 1 338.948 4.427 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cccc(OC)c2)CC1)CC1CC1 ZINC000538857294 1041561617 /nfs/dbraw/zinc/56/16/17/1041561617.db2.gz HCQOBGUKQRLOLG-UHFFFAOYSA-N 2 1 330.516 4.029 20 0 EIADMP C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)CCCc1c[nH+]cn1C ZINC000516580948 1041654764 /nfs/dbraw/zinc/65/47/64/1041654764.db2.gz XNXIEFHWOCMNPZ-GFCCVEGCSA-N 2 1 326.271 4.353 20 0 EIADMP C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)CCCc1c[nH+]cn1C ZINC000516580948 1041654771 /nfs/dbraw/zinc/65/47/71/1041654771.db2.gz XNXIEFHWOCMNPZ-GFCCVEGCSA-N 2 1 326.271 4.353 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)sn1 ZINC000638365372 1041723193 /nfs/dbraw/zinc/72/31/93/1041723193.db2.gz ATRSZZHXBMTPES-INIZCTEOSA-N 2 1 329.513 4.116 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)sn1 ZINC000638365372 1041723202 /nfs/dbraw/zinc/72/32/02/1041723202.db2.gz ATRSZZHXBMTPES-INIZCTEOSA-N 2 1 329.513 4.116 20 0 EIADMP C[C@H](c1ccc(CN2[C@@H]3CC[C@H]2CC[N@@H+](C)C3)cc1)C(F)(F)F ZINC000517387883 1042000819 /nfs/dbraw/zinc/00/08/19/1042000819.db2.gz OULRQPKAOIGLST-XOKHGSTOSA-N 2 1 326.406 4.021 20 0 EIADMP C[C@H](c1ccc(CN2[C@@H]3CC[C@H]2CC[N@H+](C)C3)cc1)C(F)(F)F ZINC000517387883 1042000827 /nfs/dbraw/zinc/00/08/27/1042000827.db2.gz OULRQPKAOIGLST-XOKHGSTOSA-N 2 1 326.406 4.021 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2ccco2)c2ccccc2)C1 ZINC000541549226 1042006560 /nfs/dbraw/zinc/00/65/60/1042006560.db2.gz PWOUUFIZYRXYQX-GHTZIAJQSA-N 2 1 326.484 4.471 20 0 EIADMP Cn1cc[nH+]c1CC1CC[NH+]([C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000438119251 1042049058 /nfs/dbraw/zinc/04/90/58/1042049058.db2.gz JDUVOQSSYDOWLZ-RBBKRZOGSA-N 2 1 337.511 4.185 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+]([C@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000464779841 1042159929 /nfs/dbraw/zinc/15/99/29/1042159929.db2.gz PZQPZHGFENNRBO-HUUCEWRRSA-N 2 1 326.431 4.013 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+]([C@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000464779841 1042159935 /nfs/dbraw/zinc/15/99/35/1042159935.db2.gz PZQPZHGFENNRBO-HUUCEWRRSA-N 2 1 326.431 4.013 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+]([C@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000464778308 1042160513 /nfs/dbraw/zinc/16/05/13/1042160513.db2.gz NQYYEIYNSUSEAI-HUUCEWRRSA-N 2 1 344.421 4.310 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+]([C@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000464778308 1042160516 /nfs/dbraw/zinc/16/05/16/1042160516.db2.gz NQYYEIYNSUSEAI-HUUCEWRRSA-N 2 1 344.421 4.310 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](CCSc2ccc(Cl)cc2)C1 ZINC000464780565 1042160604 /nfs/dbraw/zinc/16/06/04/1042160604.db2.gz QYQQHFHJROUNOE-OAHLLOKOSA-N 2 1 326.937 4.096 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCSc2ccc(Cl)cc2)C1 ZINC000464780565 1042160606 /nfs/dbraw/zinc/16/06/06/1042160606.db2.gz QYQQHFHJROUNOE-OAHLLOKOSA-N 2 1 326.937 4.096 20 0 EIADMP CSC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000541915440 1042169712 /nfs/dbraw/zinc/16/97/12/1042169712.db2.gz MJLOMSYDHFPVGA-XJKSGUPXSA-N 2 1 346.462 4.041 20 0 EIADMP CSC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000541915440 1042169714 /nfs/dbraw/zinc/16/97/14/1042169714.db2.gz MJLOMSYDHFPVGA-XJKSGUPXSA-N 2 1 346.462 4.041 20 0 EIADMP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000467373040 1042304495 /nfs/dbraw/zinc/30/44/95/1042304495.db2.gz ISBODDPRFRAERA-TZUVLKIQSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000467373040 1042304498 /nfs/dbraw/zinc/30/44/98/1042304498.db2.gz ISBODDPRFRAERA-TZUVLKIQSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258748 1042436867 /nfs/dbraw/zinc/43/68/67/1042436867.db2.gz TYDROYGRANIVFW-XMSQKQJNSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258748 1042436871 /nfs/dbraw/zinc/43/68/71/1042436871.db2.gz TYDROYGRANIVFW-XMSQKQJNSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258748 1042436878 /nfs/dbraw/zinc/43/68/78/1042436878.db2.gz TYDROYGRANIVFW-XMSQKQJNSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258748 1042436883 /nfs/dbraw/zinc/43/68/83/1042436883.db2.gz TYDROYGRANIVFW-XMSQKQJNSA-N 2 1 338.495 4.038 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1OC ZINC000173324986 1042565383 /nfs/dbraw/zinc/56/53/83/1042565383.db2.gz BQCANOFDKOKIMO-SJORKVTESA-N 2 1 334.504 4.009 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1nccc2ccccc21 ZINC000894385536 1042709976 /nfs/dbraw/zinc/70/99/76/1042709976.db2.gz SOFNOIQRXCGCLP-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP C[C@@H](C[N@H+](C)CC(C)(C)C[NH+](C)Cc1ccccc1)c1nccs1 ZINC000542464178 1042743834 /nfs/dbraw/zinc/74/38/34/1042743834.db2.gz ZGAZCHQWHBBSFH-KRWDZBQOSA-N 2 1 345.556 4.337 20 0 EIADMP C[C@@H](C[N@@H+](C)CC(C)(C)C[NH+](C)Cc1ccccc1)c1nccs1 ZINC000542464178 1042743847 /nfs/dbraw/zinc/74/38/47/1042743847.db2.gz ZGAZCHQWHBBSFH-KRWDZBQOSA-N 2 1 345.556 4.337 20 0 EIADMP C[C@@H](C[NH+](C)CC(C)(C)C[N@H+](C)Cc1ccccc1)c1nccs1 ZINC000542464178 1042743858 /nfs/dbraw/zinc/74/38/58/1042743858.db2.gz ZGAZCHQWHBBSFH-KRWDZBQOSA-N 2 1 345.556 4.337 20 0 EIADMP C[C@@H](C[NH+](C)CC(C)(C)C[N@@H+](C)Cc1ccccc1)c1nccs1 ZINC000542464178 1042743870 /nfs/dbraw/zinc/74/38/70/1042743870.db2.gz ZGAZCHQWHBBSFH-KRWDZBQOSA-N 2 1 345.556 4.337 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(Cl)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309875647 1042823040 /nfs/dbraw/zinc/82/30/40/1042823040.db2.gz SYKBHBQASWVKIU-QFBILLFUSA-N 2 1 328.887 4.340 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(Br)cc1 ZINC000157476955 1042843873 /nfs/dbraw/zinc/84/38/73/1042843873.db2.gz LXWMPXBOUSZSKG-SSKCKEOISA-N 2 1 331.257 4.245 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2[nH]ccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310902525 1042847599 /nfs/dbraw/zinc/84/75/99/1042847599.db2.gz BIVARKOEYZDMIA-PXNSSMCTSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc2ccccc2n1 ZINC000178099085 1042858916 /nfs/dbraw/zinc/85/89/16/1042858916.db2.gz DXRAEQFAPDHHRN-ROUUACIJSA-N 2 1 325.500 4.398 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]C2CC(OC(C)(C)C)C2)[C@@H]1c1cccs1 ZINC000493305922 1042891155 /nfs/dbraw/zinc/89/11/55/1042891155.db2.gz QTJXGFGEHCOQLP-MMIPBJDJSA-N 2 1 336.545 4.067 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CC(OC(C)(C)C)C2)[C@@H]1c1cccs1 ZINC000493305922 1042891158 /nfs/dbraw/zinc/89/11/58/1042891158.db2.gz QTJXGFGEHCOQLP-MMIPBJDJSA-N 2 1 336.545 4.067 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@@H]1C ZINC000493282722 1042891939 /nfs/dbraw/zinc/89/19/39/1042891939.db2.gz TZGWWDYVRCVDTC-DOTOQJQBSA-N 2 1 338.923 4.432 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@@H]1C ZINC000493282722 1042891944 /nfs/dbraw/zinc/89/19/44/1042891944.db2.gz TZGWWDYVRCVDTC-DOTOQJQBSA-N 2 1 338.923 4.432 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@@H]1C ZINC000493282722 1042891946 /nfs/dbraw/zinc/89/19/46/1042891946.db2.gz TZGWWDYVRCVDTC-DOTOQJQBSA-N 2 1 338.923 4.432 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccc(F)cc1 ZINC000645406593 1042929272 /nfs/dbraw/zinc/92/92/72/1042929272.db2.gz BSECFIBAKIVMDQ-MAODMQOUSA-N 2 1 326.459 4.354 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccc(F)cc1 ZINC000645406593 1042929282 /nfs/dbraw/zinc/92/92/82/1042929282.db2.gz BSECFIBAKIVMDQ-MAODMQOUSA-N 2 1 326.459 4.354 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C(C)(C)c2cccnc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168005146 1042958712 /nfs/dbraw/zinc/95/87/12/1042958712.db2.gz GVPDKMDFNUROHO-RMFSNUHRSA-N 2 1 337.511 4.348 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc3nc(C)sc3c2)c1 ZINC000494027603 1043006144 /nfs/dbraw/zinc/00/61/44/1043006144.db2.gz NBCFTDWITAWCBU-UHFFFAOYSA-N 2 1 339.508 4.346 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2cc(OC)ccc2c1 ZINC000152418038 1043006675 /nfs/dbraw/zinc/00/66/75/1043006675.db2.gz ANTQRRABYMDJEE-AOMKIAJQSA-N 2 1 338.495 4.373 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@H](C)C[NH+]3CCCCC3)oc21 ZINC000391917592 1043077711 /nfs/dbraw/zinc/07/77/11/1043077711.db2.gz DHJNADBIUBIOKJ-JKSUJKDBSA-N 2 1 330.472 4.214 20 0 EIADMP CSc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310082535 1043099797 /nfs/dbraw/zinc/09/97/97/1043099797.db2.gz KJRBCKLMSDCTHQ-FQEVSTJZSA-N 2 1 340.536 4.410 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCCCc2cc(Br)ccc21 ZINC000338775539 1043146181 /nfs/dbraw/zinc/14/61/81/1043146181.db2.gz PWPBJCXGRKDMRL-QGZVFWFLSA-N 2 1 348.288 4.011 20 0 EIADMP COc1cccc2cc(C[NH2+]CCCC[N@H+]3CCCC[C@@H]3C)oc21 ZINC000727643643 1043255511 /nfs/dbraw/zinc/25/55/11/1043255511.db2.gz IEQMPYJGRGAGFB-INIZCTEOSA-N 2 1 330.472 4.186 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000674005777 1043270405 /nfs/dbraw/zinc/27/04/05/1043270405.db2.gz OKTPLRBLDJJRIR-CRAIPNDOSA-N 2 1 342.449 4.443 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000674005777 1043270409 /nfs/dbraw/zinc/27/04/09/1043270409.db2.gz OKTPLRBLDJJRIR-CRAIPNDOSA-N 2 1 342.449 4.443 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000674005777 1043270416 /nfs/dbraw/zinc/27/04/16/1043270416.db2.gz OKTPLRBLDJJRIR-CRAIPNDOSA-N 2 1 342.449 4.443 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC000665249380 1043271938 /nfs/dbraw/zinc/27/19/38/1043271938.db2.gz PESIVLLKOTUQPJ-GFCCVEGCSA-N 2 1 333.476 4.180 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(C(F)F)nc1 ZINC000631084664 1043283864 /nfs/dbraw/zinc/28/38/64/1043283864.db2.gz WRTGDHWRAZVEMM-QAPCUYQASA-N 2 1 345.437 4.019 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(C(F)F)nc1 ZINC000631084664 1043283877 /nfs/dbraw/zinc/28/38/77/1043283877.db2.gz WRTGDHWRAZVEMM-QAPCUYQASA-N 2 1 345.437 4.019 20 0 EIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000166756044 1043312285 /nfs/dbraw/zinc/31/22/85/1043312285.db2.gz PCSDHKPESNIUQL-NSHGMRRFSA-N 2 1 330.516 4.389 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]C(C)(C)c1nc2ccccc2s1 ZINC000625720039 1043377261 /nfs/dbraw/zinc/37/72/61/1043377261.db2.gz UEGVSZYKBSMTBW-UHFFFAOYSA-N 2 1 328.485 4.106 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC(F)(F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168012806 1043453199 /nfs/dbraw/zinc/45/31/99/1043453199.db2.gz FKQZBWLYAGEQPB-ALXJQNPVSA-N 2 1 336.470 4.453 20 0 EIADMP COc1ccsc1C[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000521418604 1043761421 /nfs/dbraw/zinc/76/14/21/1043761421.db2.gz CBRJJKLPIPWNCO-GOSISDBHSA-N 2 1 344.524 4.149 20 0 EIADMP COc1ccsc1C[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000521418604 1043761438 /nfs/dbraw/zinc/76/14/38/1043761438.db2.gz CBRJJKLPIPWNCO-GOSISDBHSA-N 2 1 344.524 4.149 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442643135 1043790711 /nfs/dbraw/zinc/79/07/11/1043790711.db2.gz GKRLKHAVODXWFK-QAPCUYQASA-N 2 1 340.433 4.415 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000191548918 1043825360 /nfs/dbraw/zinc/82/53/60/1043825360.db2.gz MDHZUEBSKVIIJX-CZUORRHYSA-N 2 1 328.422 4.055 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccc(SC(F)F)cc2)CC1 ZINC000731847244 1043834579 /nfs/dbraw/zinc/83/45/79/1043834579.db2.gz VSJDWUXLLQDLAJ-UHFFFAOYSA-N 2 1 328.472 4.308 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(SC(F)F)cc2)CC1 ZINC000731847244 1043834584 /nfs/dbraw/zinc/83/45/84/1043834584.db2.gz VSJDWUXLLQDLAJ-UHFFFAOYSA-N 2 1 328.472 4.308 20 0 EIADMP FC(F)(F)c1cccc(CCCC[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c1 ZINC000192469801 1043926000 /nfs/dbraw/zinc/92/60/00/1043926000.db2.gz FDGSUYVDSVKXJP-INIZCTEOSA-N 2 1 340.433 4.102 20 0 EIADMP COc1ccc([C@@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@@H]2CCC[NH2+]2)cc1 ZINC000665300690 1043927305 /nfs/dbraw/zinc/92/73/05/1043927305.db2.gz HRCMLPPHLWLDJI-JKSUJKDBSA-N 2 1 344.421 4.057 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000521814052 1043980673 /nfs/dbraw/zinc/98/06/73/1043980673.db2.gz UOXPCCXHFAEPSI-HNNXBMFYSA-N 2 1 332.488 4.376 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)c1 ZINC000658208478 1044045333 /nfs/dbraw/zinc/04/53/33/1044045333.db2.gz IBZNNJAEQOUMNM-HNAYVOBHSA-N 2 1 336.545 4.027 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)c1 ZINC000658208480 1044047013 /nfs/dbraw/zinc/04/70/13/1044047013.db2.gz IBZNNJAEQOUMNM-KXBFYZLASA-N 2 1 336.545 4.027 20 0 EIADMP Clc1ccc(OCCC[NH+]2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000040866031 1044077306 /nfs/dbraw/zinc/07/73/06/1044077306.db2.gz JWKNEQZAJBYDST-UHFFFAOYSA-N 2 1 336.907 4.059 20 0 EIADMP Cc1cccc2[nH]c(C[NH2+]C[C@@H]3CC[N@@H+](Cc4ccccc4)C3)cc21 ZINC000657452426 1044094850 /nfs/dbraw/zinc/09/48/50/1044094850.db2.gz FJARTXOLDIOFFB-IBGZPJMESA-N 2 1 333.479 4.088 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1[C@@H]1CCOC1 ZINC000474043038 1044164274 /nfs/dbraw/zinc/16/42/74/1044164274.db2.gz YUZAUSYSQXRLHW-YPAWHYETSA-N 2 1 344.543 4.212 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000193973954 1044225119 /nfs/dbraw/zinc/22/51/19/1044225119.db2.gz SYSNDIKJARECGP-ZBFHGGJFSA-N 2 1 340.433 4.100 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc3cccs3)C1)CC2 ZINC000479387548 1044243610 /nfs/dbraw/zinc/24/36/10/1044243610.db2.gz HNOCFDRZQQUZSS-QRWLVFNGSA-N 2 1 344.499 4.376 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc3cccs3)C1)CC2 ZINC000479387548 1044243636 /nfs/dbraw/zinc/24/36/36/1044243636.db2.gz HNOCFDRZQQUZSS-QRWLVFNGSA-N 2 1 344.499 4.376 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CCC([NH+]2CCCCC2)CC1 ZINC000443434756 1044284281 /nfs/dbraw/zinc/28/42/81/1044284281.db2.gz FJJZZGJJPKQLHE-UHFFFAOYSA-N 2 1 329.875 4.343 20 0 EIADMP COc1cccc2c(N3CCC([NH+]4CCCCC4)CC3)cc(C)[nH+]c12 ZINC000443454097 1044295474 /nfs/dbraw/zinc/29/54/74/1044295474.db2.gz OBJVWCUCVANJPF-UHFFFAOYSA-N 2 1 339.483 4.007 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccccn3)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168017571 1044311031 /nfs/dbraw/zinc/31/10/31/1044311031.db2.gz BDQWSGDSSPVRDP-CEQLMSFQSA-N 2 1 349.522 4.144 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC(C)(C)N2CCCCC2)cc1 ZINC000347960130 1044341648 /nfs/dbraw/zinc/34/16/48/1044341648.db2.gz PDUUFYZWYXVMJO-QGZVFWFLSA-N 2 1 340.515 4.096 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000326951402 1044341726 /nfs/dbraw/zinc/34/17/26/1044341726.db2.gz JVMQNRHFIVZHOK-GOSISDBHSA-N 2 1 338.495 4.053 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3ncccc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168020342 1044379257 /nfs/dbraw/zinc/37/92/57/1044379257.db2.gz MHNNIWZKHMIXGR-DNGCBJQESA-N 2 1 349.522 4.490 20 0 EIADMP CCc1oc2ccccc2c1C[N@H+](C)CCCCn1cc[nH+]c1C ZINC000348086591 1044389881 /nfs/dbraw/zinc/38/98/81/1044389881.db2.gz ZPTKPBCFIDXUNS-UHFFFAOYSA-N 2 1 325.456 4.412 20 0 EIADMP CCc1oc2ccccc2c1C[N@@H+](C)CCCCn1cc[nH+]c1C ZINC000348086591 1044389897 /nfs/dbraw/zinc/38/98/97/1044389897.db2.gz ZPTKPBCFIDXUNS-UHFFFAOYSA-N 2 1 325.456 4.412 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(Cl)nc(Cl)c2)CC1 ZINC000733899248 1044406912 /nfs/dbraw/zinc/40/69/12/1044406912.db2.gz VRJZPXRSWYFBHZ-UHFFFAOYSA-N 2 1 344.330 4.332 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)nc(Cl)c2)CC1 ZINC000733899248 1044406940 /nfs/dbraw/zinc/40/69/40/1044406940.db2.gz VRJZPXRSWYFBHZ-UHFFFAOYSA-N 2 1 344.330 4.332 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+][C@@H](C)CCCC(F)(F)F)sc2C1 ZINC000494837430 1044425642 /nfs/dbraw/zinc/42/56/42/1044425642.db2.gz LMENTBSKCOOYCD-LBPRGKRZSA-N 2 1 349.466 4.120 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+][C@@H](C)CCCC(F)(F)F)sc2C1 ZINC000494837430 1044425647 /nfs/dbraw/zinc/42/56/47/1044425647.db2.gz LMENTBSKCOOYCD-LBPRGKRZSA-N 2 1 349.466 4.120 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(Cl)cc1 ZINC000675882631 1044552537 /nfs/dbraw/zinc/55/25/37/1044552537.db2.gz SZLQYLMENUDYBA-RTBURBONSA-N 2 1 336.907 4.024 20 0 EIADMP CC(C)[C@@H](O)[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000657744024 1044566402 /nfs/dbraw/zinc/56/64/02/1044566402.db2.gz CSRMBIHSQYFTGT-FGZHOGPDSA-N 2 1 344.543 4.131 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](C/C=C\c2ccncc2)CC1 ZINC000494984909 1044569033 /nfs/dbraw/zinc/56/90/33/1044569033.db2.gz HQEDPDXVFVUXNP-GJEJWFRCSA-N 2 1 327.516 4.071 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3ccc(F)cc32)c1 ZINC000177978428 1044606522 /nfs/dbraw/zinc/60/65/22/1044606522.db2.gz OLVZTOLXHXRKJG-OAQYLSRUSA-N 2 1 326.459 4.443 20 0 EIADMP Cc1ccccc1[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H]1CO)C1CCCC1 ZINC000495081004 1044649494 /nfs/dbraw/zinc/64/94/94/1044649494.db2.gz FLTKWKNGFHJEMQ-UNMCSNQZSA-N 2 1 344.543 4.053 20 0 EIADMP C[C@@H]1C[C@@H](Nc2ccc(C[NH3+])c(F)c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168031593 1044831207 /nfs/dbraw/zinc/83/12/07/1044831207.db2.gz AJKMJSYVZQENCK-CWPLJXCYSA-N 2 1 341.474 4.138 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@@H+](CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000474273494 1044832662 /nfs/dbraw/zinc/83/26/62/1044832662.db2.gz LWLWYJSWXCIFIE-HNNXBMFYSA-N 2 1 329.315 4.200 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H]3CCC[C@]34CCCO4)CC[N@H+]2C2CC2)cc1 ZINC000895681778 1044851365 /nfs/dbraw/zinc/85/13/65/1044851365.db2.gz WNNRSOKNCYIFEI-UVUJQTEASA-N 2 1 340.511 4.046 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H]3CCC[C@]34CCCO4)CC[N@@H+]2C2CC2)cc1 ZINC000895681778 1044851366 /nfs/dbraw/zinc/85/13/66/1044851366.db2.gz WNNRSOKNCYIFEI-UVUJQTEASA-N 2 1 340.511 4.046 20 0 EIADMP Cc1cc(C#N)ccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390899067 1044901838 /nfs/dbraw/zinc/90/18/38/1044901838.db2.gz PFDSAWIWJPONAY-JOCHJYFZSA-N 2 1 347.506 4.257 20 0 EIADMP Cc1cc(C#N)ccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390899067 1044901853 /nfs/dbraw/zinc/90/18/53/1044901853.db2.gz PFDSAWIWJPONAY-JOCHJYFZSA-N 2 1 347.506 4.257 20 0 EIADMP CCC[C@@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1cccnc1 ZINC000544570187 1044942846 /nfs/dbraw/zinc/94/28/46/1044942846.db2.gz WPZYJFSKSXZZKF-WIYYLYMNSA-N 2 1 325.500 4.423 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CCc2scnc2C)CC1)CC(C)C ZINC000509029881 1044967423 /nfs/dbraw/zinc/96/74/23/1044967423.db2.gz JGTFQNWOQYZUHO-UHFFFAOYSA-N 2 1 337.577 4.074 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1cccc(Cl)c1 ZINC000673627871 1045047929 /nfs/dbraw/zinc/04/79/29/1045047929.db2.gz WEBYHMHCIMXESU-MOPGFXCFSA-N 2 1 336.907 4.024 20 0 EIADMP S=c1ccn(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c2ccccc12 ZINC000738271545 1045048733 /nfs/dbraw/zinc/04/87/33/1045048733.db2.gz NLNRZMKYIPGWMK-KRWDZBQOSA-N 2 1 341.524 4.279 20 0 EIADMP C[C@H]1C[C@@H](N[C@H]2CCCc3cccnc32)CC[N@H+]1Cc1ccccc1 ZINC000922885034 1045055431 /nfs/dbraw/zinc/05/54/31/1045055431.db2.gz YYKBVMLTVVTKRZ-YYWHXJBOSA-N 2 1 335.495 4.102 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@H]2CCCc3cccnc32)CCN1Cc1ccccc1 ZINC000922885034 1045055445 /nfs/dbraw/zinc/05/54/45/1045055445.db2.gz YYKBVMLTVVTKRZ-YYWHXJBOSA-N 2 1 335.495 4.102 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@@H+](C)CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000923319176 1045059314 /nfs/dbraw/zinc/05/93/14/1045059314.db2.gz MJDPFPVTIYXRHX-HNSVSWJLSA-N 2 1 329.513 4.210 20 0 EIADMP c1ccc([C@@H]2C[C@@H](N[C@H]3CC[N@H+]4CCC[C@H]4C3)c3ccccc3O2)cc1 ZINC000922887093 1045085072 /nfs/dbraw/zinc/08/50/72/1045085072.db2.gz YXDDQWCLAJJRSN-VKUXKFIQSA-N 2 1 348.490 4.468 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)c3ccccc3O2)cc1 ZINC000922887093 1045085089 /nfs/dbraw/zinc/08/50/89/1045085089.db2.gz YXDDQWCLAJJRSN-VKUXKFIQSA-N 2 1 348.490 4.468 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)c3ccccc3O2)cc1 ZINC000922887093 1045085096 /nfs/dbraw/zinc/08/50/96/1045085096.db2.gz YXDDQWCLAJJRSN-VKUXKFIQSA-N 2 1 348.490 4.468 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCCNc3ccccc32)C1 ZINC000347919705 1045097413 /nfs/dbraw/zinc/09/74/13/1045097413.db2.gz KIPXHLLYKJFQPS-UEXGIBASSA-N 2 1 329.532 4.281 20 0 EIADMP CC(C)(C)c1nc(C[N@@H+]2CCC[C@H](C[C@@H]([NH3+])C3CCCC3)C2)co1 ZINC000923421334 1045098059 /nfs/dbraw/zinc/09/80/59/1045098059.db2.gz NBZDUSZAQPDADL-CRAIPNDOSA-N 2 1 333.520 4.092 20 0 EIADMP CC(C)(C)c1nc(C[N@H+]2CCC[C@H](C[C@@H]([NH3+])C3CCCC3)C2)co1 ZINC000923421334 1045098070 /nfs/dbraw/zinc/09/80/70/1045098070.db2.gz NBZDUSZAQPDADL-CRAIPNDOSA-N 2 1 333.520 4.092 20 0 EIADMP Cc1ccc(CC[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)o1 ZINC000671741210 1045166323 /nfs/dbraw/zinc/16/63/23/1045166323.db2.gz QVHOBPJPIMZZTM-UHFFFAOYSA-N 2 1 326.484 4.163 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2scnc2C2CC2)cc1 ZINC000487275387 1045224124 /nfs/dbraw/zinc/22/41/24/1045224124.db2.gz PCOHWVBUTFUSPW-ZDUSSCGKSA-N 2 1 338.480 4.365 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@H](c3ccccc3)C3CC3)CC2)cc1 ZINC000236730660 1045364409 /nfs/dbraw/zinc/36/44/09/1045364409.db2.gz PWTKXZIIUPVYHU-HSZRJFAPSA-N 2 1 334.507 4.434 20 0 EIADMP Cc1ccc(COc2ccc(C[NH2+]C[C@@H]3CCC[N@H+](C)C3)cc2)cc1 ZINC000237178384 1045377797 /nfs/dbraw/zinc/37/77/97/1045377797.db2.gz ZUXVTLSWGBONAT-NRFANRHFSA-N 2 1 338.495 4.005 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000237416219 1045384367 /nfs/dbraw/zinc/38/43/67/1045384367.db2.gz XPISOIAQQLMUHX-SFHVURJKSA-N 2 1 349.478 4.196 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cccc3cc[nH]c32)CC1 ZINC000237456331 1045385770 /nfs/dbraw/zinc/38/57/70/1045385770.db2.gz YXJNMQLDPVLTFY-QGZVFWFLSA-N 2 1 333.479 4.483 20 0 EIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)o1 ZINC000237469013 1045386721 /nfs/dbraw/zinc/38/67/21/1045386721.db2.gz JPJMHTFFZSXZIS-IAGOWNOFSA-N 2 1 326.484 4.356 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000762915749 1045413304 /nfs/dbraw/zinc/41/33/04/1045413304.db2.gz FCNJMROJAUSQCL-QGZVFWFLSA-N 2 1 337.389 4.438 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000762915749 1045413309 /nfs/dbraw/zinc/41/33/09/1045413309.db2.gz FCNJMROJAUSQCL-QGZVFWFLSA-N 2 1 337.389 4.438 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001168498144 1045455496 /nfs/dbraw/zinc/45/54/96/1045455496.db2.gz QTXMWMNPGDULOT-WIYYLYMNSA-N 2 1 340.486 4.211 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001168498144 1045455497 /nfs/dbraw/zinc/45/54/97/1045455497.db2.gz QTXMWMNPGDULOT-WIYYLYMNSA-N 2 1 340.486 4.211 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001168498144 1045455500 /nfs/dbraw/zinc/45/55/00/1045455500.db2.gz QTXMWMNPGDULOT-WIYYLYMNSA-N 2 1 340.486 4.211 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874492 1045668028 /nfs/dbraw/zinc/66/80/28/1045668028.db2.gz FUWBUTWZHJRUHT-WMZOPIPTSA-N 2 1 340.433 4.369 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874492 1045668003 /nfs/dbraw/zinc/66/80/03/1045668003.db2.gz FUWBUTWZHJRUHT-WMZOPIPTSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874492 1045668050 /nfs/dbraw/zinc/66/80/50/1045668050.db2.gz FUWBUTWZHJRUHT-WMZOPIPTSA-N 2 1 340.433 4.369 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCCC1CCOCC1 ZINC000398044840 1045826592 /nfs/dbraw/zinc/82/65/92/1045826592.db2.gz VARXDJUVWPCKQY-UGKGYDQZSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCCC1CCOCC1 ZINC000398044840 1045826597 /nfs/dbraw/zinc/82/65/97/1045826597.db2.gz VARXDJUVWPCKQY-UGKGYDQZSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1F ZINC000398042685 1045827177 /nfs/dbraw/zinc/82/71/77/1045827177.db2.gz UAMJCKRRKQBFLD-XGHQBKJUSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1F ZINC000398042685 1045827181 /nfs/dbraw/zinc/82/71/81/1045827181.db2.gz UAMJCKRRKQBFLD-XGHQBKJUSA-N 2 1 326.459 4.387 20 0 EIADMP CCn1cc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)cn1 ZINC000246946361 1045834644 /nfs/dbraw/zinc/83/46/44/1045834644.db2.gz HVBCAFDYUAKRLT-QZTJIDSGSA-N 2 1 340.515 4.128 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000237363067 1045925428 /nfs/dbraw/zinc/92/54/28/1045925428.db2.gz ZMUKDMGBVPUTBQ-NSHDSACASA-N 2 1 345.796 4.290 20 0 EIADMP Cc1cc(C)cc(C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC001170206172 1045925427 /nfs/dbraw/zinc/92/54/27/1045925427.db2.gz RJNURJMPOHTNCS-QHCPKHFHSA-N 2 1 334.507 4.401 20 0 EIADMP Cc1cc(C)cc(C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC001170206172 1045925434 /nfs/dbraw/zinc/92/54/34/1045925434.db2.gz RJNURJMPOHTNCS-QHCPKHFHSA-N 2 1 334.507 4.401 20 0 EIADMP Cc1cc(C)cc(C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1 ZINC001170206172 1045925453 /nfs/dbraw/zinc/92/54/53/1045925453.db2.gz RJNURJMPOHTNCS-QHCPKHFHSA-N 2 1 334.507 4.401 20 0 EIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@@H](C)Cc2ccccc2Cl)CC1 ZINC001170275858 1045967125 /nfs/dbraw/zinc/96/71/25/1045967125.db2.gz ZICPWYDBGJCRCM-HNNXBMFYSA-N 2 1 343.902 4.213 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc3c(c2)COC3)CC1 ZINC000769544478 1046017570 /nfs/dbraw/zinc/01/75/70/1046017570.db2.gz XGZDMEIYABLGKF-SFHVURJKSA-N 2 1 342.527 4.193 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1csc(Br)c1)C1CCCCC1 ZINC000037864052 1046163558 /nfs/dbraw/zinc/16/35/58/1046163558.db2.gz GEYWDDKGHHZWSH-UHFFFAOYSA-N 2 1 345.350 4.255 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1csc(Br)c1)C1CCCCC1 ZINC000037864052 1046163564 /nfs/dbraw/zinc/16/35/64/1046163564.db2.gz GEYWDDKGHHZWSH-UHFFFAOYSA-N 2 1 345.350 4.255 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)c(C)c1 ZINC000162288433 1046166206 /nfs/dbraw/zinc/16/62/06/1046166206.db2.gz DOVQFGAXGCMDLF-KRWDZBQOSA-N 2 1 338.499 4.030 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)C(c1ccccc1)c1ccccc1 ZINC000124379855 1046233516 /nfs/dbraw/zinc/23/35/16/1046233516.db2.gz MFHDJIAQENILBZ-RBUKOAKNSA-N 2 1 334.507 4.281 20 0 EIADMP COc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1C ZINC000508698035 1046328071 /nfs/dbraw/zinc/32/80/71/1046328071.db2.gz KSTQEXQRXZCKPL-WIYYLYMNSA-N 2 1 338.495 4.004 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508709192 1046358798 /nfs/dbraw/zinc/35/87/98/1046358798.db2.gz GMDXFVKHFKIQPO-JBJBFBLISA-N 2 1 334.507 4.118 20 0 EIADMP C[C@@H]([NH2+]CCc1ccc(Cl)s1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508718469 1046375104 /nfs/dbraw/zinc/37/51/04/1046375104.db2.gz IZAOAWBQCPDPEG-WBVHZDCISA-N 2 1 348.943 4.444 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508722735 1046426585 /nfs/dbraw/zinc/42/65/85/1046426585.db2.gz UGQANSABYXSSDN-MJGOQNOKSA-N 2 1 328.525 4.099 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000536652588 1046594415 /nfs/dbraw/zinc/59/44/15/1046594415.db2.gz ZMUOMOZDHQJEHM-UHFFFAOYSA-N 2 1 346.412 4.397 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000536652588 1046594429 /nfs/dbraw/zinc/59/44/29/1046594429.db2.gz ZMUOMOZDHQJEHM-UHFFFAOYSA-N 2 1 346.412 4.397 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CC[C@H](c4ccccc4)C3)CC2)[nH+]1 ZINC000127048865 1046597723 /nfs/dbraw/zinc/59/77/23/1046597723.db2.gz PZLNNIRXJVNTCU-PZJWPPBQSA-N 2 1 335.495 4.285 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CCC[C@@H](C(F)(F)F)C3)CC2)[nH+]1 ZINC000127051847 1046599705 /nfs/dbraw/zinc/59/97/05/1046599705.db2.gz HBAFSUPOFUUDQL-GDBMZVCRSA-N 2 1 341.421 4.070 20 0 EIADMP COc1ccc(-c2ccccc2)cc1CN(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000536661958 1046632527 /nfs/dbraw/zinc/63/25/27/1046632527.db2.gz JKENQNLPXJFYDB-DYESRHJHSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@H+](C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000536661958 1046632529 /nfs/dbraw/zinc/63/25/29/1046632529.db2.gz JKENQNLPXJFYDB-DYESRHJHSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000536661958 1046632535 /nfs/dbraw/zinc/63/25/35/1046632535.db2.gz JKENQNLPXJFYDB-DYESRHJHSA-N 2 1 338.495 4.277 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCc2sccc2[C@@H]1c1cccs1 ZINC000127275029 1046642073 /nfs/dbraw/zinc/64/20/73/1046642073.db2.gz YSFGRMNFMIKUAY-GOSISDBHSA-N 2 1 343.521 4.352 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCc2sccc2[C@@H]1c1cccs1 ZINC000127275029 1046642078 /nfs/dbraw/zinc/64/20/78/1046642078.db2.gz YSFGRMNFMIKUAY-GOSISDBHSA-N 2 1 343.521 4.352 20 0 EIADMP CC[N@H+](Cc1cccc(OC)c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536711382 1046721467 /nfs/dbraw/zinc/72/14/67/1046721467.db2.gz TZGQVIYUNRGPAH-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1cccc(OC)c1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536711382 1046721481 /nfs/dbraw/zinc/72/14/81/1046721481.db2.gz TZGQVIYUNRGPAH-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1cccc(OC)c1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536711382 1046721495 /nfs/dbraw/zinc/72/14/95/1046721495.db2.gz TZGQVIYUNRGPAH-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC000379647797 1046740106 /nfs/dbraw/zinc/74/01/06/1046740106.db2.gz LDHKQHFRDZSORX-YSZBQJHXSA-N 2 1 334.507 4.187 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC000379647797 1046740119 /nfs/dbraw/zinc/74/01/19/1046740119.db2.gz LDHKQHFRDZSORX-YSZBQJHXSA-N 2 1 334.507 4.187 20 0 EIADMP CO[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379645731 1046740137 /nfs/dbraw/zinc/74/01/37/1046740137.db2.gz IIKBSQKVVDTSQN-STZQEDGTSA-N 2 1 338.495 4.017 20 0 EIADMP CO[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379645731 1046740151 /nfs/dbraw/zinc/74/01/51/1046740151.db2.gz IIKBSQKVVDTSQN-STZQEDGTSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)CCc3ccsc3)CC2)[nH+]1 ZINC000497398325 1046784909 /nfs/dbraw/zinc/78/49/09/1046784909.db2.gz BBDXAELFFVHHQD-MRXNPFEDSA-N 2 1 329.513 4.031 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)cc1 ZINC000536831022 1046824040 /nfs/dbraw/zinc/82/40/40/1046824040.db2.gz DQUGMCSTNDFSMJ-QSFXBCCZSA-N 2 1 341.499 4.425 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC000536856428 1046825536 /nfs/dbraw/zinc/82/55/36/1046825536.db2.gz FCSLNQZRVWZAJA-CHWSQXEVSA-N 2 1 325.909 4.153 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccc(OC)cc3)cc2)[C@H](C)C1 ZINC000536874173 1046838351 /nfs/dbraw/zinc/83/83/51/1046838351.db2.gz CJHDNVFGNKGAKV-VGSWGCGISA-N 2 1 338.495 4.182 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2sc(C)nc2C)CC1)CC(C)C ZINC000536887404 1046848114 /nfs/dbraw/zinc/84/81/14/1046848114.db2.gz WIHOULOGGUWSTO-UHFFFAOYSA-N 2 1 337.577 4.340 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000459726848 1046865965 /nfs/dbraw/zinc/86/59/65/1046865965.db2.gz BWUGPPLJBVSNFQ-NXVRBGIVSA-N 2 1 340.433 4.273 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459796846 1046892497 /nfs/dbraw/zinc/89/24/97/1046892497.db2.gz WLKVQCLGSLPSTE-RTYFKUQISA-N 2 1 338.442 4.013 20 0 EIADMP COc1ccc(C2([NH2+]C3CC[NH+]([C@H]4CCC[C@H](C)C4)CC3)CC2)cc1 ZINC000537422498 1047213648 /nfs/dbraw/zinc/21/36/48/1047213648.db2.gz MGIZGPHTOLXTFB-PXNSSMCTSA-N 2 1 342.527 4.317 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCCC34CCCC4)CC2)cc1 ZINC000556061241 1047427946 /nfs/dbraw/zinc/42/79/46/1047427946.db2.gz SYRRWNJTSFZQCP-OAQYLSRUSA-N 2 1 326.528 4.396 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(F)c(Cl)c2)C[C@@H]1c1ccccc1 ZINC000556075936 1047433645 /nfs/dbraw/zinc/43/36/45/1047433645.db2.gz FPJVBJONXCFATE-VQIMIIECSA-N 2 1 332.850 4.404 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc(F)c(Cl)c2)C[C@@H]1c1ccccc1 ZINC000556075936 1047433653 /nfs/dbraw/zinc/43/36/53/1047433653.db2.gz FPJVBJONXCFATE-VQIMIIECSA-N 2 1 332.850 4.404 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170120357 1047477216 /nfs/dbraw/zinc/47/72/16/1047477216.db2.gz GBMJJHJTIQBRRH-CJNGLKHVSA-N 2 1 326.406 4.144 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793520 1047482577 /nfs/dbraw/zinc/48/25/77/1047482577.db2.gz NYKKORCOSLZHGD-RTBURBONSA-N 2 1 344.568 4.447 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793520 1047482578 /nfs/dbraw/zinc/48/25/78/1047482578.db2.gz NYKKORCOSLZHGD-RTBURBONSA-N 2 1 344.568 4.447 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2cccc3[nH]ccc32)C[C@@H]1c1ccccc1 ZINC000556179698 1047538463 /nfs/dbraw/zinc/53/84/63/1047538463.db2.gz WELFNQHLHCGYMI-DENIHFKCSA-N 2 1 333.479 4.136 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2cccc3[nH]ccc32)C[C@@H]1c1ccccc1 ZINC000556179698 1047538473 /nfs/dbraw/zinc/53/84/73/1047538473.db2.gz WELFNQHLHCGYMI-DENIHFKCSA-N 2 1 333.479 4.136 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H](c3ccncc3)C3CC3)CC[N@@H+]2C2CC2)cc1 ZINC000898317065 1047621903 /nfs/dbraw/zinc/62/19/03/1047621903.db2.gz FUYRCXNUYSHMDT-ACIOBRDBSA-N 2 1 347.506 4.490 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H](c3ccncc3)C3CC3)CC[N@H+]2C2CC2)cc1 ZINC000898317065 1047621906 /nfs/dbraw/zinc/62/19/06/1047621906.db2.gz FUYRCXNUYSHMDT-ACIOBRDBSA-N 2 1 347.506 4.490 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@H](c3ccncc3)C3CC3)CC[N@@H+]2C2CC2)cc1 ZINC000898317074 1047622030 /nfs/dbraw/zinc/62/20/30/1047622030.db2.gz FUYRCXNUYSHMDT-PUHATCMVSA-N 2 1 347.506 4.490 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@H](c3ccncc3)C3CC3)CC[N@H+]2C2CC2)cc1 ZINC000898317074 1047622036 /nfs/dbraw/zinc/62/20/36/1047622036.db2.gz FUYRCXNUYSHMDT-PUHATCMVSA-N 2 1 347.506 4.490 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCc3c2cccc3O)CC1 ZINC000130623608 1047755826 /nfs/dbraw/zinc/75/58/26/1047755826.db2.gz SFNKYRYMTNQBSO-CDHQVMDDSA-N 2 1 328.500 4.012 20 0 EIADMP COCCC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000550678092 1047813703 /nfs/dbraw/zinc/81/37/03/1047813703.db2.gz AOWJHMLBTHXDJP-PMACEKPBSA-N 2 1 330.516 4.008 20 0 EIADMP COCCC1(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000550678092 1047813705 /nfs/dbraw/zinc/81/37/05/1047813705.db2.gz AOWJHMLBTHXDJP-PMACEKPBSA-N 2 1 330.516 4.008 20 0 EIADMP C[C@H]1SCC[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000814173588 1047866267 /nfs/dbraw/zinc/86/62/67/1047866267.db2.gz STUMHEPDPLWXSQ-PANBIXPWSA-N 2 1 330.541 4.056 20 0 EIADMP COc1cccc(C2([NH2+]C3CC[NH+]([C@H]4CCC[C@@H](C)C4)CC3)CC2)c1 ZINC000556914799 1048211290 /nfs/dbraw/zinc/21/12/90/1048211290.db2.gz CTWZEXFUAISYJR-XLIONFOSSA-N 2 1 342.527 4.317 20 0 EIADMP CN(C)c1ccccc1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499126480 1048306939 /nfs/dbraw/zinc/30/69/39/1048306939.db2.gz WPPIZEHJKPAYEC-DKUWSORSSA-N 2 1 349.522 4.038 20 0 EIADMP C[C@H](CC[N@H+]1CCC[C@]2(CC2(F)F)C1)[NH+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437262 1048333919 /nfs/dbraw/zinc/33/39/19/1048333919.db2.gz MTLKTALOLQNCTL-OWCLPIDISA-N 2 1 348.428 4.007 20 0 EIADMP C[C@H](CC[NH+]1CCC[C@]2(CC2(F)F)C1)[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437262 1048333934 /nfs/dbraw/zinc/33/39/34/1048333934.db2.gz MTLKTALOLQNCTL-OWCLPIDISA-N 2 1 348.428 4.007 20 0 EIADMP C[C@H](CC[NH+]1CCC[C@]2(CC2(F)F)C1)[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437262 1048333951 /nfs/dbraw/zinc/33/39/51/1048333951.db2.gz MTLKTALOLQNCTL-OWCLPIDISA-N 2 1 348.428 4.007 20 0 EIADMP CC(C)[C@H](Cc1ccc(F)cc1)[N@H+](C)Cc1ncc(C[NH+](C)C)s1 ZINC000809585570 1048423994 /nfs/dbraw/zinc/42/39/94/1048423994.db2.gz CFVATNCINNNKNK-SFHVURJKSA-N 2 1 349.519 4.043 20 0 EIADMP CC(C)[C@H](Cc1ccc(F)cc1)[N@@H+](C)Cc1ncc(C[NH+](C)C)s1 ZINC000809585570 1048424001 /nfs/dbraw/zinc/42/40/01/1048424001.db2.gz CFVATNCINNNKNK-SFHVURJKSA-N 2 1 349.519 4.043 20 0 EIADMP Cc1ccc([C@H]2CCC[C@H]2[N@@H+](C)Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000809582782 1048425482 /nfs/dbraw/zinc/42/54/82/1048425482.db2.gz DDGNZKREOGBTEL-RTBURBONSA-N 2 1 343.540 4.281 20 0 EIADMP Cc1ccc([C@H]2CCC[C@H]2[N@H+](C)Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000809582782 1048425494 /nfs/dbraw/zinc/42/54/94/1048425494.db2.gz DDGNZKREOGBTEL-RTBURBONSA-N 2 1 343.540 4.281 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2coc(C3CC3)n2)CC1)CC(C)C ZINC000809755496 1048519639 /nfs/dbraw/zinc/51/96/39/1048519639.db2.gz ISHRHHJOCLWZCV-UHFFFAOYSA-N 2 1 333.520 4.132 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2coc(C3CC3)n2)CC1)CC(C)C ZINC000809755496 1048519650 /nfs/dbraw/zinc/51/96/50/1048519650.db2.gz ISHRHHJOCLWZCV-UHFFFAOYSA-N 2 1 333.520 4.132 20 0 EIADMP Clc1ncccc1CNC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000810178715 1048668515 /nfs/dbraw/zinc/66/85/15/1048668515.db2.gz YUTNICHYVKOBRG-SFHVURJKSA-N 2 1 343.902 4.127 20 0 EIADMP c1ccc2c(c1)OCCC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000133463164 1048727075 /nfs/dbraw/zinc/72/70/75/1048727075.db2.gz WVASOQBMDQUOSJ-FQEVSTJZSA-N 2 1 328.500 4.287 20 0 EIADMP c1cc2cccc(C[NH+]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]4C3)c2[nH]1 ZINC001144718328 1048818467 /nfs/dbraw/zinc/81/84/67/1048818467.db2.gz HQZRWDQUAYKAET-IRLDBZIGSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2cccc(C[N@H+]3CC[C@@H]4C[NH+](Cc5ccccc5)C[C@@H]4C3)c2[nH]1 ZINC001144718328 1048818469 /nfs/dbraw/zinc/81/84/69/1048818469.db2.gz HQZRWDQUAYKAET-IRLDBZIGSA-N 2 1 345.490 4.122 20 0 EIADMP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@H+]1CCCCCC[NH3+] ZINC000846220264 1048844113 /nfs/dbraw/zinc/84/41/13/1048844113.db2.gz MSXKFOANRCXOLI-LJQANCHMSA-N 2 1 328.504 4.273 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccnc(Cl)c2Cl)C1 ZINC000811474205 1049092857 /nfs/dbraw/zinc/09/28/57/1049092857.db2.gz FJOIUHUBXYAABB-OKILXGFUSA-N 2 1 344.330 4.236 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cc(F)c(F)cc2F)c1 ZINC000135971630 1049299792 /nfs/dbraw/zinc/29/97/92/1049299792.db2.gz KGJOHSMCXSOGLL-UHFFFAOYSA-N 2 1 336.401 4.234 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(F)c(F)cc2F)c1 ZINC000135971630 1049299805 /nfs/dbraw/zinc/29/98/05/1049299805.db2.gz KGJOHSMCXSOGLL-UHFFFAOYSA-N 2 1 336.401 4.234 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170933618 1049353650 /nfs/dbraw/zinc/35/36/50/1049353650.db2.gz IODGJOCXNRQZGZ-GOSISDBHSA-N 2 1 334.935 4.250 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(Cl)c(Br)c2)CC1 ZINC000137092261 1049575554 /nfs/dbraw/zinc/57/55/54/1049575554.db2.gz VBUKGNWPRLXOOM-UHFFFAOYSA-N 2 1 345.712 4.067 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495143 1049721253 /nfs/dbraw/zinc/72/12/53/1049721253.db2.gz XTNDEBFJWRHBDH-OTWHNJEPSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495143 1049721261 /nfs/dbraw/zinc/72/12/61/1049721261.db2.gz XTNDEBFJWRHBDH-OTWHNJEPSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495143 1049721267 /nfs/dbraw/zinc/72/12/67/1049721267.db2.gz XTNDEBFJWRHBDH-OTWHNJEPSA-N 2 1 348.481 4.161 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001171548532 1049752423 /nfs/dbraw/zinc/75/24/23/1049752423.db2.gz COYNBKVGWDYSMK-JOCHJYFZSA-N 2 1 334.507 4.107 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171559090 1049754775 /nfs/dbraw/zinc/75/47/75/1049754775.db2.gz VGGJRKZYTOYHMJ-YPAWHYETSA-N 2 1 349.522 4.019 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557460 1049754881 /nfs/dbraw/zinc/75/48/81/1049754881.db2.gz CEYCYRIHGYAKQL-FKBYEOEOSA-N 2 1 349.522 4.019 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C)C2 ZINC001171573115 1049758724 /nfs/dbraw/zinc/75/87/24/1049758724.db2.gz GNFQTFOEDBDFRO-HBMCJLEFSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C)C2 ZINC001171573115 1049758730 /nfs/dbraw/zinc/75/87/30/1049758730.db2.gz GNFQTFOEDBDFRO-HBMCJLEFSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C)C2 ZINC001171573115 1049758735 /nfs/dbraw/zinc/75/87/35/1049758735.db2.gz GNFQTFOEDBDFRO-HBMCJLEFSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1ccc(CC[C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001171658589 1049771980 /nfs/dbraw/zinc/77/19/80/1049771980.db2.gz TXNNNIOJXHZJKC-NFBKMPQASA-N 2 1 336.523 4.428 20 0 EIADMP Fc1ccc(C2CC([NH2+]C3CC[NH+](Cc4ccccc4)CC3)C2)cc1 ZINC000237831978 1049775062 /nfs/dbraw/zinc/77/50/62/1049775062.db2.gz VBEONWWLDYHYBH-UHFFFAOYSA-N 2 1 338.470 4.326 20 0 EIADMP Fc1cccc2c1C[C@@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)CC2 ZINC001170993221 1049777582 /nfs/dbraw/zinc/77/75/82/1049777582.db2.gz ZBOWEEXDGGGZAF-IBGZPJMESA-N 2 1 342.502 4.023 20 0 EIADMP Fc1cccc2c1C[C@@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)CC2 ZINC001170993221 1049777590 /nfs/dbraw/zinc/77/75/90/1049777590.db2.gz ZBOWEEXDGGGZAF-IBGZPJMESA-N 2 1 342.502 4.023 20 0 EIADMP C[C@@H]1C[C@H](n2c(C[NH3+])cc3cccc(F)c32)C[N@H+]1Cc1ccccc1 ZINC001171741661 1049802080 /nfs/dbraw/zinc/80/20/80/1049802080.db2.gz QSJMHHDTQCOPDE-BEFAXECRSA-N 2 1 337.442 4.075 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH+]1CCC([N@H+](C)C2CC2)CC1 ZINC001171964816 1049826671 /nfs/dbraw/zinc/82/66/71/1049826671.db2.gz KJIJJEOBNZUYIU-AWEZNQCLSA-N 2 1 340.433 4.195 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001171964816 1049826675 /nfs/dbraw/zinc/82/66/75/1049826675.db2.gz KJIJJEOBNZUYIU-AWEZNQCLSA-N 2 1 340.433 4.195 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2ccc(F)cc2)CC[N@H+]1Cc1ccccc1 ZINC001171966220 1049827063 /nfs/dbraw/zinc/82/70/63/1049827063.db2.gz UGHPQZJAGMRFAY-FQEVSTJZSA-N 2 1 326.459 4.359 20 0 EIADMP COc1ccccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171965166 1049827191 /nfs/dbraw/zinc/82/71/91/1049827191.db2.gz OLNFHKLBJQCOQW-HXUWFJFHSA-N 2 1 338.495 4.228 20 0 EIADMP COc1ccccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171965166 1049827195 /nfs/dbraw/zinc/82/71/95/1049827195.db2.gz OLNFHKLBJQCOQW-HXUWFJFHSA-N 2 1 338.495 4.228 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2cc(F)cc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171966603 1049828093 /nfs/dbraw/zinc/82/80/93/1049828093.db2.gz VTGOILNWHZNASN-HXUWFJFHSA-N 2 1 344.449 4.498 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2cc(F)cc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC001171966603 1049828098 /nfs/dbraw/zinc/82/80/98/1049828098.db2.gz VTGOILNWHZNASN-HXUWFJFHSA-N 2 1 344.449 4.498 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CCC(C(F)F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171988969 1049832178 /nfs/dbraw/zinc/83/21/78/1049832178.db2.gz YEQIOKUWPLEYLD-SFHVURJKSA-N 2 1 336.470 4.407 20 0 EIADMP COc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)cc1 ZINC001171969231 1049833526 /nfs/dbraw/zinc/83/35/26/1049833526.db2.gz UOYVCPCSIIQBEJ-HXUWFJFHSA-N 2 1 338.495 4.228 20 0 EIADMP C[C@H](CCCC(C)(C)O)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171972623 1049835113 /nfs/dbraw/zinc/83/51/13/1049835113.db2.gz RRDFWUDAAWBPHJ-UYAOXDASSA-N 2 1 346.559 4.349 20 0 EIADMP Cc1cccc(C(=[NH2+])N[C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171976177 1049837686 /nfs/dbraw/zinc/83/76/86/1049837686.db2.gz QASTWNSOXHVPTO-FQEVSTJZSA-N 2 1 335.495 4.353 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C(C)(C)O1 ZINC000245720032 1049838737 /nfs/dbraw/zinc/83/87/37/1049838737.db2.gz OOQTYJZGAFMGEI-YSTOQKLRSA-N 2 1 342.527 4.118 20 0 EIADMP CC1(C)C[C@H]([NH2+]CC2(c3ccccn3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171984162 1049839712 /nfs/dbraw/zinc/83/97/12/1049839712.db2.gz SFWFKTBEGDFXMN-HXUWFJFHSA-N 2 1 349.522 4.146 20 0 EIADMP CC1(C)C[C@@H](N2CC[C@H]([NH3+])c3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC001171984474 1049839825 /nfs/dbraw/zinc/83/98/25/1049839825.db2.gz WBDLPIVSTRLZID-FPOVZHCZSA-N 2 1 349.522 4.340 20 0 EIADMP Cc1cc(C[NH+](C)[C@H]2CC[N@H+](C)[C@@H](C)C2)ccc1Oc1cccnc1 ZINC000245730738 1049840875 /nfs/dbraw/zinc/84/08/75/1049840875.db2.gz JSENJGATOPIWHP-HKUYNNGSSA-N 2 1 339.483 4.097 20 0 EIADMP Cc1cc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1Oc1cccnc1 ZINC000245730738 1049840878 /nfs/dbraw/zinc/84/08/78/1049840878.db2.gz JSENJGATOPIWHP-HKUYNNGSSA-N 2 1 339.483 4.097 20 0 EIADMP Cc1cc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)ccc1Oc1cccnc1 ZINC000245730738 1049840881 /nfs/dbraw/zinc/84/08/81/1049840881.db2.gz JSENJGATOPIWHP-HKUYNNGSSA-N 2 1 339.483 4.097 20 0 EIADMP Cc1cc(C[N@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)ccc1Oc1cccnc1 ZINC000245730738 1049840884 /nfs/dbraw/zinc/84/08/84/1049840884.db2.gz JSENJGATOPIWHP-HKUYNNGSSA-N 2 1 339.483 4.097 20 0 EIADMP CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)c1 ZINC000245733928 1049842035 /nfs/dbraw/zinc/84/20/35/1049842035.db2.gz JKMZBJHCGZSSOA-ABSDTBQOSA-N 2 1 340.515 4.195 20 0 EIADMP CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H]2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1 ZINC000245733928 1049842041 /nfs/dbraw/zinc/84/20/41/1049842041.db2.gz JKMZBJHCGZSSOA-ABSDTBQOSA-N 2 1 340.515 4.195 20 0 EIADMP CCO[C@@H]1CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172075205 1049844683 /nfs/dbraw/zinc/84/46/83/1049844683.db2.gz OROAGRMQZDFVLN-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172075205 1049844686 /nfs/dbraw/zinc/84/46/86/1049844686.db2.gz OROAGRMQZDFVLN-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172075205 1049844687 /nfs/dbraw/zinc/84/46/87/1049844687.db2.gz OROAGRMQZDFVLN-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2(c4ccncc4)CC2)C3)cc1 ZINC001172066199 1049851395 /nfs/dbraw/zinc/85/13/95/1049851395.db2.gz UTLUNTCXXTUYCW-KOUNCHBCSA-N 2 1 347.506 4.246 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2(c4ccncc4)CC2)C3)cc1 ZINC001172066199 1049851396 /nfs/dbraw/zinc/85/13/96/1049851396.db2.gz UTLUNTCXXTUYCW-KOUNCHBCSA-N 2 1 347.506 4.246 20 0 EIADMP F[C@@H]1CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172067064 1049851788 /nfs/dbraw/zinc/85/17/88/1049851788.db2.gz AEAWBMWKJZGXCZ-CGXNFDGLSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172067064 1049851792 /nfs/dbraw/zinc/85/17/92/1049851792.db2.gz AEAWBMWKJZGXCZ-CGXNFDGLSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172067064 1049851795 /nfs/dbraw/zinc/85/17/95/1049851795.db2.gz AEAWBMWKJZGXCZ-CGXNFDGLSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172067064 1049851797 /nfs/dbraw/zinc/85/17/97/1049851797.db2.gz AEAWBMWKJZGXCZ-CGXNFDGLSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccncc1 ZINC001172066630 1049851842 /nfs/dbraw/zinc/85/18/42/1049851842.db2.gz JPPHKUJKYSZQNR-HLRQEUIKSA-N 2 1 335.495 4.318 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCc3cc(C(F)(F)F)ccc3C1)C2 ZINC001172127997 1049852709 /nfs/dbraw/zinc/85/27/09/1049852709.db2.gz NHDHFFCBBXHHQZ-PIIMJCKOSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCc3cc(C(F)(F)F)ccc3C1)C2 ZINC001172127997 1049852716 /nfs/dbraw/zinc/85/27/16/1049852716.db2.gz NHDHFFCBBXHHQZ-PIIMJCKOSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCc3cc(C(F)(F)F)ccc3C1)C2 ZINC001172127997 1049852719 /nfs/dbraw/zinc/85/27/19/1049852719.db2.gz NHDHFFCBBXHHQZ-PIIMJCKOSA-N 2 1 338.417 4.079 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Cc3ccc(F)cc3F)CC1)C2 ZINC001172127941 1049852758 /nfs/dbraw/zinc/85/27/58/1049852758.db2.gz MAMSKLAJBBSDPH-PMOLBWCYSA-N 2 1 348.481 4.235 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Cc3ccc(F)cc3F)CC1)C2 ZINC001172127941 1049852763 /nfs/dbraw/zinc/85/27/63/1049852763.db2.gz MAMSKLAJBBSDPH-PMOLBWCYSA-N 2 1 348.481 4.235 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccnc1 ZINC001172069616 1049853065 /nfs/dbraw/zinc/85/30/65/1049853065.db2.gz VTHZOJRCJNEBRA-HLRQEUIKSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccnc1 ZINC001172069616 1049853069 /nfs/dbraw/zinc/85/30/69/1049853069.db2.gz VTHZOJRCJNEBRA-HLRQEUIKSA-N 2 1 335.495 4.318 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCc3cccc(C(F)(F)F)c3C1)C2 ZINC001172128061 1049853231 /nfs/dbraw/zinc/85/32/31/1049853231.db2.gz NSVABFDNOILMPC-MUJYYYPQSA-N 2 1 338.417 4.079 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCc3cccc(C(F)(F)F)c3C1)C2 ZINC001172128061 1049853232 /nfs/dbraw/zinc/85/32/32/1049853232.db2.gz NSVABFDNOILMPC-MUJYYYPQSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCc3cccc(C(F)(F)F)c3C1)C2 ZINC001172128061 1049853233 /nfs/dbraw/zinc/85/32/33/1049853233.db2.gz NSVABFDNOILMPC-MUJYYYPQSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCc3cccc(C(F)(F)F)c3C1)C2 ZINC001172128061 1049853235 /nfs/dbraw/zinc/85/32/35/1049853235.db2.gz NSVABFDNOILMPC-MUJYYYPQSA-N 2 1 338.417 4.079 20 0 EIADMP CO[C@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172070029 1049853279 /nfs/dbraw/zinc/85/32/79/1049853279.db2.gz IXJKXAMNDOMHJC-UZBCKPFNSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129295 1049854799 /nfs/dbraw/zinc/85/47/99/1049854799.db2.gz YBJQTXAQHPUBPY-XFKSJGNHSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129295 1049854800 /nfs/dbraw/zinc/85/48/00/1049854800.db2.gz YBJQTXAQHPUBPY-XFKSJGNHSA-N 2 1 348.918 4.199 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129295 1049854801 /nfs/dbraw/zinc/85/48/01/1049854801.db2.gz YBJQTXAQHPUBPY-XFKSJGNHSA-N 2 1 348.918 4.199 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129295 1049854805 /nfs/dbraw/zinc/85/48/05/1049854805.db2.gz YBJQTXAQHPUBPY-XFKSJGNHSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H](CCc3ccccc3)C1)C2 ZINC001172134695 1049854914 /nfs/dbraw/zinc/85/49/14/1049854914.db2.gz YPGCDIDIDBVSNK-FNAHDJPLSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H](CCc3ccccc3)C1)C2 ZINC001172134695 1049854915 /nfs/dbraw/zinc/85/49/15/1049854915.db2.gz YPGCDIDIDBVSNK-FNAHDJPLSA-N 2 1 326.528 4.347 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H](CCc3ccccc3)C1)C2 ZINC001172134695 1049854919 /nfs/dbraw/zinc/85/49/19/1049854919.db2.gz YPGCDIDIDBVSNK-FNAHDJPLSA-N 2 1 326.528 4.347 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H](CCc3ccccc3)C1)C2 ZINC001172134695 1049854920 /nfs/dbraw/zinc/85/49/20/1049854920.db2.gz YPGCDIDIDBVSNK-FNAHDJPLSA-N 2 1 326.528 4.347 20 0 EIADMP CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109907 1049856582 /nfs/dbraw/zinc/85/65/82/1049856582.db2.gz GOXCATJJKNDTNZ-YPHBOWRQSA-N 3 1 347.591 4.154 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109907 1049856586 /nfs/dbraw/zinc/85/65/86/1049856586.db2.gz GOXCATJJKNDTNZ-YPHBOWRQSA-N 3 1 347.591 4.154 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109907 1049856587 /nfs/dbraw/zinc/85/65/87/1049856587.db2.gz GOXCATJJKNDTNZ-YPHBOWRQSA-N 3 1 347.591 4.154 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109907 1049856589 /nfs/dbraw/zinc/85/65/89/1049856589.db2.gz GOXCATJJKNDTNZ-YPHBOWRQSA-N 3 1 347.591 4.154 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109907 1049856591 /nfs/dbraw/zinc/85/65/91/1049856591.db2.gz GOXCATJJKNDTNZ-YPHBOWRQSA-N 3 1 347.591 4.154 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108404 1049857407 /nfs/dbraw/zinc/85/74/07/1049857407.db2.gz AAORPMLCJSBXIZ-YUMYIRISSA-N 2 1 342.527 4.149 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108404 1049857410 /nfs/dbraw/zinc/85/74/10/1049857410.db2.gz AAORPMLCJSBXIZ-YUMYIRISSA-N 2 1 342.527 4.149 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3cccc(Br)c3)CC1)C2 ZINC001172104739 1049857492 /nfs/dbraw/zinc/85/74/92/1049857492.db2.gz CPCBURKLVHPHAI-OSYLJGHBSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3cccc(Br)c3)CC1)C2 ZINC001172104739 1049857496 /nfs/dbraw/zinc/85/74/96/1049857496.db2.gz CPCBURKLVHPHAI-OSYLJGHBSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1c3ccc(Cl)cc3c3c1CC[NH2+]C3)C2 ZINC001172120164 1049858419 /nfs/dbraw/zinc/85/84/19/1049858419.db2.gz DMCFADXUKJTXMD-ZSHCYNCHSA-N 2 1 343.902 4.128 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(Cc3cccc(F)c3)CCC1)C2 ZINC001172112556 1049858540 /nfs/dbraw/zinc/85/85/40/1049858540.db2.gz XPGPDJCLJZHIFH-OWZKRDHZSA-N 2 1 330.491 4.143 20 0 EIADMP Cc1ccc2c(C[C@H](C)[NH3+])cn([C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)c2c1 ZINC001172113279 1049858988 /nfs/dbraw/zinc/85/89/88/1049858988.db2.gz BTLIXCVKTDMHAZ-KANFNMMFSA-N 2 1 325.500 4.027 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCc3c1cccc3Br)C2 ZINC001172112813 1049859153 /nfs/dbraw/zinc/85/91/53/1049859153.db2.gz AHZHMCYMNUDEHV-ZUMXRPEOSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCc3c1cccc3Br)C2 ZINC001172112813 1049859154 /nfs/dbraw/zinc/85/91/54/1049859154.db2.gz AHZHMCYMNUDEHV-ZUMXRPEOSA-N 2 1 349.316 4.041 20 0 EIADMP CCOc1ccc([C@H]2CCC[N@@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)cc1 ZINC001172124111 1049860248 /nfs/dbraw/zinc/86/02/48/1049860248.db2.gz JMLRWYHYHBEQJV-XODKDNOYSA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@H]2CCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)cc1 ZINC001172124111 1049860252 /nfs/dbraw/zinc/86/02/52/1049860252.db2.gz JMLRWYHYHBEQJV-XODKDNOYSA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@H]2CCC[NH+]2[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172124111 1049860253 /nfs/dbraw/zinc/86/02/53/1049860253.db2.gz JMLRWYHYHBEQJV-XODKDNOYSA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@H]2CCC[NH+]2[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172124111 1049860254 /nfs/dbraw/zinc/86/02/54/1049860254.db2.gz JMLRWYHYHBEQJV-XODKDNOYSA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@H]2CCCC[N@@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172124243 1049860371 /nfs/dbraw/zinc/86/03/71/1049860371.db2.gz JTGJLQZFFFBPMS-XODKDNOYSA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@H]2CCCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172124243 1049860375 /nfs/dbraw/zinc/86/03/75/1049860375.db2.gz JTGJLQZFFFBPMS-XODKDNOYSA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@H]2CCCC[NH+]2[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172124243 1049860377 /nfs/dbraw/zinc/86/03/77/1049860377.db2.gz JTGJLQZFFFBPMS-XODKDNOYSA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@H]2CCCC[NH+]2[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172124243 1049860381 /nfs/dbraw/zinc/86/03/81/1049860381.db2.gz JTGJLQZFFFBPMS-XODKDNOYSA-N 2 1 328.500 4.238 20 0 EIADMP COCCC[NH+]1CCC([NH2+]C2(CC(C)C)CCC(F)(F)CC2)CC1 ZINC001172250575 1049872520 /nfs/dbraw/zinc/87/25/20/1049872520.db2.gz SFWOBYHSHCPBBB-UHFFFAOYSA-N 2 1 346.506 4.071 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC001172319421 1049877701 /nfs/dbraw/zinc/87/77/01/1049877701.db2.gz QUNPRFHXWOVOBT-MKJVIKKCSA-N 2 1 344.543 4.080 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(OC)cc2)C1 ZINC000245954244 1049882492 /nfs/dbraw/zinc/88/24/92/1049882492.db2.gz LNQZOYFYNILALM-XMSQKQJNSA-N 2 1 338.495 4.106 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(OC)cc2)C1 ZINC000245954244 1049882498 /nfs/dbraw/zinc/88/24/98/1049882498.db2.gz LNQZOYFYNILALM-XMSQKQJNSA-N 2 1 338.495 4.106 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[N@@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC001172327955 1049886035 /nfs/dbraw/zinc/88/60/35/1049886035.db2.gz AENGEPFONOVMPI-OALUTQOASA-N 2 1 332.532 4.177 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1CCC2(C[C@H]([N@@H+](C)Cc3ccco3)CO2)CC1 ZINC001172402920 1049899345 /nfs/dbraw/zinc/89/93/45/1049899345.db2.gz PSRIQKLDUMVNBS-MOPGFXCFSA-N 2 1 348.531 4.160 20 0 EIADMP CCOCC[C@@H](C)[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001172427389 1049901088 /nfs/dbraw/zinc/90/10/88/1049901088.db2.gz OVETZYOVSGKTGP-HXUWFJFHSA-N 2 1 344.543 4.180 20 0 EIADMP CC(C)COCC[C@@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001172470090 1049908614 /nfs/dbraw/zinc/90/86/14/1049908614.db2.gz GBCXSOXEBZQARW-LJQANCHMSA-N 2 1 348.531 4.019 20 0 EIADMP CC(C)COCC[C@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001172470089 1049908675 /nfs/dbraw/zinc/90/86/75/1049908675.db2.gz GBCXSOXEBZQARW-IBGZPJMESA-N 2 1 348.531 4.019 20 0 EIADMP CC(C)COCC[C@H](C)[NH+]1CCC([NH3+])(c2ccc(Cl)cc2)CC1 ZINC001172466809 1049919521 /nfs/dbraw/zinc/91/95/21/1049919521.db2.gz GAGPUIVQQGXIGC-INIZCTEOSA-N 2 1 338.923 4.041 20 0 EIADMP CC(C)COCC[C@@H](C)[NH+]1CCC([NH3+])(c2ccccc2Cl)CC1 ZINC001172467590 1049919826 /nfs/dbraw/zinc/91/98/26/1049919826.db2.gz MEMKWDZOXROLLM-MRXNPFEDSA-N 2 1 338.923 4.041 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccnc2)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172554713 1049931646 /nfs/dbraw/zinc/93/16/46/1049931646.db2.gz BSWMPTLOXXKZTC-SSGKUCQKSA-N 2 1 349.522 4.490 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+]([C@@H]2CC[C@@H](c3ccccc3)C2)C2CCOCC2)CC1 ZINC001172556401 1049932364 /nfs/dbraw/zinc/93/23/64/1049932364.db2.gz LXLDGVHWGWNVML-NXLVEIQXSA-N 2 1 342.527 4.074 20 0 EIADMP C[C@H](CCc1c(F)cc(Cl)cc1F)[N@@H+](C)C1CCC([NH3+])CC1 ZINC001172565996 1049935362 /nfs/dbraw/zinc/93/53/62/1049935362.db2.gz ANMAXRWGPYJYLY-LMWSTFAQSA-N 2 1 330.850 4.141 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172721649 1049964987 /nfs/dbraw/zinc/96/49/87/1049964987.db2.gz IIPPCFCULXSBKH-ZCNNSNEGSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172721649 1049964990 /nfs/dbraw/zinc/96/49/90/1049964990.db2.gz IIPPCFCULXSBKH-ZCNNSNEGSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172721649 1049964994 /nfs/dbraw/zinc/96/49/94/1049964994.db2.gz IIPPCFCULXSBKH-ZCNNSNEGSA-N 2 1 332.919 4.146 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000247044034 1050010998 /nfs/dbraw/zinc/01/09/98/1050010998.db2.gz OIONFXABPGHRHZ-DCGLDWPTSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000247044034 1050011003 /nfs/dbraw/zinc/01/10/03/1050011003.db2.gz OIONFXABPGHRHZ-DCGLDWPTSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)s1 ZINC000247228832 1050017686 /nfs/dbraw/zinc/01/76/86/1050017686.db2.gz YETUNGUXECERKN-DOTOQJQBSA-N 2 1 344.524 4.128 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)s1 ZINC000247228832 1050017691 /nfs/dbraw/zinc/01/76/91/1050017691.db2.gz YETUNGUXECERKN-DOTOQJQBSA-N 2 1 344.524 4.128 20 0 EIADMP Cc1nc(-c2ccc(CC[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)s2)cs1 ZINC000248050826 1050040043 /nfs/dbraw/zinc/04/00/43/1050040043.db2.gz WFPMFNCRTBEFOW-XJKCOSOUSA-N 2 1 349.569 4.041 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1N(C)C ZINC000248394303 1050053070 /nfs/dbraw/zinc/05/30/70/1050053070.db2.gz FPTWWGJFYBMTKI-ULQDDVLXSA-N 2 1 347.522 4.195 20 0 EIADMP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(OC)cc1 ZINC000248399828 1050054279 /nfs/dbraw/zinc/05/42/79/1050054279.db2.gz KIMIAYUJTQNZJD-MMOPVJDHSA-N 2 1 330.516 4.389 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCCNc2ccccc2)C3)cc1 ZINC000248997053 1050087496 /nfs/dbraw/zinc/08/74/96/1050087496.db2.gz PGWYTTYZMSJKKF-NUNAXRQHSA-N 2 1 349.522 4.274 20 0 EIADMP C[N@@H+]1CC[C@H]2CC[NH+](CCCCc3cccc(C(F)(F)F)c3)[C@H]2C1 ZINC000249106030 1050091233 /nfs/dbraw/zinc/09/12/33/1050091233.db2.gz PIDNNBGXKSLDQH-WMZOPIPTSA-N 2 1 340.433 4.054 20 0 EIADMP C[N@H+]1CC[C@H]2CC[NH+](CCCCc3cccc(C(F)(F)F)c3)[C@H]2C1 ZINC000249106030 1050091240 /nfs/dbraw/zinc/09/12/40/1050091240.db2.gz PIDNNBGXKSLDQH-WMZOPIPTSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@H+](CCCCc3cccc(C(F)(F)F)c3)[C@H]2C1 ZINC000249106030 1050091244 /nfs/dbraw/zinc/09/12/44/1050091244.db2.gz PIDNNBGXKSLDQH-WMZOPIPTSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@@H+](CCCCc3cccc(C(F)(F)F)c3)[C@H]2C1 ZINC000249106030 1050091248 /nfs/dbraw/zinc/09/12/48/1050091248.db2.gz PIDNNBGXKSLDQH-WMZOPIPTSA-N 2 1 340.433 4.054 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C2CC2)[C@H]2CCCCO2)cc1 ZINC000655789076 1050103266 /nfs/dbraw/zinc/10/32/66/1050103266.db2.gz VFPXBBGCDBOYDC-RVHYNSKXSA-N 2 1 339.483 4.179 20 0 EIADMP C[NH+]1CCC(c2ccc(Nc3cc[nH+]cc3C(F)(F)F)cc2)CC1 ZINC001212686655 1050181470 /nfs/dbraw/zinc/18/14/70/1050181470.db2.gz DBJFDYJZLMGBEM-UHFFFAOYSA-N 2 1 335.373 4.075 20 0 EIADMP CC(C)[N@@H+]([C@H](C)Cc1c(F)cccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172847547 1050186112 /nfs/dbraw/zinc/18/61/12/1050186112.db2.gz KMFGNHOLLXTQPW-RBSFLKMASA-N 2 1 326.887 4.390 20 0 EIADMP COc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1OC ZINC000090586764 1050187082 /nfs/dbraw/zinc/18/70/82/1050187082.db2.gz JFAXXFWUQAMPBR-ZWKOTPCHSA-N 2 1 348.531 4.031 20 0 EIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H](C)Cc2c(F)cccc2Cl)[C@@H](C)C1 ZINC001172849532 1050188639 /nfs/dbraw/zinc/18/86/39/1050188639.db2.gz NPSIXVIBKSUVMT-PMUMKWKESA-N 2 1 326.887 4.119 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2c(F)cc(C)cc2F)c1 ZINC001177315111 1050190707 /nfs/dbraw/zinc/19/07/07/1050190707.db2.gz KACKMJSGKPHJQH-UHFFFAOYSA-N 2 1 332.438 4.405 20 0 EIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC001206303580 1050209394 /nfs/dbraw/zinc/20/93/94/1050209394.db2.gz CYKPHKCOEPBEQW-OAHLLOKOSA-N 2 1 334.813 4.310 20 0 EIADMP Cc1ccc(Oc2cccc(C[N@H+]3CC[C@H]([NH3+])[C@@H](F)CC3)c2)cc1 ZINC001206185390 1050266947 /nfs/dbraw/zinc/26/69/47/1050266947.db2.gz NEXSHDPBOBHIMX-PMACEKPBSA-N 2 1 328.431 4.049 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000252646030 1050282474 /nfs/dbraw/zinc/28/24/74/1050282474.db2.gz DFZLZGZUGJBJQP-MDZRGWNJSA-N 2 1 338.923 4.128 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000252646030 1050282508 /nfs/dbraw/zinc/28/25/08/1050282508.db2.gz DFZLZGZUGJBJQP-MDZRGWNJSA-N 2 1 338.923 4.128 20 0 EIADMP CCCOC1CCC([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001173090718 1050283322 /nfs/dbraw/zinc/28/33/22/1050283322.db2.gz GZGHHQSONSPDET-HWELCPFYSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccc(F)c1 ZINC001177712023 1050286601 /nfs/dbraw/zinc/28/66/01/1050286601.db2.gz CIYUNTRLFKWOJF-QGZVFWFLSA-N 2 1 326.459 4.183 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@H](c3cccc(OC)c3)C2)CC1 ZINC001173113104 1050310578 /nfs/dbraw/zinc/31/05/78/1050310578.db2.gz HEZOERYGOTWEBE-HDYDNRTBSA-N 2 1 330.516 4.138 20 0 EIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001173210551 1050369795 /nfs/dbraw/zinc/36/97/95/1050369795.db2.gz MWZFGTFYRQVIFF-YUXAGFNASA-N 2 1 334.507 4.091 20 0 EIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH+]1C[C@H]2C[N@@H+](C)C[C@H]2C1 ZINC001173210551 1050369802 /nfs/dbraw/zinc/36/98/02/1050369802.db2.gz MWZFGTFYRQVIFF-YUXAGFNASA-N 2 1 334.507 4.091 20 0 EIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH+]1C[C@H]2C[N@H+](C)C[C@H]2C1 ZINC001173210551 1050369813 /nfs/dbraw/zinc/36/98/13/1050369813.db2.gz MWZFGTFYRQVIFF-YUXAGFNASA-N 2 1 334.507 4.091 20 0 EIADMP CC(C)CSCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001178205140 1050403666 /nfs/dbraw/zinc/40/36/66/1050403666.db2.gz NZIRVVUYNYFZLY-QUCCMNQESA-N 2 1 334.573 4.408 20 0 EIADMP CC(C)CSCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001178205140 1050403676 /nfs/dbraw/zinc/40/36/76/1050403676.db2.gz NZIRVVUYNYFZLY-QUCCMNQESA-N 2 1 334.573 4.408 20 0 EIADMP COc1ccc2cc(C[NH2+]C[C@H]3CCC[N@@H+](CC(C)C)C3)ccc2c1 ZINC001178249566 1050409597 /nfs/dbraw/zinc/40/95/97/1050409597.db2.gz QWDKCJWMNUFDDF-LJQANCHMSA-N 2 1 340.511 4.306 20 0 EIADMP CC[N@H+]1CC[C@@H](n2c(C)c(CC[NH3+])c3c2cc(Cl)cc3Cl)C1 ZINC001173354835 1050441005 /nfs/dbraw/zinc/44/10/05/1050441005.db2.gz JVEQMMGNFJCULS-CYBMUJFWSA-N 2 1 340.298 4.024 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000253355503 1050455288 /nfs/dbraw/zinc/45/52/88/1050455288.db2.gz HNOFEUCVUDALQA-KNQAVFIVSA-N 2 1 335.495 4.045 20 0 EIADMP CC(C)(C)C[N@@H+](C1Cc2cc(F)c(F)cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173476090 1050458773 /nfs/dbraw/zinc/45/87/73/1050458773.db2.gz OPWNMHLPYKRWTG-WKILWMFISA-N 2 1 336.470 4.050 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC001173545633 1050477629 /nfs/dbraw/zinc/47/76/29/1050477629.db2.gz CBXSTIYOYDDEPT-PBFPGSCMSA-N 2 1 329.315 4.244 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1CC[N@@H+](C)C[C@H]1C ZINC001173545633 1050477631 /nfs/dbraw/zinc/47/76/31/1050477631.db2.gz CBXSTIYOYDDEPT-PBFPGSCMSA-N 2 1 329.315 4.244 20 0 EIADMP [NH3+][C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC[C@@H]1F ZINC001206212291 1050542619 /nfs/dbraw/zinc/54/26/19/1050542619.db2.gz RKNYPRGXPPFSPW-RBUKOAKNSA-N 2 1 332.850 4.268 20 0 EIADMP [NH3+][C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC[C@@H]1F ZINC001206212291 1050542628 /nfs/dbraw/zinc/54/26/28/1050542628.db2.gz RKNYPRGXPPFSPW-RBUKOAKNSA-N 2 1 332.850 4.268 20 0 EIADMP CCc1cccc(Cl)c1C[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC001179015565 1050610391 /nfs/dbraw/zinc/61/03/91/1050610391.db2.gz FSMAOHSNCZNOEX-QUCCMNQESA-N 2 1 342.914 4.337 20 0 EIADMP CCc1cccc(Cl)c1C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001179015565 1050610394 /nfs/dbraw/zinc/61/03/94/1050610394.db2.gz FSMAOHSNCZNOEX-QUCCMNQESA-N 2 1 342.914 4.337 20 0 EIADMP C[N@@H+]1C[C@@H](C[NH2+]Cc2ccc(Cl)cc2Cl)[C@H](c2ccccc2)C1 ZINC001179015646 1050611093 /nfs/dbraw/zinc/61/10/93/1050611093.db2.gz HVXBVEKKJOOWLH-AEFFLSMTSA-N 2 1 349.305 4.428 20 0 EIADMP C[N@H+]1C[C@@H](C[NH2+]Cc2ccc(Cl)cc2Cl)[C@H](c2ccccc2)C1 ZINC001179015646 1050611103 /nfs/dbraw/zinc/61/11/03/1050611103.db2.gz HVXBVEKKJOOWLH-AEFFLSMTSA-N 2 1 349.305 4.428 20 0 EIADMP Nc1ccc2[nH+]c(-c3ccc(F)cc3)cc(Nc3cc[nH+]cc3)c2c1 ZINC001173885396 1050638058 /nfs/dbraw/zinc/63/80/58/1050638058.db2.gz XZLLNURWSSMOIH-UHFFFAOYSA-N 2 1 330.366 4.184 20 0 EIADMP COc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1C ZINC001179205097 1050649634 /nfs/dbraw/zinc/64/96/34/1050649634.db2.gz JHIUIRRSTJJVLO-UWJYYQICSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1C ZINC001179205097 1050649638 /nfs/dbraw/zinc/64/96/38/1050649638.db2.gz JHIUIRRSTJJVLO-UWJYYQICSA-N 2 1 338.495 4.146 20 0 EIADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c2ccccc12 ZINC001179257489 1050663073 /nfs/dbraw/zinc/66/30/73/1050663073.db2.gz BJKKZJABILUQAG-GOSISDBHSA-N 2 1 338.495 4.060 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc3ccnc(Cl)c3s2)C[C@@H]1C ZINC001179899196 1050806890 /nfs/dbraw/zinc/80/68/90/1050806890.db2.gz ZIUJLKSTQUOODP-JSGCOSHPSA-N 2 1 337.920 4.254 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3ccnc(Cl)c3s2)C[C@@H]1C ZINC001179899196 1050806893 /nfs/dbraw/zinc/80/68/93/1050806893.db2.gz ZIUJLKSTQUOODP-JSGCOSHPSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc3ccnc(Cl)c3s2)C[C@@H]1C ZINC001179899196 1050806899 /nfs/dbraw/zinc/80/68/99/1050806899.db2.gz ZIUJLKSTQUOODP-JSGCOSHPSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc3ccnc(Cl)c3s2)C[C@@H]1C ZINC001179899196 1050806902 /nfs/dbraw/zinc/80/69/02/1050806902.db2.gz ZIUJLKSTQUOODP-JSGCOSHPSA-N 2 1 337.920 4.254 20 0 EIADMP C[C@]1(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CCCS1 ZINC001179918975 1050833192 /nfs/dbraw/zinc/83/31/92/1050833192.db2.gz GEQHTJJWHJCDFZ-NJDAHSKKSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@]1(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)CCCS1 ZINC001179918975 1050833194 /nfs/dbraw/zinc/83/31/94/1050833194.db2.gz GEQHTJJWHJCDFZ-NJDAHSKKSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@]1(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CCCS1 ZINC001179918975 1050833199 /nfs/dbraw/zinc/83/31/99/1050833199.db2.gz GEQHTJJWHJCDFZ-NJDAHSKKSA-N 2 1 344.568 4.259 20 0 EIADMP CCOc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1F ZINC000152749999 1050842202 /nfs/dbraw/zinc/84/22/02/1050842202.db2.gz YJGCEYIXKSHTER-UHFFFAOYSA-N 2 1 334.479 4.111 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccn2C2CC2)CC1 ZINC001180051819 1050868812 /nfs/dbraw/zinc/86/88/12/1050868812.db2.gz LYGZLVALQSLRKZ-UHFFFAOYSA-N 2 1 337.511 4.167 20 0 EIADMP Cc1cc(NC2CC[NH+](C(C)(C)C)CC2)c[nH+]c1N1CCCC[C@@H]1C ZINC001180300980 1050945428 /nfs/dbraw/zinc/94/54/28/1050945428.db2.gz HGDPIRZSAZJKRT-KRWDZBQOSA-N 2 1 344.547 4.444 20 0 EIADMP FC(F)(F)Sc1cccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1 ZINC000781330494 1050967335 /nfs/dbraw/zinc/96/73/35/1050967335.db2.gz AQRDBEULIOFDJF-HNNXBMFYSA-N 2 1 344.446 4.216 20 0 EIADMP FC(F)(F)Sc1cccc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1 ZINC000781330494 1050967348 /nfs/dbraw/zinc/96/73/48/1050967348.db2.gz AQRDBEULIOFDJF-HNNXBMFYSA-N 2 1 344.446 4.216 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000763604580 1050977403 /nfs/dbraw/zinc/97/74/03/1050977403.db2.gz HOBWEORFGXOLRF-CQSZACIVSA-N 2 1 332.435 4.215 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000763604580 1050977416 /nfs/dbraw/zinc/97/74/16/1050977416.db2.gz HOBWEORFGXOLRF-CQSZACIVSA-N 2 1 332.435 4.215 20 0 EIADMP COc1ccc(SCC[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001180795290 1051080295 /nfs/dbraw/zinc/08/02/95/1051080295.db2.gz UOTZOKJBQUHDPF-IRXDYDNUSA-N 2 1 348.556 4.030 20 0 EIADMP C[C@@H](CCC1CCCCC1)[NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC001180802464 1051088705 /nfs/dbraw/zinc/08/87/05/1051088705.db2.gz QWLFDKWMGRIRJH-AVRDEDQJSA-N 2 1 344.543 4.092 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCCc2cc(SC(F)F)ccc21 ZINC000775379229 1051172513 /nfs/dbraw/zinc/17/25/13/1051172513.db2.gz CCRMBJRYQLRXHN-MRXNPFEDSA-N 2 1 337.439 4.173 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cnccc2C(C)(C)C)C[C@H]1c1ccccc1 ZINC000414224362 1051180123 /nfs/dbraw/zinc/18/01/23/1051180123.db2.gz HQAQWGWHPLIZSP-CTNGQTDRSA-N 2 1 337.511 4.304 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2cnccc2C(C)(C)C)C[C@H]1c1ccccc1 ZINC000414224362 1051180125 /nfs/dbraw/zinc/18/01/25/1051180125.db2.gz HQAQWGWHPLIZSP-CTNGQTDRSA-N 2 1 337.511 4.304 20 0 EIADMP COc1ccccc1CCC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190826520 1051286915 /nfs/dbraw/zinc/28/69/15/1051286915.db2.gz HRIVAMYJLKUNSL-FQEVSTJZSA-N 2 1 344.543 4.216 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000163229620 1051290249 /nfs/dbraw/zinc/29/02/49/1051290249.db2.gz NUFZEZZDBLTINP-DOTOQJQBSA-N 2 1 341.524 4.119 20 0 EIADMP COCC[NH+]1CCC([NH2+][C@H](C)c2cccc(-c3ccccc3)c2)CC1 ZINC000154817544 1051339523 /nfs/dbraw/zinc/33/95/23/1051339523.db2.gz IMNGZPNFTAMNHF-GOSISDBHSA-N 2 1 338.495 4.115 20 0 EIADMP C([C@H]1CCC2(CCCCCC2)O1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001191098494 1051349858 /nfs/dbraw/zinc/34/98/58/1051349858.db2.gz CWLBBRDOYPZTJC-WOJBJXKFSA-N 2 1 334.548 4.209 20 0 EIADMP C([C@@H]1CCC2(CCCCCC2)O1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001191098492 1051351059 /nfs/dbraw/zinc/35/10/59/1051351059.db2.gz CWLBBRDOYPZTJC-UXHICEINSA-N 2 1 334.548 4.209 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3OC)cc2)C1 ZINC000163239995 1051357761 /nfs/dbraw/zinc/35/77/61/1051357761.db2.gz FWKAEEXJTUXSQM-ZWKOTPCHSA-N 2 1 338.495 4.355 20 0 EIADMP CO[C@H](CC(C)C)C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191358531 1051429828 /nfs/dbraw/zinc/42/98/28/1051429828.db2.gz MMZBVIWRHYQDJR-FGZHOGPDSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@H](CC(C)C)C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001191358531 1051429832 /nfs/dbraw/zinc/42/98/32/1051429832.db2.gz MMZBVIWRHYQDJR-FGZHOGPDSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@H](CC(C)C)C[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001191358531 1051429839 /nfs/dbraw/zinc/42/98/39/1051429839.db2.gz MMZBVIWRHYQDJR-FGZHOGPDSA-N 2 1 344.543 4.036 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCc2c(Cl)cccc2Cl)C[C@H]1C ZINC001191417636 1051451722 /nfs/dbraw/zinc/45/17/22/1051451722.db2.gz PZSKEHNRLJOPMB-KGLIPLIRSA-N 2 1 329.315 4.341 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCc2c(Cl)cccc2Cl)C[C@H]1C ZINC001191417636 1051451735 /nfs/dbraw/zinc/45/17/35/1051451735.db2.gz PZSKEHNRLJOPMB-KGLIPLIRSA-N 2 1 329.315 4.341 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCc2c(Cl)cccc2Cl)C[C@H]1C ZINC001191417636 1051451741 /nfs/dbraw/zinc/45/17/41/1051451741.db2.gz PZSKEHNRLJOPMB-KGLIPLIRSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2cc[nH]c2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311009198 1051453197 /nfs/dbraw/zinc/45/31/97/1051453197.db2.gz WXUZODRPQNQOLU-UWJYYQICSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cc2cc(Br)ccc2o1 ZINC000271902766 1051556670 /nfs/dbraw/zinc/55/66/70/1051556670.db2.gz VXQQSJNMBHSFGL-LBPRGKRZSA-N 2 1 349.272 4.108 20 0 EIADMP C[C@@H]([NH2+]C[C@@H](C)c1cccc(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000775490363 1051576734 /nfs/dbraw/zinc/57/67/34/1051576734.db2.gz WQDSGNOVRIZTMU-DBXWQHBBSA-N 2 1 340.486 4.429 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCOCc2ccccc2)cc1 ZINC000156950040 1051583996 /nfs/dbraw/zinc/58/39/96/1051583996.db2.gz JPZRGPCUNDWKHJ-KRWDZBQOSA-N 2 1 335.451 4.048 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000157003012 1051585683 /nfs/dbraw/zinc/58/56/83/1051585683.db2.gz RGKIAVNNJYRZDK-CVEARBPZSA-N 2 1 329.488 4.356 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157138608 1051600972 /nfs/dbraw/zinc/60/09/72/1051600972.db2.gz UKONXNOPNFOVJY-WBVHZDCISA-N 2 1 338.442 4.299 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157138608 1051600978 /nfs/dbraw/zinc/60/09/78/1051600978.db2.gz UKONXNOPNFOVJY-WBVHZDCISA-N 2 1 338.442 4.299 20 0 EIADMP CCOc1c(Cl)cc(C[N@H+]2CCC[C@@](F)(C[NH3+])CC2)cc1Cl ZINC001205581399 1051642046 /nfs/dbraw/zinc/64/20/46/1051642046.db2.gz TTZJGVQSVACNGS-INIZCTEOSA-N 2 1 349.277 4.045 20 0 EIADMP CC(C)C[N@@H+](CC[C@H]1CCc2ccccc21)CC1CC[NH+](C)CC1 ZINC001175601021 1051664326 /nfs/dbraw/zinc/66/43/26/1051664326.db2.gz FIHXBNXUPWHRFX-OAQYLSRUSA-N 2 1 328.544 4.406 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc2c(c1)OCCCO2 ZINC000157896464 1051682265 /nfs/dbraw/zinc/68/22/65/1051682265.db2.gz LBPMRJVUTZSQRU-MSOLQXFVSA-N 2 1 346.515 4.153 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000158103080 1051709023 /nfs/dbraw/zinc/70/90/23/1051709023.db2.gz BFFSAQLGOJJYKT-KGLIPLIRSA-N 2 1 328.472 4.036 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000158109973 1051711654 /nfs/dbraw/zinc/71/16/54/1051711654.db2.gz STNZCQWGZNPLOD-HUUCEWRRSA-N 2 1 348.437 4.434 20 0 EIADMP COc1ccccc1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000158142657 1051720196 /nfs/dbraw/zinc/72/01/96/1051720196.db2.gz BJFQOAQJUJBIEY-QZTJIDSGSA-N 2 1 338.495 4.355 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158218765 1051728711 /nfs/dbraw/zinc/72/87/11/1051728711.db2.gz GATLDIWAESYHMD-GDBMZVCRSA-N 2 1 329.513 4.111 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000158218765 1051728718 /nfs/dbraw/zinc/72/87/18/1051728718.db2.gz GATLDIWAESYHMD-GDBMZVCRSA-N 2 1 329.513 4.111 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC001182959833 1051749171 /nfs/dbraw/zinc/74/91/71/1051749171.db2.gz MPYVZNGBQLKLHG-ONTIZHBOSA-N 2 1 326.528 4.493 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC001182959833 1051749182 /nfs/dbraw/zinc/74/91/82/1051749182.db2.gz MPYVZNGBQLKLHG-ONTIZHBOSA-N 2 1 326.528 4.493 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2nc3ccccc3o2)CC1 ZINC000159065726 1051808388 /nfs/dbraw/zinc/80/83/88/1051808388.db2.gz VAYCIFIEJJBYJC-QGZVFWFLSA-N 2 1 341.499 4.304 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1cccc(OC(F)(F)F)c1 ZINC000775549662 1051815625 /nfs/dbraw/zinc/81/56/25/1051815625.db2.gz ZGZFYQFQQKMWJZ-DZGCQCFKSA-N 2 1 330.394 4.110 20 0 EIADMP CCc1ccccc1C[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175973094 1051854839 /nfs/dbraw/zinc/85/48/39/1051854839.db2.gz JIFMIXAXIGXXBL-PKTZIBPZSA-N 2 1 334.507 4.203 20 0 EIADMP CCc1ccccc1C[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175973094 1051854845 /nfs/dbraw/zinc/85/48/45/1051854845.db2.gz JIFMIXAXIGXXBL-PKTZIBPZSA-N 2 1 334.507 4.203 20 0 EIADMP CCc1ccccc1C[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175973094 1051854850 /nfs/dbraw/zinc/85/48/50/1051854850.db2.gz JIFMIXAXIGXXBL-PKTZIBPZSA-N 2 1 334.507 4.203 20 0 EIADMP C[C@@H]1CC[N@@H+](Cc2c(Cl)cccc2C(F)(F)F)CC[C@@H]1C[NH3+] ZINC001205628565 1051913984 /nfs/dbraw/zinc/91/39/84/1051913984.db2.gz VZXUTCYMPLUGOM-VXGBXAGGSA-N 2 1 334.813 4.166 20 0 EIADMP CC[C@H]([NH2+]CCC[NH+](CC)CC)c1cc(F)cc(Br)c1 ZINC001193535314 1051936159 /nfs/dbraw/zinc/93/61/59/1051936159.db2.gz CJPYVFXYXUKVAA-INIZCTEOSA-N 2 1 345.300 4.361 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)c3c2cccc3Br)CC1 ZINC000159305861 1051973630 /nfs/dbraw/zinc/97/36/30/1051973630.db2.gz YBNNYZJMNOIRLO-MLGOLLRUSA-N 2 1 337.305 4.071 20 0 EIADMP C[NH+](C)[C@@H]1CC[C@@H]2C[N@@H+](Cc3cc(F)cc(C(F)(F)F)c3)C[C@@H]2C1 ZINC001184303257 1051982004 /nfs/dbraw/zinc/98/20/04/1051982004.db2.gz NZSBTSAGSRRTRN-JKIFEVAISA-N 2 1 344.396 4.007 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)C(c1ccccc1)c1ccccc1 ZINC000165634812 1052071859 /nfs/dbraw/zinc/07/18/59/1052071859.db2.gz FOYMCYOKJRWRAZ-GOSISDBHSA-N 2 1 333.479 4.392 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CCc3cccc(F)c3)C2)s1 ZINC001194152588 1052090341 /nfs/dbraw/zinc/09/03/41/1052090341.db2.gz DUHOQJFECXYZTM-SFHVURJKSA-N 2 1 346.515 4.192 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CCc3cccc(F)c3)C2)s1 ZINC001194152588 1052090352 /nfs/dbraw/zinc/09/03/52/1052090352.db2.gz DUHOQJFECXYZTM-SFHVURJKSA-N 2 1 346.515 4.192 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CCc3cccc(F)c3)C2)s1 ZINC001194152588 1052090362 /nfs/dbraw/zinc/09/03/62/1052090362.db2.gz DUHOQJFECXYZTM-SFHVURJKSA-N 2 1 346.515 4.192 20 0 EIADMP COc1cccc(C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)c2ccccc2)c1 ZINC000166339680 1052090951 /nfs/dbraw/zinc/09/09/51/1052090951.db2.gz RDWWKJWOKFOJKX-ZNLUXHQJSA-N 2 1 338.495 4.051 20 0 EIADMP COc1cccc(C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)c2ccccc2)c1 ZINC000166339680 1052090955 /nfs/dbraw/zinc/09/09/55/1052090955.db2.gz RDWWKJWOKFOJKX-ZNLUXHQJSA-N 2 1 338.495 4.051 20 0 EIADMP CCC[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426548 1052146107 /nfs/dbraw/zinc/14/61/07/1052146107.db2.gz LBWINWMPIAIAMK-WOJBJXKFSA-N 2 1 332.532 4.082 20 0 EIADMP CCC[C@@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426548 1052146114 /nfs/dbraw/zinc/14/61/14/1052146114.db2.gz LBWINWMPIAIAMK-WOJBJXKFSA-N 2 1 332.532 4.082 20 0 EIADMP C[N@@H+]1C[C@]23C[NH+](Cc4cccc(OC(C)(C)C)c4)C[C@@]2(C1)CCCC3 ZINC001177007646 1052215610 /nfs/dbraw/zinc/21/56/10/1052215610.db2.gz BVQANGLTQXLYEO-SZPZYZBQSA-N 2 1 342.527 4.172 20 0 EIADMP C[N@H+]1C[C@]23C[NH+](Cc4cccc(OC(C)(C)C)c4)C[C@@]2(C1)CCCC3 ZINC001177007646 1052215620 /nfs/dbraw/zinc/21/56/20/1052215620.db2.gz BVQANGLTQXLYEO-SZPZYZBQSA-N 2 1 342.527 4.172 20 0 EIADMP C[NH+]1C[C@]23C[N@H+](Cc4cccc(OC(C)(C)C)c4)C[C@@]2(C1)CCCC3 ZINC001177007646 1052215630 /nfs/dbraw/zinc/21/56/30/1052215630.db2.gz BVQANGLTQXLYEO-SZPZYZBQSA-N 2 1 342.527 4.172 20 0 EIADMP C[NH+]1C[C@]23C[N@@H+](Cc4cccc(OC(C)(C)C)c4)C[C@@]2(C1)CCCC3 ZINC001177007646 1052215641 /nfs/dbraw/zinc/21/56/41/1052215641.db2.gz BVQANGLTQXLYEO-SZPZYZBQSA-N 2 1 342.527 4.172 20 0 EIADMP c1cc2c(s1)CCC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000336707878 1052513133 /nfs/dbraw/zinc/51/31/33/1052513133.db2.gz JFXYQAFAHHBICT-HKUYNNGSSA-N 2 1 326.509 4.237 20 0 EIADMP Cc1ccc2cc(C[NH2+]C[C@H]3CC[N@@H+](Cc4ccccc4)C3)ccc2n1 ZINC000336810984 1052520693 /nfs/dbraw/zinc/52/06/93/1052520693.db2.gz KLCUPSCENCKCKM-OAQYLSRUSA-N 2 1 345.490 4.155 20 0 EIADMP Clc1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c2ncccc12 ZINC000173880150 1052554349 /nfs/dbraw/zinc/55/43/49/1052554349.db2.gz PHSUOUUDEJIJOZ-MRXNPFEDSA-N 2 1 343.902 4.196 20 0 EIADMP Clc1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c2ncccc12 ZINC000173880150 1052554356 /nfs/dbraw/zinc/55/43/56/1052554356.db2.gz PHSUOUUDEJIJOZ-MRXNPFEDSA-N 2 1 343.902 4.196 20 0 EIADMP Cc1cccc2c(CC[NH2+]C3CC[NH+](Cc4ccccc4)CC3)c[nH]c21 ZINC000174447502 1052567226 /nfs/dbraw/zinc/56/72/26/1052567226.db2.gz NXIHJOKODLIEKA-UHFFFAOYSA-N 2 1 347.506 4.273 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+]Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000623086198 1052586824 /nfs/dbraw/zinc/58/68/24/1052586824.db2.gz BJNCUMMQLSXEAO-UHFFFAOYSA-N 2 1 349.356 4.031 20 0 EIADMP C[N@H+]1CC[C@@H](N[C@@H](c2cccs2)c2ccc(F)cc2)CC1(C)C ZINC000623342027 1052626135 /nfs/dbraw/zinc/62/61/35/1052626135.db2.gz BHEAZOVKVWBUBN-SJLPKXTDSA-N 2 1 332.488 4.439 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349596 1052630272 /nfs/dbraw/zinc/63/02/72/1052630272.db2.gz GFVBJKDFFPRKOM-DOTOQJQBSA-N 2 1 334.504 4.006 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349596 1052630273 /nfs/dbraw/zinc/63/02/73/1052630273.db2.gz GFVBJKDFFPRKOM-DOTOQJQBSA-N 2 1 334.504 4.006 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCOc2ccccc2-c2ccccc2)CC1(C)C ZINC000623378450 1052641862 /nfs/dbraw/zinc/64/18/62/1052641862.db2.gz BERVJTMGFAHYNE-LJQANCHMSA-N 2 1 338.495 4.195 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC3c4ccccc4C2c2ccccc23)CC[N@H+]1C ZINC000177839483 1052692020 /nfs/dbraw/zinc/69/20/20/1052692020.db2.gz HKSRUBZRQXHUFG-IDRARTPTSA-N 2 1 346.518 4.356 20 0 EIADMP CC[C@H](C)Oc1cc(C[NH2+]CCC[NH+]2CCC(C)CC2)ccc1OC ZINC000624018930 1052853654 /nfs/dbraw/zinc/85/36/54/1052853654.db2.gz AXOIBAKTBPBPRM-SFHVURJKSA-N 2 1 348.531 4.084 20 0 EIADMP COc1ccc([C@@H]([NH2+]C[C@@H]2CCCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000624121675 1052867548 /nfs/dbraw/zinc/86/75/48/1052867548.db2.gz AUPOUYYBTFCHBJ-AVRDEDQJSA-N 2 1 338.495 4.106 20 0 EIADMP COc1ccc([C@@H]([NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000624121675 1052867552 /nfs/dbraw/zinc/86/75/52/1052867552.db2.gz AUPOUYYBTFCHBJ-AVRDEDQJSA-N 2 1 338.495 4.106 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000624123494 1052868436 /nfs/dbraw/zinc/86/84/36/1052868436.db2.gz NFEYHAZOUFTXRR-ZWKOTPCHSA-N 2 1 339.483 4.256 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000624123494 1052868438 /nfs/dbraw/zinc/86/84/38/1052868438.db2.gz NFEYHAZOUFTXRR-ZWKOTPCHSA-N 2 1 339.483 4.256 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]C[C@H](C)Cn3cc[nH+]c3C)oc21 ZINC000181693083 1052892669 /nfs/dbraw/zinc/89/26/69/1052892669.db2.gz UHRAIYOBJFDPCZ-GJZGRUSLSA-N 2 1 341.455 4.323 20 0 EIADMP Cc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)s1 ZINC000381862472 1053105690 /nfs/dbraw/zinc/10/56/90/1053105690.db2.gz JAUMRKJKSPTQCJ-LPHOPBHVSA-N 2 1 328.525 4.365 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(Cl)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382069721 1053135525 /nfs/dbraw/zinc/13/55/25/1053135525.db2.gz RWYAIVIHTITHSO-QFBILLFUSA-N 2 1 328.887 4.340 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000850432238 1053204593 /nfs/dbraw/zinc/20/45/93/1053204593.db2.gz VGLIMPMFCIXDMP-KRWDZBQOSA-N 2 1 338.495 4.314 20 0 EIADMP C[C@@H]([NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000850466524 1053245842 /nfs/dbraw/zinc/24/58/42/1053245842.db2.gz LIFWFJAOLZKADK-VGSWGCGISA-N 2 1 349.478 4.391 20 0 EIADMP C[C@@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000850466524 1053245857 /nfs/dbraw/zinc/24/58/57/1053245857.db2.gz LIFWFJAOLZKADK-VGSWGCGISA-N 2 1 349.478 4.391 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](O)c3ccccc32)cc1 ZINC000850527323 1053290494 /nfs/dbraw/zinc/29/04/94/1053290494.db2.gz FUUYWZGMFVQOHX-LVXYXVKQSA-N 2 1 333.435 4.010 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000339070111 1053319507 /nfs/dbraw/zinc/31/95/07/1053319507.db2.gz WPWCKUPRTRSTIP-CUXKYVRBSA-N 2 1 344.543 4.112 20 0 EIADMP Cc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000383428563 1053339522 /nfs/dbraw/zinc/33/95/22/1053339522.db2.gz BIUMWIXIEPRFTR-PXNSSMCTSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCc3cc(C)ccc32)cc1F ZINC000765322256 1053507744 /nfs/dbraw/zinc/50/77/44/1053507744.db2.gz DYNKHQSAALWYDF-FQEVSTJZSA-N 2 1 335.426 4.405 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2COc3ccccc3C2)cc1 ZINC000765333874 1053507831 /nfs/dbraw/zinc/50/78/31/1053507831.db2.gz MIIZSKQGEJQHOQ-SJLPKXTDSA-N 2 1 347.462 4.083 20 0 EIADMP CSCC1CCC([NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000385424948 1053523443 /nfs/dbraw/zinc/52/34/43/1053523443.db2.gz LCMVAGVBCYGMHR-MAKTXDPSSA-N 2 1 346.584 4.408 20 0 EIADMP FC(F)Sc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC000853093537 1053643333 /nfs/dbraw/zinc/64/33/33/1053643333.db2.gz MLOHDKVIAFFBGR-MRXNPFEDSA-N 2 1 340.483 4.213 20 0 EIADMP Fc1cccc2c1SCC[C@H]2[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000853239140 1053654919 /nfs/dbraw/zinc/65/49/19/1053654919.db2.gz ATHQDANHRUPJMJ-MAUKXSAKSA-N 2 1 334.504 4.074 20 0 EIADMP Fc1cccc2c1SCC[C@H]2[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000853239140 1053654927 /nfs/dbraw/zinc/65/49/27/1053654927.db2.gz ATHQDANHRUPJMJ-MAUKXSAKSA-N 2 1 334.504 4.074 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866241120 1053661226 /nfs/dbraw/zinc/66/12/26/1053661226.db2.gz WPVWLVDNSSWZHI-IFMALSPDSA-N 2 1 337.511 4.077 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866241120 1053661235 /nfs/dbraw/zinc/66/12/35/1053661235.db2.gz WPVWLVDNSSWZHI-IFMALSPDSA-N 2 1 337.511 4.077 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866372469 1053708828 /nfs/dbraw/zinc/70/88/28/1053708828.db2.gz GXFDBBBDCSNYRZ-RBBKRZOGSA-N 2 1 337.511 4.077 20 0 EIADMP CCOc1ccccc1[C@@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386432704 1053724262 /nfs/dbraw/zinc/72/42/62/1053724262.db2.gz OOEJLXSFWDMRGI-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP CCOc1ccccc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386432704 1053724275 /nfs/dbraw/zinc/72/42/75/1053724275.db2.gz OOEJLXSFWDMRGI-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CC[C@H]2CCCS2)C3)cc1 ZINC000866482265 1053746946 /nfs/dbraw/zinc/74/69/46/1053746946.db2.gz ZJEXLENRIZOXDD-YSTOQKLRSA-N 2 1 330.541 4.057 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386797870 1053829189 /nfs/dbraw/zinc/82/91/89/1053829189.db2.gz MFGQFWZLYGCAFY-DBXWQHBBSA-N 2 1 340.486 4.257 20 0 EIADMP CC(C)C[N@@H+](CCCc1c(F)cccc1F)CC1CC[NH+](C)CC1 ZINC001197193453 1053850132 /nfs/dbraw/zinc/85/01/32/1053850132.db2.gz BEKKMACDUPIBMH-UHFFFAOYSA-N 2 1 338.486 4.197 20 0 EIADMP CC(C)C[N@@H+](CCc1c(F)cccc1Cl)CC1CC[NH+](C)CC1 ZINC001197194860 1053851535 /nfs/dbraw/zinc/85/15/35/1053851535.db2.gz VQGONIZTAOALSZ-UHFFFAOYSA-N 2 1 340.914 4.321 20 0 EIADMP c1cc(C[NH+]2CCCCC2)cc(C[N@H+]2CCCC[C@]23CCCOC3)c1 ZINC001198830685 1054266141 /nfs/dbraw/zinc/26/61/41/1054266141.db2.gz WMUPCVPQPHHTBK-JOCHJYFZSA-N 2 1 342.527 4.208 20 0 EIADMP CC[N@H+]1CCC[C@H]1CNCc1ccc(Sc2ccccc2)cc1 ZINC001198908292 1054308179 /nfs/dbraw/zinc/30/81/79/1054308179.db2.gz OCEQMZDJACVUPT-SFHVURJKSA-N 2 1 326.509 4.412 20 0 EIADMP CC[C@H]([NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)[C@H]1CCCOC1 ZINC000872040804 1054355784 /nfs/dbraw/zinc/35/57/84/1054355784.db2.gz CJAKGHSESZZJMG-QSFXBCCZSA-N 2 1 327.472 4.037 20 0 EIADMP COCC[N@@H+](C)CCC[NH2+]Cc1ccccc1-c1ccc(C)cc1C ZINC001199238471 1054370495 /nfs/dbraw/zinc/37/04/95/1054370495.db2.gz PNQJVBKQOBBYFC-UHFFFAOYSA-N 2 1 340.511 4.028 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CCOC(C)(C)C1 ZINC001199267676 1054376105 /nfs/dbraw/zinc/37/61/05/1054376105.db2.gz QJGWWHLOXFOBHG-PXNSSMCTSA-N 2 1 330.516 4.108 20 0 EIADMP [NH3+][C@H](C[C@H]1CCC[N@@H+](Cc2cnc(C3CC3)s2)C1)C1CCCC1 ZINC000873232529 1054509202 /nfs/dbraw/zinc/50/92/02/1054509202.db2.gz SDZZWXWQRPDLKB-RDTXWAMCSA-N 2 1 333.545 4.140 20 0 EIADMP [NH3+][C@H](C[C@H]1CCC[N@@H+](Cc2scnc2C2CC2)C1)C1CCCC1 ZINC000873232494 1054510253 /nfs/dbraw/zinc/51/02/53/1054510253.db2.gz RPIAAMVDYVWVOG-RHSMWYFYSA-N 2 1 333.545 4.140 20 0 EIADMP CSc1ccc(CN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC001200880369 1054565046 /nfs/dbraw/zinc/56/50/46/1054565046.db2.gz SIMJNHSDFTZRMG-NVXWUHKLSA-N 2 1 330.497 4.144 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1ccc(C(F)(F)F)cc1)Cc1ccccc1 ZINC000061556834 1054762043 /nfs/dbraw/zinc/76/20/43/1054762043.db2.gz ICELJFWHTRUOOZ-UHFFFAOYSA-N 2 1 336.401 4.317 20 0 EIADMP C[NH+](C)Cc1cnc(CN(Cc2cccc(F)c2)C2CCCC2)s1 ZINC000347598809 1054771346 /nfs/dbraw/zinc/77/13/46/1054771346.db2.gz XYPMZEXSSVRXKU-UHFFFAOYSA-N 2 1 347.503 4.289 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](C[C@H]1CC=CCC1)CC2 ZINC001201408955 1054788590 /nfs/dbraw/zinc/78/85/90/1054788590.db2.gz MXIJBXUSFNRJPA-ICSRJNTNSA-N 2 1 328.500 4.312 20 0 EIADMP Cc1noc(C)c1C[N@H+]1CCCC12CC[NH+](C[C@H]1CC=CCC1)CC2 ZINC001201412217 1054790257 /nfs/dbraw/zinc/79/02/57/1054790257.db2.gz VBWYCNHCACOQLZ-IBGZPJMESA-N 2 1 343.515 4.078 20 0 EIADMP c1csc(C[N@@H+]2CCC3(C2)CC[NH+](C[C@H]2CC=CCC2)CC3)c1 ZINC001201410363 1054803283 /nfs/dbraw/zinc/80/32/83/1054803283.db2.gz JPGPYHYPAQMQPE-SFHVURJKSA-N 2 1 330.541 4.392 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2cc(F)ccc2F)C[N@H+]1Cc1ccccc1 ZINC001201492026 1054819174 /nfs/dbraw/zinc/81/91/74/1054819174.db2.gz PANQHTNAIMUPLH-SJLPKXTDSA-N 2 1 344.449 4.355 20 0 EIADMP CCC[C@@H](C)C[N@@H+]1CCc2c(C[NH+](C)Cc3ccco3)cncc2C1 ZINC001201543406 1054835830 /nfs/dbraw/zinc/83/58/30/1054835830.db2.gz GFWXFYIADKYHAS-QGZVFWFLSA-N 2 1 341.499 4.101 20 0 EIADMP CCC[C@@H](C)C[N@H+]1CCc2c(C[NH+](C)Cc3ccco3)cncc2C1 ZINC001201543406 1054835835 /nfs/dbraw/zinc/83/58/35/1054835835.db2.gz GFWXFYIADKYHAS-QGZVFWFLSA-N 2 1 341.499 4.101 20 0 EIADMP CCC[C@@H](C)C[NH+]1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001201543406 1054835838 /nfs/dbraw/zinc/83/58/38/1054835838.db2.gz GFWXFYIADKYHAS-QGZVFWFLSA-N 2 1 341.499 4.101 20 0 EIADMP CCC[C@@H](C)C[NH+]1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001201543406 1054835843 /nfs/dbraw/zinc/83/58/43/1054835843.db2.gz GFWXFYIADKYHAS-QGZVFWFLSA-N 2 1 341.499 4.101 20 0 EIADMP CCC(CC)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201528633 1054845974 /nfs/dbraw/zinc/84/59/74/1054845974.db2.gz VFZSXAINRAPSLZ-CEWLAPEOSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201528633 1054845981 /nfs/dbraw/zinc/84/59/81/1054845981.db2.gz VFZSXAINRAPSLZ-CEWLAPEOSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201528633 1054845984 /nfs/dbraw/zinc/84/59/84/1054845984.db2.gz VFZSXAINRAPSLZ-CEWLAPEOSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201528633 1054845990 /nfs/dbraw/zinc/84/59/90/1054845990.db2.gz VFZSXAINRAPSLZ-CEWLAPEOSA-N 2 1 329.532 4.050 20 0 EIADMP c1ccc(CCC[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1 ZINC001201673812 1054872480 /nfs/dbraw/zinc/87/24/80/1054872480.db2.gz PTMLRQATNISFCL-QHCPKHFHSA-N 2 1 334.507 4.217 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cnn(-c3ccccc3)c2)c1 ZINC000765774531 1054896495 /nfs/dbraw/zinc/89/64/95/1054896495.db2.gz DVXGFPHUSDYIQV-GOSISDBHSA-N 2 1 348.494 4.175 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc3c(ccnc3Cl)o2)CC1 ZINC000876625208 1054939512 /nfs/dbraw/zinc/93/95/12/1054939512.db2.gz RPQDPAFGNGFDJA-UHFFFAOYSA-N 2 1 335.879 4.033 20 0 EIADMP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+](CC[C@H](C)CCC=C(C)C)CC1 ZINC001201981667 1054959738 /nfs/dbraw/zinc/95/97/38/1054959738.db2.gz QLDWCFNTVMZDNC-TZIWHRDSSA-N 2 1 336.564 4.334 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(-c2cccnc2)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001201946722 1054962702 /nfs/dbraw/zinc/96/27/02/1054962702.db2.gz KTXXNFWZQKJBLR-PGRDOPGGSA-N 2 1 349.522 4.491 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2nc(Cl)cs2)cc1 ZINC000876931525 1054985724 /nfs/dbraw/zinc/98/57/24/1054985724.db2.gz OAFYRQODSKTETK-AWEZNQCLSA-N 2 1 349.931 4.461 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2nc(Cl)cs2)cc1 ZINC000876931525 1054985738 /nfs/dbraw/zinc/98/57/38/1054985738.db2.gz OAFYRQODSKTETK-AWEZNQCLSA-N 2 1 349.931 4.461 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2cc3nc(Cl)ccc3s2)CC1 ZINC000877457847 1055054816 /nfs/dbraw/zinc/05/48/16/1055054816.db2.gz DHNOAJKFQBDDCM-UHFFFAOYSA-N 2 1 335.904 4.010 20 0 EIADMP C[C@@]1(C[NH2+]C/C=C\c2ccc(F)cc2)CC[N@@H+](Cc2ccccc2)C1 ZINC001202221008 1055092964 /nfs/dbraw/zinc/09/29/64/1055092964.db2.gz XUTUWIFFHNUYMW-ZQAYIGKJSA-N 2 1 338.470 4.341 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]CC[C@H]3CCSC3)CC[N@@H+]2C2CC2)cc1 ZINC000877661544 1055102253 /nfs/dbraw/zinc/10/22/53/1055102253.db2.gz DTLXRJAVMCMWGO-HQRMLTQVSA-N 2 1 330.541 4.087 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]CC[C@H]3CCSC3)CC[N@H+]2C2CC2)cc1 ZINC000877661544 1055102264 /nfs/dbraw/zinc/10/22/64/1055102264.db2.gz DTLXRJAVMCMWGO-HQRMLTQVSA-N 2 1 330.541 4.087 20 0 EIADMP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC000877733353 1055111364 /nfs/dbraw/zinc/11/13/64/1055111364.db2.gz RYCIXAVCMBNNNL-XAEMIUIASA-N 2 1 344.480 4.096 20 0 EIADMP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1 ZINC000877733353 1055111379 /nfs/dbraw/zinc/11/13/79/1055111379.db2.gz RYCIXAVCMBNNNL-XAEMIUIASA-N 2 1 344.480 4.096 20 0 EIADMP FC(F)(F)CCC[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001202441967 1055177136 /nfs/dbraw/zinc/17/71/36/1055177136.db2.gz IVBYZCRDTPIQIV-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCC[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001202441967 1055177146 /nfs/dbraw/zinc/17/71/46/1055177146.db2.gz IVBYZCRDTPIQIV-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCC[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001202441967 1055177152 /nfs/dbraw/zinc/17/71/52/1055177152.db2.gz IVBYZCRDTPIQIV-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCC[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001202441967 1055177161 /nfs/dbraw/zinc/17/71/61/1055177161.db2.gz IVBYZCRDTPIQIV-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1CC[C@@H](c2ccccc2)O1 ZINC000878511729 1055327716 /nfs/dbraw/zinc/32/77/16/1055327716.db2.gz HHQDEDACAKLCPU-PMACEKPBSA-N 2 1 341.499 4.078 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1CC[C@@H](c2ccccc2)O1 ZINC000878511729 1055327735 /nfs/dbraw/zinc/32/77/35/1055327735.db2.gz HHQDEDACAKLCPU-PMACEKPBSA-N 2 1 341.499 4.078 20 0 EIADMP Cc1cc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)ccc1Oc1cccnc1 ZINC000623656530 1055526882 /nfs/dbraw/zinc/52/68/82/1055526882.db2.gz WFPBPVXGNAXWRB-LJQANCHMSA-N 2 1 339.483 4.004 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)sc1Br ZINC000623657314 1055533095 /nfs/dbraw/zinc/53/30/95/1055533095.db2.gz NKFOECRTFJJQEL-QWHCGFSZSA-N 2 1 345.350 4.202 20 0 EIADMP c1cc(OC2CCCCC2)ccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000166420958 1055570909 /nfs/dbraw/zinc/57/09/09/1055570909.db2.gz BOSRNQNHHAITAX-RTBURBONSA-N 2 1 328.500 4.115 20 0 EIADMP C[NH+](C)CC[C@H]([NH2+][C@H]1Cc2cccc(Cl)c2C1)c1ccccc1 ZINC001168684234 1056719664 /nfs/dbraw/zinc/71/96/64/1056719664.db2.gz HPCXNSUFWIYTPN-PXNSSMCTSA-N 2 1 328.887 4.090 20 0 EIADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](CC(C)(C)C)c2ccccc2)CC1 ZINC000181493888 1059464860 /nfs/dbraw/zinc/46/48/60/1059464860.db2.gz OMIOOJPGTGJECC-NRFANRHFSA-N 2 1 345.575 4.171 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3cccc4cnccc43)C2)CC1 ZINC000183200969 1059948992 /nfs/dbraw/zinc/94/89/92/1059948992.db2.gz SXUHBXQQPITDJF-LJQANCHMSA-N 2 1 337.511 4.179 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000383343406 1060248789 /nfs/dbraw/zinc/24/87/89/1060248789.db2.gz LNEFHQLOZUKONT-HNAYVOBHSA-N 2 1 343.540 4.323 20 0 EIADMP Cc1nc(C)c([C@@H](C)[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000379737956 1060259133 /nfs/dbraw/zinc/25/91/33/1060259133.db2.gz CRMVDNLARQSITM-QRWLVFNGSA-N 2 1 343.540 4.323 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](NCc1cccc(OCC3CCCCC3)c1)C2 ZINC001169108066 1060658913 /nfs/dbraw/zinc/65/89/13/1060658913.db2.gz NVHNJUNBTOJGFD-WKCHPHFGSA-N 2 1 342.527 4.361 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1cccc(OCC3CCCCC3)c1)C2 ZINC001169108066 1060658918 /nfs/dbraw/zinc/65/89/18/1060658918.db2.gz NVHNJUNBTOJGFD-WKCHPHFGSA-N 2 1 342.527 4.361 20 0 EIADMP C[N@H+]1CCCC[C@@H]1c1ccc(N[C@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)nc1 ZINC001169141812 1060663321 /nfs/dbraw/zinc/66/33/21/1060663321.db2.gz KWSLKQMCLDDPLD-WAOWUJCRSA-N 2 1 344.547 4.194 20 0 EIADMP Cc1ccc(Cl)c(O[C@H]2CCC[NH+]([C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4C)C2)c1 ZINC001169142741 1060663552 /nfs/dbraw/zinc/66/35/52/1060663552.db2.gz VEGFRBAJIJUTDW-MHORFTMASA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@H]2CCC[NH+]([C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4C)C2)c1 ZINC001169142741 1060663559 /nfs/dbraw/zinc/66/35/59/1060663559.db2.gz VEGFRBAJIJUTDW-MHORFTMASA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@H]2CCC[N@@H+]([C@@H]3C[C@H]4CC[C@@H](C3)[NH+]4C)C2)c1 ZINC001169142741 1060663566 /nfs/dbraw/zinc/66/35/66/1060663566.db2.gz VEGFRBAJIJUTDW-MHORFTMASA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@H]2CCC[N@H+]([C@@H]3C[C@H]4CC[C@@H](C3)[NH+]4C)C2)c1 ZINC001169142741 1060663575 /nfs/dbraw/zinc/66/35/75/1060663575.db2.gz VEGFRBAJIJUTDW-MHORFTMASA-N 2 1 348.918 4.117 20 0 EIADMP CC[NH+]1CCC([NH+]2CCC(Sc3ccc(Cl)cc3)CC2)CC1 ZINC001169261877 1060709699 /nfs/dbraw/zinc/70/96/99/1060709699.db2.gz PVDAYUJXEHLUKN-UHFFFAOYSA-N 2 1 338.948 4.381 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(c3ccc(C)cc3)CCC(F)(F)CC2)CC1 ZINC001169241904 1060719105 /nfs/dbraw/zinc/71/91/05/1060719105.db2.gz TUDYMEHTZAEUMG-UHFFFAOYSA-N 2 1 336.470 4.474 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cccc(C(C)(C)C)c2)[C@@H](C)C1 ZINC001169555157 1060854792 /nfs/dbraw/zinc/85/47/92/1060854792.db2.gz NQRBEKGDIJDOAC-GHTZIAJQSA-N 2 1 346.559 4.211 20 0 EIADMP Cc1ccccc1CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC001169566939 1060860055 /nfs/dbraw/zinc/86/00/55/1060860055.db2.gz KUAROABLZDJOEM-NZQKXSOJSA-N 2 1 336.523 4.428 20 0 EIADMP Cc1ccccc1CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001169566939 1060860061 /nfs/dbraw/zinc/86/00/61/1060860061.db2.gz KUAROABLZDJOEM-NZQKXSOJSA-N 2 1 336.523 4.428 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)c(C)o1 ZINC000767363246 1061210016 /nfs/dbraw/zinc/21/00/16/1061210016.db2.gz VQCVRTWUJONELZ-MRXNPFEDSA-N 2 1 326.484 4.418 20 0 EIADMP COc1ccc2c(cc[nH+]c2N2CCCC[C@H]2CC[NH+]2CCCC2)c1 ZINC001165046489 721967502 /nfs/dbraw/zinc/96/75/02/721967502.db2.gz GCAJBYJQSGQCPJ-SFHVURJKSA-N 2 1 339.483 4.088 20 0 EIADMP Cc1cc(C)[nH+]c(N2CCC[C@@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)c1 ZINC001164992862 722191776 /nfs/dbraw/zinc/19/17/76/722191776.db2.gz BJKCNIULDPLDHI-OAQYLSRUSA-N 2 1 339.458 4.082 20 0 EIADMP Cc1cc(C)[nH+]c(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c1 ZINC001164992862 722191780 /nfs/dbraw/zinc/19/17/80/722191780.db2.gz BJKCNIULDPLDHI-OAQYLSRUSA-N 2 1 339.458 4.082 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)sc1Br ZINC000453393798 1031959069 /nfs/dbraw/zinc/95/90/69/1031959069.db2.gz GKTRQBAVQALMPH-GFCCVEGCSA-N 2 1 345.350 4.344 20 0 EIADMP COc1ccc(CCC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000532212279 1032095671 /nfs/dbraw/zinc/09/56/71/1032095671.db2.gz BDQHEHUOVCUITA-QGZVFWFLSA-N 2 1 349.478 4.473 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@H]3C)s2)cc1 ZINC000532249382 1032111560 /nfs/dbraw/zinc/11/15/60/1032111560.db2.gz WYXNNSZKMKCTEY-SPYBWZPUSA-N 2 1 344.524 4.242 20 0 EIADMP CC(C)Oc1ccc2[nH+]ccc(N3CCC[C@@H](c4[nH]cc[nH+]4)C3)c2c1 ZINC000450307961 1032409599 /nfs/dbraw/zinc/40/95/99/1032409599.db2.gz IRWCKHXGJBLZHP-OAHLLOKOSA-N 2 1 336.439 4.129 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000532967756 1032417611 /nfs/dbraw/zinc/41/76/11/1032417611.db2.gz UKONXNOPNFOVJY-DOTOQJQBSA-N 2 1 338.442 4.299 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000532967756 1032417615 /nfs/dbraw/zinc/41/76/15/1032417615.db2.gz UKONXNOPNFOVJY-DOTOQJQBSA-N 2 1 338.442 4.299 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)C1CC(F)(F)C1 ZINC000529543535 1032434032 /nfs/dbraw/zinc/43/40/32/1032434032.db2.gz BBVXMKVYPLHOOT-WOSRLPQWSA-N 2 1 328.472 4.154 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)C1CC(F)(F)C1 ZINC000529543535 1032434039 /nfs/dbraw/zinc/43/40/39/1032434039.db2.gz BBVXMKVYPLHOOT-WOSRLPQWSA-N 2 1 328.472 4.154 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)C1CC(F)(F)C1 ZINC000529543537 1032434810 /nfs/dbraw/zinc/43/48/10/1032434810.db2.gz BBVXMKVYPLHOOT-XEZPLFJOSA-N 2 1 328.472 4.154 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)C1CC(F)(F)C1 ZINC000529543537 1032434828 /nfs/dbraw/zinc/43/48/28/1032434828.db2.gz BBVXMKVYPLHOOT-XEZPLFJOSA-N 2 1 328.472 4.154 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)CC1 ZINC000245843434 1032509611 /nfs/dbraw/zinc/50/96/11/1032509611.db2.gz DYFJUGFOXTUDQY-QYRPDUKASA-N 2 1 342.527 4.005 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccsc1 ZINC000177890461 1032524305 /nfs/dbraw/zinc/52/43/05/1032524305.db2.gz KCJAFKGVPRKVAG-BBWFWOEESA-N 2 1 344.524 4.208 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCSc2ccc(Cl)cc21 ZINC000178700662 1032544275 /nfs/dbraw/zinc/54/42/75/1032544275.db2.gz FLUZIUKNKLJEHS-WBMJQRKESA-N 2 1 335.904 4.308 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000391418354 1032619528 /nfs/dbraw/zinc/61/95/28/1032619528.db2.gz JFCFCXBAIRQFBK-SNVBAGLBSA-N 2 1 342.327 4.154 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(-c2cccnc2)cc1 ZINC000181278072 1032650230 /nfs/dbraw/zinc/65/02/30/1032650230.db2.gz FXAAUONXRSZLGH-KRWDZBQOSA-N 2 1 334.467 4.385 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc3[nH]ccc32)[C@H]1c1cccs1 ZINC000246170443 1032759662 /nfs/dbraw/zinc/75/96/62/1032759662.db2.gz MOKWSDFGHORVAP-UZLBHIALSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cccc3[nH]ccc32)[C@H]1c1cccs1 ZINC000246170443 1032759693 /nfs/dbraw/zinc/75/96/93/1032759693.db2.gz MOKWSDFGHORVAP-UZLBHIALSA-N 2 1 339.508 4.402 20 0 EIADMP COc1ccc(-c2ccccc2)cc1CNC[C@@H]1CC[N@H+](C(C)C)C1 ZINC000579765410 1018872822 /nfs/dbraw/zinc/87/28/22/1018872822.db2.gz XUVIFFJWQLZYET-SFHVURJKSA-N 2 1 338.495 4.182 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000579765410 1018872824 /nfs/dbraw/zinc/87/28/24/1018872824.db2.gz XUVIFFJWQLZYET-SFHVURJKSA-N 2 1 338.495 4.182 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H]1CC[N@H+](C(C)C)C1 ZINC000579765410 1018872826 /nfs/dbraw/zinc/87/28/26/1018872826.db2.gz XUVIFFJWQLZYET-SFHVURJKSA-N 2 1 338.495 4.182 20 0 EIADMP C[C@@H](C[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1)C[NH+](C)C ZINC000312443915 1019092009 /nfs/dbraw/zinc/09/20/09/1019092009.db2.gz CKIDJDLFEHGRHS-RYUDHWBXSA-N 2 1 339.277 4.044 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613706 1019461066 /nfs/dbraw/zinc/46/10/66/1019461066.db2.gz YMUBJSLFCPVHKF-UKRRQHHQSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@@H](C[N@@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613706 1019461079 /nfs/dbraw/zinc/46/10/79/1019461079.db2.gz YMUBJSLFCPVHKF-UKRRQHHQSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@@H](C[N@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613706 1019461092 /nfs/dbraw/zinc/46/10/92/1019461092.db2.gz YMUBJSLFCPVHKF-UKRRQHHQSA-N 2 1 327.299 4.125 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCC[C@H]1c1ccc(Br)c(C)c1 ZINC000430227929 1019525643 /nfs/dbraw/zinc/52/56/43/1019525643.db2.gz QSFZXCFZBQWXMT-KRWDZBQOSA-N 2 1 348.288 4.100 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCC[C@H]1c1ccc(Br)c(C)c1 ZINC000430227929 1019525656 /nfs/dbraw/zinc/52/56/56/1019525656.db2.gz QSFZXCFZBQWXMT-KRWDZBQOSA-N 2 1 348.288 4.100 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(C)c(Br)s2)C1 ZINC001345412333 1019789088 /nfs/dbraw/zinc/78/90/88/1019789088.db2.gz QBHJNYXOAXMQRZ-STQMWFEESA-N 2 1 345.350 4.202 20 0 EIADMP Cc1cc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)ccc1Oc1cccnc1 ZINC000432814799 1032859947 /nfs/dbraw/zinc/85/99/47/1032859947.db2.gz BFSMJELDIOAVAA-LJQANCHMSA-N 2 1 339.483 4.098 20 0 EIADMP Cc1cc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)ccc1Oc1cccnc1 ZINC000432814799 1032859950 /nfs/dbraw/zinc/85/99/50/1032859950.db2.gz BFSMJELDIOAVAA-LJQANCHMSA-N 2 1 339.483 4.098 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(CSC(F)F)o2)C1 ZINC000120621237 1019898578 /nfs/dbraw/zinc/89/85/78/1019898578.db2.gz FSBIYEHQFUWLFA-AWEZNQCLSA-N 2 1 346.487 4.337 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000398190511 1020528429 /nfs/dbraw/zinc/52/84/29/1020528429.db2.gz ZETGDMONIDYTNF-KDOFPFPSSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000398190511 1020528434 /nfs/dbraw/zinc/52/84/34/1020528434.db2.gz ZETGDMONIDYTNF-KDOFPFPSSA-N 2 1 334.916 4.402 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)s2)cc1C ZINC000655711521 1020907530 /nfs/dbraw/zinc/90/75/30/1020907530.db2.gz KUNZOEMOSMEAAJ-ZWKOTPCHSA-N 2 1 341.524 4.143 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)s2)cc1C ZINC000655711521 1020907540 /nfs/dbraw/zinc/90/75/40/1020907540.db2.gz KUNZOEMOSMEAAJ-ZWKOTPCHSA-N 2 1 341.524 4.143 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc3[nH]ccc3c2)[C@@H]1c1cccs1 ZINC000655742631 1020931627 /nfs/dbraw/zinc/93/16/27/1020931627.db2.gz AWZXFZCVMNLMIU-FXAWDEMLSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc3[nH]ccc3c2)[C@@H]1c1cccs1 ZINC000655742631 1020931631 /nfs/dbraw/zinc/93/16/31/1020931631.db2.gz AWZXFZCVMNLMIU-FXAWDEMLSA-N 2 1 339.508 4.402 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C[C@@H]3CCCO3)CC1)CC2 ZINC000655756718 1020943599 /nfs/dbraw/zinc/94/35/99/1020943599.db2.gz WUGYURVYYGTJHN-RBBKRZOGSA-N 2 1 342.527 4.030 20 0 EIADMP COc1c(C)cccc1C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000655809563 1020978931 /nfs/dbraw/zinc/97/89/31/1020978931.db2.gz ACCPLGWETFNWSO-INIZCTEOSA-N 2 1 335.451 4.349 20 0 EIADMP Cn1c[nH+]cc1CCC[NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000579969497 1021042654 /nfs/dbraw/zinc/04/26/54/1021042654.db2.gz JCUOYXLJVOBPOR-KRWDZBQOSA-N 2 1 338.282 4.400 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000340473002 1021085384 /nfs/dbraw/zinc/08/53/84/1021085384.db2.gz JHCFBUZNEDBAOW-SFHVURJKSA-N 3 1 340.515 4.097 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000472468663 1021387332 /nfs/dbraw/zinc/38/73/32/1021387332.db2.gz UFXMFZNGXWYSNS-HOCLYGCPSA-N 2 1 340.433 4.430 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000570425255 1021433213 /nfs/dbraw/zinc/43/32/13/1021433213.db2.gz OAXCISMVKFWALT-IITNATTFSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000570425255 1021433223 /nfs/dbraw/zinc/43/32/23/1021433223.db2.gz OAXCISMVKFWALT-IITNATTFSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H](CSC(C)(C)C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000177969277 1021835155 /nfs/dbraw/zinc/83/51/55/1021835155.db2.gz NHZSCGVEQDWZIR-KRWDZBQOSA-N 2 1 334.573 4.203 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCSc2ccccc2Cl)CC[N@@H+]1C ZINC000531143399 1021842369 /nfs/dbraw/zinc/84/23/69/1021842369.db2.gz IZOICXCKQWSUAQ-GJZGRUSLSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCSc2ccccc2Cl)CC[N@H+]1C ZINC000531143399 1021842373 /nfs/dbraw/zinc/84/23/73/1021842373.db2.gz IZOICXCKQWSUAQ-GJZGRUSLSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)CCCSc2ccccc2Cl)CC[NH+]1C ZINC000531143399 1021842376 /nfs/dbraw/zinc/84/23/76/1021842376.db2.gz IZOICXCKQWSUAQ-GJZGRUSLSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCSc2ccccc2Cl)CC[NH+]1C ZINC000531143399 1021842385 /nfs/dbraw/zinc/84/23/85/1021842385.db2.gz IZOICXCKQWSUAQ-GJZGRUSLSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1csc(-c2ccccc2)n1 ZINC000414169522 1022017446 /nfs/dbraw/zinc/01/74/46/1022017446.db2.gz BGFOFIAVLFHPPW-CVEARBPZSA-N 2 1 329.513 4.193 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CC[C@@H]3CCC[N@@H+](C)C3)oc21 ZINC000414199446 1022105909 /nfs/dbraw/zinc/10/59/09/1022105909.db2.gz XBBOVPBWQIZPGU-CVEARBPZSA-N 2 1 330.472 4.214 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc(OC(C)C)c2)CC1 ZINC000613491072 1022156992 /nfs/dbraw/zinc/15/69/92/1022156992.db2.gz DHEJLJOOWKKRIV-UHFFFAOYSA-N 2 1 332.532 4.418 20 0 EIADMP FC(F)(F)c1cccc(C2([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CCC2)c1 ZINC000245925495 1033038908 /nfs/dbraw/zinc/03/89/08/1033038908.db2.gz SCHWLBLEPDEOJM-SJORKVTESA-N 2 1 338.417 4.301 20 0 EIADMP Cc1cc(F)ncc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000892570761 1022239436 /nfs/dbraw/zinc/23/94/36/1022239436.db2.gz NSFIOPSFCUIXSH-KRWDZBQOSA-N 2 1 341.474 4.193 20 0 EIADMP Cc1cc(F)ncc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000892581020 1022311111 /nfs/dbraw/zinc/31/11/11/1022311111.db2.gz SDGPPBPBRAYFFD-MRXNPFEDSA-N 2 1 341.474 4.051 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@H]2CCCC23CCOCC3)C1 ZINC001167424092 1022316166 /nfs/dbraw/zinc/31/61/66/1022316166.db2.gz AXNRWPIMZJTFCO-NJDAHSKKSA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@H]2CCCC23CCOCC3)C1 ZINC001167424092 1022316185 /nfs/dbraw/zinc/31/61/85/1022316185.db2.gz AXNRWPIMZJTFCO-NJDAHSKKSA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@H]2CCCC23CCOCC3)C1 ZINC001167424092 1022316202 /nfs/dbraw/zinc/31/62/02/1022316202.db2.gz AXNRWPIMZJTFCO-NJDAHSKKSA-N 2 1 348.575 4.170 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(C(F)(F)F)cc1C ZINC000349341394 1022350943 /nfs/dbraw/zinc/35/09/43/1022350943.db2.gz BJRXVELZXMYNGC-UHFFFAOYSA-N 2 1 325.378 4.041 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(C(F)(F)F)cc1C ZINC000349341394 1022350959 /nfs/dbraw/zinc/35/09/59/1022350959.db2.gz BJRXVELZXMYNGC-UHFFFAOYSA-N 2 1 325.378 4.041 20 0 EIADMP CC(C)c1nccn1[C@@H]1CCC[N@@H+](Cc2nc3ccc(F)cc3o2)C1 ZINC000378089455 1022363998 /nfs/dbraw/zinc/36/39/98/1022363998.db2.gz NSONRLQFEODMDK-OAHLLOKOSA-N 2 1 342.418 4.124 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cs1 ZINC000103143007 1022660265 /nfs/dbraw/zinc/66/02/65/1022660265.db2.gz AJPPGTUPKIQOAH-UHFFFAOYSA-N 2 1 343.540 4.050 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)cs1 ZINC000103143007 1022660277 /nfs/dbraw/zinc/66/02/77/1022660277.db2.gz AJPPGTUPKIQOAH-UHFFFAOYSA-N 2 1 343.540 4.050 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1F ZINC000162263429 1022661097 /nfs/dbraw/zinc/66/10/97/1022661097.db2.gz RKNVWYOEFLVYPP-HNNXBMFYSA-N 2 1 334.479 4.282 20 0 EIADMP CO[C@@H](c1ccccc1F)[C@@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000557792399 1022708805 /nfs/dbraw/zinc/70/88/05/1022708805.db2.gz RKNPNOBPOPTVFD-IIBYNOLFSA-N 2 1 348.506 4.288 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1C ZINC000580945765 1022734833 /nfs/dbraw/zinc/73/48/33/1022734833.db2.gz ZVIQVSWXRBGARS-XLIONFOSSA-N 2 1 344.524 4.238 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ccc1C ZINC000580945765 1022734857 /nfs/dbraw/zinc/73/48/57/1022734857.db2.gz ZVIQVSWXRBGARS-XLIONFOSSA-N 2 1 344.524 4.238 20 0 EIADMP COC[C@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000089668720 1022756092 /nfs/dbraw/zinc/75/60/92/1022756092.db2.gz HLYRXDVKSGPCQI-QIJUGHKUSA-N 2 1 338.495 4.017 20 0 EIADMP COC[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000089668720 1022756115 /nfs/dbraw/zinc/75/61/15/1022756115.db2.gz HLYRXDVKSGPCQI-QIJUGHKUSA-N 2 1 338.495 4.017 20 0 EIADMP Clc1ccc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c2ncccc12 ZINC000647543834 1022798126 /nfs/dbraw/zinc/79/81/26/1022798126.db2.gz SRFKPSBBSHAPRI-HOTGVXAUSA-N 2 1 343.902 4.100 20 0 EIADMP Cc1cc2cc(C[NH2+][C@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)ccc2[nH]1 ZINC000581026086 1022802309 /nfs/dbraw/zinc/80/23/09/1022802309.db2.gz QHKURDSJSCTSON-RBBKRZOGSA-N 2 1 333.479 4.401 20 0 EIADMP Cc1cc2cc(C[NH2+][C@H]3CC[N@H+](C)[C@@H](c4ccccc4)C3)ccc2[nH]1 ZINC000581026086 1022802312 /nfs/dbraw/zinc/80/23/12/1022802312.db2.gz QHKURDSJSCTSON-RBBKRZOGSA-N 2 1 333.479 4.401 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022515 1022814353 /nfs/dbraw/zinc/81/43/53/1022814353.db2.gz OMNLSDIEGRCWDH-AZUAARDMSA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022515 1022814363 /nfs/dbraw/zinc/81/43/63/1022814363.db2.gz OMNLSDIEGRCWDH-AZUAARDMSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cc(C3CC3)no2)CC1 ZINC000660006657 1022853244 /nfs/dbraw/zinc/85/32/44/1022853244.db2.gz RAMZUYLLDVTOFV-INIZCTEOSA-N 2 1 331.504 4.029 20 0 EIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc(C)c1O ZINC000311195078 1022877641 /nfs/dbraw/zinc/87/76/41/1022877641.db2.gz HOSNHISJYLNCSV-FQEVSTJZSA-N 2 1 338.495 4.011 20 0 EIADMP Fc1ccc2c(c1)[C@H]([N@@H+]1CC[C@H]3[C@H](CCC[NH+]3C3CC3)C1)CCC2 ZINC000510377671 1022962705 /nfs/dbraw/zinc/96/27/05/1022962705.db2.gz WLKQPGGEKZZSIG-TYCQWZJGSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([N@H+]1CC[C@H]3[C@H](CCC[NH+]3C3CC3)C1)CCC2 ZINC000510377671 1022962720 /nfs/dbraw/zinc/96/27/20/1022962720.db2.gz WLKQPGGEKZZSIG-TYCQWZJGSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH+]1CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C1)CCC2 ZINC000510377671 1022962733 /nfs/dbraw/zinc/96/27/33/1022962733.db2.gz WLKQPGGEKZZSIG-TYCQWZJGSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH+]1CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C1)CCC2 ZINC000510377671 1022962749 /nfs/dbraw/zinc/96/27/49/1022962749.db2.gz WLKQPGGEKZZSIG-TYCQWZJGSA-N 2 1 328.475 4.152 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(C)nc2C)cc1F ZINC000363947622 1023030700 /nfs/dbraw/zinc/03/07/00/1023030700.db2.gz JDEGJYGTIHUPMY-AWEZNQCLSA-N 2 1 338.430 4.182 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)[C@H]3C[C@@H]3c3cccs3)CC2)[nH+]c1 ZINC000367437839 1023036772 /nfs/dbraw/zinc/03/67/72/1023036772.db2.gz JVZSUWXYELHATF-JQHSSLGASA-N 2 1 341.524 4.202 20 0 EIADMP CC[N@@H+](Cc1ccc(C(=O)Nc2ccc([C@H](C)[NH3+])cc2)cc1)C(C)C ZINC000178219454 1023074773 /nfs/dbraw/zinc/07/47/73/1023074773.db2.gz HXTDAWJMBBPRCY-INIZCTEOSA-N 2 1 339.483 4.189 20 0 EIADMP Cc1ccccc1SC[C@@H](C)C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC001167457589 1023100723 /nfs/dbraw/zinc/10/07/23/1023100723.db2.gz FXWIEXUNKHSYHR-PKOBYXMFSA-N 2 1 332.557 4.141 20 0 EIADMP Cn1cc[nH+]c1CC1CCN(c2ccnc3ccc(Cl)cc32)CC1 ZINC000178771345 1023169834 /nfs/dbraw/zinc/16/98/34/1023169834.db2.gz OZORZHIIHGKYDJ-UHFFFAOYSA-N 2 1 340.858 4.081 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000584819126 1023345765 /nfs/dbraw/zinc/34/57/65/1023345765.db2.gz DWIHZDUNRLXAJE-NQIIRXRSSA-N 2 1 326.459 4.041 20 0 EIADMP C[C@@H]([NH2+]CCc1nsc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000660255323 1023389346 /nfs/dbraw/zinc/38/93/46/1023389346.db2.gz BAHHSGGXZQOSBJ-HZPDHXFCSA-N 2 1 343.540 4.081 20 0 EIADMP Cc1cc(Cl)cc(C)c1C[NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1 ZINC000377299724 1023457773 /nfs/dbraw/zinc/45/77/73/1023457773.db2.gz RDEWOSIBJGVGNL-PXNSSMCTSA-N 2 1 343.902 4.134 20 0 EIADMP Cc1cc(Cl)cc(C)c1C[NH2+]C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1 ZINC000377299724 1023457777 /nfs/dbraw/zinc/45/77/77/1023457777.db2.gz RDEWOSIBJGVGNL-PXNSSMCTSA-N 2 1 343.902 4.134 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500077006 1023484225 /nfs/dbraw/zinc/48/42/25/1023484225.db2.gz VVPQDPXBAIKMFR-JKSUJKDBSA-N 2 1 342.449 4.473 20 0 EIADMP C[C@@]1(C[NH2+]Cc2cccc3cc[nH]c32)CC[N@@H+](Cc2ccccc2)C1 ZINC000310970411 1023494768 /nfs/dbraw/zinc/49/47/68/1023494768.db2.gz DERVVDQDYSFKTG-QFIPXVFZSA-N 2 1 333.479 4.170 20 0 EIADMP C[C@@H](C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500106262 1023505664 /nfs/dbraw/zinc/50/56/64/1023505664.db2.gz ZLIHJQSZQXBZLJ-HOTGVXAUSA-N 2 1 340.433 4.227 20 0 EIADMP c1csc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)cs2)c1 ZINC000656785122 1023528813 /nfs/dbraw/zinc/52/88/13/1023528813.db2.gz JAMHLFXSPOEXLV-HNNXBMFYSA-N 2 1 347.553 4.083 20 0 EIADMP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)C1 ZINC000684369840 1023539922 /nfs/dbraw/zinc/53/99/22/1023539922.db2.gz BYKOLPKQRJCXQU-IOMROCGXSA-N 2 1 330.516 4.108 20 0 EIADMP CSc1ccc(C[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310079813 1023544078 /nfs/dbraw/zinc/54/40/78/1023544078.db2.gz IKJJDLZYSPYWFB-NRFANRHFSA-N 2 1 340.536 4.410 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1nc(C(F)(F)F)cs1 ZINC000343844491 1023553076 /nfs/dbraw/zinc/55/30/76/1023553076.db2.gz XGTGQVOYVHZICI-LLVKDONJSA-N 2 1 343.418 4.074 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000394556596 1023607164 /nfs/dbraw/zinc/60/71/64/1023607164.db2.gz IXSPKLHYOKXVBD-WDSOQIARSA-N 2 1 336.470 4.312 20 0 EIADMP Cc1ccc([C@H](C2CC2)[N@H+](C)C2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000377650843 1023653819 /nfs/dbraw/zinc/65/38/19/1023653819.db2.gz NZLVYDRVOSWXDI-JOCHJYFZSA-N 2 1 342.527 4.021 20 0 EIADMP Clc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)C2 ZINC000310086308 1023684167 /nfs/dbraw/zinc/68/41/67/1023684167.db2.gz NRAVHDXYEPVVMP-NRFANRHFSA-N 2 1 340.898 4.061 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[N@@H+]2CCC3(CCOCC3)[C@@H]2C)cc1 ZINC000377710950 1023704721 /nfs/dbraw/zinc/70/47/21/1023704721.db2.gz YKLQOAWRXMNGSP-IRXDYDNUSA-N 2 1 339.483 4.133 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[N@H+]2CCC3(CCOCC3)[C@@H]2C)cc1 ZINC000377710950 1023704733 /nfs/dbraw/zinc/70/47/33/1023704733.db2.gz YKLQOAWRXMNGSP-IRXDYDNUSA-N 2 1 339.483 4.133 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)o1 ZINC000377750834 1023741154 /nfs/dbraw/zinc/74/11/54/1023741154.db2.gz WTCJWEDELPJKBG-DLBZAZTESA-N 2 1 328.431 4.111 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@H](c4cccnc4)C3)C2)cc1 ZINC000500382545 1023769816 /nfs/dbraw/zinc/76/98/16/1023769816.db2.gz HQVZFYDPXTVPIL-FUPPJEDESA-N 2 1 349.522 4.220 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccc(Br)cc1)C1CCC1 ZINC000341590829 1023899137 /nfs/dbraw/zinc/89/91/37/1023899137.db2.gz VRQZUPLZXRIPMR-KRWDZBQOSA-N 2 1 348.288 4.085 20 0 EIADMP Fc1ccccc1Oc1cccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000651864449 1024116298 /nfs/dbraw/zinc/11/62/98/1024116298.db2.gz UKNSQBRUIZTJEY-QZTJIDSGSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1ccccc1Oc1cccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000651864449 1024116330 /nfs/dbraw/zinc/11/63/30/1024116330.db2.gz UKNSQBRUIZTJEY-QZTJIDSGSA-N 2 1 340.442 4.334 20 0 EIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2cccc(C)c2)c2cccc(F)c2)C1 ZINC000510648508 1024169485 /nfs/dbraw/zinc/16/94/85/1024169485.db2.gz FRPFRSDQCJQREI-LAUBAEHRSA-N 2 1 326.459 4.155 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2cccc(C)c2)c2cccc(F)c2)C1 ZINC000510648508 1024169500 /nfs/dbraw/zinc/16/95/00/1024169500.db2.gz FRPFRSDQCJQREI-LAUBAEHRSA-N 2 1 326.459 4.155 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000164611410 1024705187 /nfs/dbraw/zinc/70/51/87/1024705187.db2.gz ZOVNKGVKEYXNAT-NSHDSACASA-N 2 1 342.306 4.147 20 0 EIADMP C[C@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000511909475 1024745597 /nfs/dbraw/zinc/74/55/97/1024745597.db2.gz FRJMJEVRSDFNCZ-JRKQMZJPSA-N 2 1 334.454 4.221 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccccc1C(F)(F)F ZINC000164650357 1024765880 /nfs/dbraw/zinc/76/58/80/1024765880.db2.gz RAFQCVBRJUYXOM-CYBMUJFWSA-N 2 1 325.378 4.341 20 0 EIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000164674767 1024788358 /nfs/dbraw/zinc/78/83/58/1024788358.db2.gz ZOHYTFJWALENCZ-ZDUSSCGKSA-N 2 1 334.533 4.385 20 0 EIADMP COC1CCC(CC[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000548485644 1024839111 /nfs/dbraw/zinc/83/91/11/1024839111.db2.gz ASZZJZHNAJOVFY-JJZDCNPZSA-N 2 1 344.543 4.082 20 0 EIADMP COC1(C[C@@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000510937505 1024849009 /nfs/dbraw/zinc/84/90/09/1024849009.db2.gz YDNHPOCWMOPHTQ-UYAOXDASSA-N 2 1 344.543 4.224 20 0 EIADMP COC1(C[C@@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000510937505 1024849013 /nfs/dbraw/zinc/84/90/13/1024849013.db2.gz YDNHPOCWMOPHTQ-UYAOXDASSA-N 2 1 344.543 4.224 20 0 EIADMP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]CCCn2cc[nH+]c2C)cc1F ZINC000510931975 1024850553 /nfs/dbraw/zinc/85/05/53/1024850553.db2.gz UGXRTASUEFWWCK-MJGOQNOKSA-N 2 1 345.462 4.045 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCc2c3ccccc3sc21 ZINC000510944631 1024859401 /nfs/dbraw/zinc/85/94/01/1024859401.db2.gz KFNCZCFTFUQPHC-KRWDZBQOSA-N 2 1 325.481 4.464 20 0 EIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(Oc2ccc(C(C)C)cc2)CC1 ZINC000535669627 1024879378 /nfs/dbraw/zinc/87/93/78/1024879378.db2.gz ZWXDLTFYTJYLOM-UHFFFAOYSA-N 2 1 341.499 4.248 20 0 EIADMP COC1(C[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000277057131 1025015561 /nfs/dbraw/zinc/01/55/61/1025015561.db2.gz HQXKEJSVTSXRDZ-LBFURVHYSA-N 2 1 342.527 4.119 20 0 EIADMP c1sc(C2CCCC2)nc1C[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662293742 1025044024 /nfs/dbraw/zinc/04/40/24/1025044024.db2.gz MURINDYQGGDRFJ-KRWDZBQOSA-N 2 1 333.545 4.012 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3csc(C)n3)CC2)s1 ZINC000161694323 1025062945 /nfs/dbraw/zinc/06/29/45/1025062945.db2.gz BDGLZLBQQRTXLL-AWEZNQCLSA-N 2 1 349.569 4.384 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ncc(-c3ccc(Cl)cc3)o2)[C@@H]1CCC[NH3+] ZINC000662314136 1025068618 /nfs/dbraw/zinc/06/86/18/1025068618.db2.gz NBUFVKLZBWGHEU-RHSMWYFYSA-N 2 1 347.890 4.334 20 0 EIADMP CC1(C)CC[C@H]([NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)c2ccccc21 ZINC000684612477 1025071440 /nfs/dbraw/zinc/07/14/40/1025071440.db2.gz UOANEFWKNRZIRH-RXVVDRJESA-N 2 1 342.527 4.032 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)c1ccc(C)cc1 ZINC000162232238 1025114345 /nfs/dbraw/zinc/11/43/45/1025114345.db2.gz ONDGLPGDFOARHT-FQEVSTJZSA-N 2 1 338.499 4.112 20 0 EIADMP c1nc(C2CCCC2)sc1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663345878 1025142733 /nfs/dbraw/zinc/14/27/33/1025142733.db2.gz NLUNHBLLUXUIEG-MRXNPFEDSA-N 2 1 333.545 4.012 20 0 EIADMP c1nc(C2CCCC2)sc1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663345878 1025142743 /nfs/dbraw/zinc/14/27/43/1025142743.db2.gz NLUNHBLLUXUIEG-MRXNPFEDSA-N 2 1 333.545 4.012 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc2ccncc2s1 ZINC000663463804 1025393381 /nfs/dbraw/zinc/39/33/81/1025393381.db2.gz BRZVAFHGHKPBGD-ZBFHGGJFSA-N 2 1 329.513 4.069 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc1Cl ZINC000663467356 1025397333 /nfs/dbraw/zinc/39/73/33/1025397333.db2.gz DZNBDXODMCLFLT-GOEBONIOSA-N 2 1 336.907 4.121 20 0 EIADMP C[C@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469911 1025416263 /nfs/dbraw/zinc/41/62/63/1025416263.db2.gz RREQOHPAMNBVOG-HOCLYGCPSA-N 2 1 338.442 4.061 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469911 1025416268 /nfs/dbraw/zinc/41/62/68/1025416268.db2.gz RREQOHPAMNBVOG-HOCLYGCPSA-N 2 1 338.442 4.061 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1OC(F)F ZINC000663469911 1025416280 /nfs/dbraw/zinc/41/62/80/1025416280.db2.gz RREQOHPAMNBVOG-HOCLYGCPSA-N 2 1 338.442 4.061 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2occc2c1 ZINC000511995490 1025592657 /nfs/dbraw/zinc/59/26/57/1025592657.db2.gz ABNDZKZARBUYFV-DYESRHJHSA-N 2 1 334.463 4.433 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](Cc1ccccc1)C1CCOCC1 ZINC001167826582 1025623376 /nfs/dbraw/zinc/62/33/76/1025623376.db2.gz QRYDAXUKWXVBOP-LJQANCHMSA-N 2 1 332.532 4.178 20 0 EIADMP CC[C@@H](CC(F)(F)F)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000546167301 1025636863 /nfs/dbraw/zinc/63/68/63/1025636863.db2.gz ZPVVERAFBQGRGW-INIZCTEOSA-N 2 1 346.412 4.153 20 0 EIADMP CC[C@@H](c1ccccc1)[NH+]1CCN(C[C@@H]2CCCC[N@H+]2C(C)C)CC1 ZINC001167508355 1025751619 /nfs/dbraw/zinc/75/16/19/1025751619.db2.gz GQPYXPHHLCLNTL-VXKWHMMOSA-N 2 1 343.559 4.018 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H](Cc2ccc(OC)cc2)C1 ZINC001167839908 1025856070 /nfs/dbraw/zinc/85/60/70/1025856070.db2.gz COTPULONLFKIGA-TZIWHRDSSA-N 2 1 346.559 4.460 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000432409161 1025877872 /nfs/dbraw/zinc/87/78/72/1025877872.db2.gz FGQFWCAWVCEDBS-ZWKOTPCHSA-N 2 1 348.531 4.015 20 0 EIADMP Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c2cc(Cl)cc(C)c2[nH+]1 ZINC000467023835 1025889193 /nfs/dbraw/zinc/88/91/93/1025889193.db2.gz MPKRXTPEDLBTRJ-CVEARBPZSA-N 2 1 329.875 4.178 20 0 EIADMP COc1cccc([C@H]2C[C@H](C)C[N@H+]2CCCCn2ccnc2C)c1 ZINC000344034476 1025890205 /nfs/dbraw/zinc/89/02/05/1025890205.db2.gz FASLQLGNNBFDKQ-OXJNMPFZSA-N 2 1 327.472 4.063 20 0 EIADMP COc1cccc([C@H]2C[C@H](C)C[N@@H+]2CCCCn2cc[nH+]c2C)c1 ZINC000344034476 1025890206 /nfs/dbraw/zinc/89/02/06/1025890206.db2.gz FASLQLGNNBFDKQ-OXJNMPFZSA-N 2 1 327.472 4.063 20 0 EIADMP COc1cccc([C@H]2C[C@H](C)C[N@H+]2CCCCn2cc[nH+]c2C)c1 ZINC000344034476 1025890207 /nfs/dbraw/zinc/89/02/07/1025890207.db2.gz FASLQLGNNBFDKQ-OXJNMPFZSA-N 2 1 327.472 4.063 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCOC[C@H]1c1ccccc1Cl ZINC001167842031 1025892414 /nfs/dbraw/zinc/89/24/14/1025892414.db2.gz WAVKUBISTMJBRW-APWZRJJASA-N 2 1 338.923 4.224 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCOC[C@H]1c1ccccc1Cl ZINC001167842031 1025892416 /nfs/dbraw/zinc/89/24/16/1025892416.db2.gz WAVKUBISTMJBRW-APWZRJJASA-N 2 1 338.923 4.224 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)sc1Br ZINC000375660401 1025904247 /nfs/dbraw/zinc/90/42/47/1025904247.db2.gz MWZQNBKVLIKFDE-XQQFMLRXSA-N 2 1 343.334 4.096 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)sc1Br ZINC000375660401 1025904262 /nfs/dbraw/zinc/90/42/62/1025904262.db2.gz MWZQNBKVLIKFDE-XQQFMLRXSA-N 2 1 343.334 4.096 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C12CCC2 ZINC000344082732 1025975239 /nfs/dbraw/zinc/97/52/39/1025975239.db2.gz ZOMYSKSZMRPCKW-RYGJVYDSSA-N 2 1 339.483 4.179 20 0 EIADMP c1cncc(-c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)cc2)c1 ZINC001167969364 1025993802 /nfs/dbraw/zinc/99/38/02/1025993802.db2.gz BMVZUGSFYAIJES-NOTZXAQLSA-N 2 1 347.506 4.244 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2COc3c(C)cccc3C2)cc1 ZINC000582032710 1025994783 /nfs/dbraw/zinc/99/47/83/1025994783.db2.gz VQMNPBUJEPHDGB-UZLBHIALSA-N 2 1 347.462 4.143 20 0 EIADMP Clc1ccc2c(c1)C[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)CC2 ZINC001167969822 1026028928 /nfs/dbraw/zinc/02/89/28/1026028928.db2.gz FDJXMIGJBSBOMY-UDEWTMQYSA-N 2 1 344.930 4.192 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(C(F)F)c(F)c1 ZINC000894478967 1026036776 /nfs/dbraw/zinc/03/67/76/1026036776.db2.gz HHCWJJKTKBJEIT-UHFFFAOYSA-N 2 1 339.405 4.434 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(C(F)F)c(F)c1 ZINC000894478967 1026036806 /nfs/dbraw/zinc/03/68/06/1026036806.db2.gz HHCWJJKTKBJEIT-UHFFFAOYSA-N 2 1 339.405 4.434 20 0 EIADMP CCC1(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCOCC1 ZINC000582091756 1026130228 /nfs/dbraw/zinc/13/02/28/1026130228.db2.gz ISXLCEUWOQUPCI-OAQYLSRUSA-N 2 1 344.543 4.085 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c(F)c1F ZINC001167973390 1026163505 /nfs/dbraw/zinc/16/35/05/1026163505.db2.gz JEEKPDIVTXSOIW-LNRIEFBSSA-N 2 1 334.454 4.329 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c(F)c1F ZINC001167973390 1026163513 /nfs/dbraw/zinc/16/35/13/1026163513.db2.gz JEEKPDIVTXSOIW-LNRIEFBSSA-N 2 1 334.454 4.329 20 0 EIADMP CCCC[C@H](CC)C[N@@H+]1CCO[C@]2(CCC[NH+](C[C@@H]3C[C@@H]3C)C2)C1 ZINC001279268834 1026195968 /nfs/dbraw/zinc/19/59/68/1026195968.db2.gz HODAOKIHFSERIY-TUFLPTIASA-N 2 1 336.564 4.026 20 0 EIADMP CCCC[C@H](CC)C[N@H+]1CCO[C@]2(CCC[NH+](C[C@@H]3C[C@@H]3C)C2)C1 ZINC001279268834 1026195978 /nfs/dbraw/zinc/19/59/78/1026195978.db2.gz HODAOKIHFSERIY-TUFLPTIASA-N 2 1 336.564 4.026 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCO[C@]2(CCC[N@H+](C[C@@H]3C[C@@H]3C)C2)C1 ZINC001279268834 1026195985 /nfs/dbraw/zinc/19/59/85/1026195985.db2.gz HODAOKIHFSERIY-TUFLPTIASA-N 2 1 336.564 4.026 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCO[C@]2(CCC[N@@H+](C[C@@H]3C[C@@H]3C)C2)C1 ZINC001279268834 1026195994 /nfs/dbraw/zinc/19/59/94/1026195994.db2.gz HODAOKIHFSERIY-TUFLPTIASA-N 2 1 336.564 4.026 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3cccc4cccnc43)C2)CC1 ZINC000512177110 1026234506 /nfs/dbraw/zinc/23/45/06/1026234506.db2.gz FBOXIQKXCAHMEX-LJQANCHMSA-N 2 1 337.511 4.179 20 0 EIADMP Fc1cccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)c1 ZINC001167975358 1026251954 /nfs/dbraw/zinc/25/19/54/1026251954.db2.gz NULPOPBQMBSAJM-VTHDOGFWSA-N 2 1 328.475 4.272 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cc(Cl)cc4cccnc43)C2)CC1 ZINC000550200412 1026334241 /nfs/dbraw/zinc/33/42/41/1026334241.db2.gz IVKZSZDJVLZVCD-QGZVFWFLSA-N 2 1 343.902 4.052 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCSc2cc(C)c(C)cc21 ZINC000187160665 1026343160 /nfs/dbraw/zinc/34/31/60/1026343160.db2.gz BTLAWAKNEWQIJU-FZKQIMNGSA-N 2 1 329.513 4.271 20 0 EIADMP CC[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)CC1 ZINC000657371233 1026351816 /nfs/dbraw/zinc/35/18/16/1026351816.db2.gz ONRUTSITGSNGBA-UYAOXDASSA-N 2 1 347.547 4.452 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccc(OC)cc1 ZINC000163484531 1026379984 /nfs/dbraw/zinc/37/99/84/1026379984.db2.gz LGMGRFQZICBRJS-FQEVSTJZSA-N 2 1 339.483 4.108 20 0 EIADMP c1ccc(CC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)cc1 ZINC001167982113 1026384531 /nfs/dbraw/zinc/38/45/31/1026384531.db2.gz XKTUJGDYKJDMOM-AIZNXBIQSA-N 2 1 338.539 4.347 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](CCc2ccncc2)CC1)C1CCCCC1 ZINC000152900334 1026875446 /nfs/dbraw/zinc/87/54/46/1026875446.db2.gz FACBPPCAMKYOOD-OAQYLSRUSA-N 2 1 329.532 4.037 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3cccnc32)[C@@H]1c1cccs1 ZINC000684956334 1026890973 /nfs/dbraw/zinc/89/09/73/1026890973.db2.gz APVZKIAFQUYGPK-MBOZVWFJSA-N 2 1 341.524 4.193 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3cccnc32)[C@@H]1c1cccs1 ZINC000684956334 1026890974 /nfs/dbraw/zinc/89/09/74/1026890974.db2.gz APVZKIAFQUYGPK-MBOZVWFJSA-N 2 1 341.524 4.193 20 0 EIADMP FC(F)(F)c1cccc(CCCC[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000474470000 1027096985 /nfs/dbraw/zinc/09/69/85/1027096985.db2.gz CYJYJKDSTSAWOZ-QZTJIDSGSA-N 2 1 340.433 4.245 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000474481609 1027116676 /nfs/dbraw/zinc/11/66/76/1027116676.db2.gz YJTDCRICZLBETR-GUDVDZBRSA-N 2 1 332.532 4.289 20 0 EIADMP FC(F)(F)c1ccc2c(c1)[nH+]ccc2N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000301986912 1027174189 /nfs/dbraw/zinc/17/41/89/1027174189.db2.gz MTXAPCNOKJGDAO-OAHLLOKOSA-N 2 1 349.400 4.318 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)CCCS2 ZINC000188170984 1027178602 /nfs/dbraw/zinc/17/86/02/1027178602.db2.gz GMDRXJHXCWHQPB-SFHVURJKSA-N 2 1 348.556 4.475 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)CCCS2 ZINC000188170959 1027179969 /nfs/dbraw/zinc/17/99/69/1027179969.db2.gz GMDRXJHXCWHQPB-GOSISDBHSA-N 2 1 348.556 4.475 20 0 EIADMP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CC[N@H+](C)C2CCCCC2)cc1OC ZINC000474629206 1027336905 /nfs/dbraw/zinc/33/69/05/1027336905.db2.gz CSVUBWNXCXJIII-DLBZAZTESA-N 2 1 348.531 4.050 20 0 EIADMP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CC[N@@H+](C)C2CCCCC2)cc1OC ZINC000474629206 1027336921 /nfs/dbraw/zinc/33/69/21/1027336921.db2.gz CSVUBWNXCXJIII-DLBZAZTESA-N 2 1 348.531 4.050 20 0 EIADMP Cc1ccc(F)c(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000453362294 1027425837 /nfs/dbraw/zinc/42/58/37/1027425837.db2.gz QZEFTFTURINELT-TZIWHRDSSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1ccc(F)c(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000453362294 1027425850 /nfs/dbraw/zinc/42/58/50/1027425850.db2.gz QZEFTFTURINELT-TZIWHRDSSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1ccc(F)c(CC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000453362290 1027426221 /nfs/dbraw/zinc/42/62/21/1027426221.db2.gz QZEFTFTURINELT-PZJWPPBQSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1ccc(F)c(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000453362290 1027426226 /nfs/dbraw/zinc/42/62/26/1027426226.db2.gz QZEFTFTURINELT-PZJWPPBQSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]C1CC[NH+](CCc2ccncc2)CC1 ZINC000153468777 1027478630 /nfs/dbraw/zinc/47/86/30/1027478630.db2.gz PQMQJKDGTHNLGA-AVRDEDQJSA-N 2 1 349.522 4.235 20 0 EIADMP FC(F)Oc1ccccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000473924787 1027611999 /nfs/dbraw/zinc/61/19/99/1027611999.db2.gz WLBBFSIGXCAOJG-UHFFFAOYSA-N 2 1 338.442 4.175 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475572318 1027687112 /nfs/dbraw/zinc/68/71/12/1027687112.db2.gz ISCIRRKMWJMTAQ-UHFFFAOYSA-N 2 1 326.406 4.120 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@H](C)[C@@H](C)C3CCCCC3)CC2)nc(C)[nH+]1 ZINC000474879751 1027710506 /nfs/dbraw/zinc/71/05/06/1027710506.db2.gz ODQWTICHOQYCLA-IAGOWNOFSA-N 2 1 344.547 4.257 20 0 EIADMP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000657706268 1027759214 /nfs/dbraw/zinc/75/92/14/1027759214.db2.gz KYOPEPAYXVVQLE-CHWSQXEVSA-N 2 1 346.359 4.256 20 0 EIADMP CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cs1 ZINC000162277787 1027846554 /nfs/dbraw/zinc/84/65/54/1027846554.db2.gz BTLFIKJAQQSQFF-GJZGRUSLSA-N 2 1 347.528 4.058 20 0 EIADMP C[C@H]1CC([N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168044897 1027886349 /nfs/dbraw/zinc/88/63/49/1027886349.db2.gz HLNMXZKLZJFLDL-BVYOLEPJSA-N 2 1 334.454 4.015 20 0 EIADMP c1cc(-c2ccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCC4)C3)cc2)cs1 ZINC000444650121 1027919619 /nfs/dbraw/zinc/91/96/19/1027919619.db2.gz CHXCNLDLOGDBCP-SFHVURJKSA-N 2 1 326.509 4.333 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2ccc(Cl)nc2)cc1 ZINC000122764972 1027944178 /nfs/dbraw/zinc/94/41/78/1027944178.db2.gz YMCPNRQGHKLEDG-AWEZNQCLSA-N 2 1 340.858 4.122 20 0 EIADMP Cc1cccc2nc(C3CC[NH+](CC[C@@H]4CCCC[N@@H+]4C)CC3)oc21 ZINC000444780295 1028043186 /nfs/dbraw/zinc/04/31/86/1028043186.db2.gz FSVBBTLLUBEHLF-SFHVURJKSA-N 2 1 341.499 4.190 20 0 EIADMP CC[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccc(F)cc1 ZINC000523386626 1028059287 /nfs/dbraw/zinc/05/92/87/1028059287.db2.gz AINLNTULRUVHJI-NRFANRHFSA-N 2 1 326.459 4.315 20 0 EIADMP CC[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccc(F)cc1 ZINC000523386626 1028059307 /nfs/dbraw/zinc/05/93/07/1028059307.db2.gz AINLNTULRUVHJI-NRFANRHFSA-N 2 1 326.459 4.315 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000189242463 1028108290 /nfs/dbraw/zinc/10/82/90/1028108290.db2.gz NDBABOVGAFMTGW-UHFFFAOYSA-N 2 1 345.796 4.434 20 0 EIADMP Cc1ccc2cc(C[NH2+][C@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)ccc2n1 ZINC000189427189 1028134377 /nfs/dbraw/zinc/13/43/77/1028134377.db2.gz CAJGRTOOAQKREW-XLIONFOSSA-N 2 1 337.511 4.286 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)Cc1cccs1 ZINC000583194606 1028218249 /nfs/dbraw/zinc/21/82/49/1028218249.db2.gz LUOJUAJMOQDQJI-QRFRQXIXSA-N 2 1 328.525 4.352 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)Cc1cccs1 ZINC000583194606 1028218263 /nfs/dbraw/zinc/21/82/63/1028218263.db2.gz LUOJUAJMOQDQJI-QRFRQXIXSA-N 2 1 328.525 4.352 20 0 EIADMP CC[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1cccc(Cl)c1 ZINC000346148197 1028283128 /nfs/dbraw/zinc/28/31/28/1028283128.db2.gz WLGLKOPXQSBYQY-UHFFFAOYSA-N 2 1 340.858 4.251 20 0 EIADMP Cc1cccc(C)c1OCCC[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000523654214 1028295575 /nfs/dbraw/zinc/29/55/75/1028295575.db2.gz ZSPCRDQJULOEAO-UHFFFAOYSA-N 2 1 332.532 4.125 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)Cc1ccccc1C(F)(F)F ZINC000281010434 1028334481 /nfs/dbraw/zinc/33/44/81/1028334481.db2.gz YOEIJBFSTVOENS-CQSZACIVSA-N 2 1 339.405 4.211 20 0 EIADMP Cc1nc(C)c(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)s1 ZINC000281129899 1028403839 /nfs/dbraw/zinc/40/38/39/1028403839.db2.gz YFHMVTXQKAAGOA-UHFFFAOYSA-N 2 1 343.540 4.293 20 0 EIADMP C[C@@H]([NH2+]CCSCc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000192637944 1028861136 /nfs/dbraw/zinc/86/11/36/1028861136.db2.gz MMFSLYUYMOXJKV-IEBWSBKVSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@@H]([NH2+]CCSCc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000192637971 1028861230 /nfs/dbraw/zinc/86/12/30/1028861230.db2.gz MMFSLYUYMOXJKV-MJGOQNOKSA-N 2 1 332.557 4.162 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)cc1OC ZINC000324383741 1028862700 /nfs/dbraw/zinc/86/27/00/1028862700.db2.gz OBRHTLOKODYVEE-MRXNPFEDSA-N 2 1 334.504 4.009 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1OC ZINC000324383741 1028862707 /nfs/dbraw/zinc/86/27/07/1028862707.db2.gz OBRHTLOKODYVEE-MRXNPFEDSA-N 2 1 334.504 4.009 20 0 EIADMP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1C/C=C/c1ccc(OCc2ccccc2)cc1 ZINC000583572433 1028883032 /nfs/dbraw/zinc/88/30/32/1028883032.db2.gz IQSCKUZAJHQEPA-HGGRVWGASA-N 2 1 336.479 4.090 20 0 EIADMP C[C@@H]1C[C@@H]([NH3+])CC[N@H+]1C/C=C/c1ccc(OCc2ccccc2)cc1 ZINC000583572433 1028883041 /nfs/dbraw/zinc/88/30/41/1028883041.db2.gz IQSCKUZAJHQEPA-HGGRVWGASA-N 2 1 336.479 4.090 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccccc2OC(F)F)C1 ZINC000151127571 1029121152 /nfs/dbraw/zinc/12/11/52/1029121152.db2.gz YVJHJHZGSCRUKS-ZBFHGGJFSA-N 2 1 326.431 4.061 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+]Cc1ccc(Br)s1 ZINC000524680578 1029152844 /nfs/dbraw/zinc/15/28/44/1029152844.db2.gz GZJIIFDACGAFLA-UHFFFAOYSA-N 2 1 333.339 4.112 20 0 EIADMP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000650757785 1029210280 /nfs/dbraw/zinc/21/02/80/1029210280.db2.gz ASZWCJRAXQYRQS-OAHLLOKOSA-N 2 1 337.492 4.380 20 0 EIADMP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000278441984 1029228811 /nfs/dbraw/zinc/22/88/11/1029228811.db2.gz UTDHKWXRNOPOOX-INIZCTEOSA-N 2 1 341.474 4.193 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cc3cccc(OC)c3o2)CC1 ZINC000192844388 1029442915 /nfs/dbraw/zinc/44/29/15/1029442915.db2.gz BBAPKTVFEVIROQ-HNNXBMFYSA-N 2 1 330.472 4.357 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@@H]3c3ccccc3)C2)cc1 ZINC000475274050 1029480216 /nfs/dbraw/zinc/48/02/16/1029480216.db2.gz HKAOSXPXPKMLRO-YMPZKCBVSA-N 2 1 334.507 4.434 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475272456 1029489990 /nfs/dbraw/zinc/48/99/90/1029489990.db2.gz BSHNFTOZHSPGPY-WIYYLYMNSA-N 2 1 340.486 4.259 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCCSc3ccc(OC)cc32)CC1 ZINC000446751793 1029559489 /nfs/dbraw/zinc/55/94/89/1029559489.db2.gz MALBWPWMHKJELW-GOSISDBHSA-N 2 1 334.529 4.086 20 0 EIADMP CCC[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccn1 ZINC000158991051 1029635637 /nfs/dbraw/zinc/63/56/37/1029635637.db2.gz VAUBDZYTUBWTSU-NHCUHLMSSA-N 2 1 337.511 4.077 20 0 EIADMP CCC[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccn1 ZINC000158991051 1029635641 /nfs/dbraw/zinc/63/56/41/1029635641.db2.gz VAUBDZYTUBWTSU-NHCUHLMSSA-N 2 1 337.511 4.077 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)cc1 ZINC000584140659 1029640481 /nfs/dbraw/zinc/64/04/81/1029640481.db2.gz SBADXBSZNSHYNR-DYESRHJHSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)cc1 ZINC000584140659 1029640485 /nfs/dbraw/zinc/64/04/85/1029640485.db2.gz SBADXBSZNSHYNR-DYESRHJHSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000584140659 1029640487 /nfs/dbraw/zinc/64/04/87/1029640487.db2.gz SBADXBSZNSHYNR-DYESRHJHSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000584140659 1029640490 /nfs/dbraw/zinc/64/04/90/1029640490.db2.gz SBADXBSZNSHYNR-DYESRHJHSA-N 2 1 338.495 4.134 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Br)cc1F ZINC000446938967 1029646078 /nfs/dbraw/zinc/64/60/78/1029646078.db2.gz YSRODOJNOGTRRN-IACUBPJLSA-N 2 1 343.284 4.112 20 0 EIADMP CC(C)[NH+]1CCC(Nc2cc[nH+]c3ccc(Br)cc23)CC1 ZINC000301132783 1029675065 /nfs/dbraw/zinc/67/50/65/1029675065.db2.gz UNFNZTYAEHTNQS-UHFFFAOYSA-N 2 1 348.288 4.282 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2csc(-c3csc(C)n3)c2)CC1 ZINC000159290866 1029685949 /nfs/dbraw/zinc/68/59/49/1029685949.db2.gz MQEWOGNGLKIFCM-GFCCVEGCSA-N 2 1 335.542 4.315 20 0 EIADMP Cc1cnccc1OC1CCN(Cc2ccc([C@H]3C[C@@H]3C)o2)CC1 ZINC000447099345 1029694666 /nfs/dbraw/zinc/69/46/66/1029694666.db2.gz RANBUOBLXUGPIG-KSSFIOAISA-N 2 1 326.440 4.150 20 0 EIADMP Cc1noc(C)c1[C@H](C)C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000090764507 1029869469 /nfs/dbraw/zinc/86/94/69/1029869469.db2.gz MTGXYVBRGLUJAF-QINHECLXSA-N 2 1 341.499 4.038 20 0 EIADMP Cc1noc(C)c1[C@H](C)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000090764507 1029869470 /nfs/dbraw/zinc/86/94/70/1029869470.db2.gz MTGXYVBRGLUJAF-QINHECLXSA-N 2 1 341.499 4.038 20 0 EIADMP Fc1cccc(F)c1-c1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)o1 ZINC000092072186 1029899459 /nfs/dbraw/zinc/89/94/59/1029899459.db2.gz BMAQODBBWQSPEN-ZDUSSCGKSA-N 2 1 343.377 4.328 20 0 EIADMP Cc1cc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)c(OC(F)F)cc1C ZINC000092073656 1029899694 /nfs/dbraw/zinc/89/96/94/1029899694.db2.gz WDZLPKXJLDKUBJ-AWEZNQCLSA-N 2 1 335.398 4.008 20 0 EIADMP CC[C@H]1CCCC[C@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000181747274 1029913191 /nfs/dbraw/zinc/91/31/91/1029913191.db2.gz MPUMBANXNCPVBY-RBUKOAKNSA-N 2 1 333.520 4.062 20 0 EIADMP COc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1Cl ZINC000450728075 1029931925 /nfs/dbraw/zinc/93/19/25/1029931925.db2.gz NYJVSADYNSVNNL-HOCLYGCPSA-N 2 1 336.907 4.091 20 0 EIADMP COc1cc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1Cl ZINC000450728070 1029934056 /nfs/dbraw/zinc/93/40/56/1029934056.db2.gz NYJVSADYNSVNNL-GDBMZVCRSA-N 2 1 336.907 4.091 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390682494 1030034410 /nfs/dbraw/zinc/03/44/10/1030034410.db2.gz WINOUGHSAKZNHW-NQIIRXRSSA-N 2 1 340.511 4.491 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390682494 1030034422 /nfs/dbraw/zinc/03/44/22/1030034422.db2.gz WINOUGHSAKZNHW-NQIIRXRSSA-N 2 1 340.511 4.491 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC[N@H+]1C ZINC000447563834 1030172419 /nfs/dbraw/zinc/17/24/19/1030172419.db2.gz FWOBGAWISJEGNH-UONOGXRCSA-N 2 1 341.326 4.487 20 0 EIADMP CCOC1CCC([NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CC1 ZINC000657885665 1030183133 /nfs/dbraw/zinc/18/31/33/1030183133.db2.gz BFGFRVNBDTUSJL-JIZBTBOESA-N 2 1 336.545 4.068 20 0 EIADMP CCOC1CCC([NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CC1 ZINC000657885665 1030183149 /nfs/dbraw/zinc/18/31/49/1030183149.db2.gz BFGFRVNBDTUSJL-JIZBTBOESA-N 2 1 336.545 4.068 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccc(F)c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000526050077 1030232588 /nfs/dbraw/zinc/23/25/88/1030232588.db2.gz KGDHETITUATNCM-LPHOPBHVSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccc(F)c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000526050077 1030232611 /nfs/dbraw/zinc/23/26/11/1030232611.db2.gz KGDHETITUATNCM-LPHOPBHVSA-N 2 1 344.449 4.150 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2c(F)cccc2Cl)C[C@@H]1C ZINC000447723519 1030307798 /nfs/dbraw/zinc/30/77/98/1030307798.db2.gz PQHSWZYRNMKCGF-LSDHHAIUSA-N 2 1 326.887 4.216 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2c(F)cccc2Cl)C[C@@H]1C ZINC000447723519 1030307812 /nfs/dbraw/zinc/30/78/12/1030307812.db2.gz PQHSWZYRNMKCGF-LSDHHAIUSA-N 2 1 326.887 4.216 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2c(F)cccc2Cl)C[C@@H]1C ZINC000447723519 1030307828 /nfs/dbraw/zinc/30/78/28/1030307828.db2.gz PQHSWZYRNMKCGF-LSDHHAIUSA-N 2 1 326.887 4.216 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2c(F)cccc2Cl)C[C@@H]1C ZINC000447723517 1030309649 /nfs/dbraw/zinc/30/96/49/1030309649.db2.gz PQHSWZYRNMKCGF-GJZGRUSLSA-N 2 1 326.887 4.216 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2c(F)cccc2Cl)C[C@@H]1C ZINC000447723517 1030309671 /nfs/dbraw/zinc/30/96/71/1030309671.db2.gz PQHSWZYRNMKCGF-GJZGRUSLSA-N 2 1 326.887 4.216 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2c(F)cccc2Cl)C[C@@H]1C ZINC000447723517 1030309693 /nfs/dbraw/zinc/30/96/93/1030309693.db2.gz PQHSWZYRNMKCGF-GJZGRUSLSA-N 2 1 326.887 4.216 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000530354822 1030333300 /nfs/dbraw/zinc/33/33/00/1030333300.db2.gz KCFBFGPCQMJKMU-IBGZPJMESA-N 2 1 343.833 4.134 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(F)cc3C(F)(F)F)C2)CC1 ZINC000685462795 1030342752 /nfs/dbraw/zinc/34/27/52/1030342752.db2.gz FLHPLUOTMCXRFE-AWEZNQCLSA-N 2 1 344.396 4.008 20 0 EIADMP c1csc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000170073576 1030456907 /nfs/dbraw/zinc/45/69/07/1030456907.db2.gz CFQKSPRNMVTUEI-YQQQUEKLSA-N 2 1 326.509 4.076 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1cc(F)cc(F)c1 ZINC000527074099 1030462374 /nfs/dbraw/zinc/46/23/74/1030462374.db2.gz PPWKBYIKZFZJGP-UHFFFAOYSA-N 2 1 345.437 4.098 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCOc2ccc3ccccc3c2)C[C@@H]1C ZINC000530662944 1030621175 /nfs/dbraw/zinc/62/11/75/1030621175.db2.gz RXDWRDXVDHATOU-PXNSSMCTSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCOc2ccc3ccccc3c2)C[C@@H]1C ZINC000530662944 1030621190 /nfs/dbraw/zinc/62/11/90/1030621190.db2.gz RXDWRDXVDHATOU-PXNSSMCTSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCOc2ccc3ccccc3c2)C[C@@H]1C ZINC000530662944 1030621201 /nfs/dbraw/zinc/62/12/01/1030621201.db2.gz RXDWRDXVDHATOU-PXNSSMCTSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]([NH2+]CCCCOc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000527354937 1030663679 /nfs/dbraw/zinc/66/36/79/1030663679.db2.gz OAFPUEYSCGKFCQ-RTBURBONSA-N 2 1 330.516 4.088 20 0 EIADMP CC(C)[N@H+]1CCCC[C@H]1CN1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000451896102 1030770859 /nfs/dbraw/zinc/77/08/59/1030770859.db2.gz BCSXOPDUHYCTQG-IBGZPJMESA-N 2 1 337.596 4.082 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2ccc3cc[nH]c3c2)CC1 ZINC000527637581 1030790784 /nfs/dbraw/zinc/79/07/84/1030790784.db2.gz JSNGFWIUKXQXPX-UHFFFAOYSA-N 2 1 333.479 4.231 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccncc2Cl)C1 ZINC000527638923 1030796093 /nfs/dbraw/zinc/79/60/93/1030796093.db2.gz PCZZOYDBURDTGY-MRXNPFEDSA-N 2 1 343.902 4.257 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccncc2Cl)C1 ZINC000527638923 1030796111 /nfs/dbraw/zinc/79/61/11/1030796111.db2.gz PCZZOYDBURDTGY-MRXNPFEDSA-N 2 1 343.902 4.257 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc(F)ccc1F ZINC000122309975 1030800476 /nfs/dbraw/zinc/80/04/76/1030800476.db2.gz FQVUUBUVSGEBJT-IBGZPJMESA-N 2 1 348.437 4.146 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)c1 ZINC000658209999 1030883088 /nfs/dbraw/zinc/88/30/88/1030883088.db2.gz STMJUKSRYSHICC-CRAIPNDOSA-N 2 1 336.545 4.027 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)c1 ZINC000658210002 1030883288 /nfs/dbraw/zinc/88/32/88/1030883288.db2.gz STMJUKSRYSHICC-YJBOKZPZSA-N 2 1 336.545 4.027 20 0 EIADMP C[C@]1(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1(F)F ZINC000658223154 1030885648 /nfs/dbraw/zinc/88/56/48/1030885648.db2.gz SPHGYKJKOYLGLR-RDGPPVDQSA-N 2 1 334.454 4.207 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccccn1 ZINC000658320161 1030979740 /nfs/dbraw/zinc/97/97/40/1030979740.db2.gz OVZJZDZZTIAJMU-QUCCMNQESA-N 2 1 335.495 4.035 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccccn1 ZINC000658320161 1030979760 /nfs/dbraw/zinc/97/97/60/1030979760.db2.gz OVZJZDZZTIAJMU-QUCCMNQESA-N 2 1 335.495 4.035 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCc2c(F)cccc2Cl)CC1 ZINC000531346183 1031121287 /nfs/dbraw/zinc/12/12/87/1031121287.db2.gz KHYJGWCTBKNBCX-UHFFFAOYSA-N 2 1 326.887 4.074 20 0 EIADMP C[N@H+]1CC[C@H](NCc2cnc3ccccc3c2)C[C@@H]1c1ccccc1 ZINC000340209150 1031191223 /nfs/dbraw/zinc/19/12/23/1031191223.db2.gz IIIHEBRETUKJOW-RBBKRZOGSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cnc3ccccc3c2)C[C@@H]1c1ccccc1 ZINC000340209150 1031191230 /nfs/dbraw/zinc/19/12/30/1031191230.db2.gz IIIHEBRETUKJOW-RBBKRZOGSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cnc3ccccc3c2)C[C@@H]1c1ccccc1 ZINC000340209150 1031191239 /nfs/dbraw/zinc/19/12/39/1031191239.db2.gz IIIHEBRETUKJOW-RBBKRZOGSA-N 2 1 331.463 4.160 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)c(OCCC)c1 ZINC000532505309 1031224320 /nfs/dbraw/zinc/22/43/20/1031224320.db2.gz AWDAVHVZWRZAKF-ROUUACIJSA-N 2 1 348.531 4.257 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)c(OCCC)c1 ZINC000532505309 1031224331 /nfs/dbraw/zinc/22/43/31/1031224331.db2.gz AWDAVHVZWRZAKF-ROUUACIJSA-N 2 1 348.531 4.257 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000532506784 1031227670 /nfs/dbraw/zinc/22/76/70/1031227670.db2.gz FXUMAODPFZMWOV-ZHALLVOQSA-N 2 1 332.557 4.410 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)C2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000897451799 1031342232 /nfs/dbraw/zinc/34/22/32/1031342232.db2.gz QCJCPMQDXFCAAO-GHTZIAJQSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)C2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000897451799 1031342242 /nfs/dbraw/zinc/34/22/42/1031342242.db2.gz QCJCPMQDXFCAAO-GHTZIAJQSA-N 2 1 344.543 4.082 20 0 EIADMP CCc1ccc(C[NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)o1 ZINC000531602953 1031406201 /nfs/dbraw/zinc/40/62/01/1031406201.db2.gz PNCBHILCMLEUFH-KRWDZBQOSA-N 2 1 326.484 4.364 20 0 EIADMP Clc1ccc(C2=CC[C@@H]([NH2+]C[C@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000449074346 1031427124 /nfs/dbraw/zinc/42/71/24/1031427124.db2.gz KPBATSWRXUUFFB-DNVCBOLYSA-N 2 1 330.903 4.350 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H](C)[C@H]3CCCC[C@@H]3C)CC2)oc1C ZINC000449123519 1031461157 /nfs/dbraw/zinc/46/11/57/1031461157.db2.gz NIJAEHUGBAJREP-VPWXQRGCSA-N 2 1 347.547 4.308 20 0 EIADMP Cc1nn(C)cc1[C@H](C)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449131318 1031465944 /nfs/dbraw/zinc/46/59/44/1031465944.db2.gz LUYGWTSIGQOTJA-HNNXBMFYSA-N 2 1 334.552 4.058 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449131135 1031467458 /nfs/dbraw/zinc/46/74/58/1031467458.db2.gz KHIGTBUXYXMVDT-QGZVFWFLSA-N 2 1 348.412 4.333 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)C1CCOCC1 ZINC000531682141 1031473410 /nfs/dbraw/zinc/47/34/10/1031473410.db2.gz HNOMNZUCSCQWCA-GCJKJVERSA-N 2 1 344.543 4.356 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1cccc(OC)c1 ZINC000123910944 1031493350 /nfs/dbraw/zinc/49/33/50/1031493350.db2.gz YNSPASMOJZOVDZ-OAQYLSRUSA-N 2 1 326.484 4.388 20 0 EIADMP Cc1ccc(N2CCC([NH2+]C[C@H](C)c3cc(F)cc(F)c3)CC2)[nH+]c1 ZINC000449165901 1031507510 /nfs/dbraw/zinc/50/75/10/1031507510.db2.gz YALHTNLGJDAIQG-HNNXBMFYSA-N 2 1 345.437 4.030 20 0 EIADMP C[C@@H](CCCc1cccnc1)[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000453070103 1031535350 /nfs/dbraw/zinc/53/53/50/1031535350.db2.gz ZVUABRYSDLFWLO-ZCNNSNEGSA-N 2 1 331.548 4.141 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1nc2cc(C)ccc2s1 ZINC000528472360 1031556260 /nfs/dbraw/zinc/55/62/60/1031556260.db2.gz DFLQHVJYPHMMPI-UHFFFAOYSA-N 2 1 342.512 4.276 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1nc2cc(C)ccc2s1 ZINC000528472360 1031556267 /nfs/dbraw/zinc/55/62/67/1031556267.db2.gz DFLQHVJYPHMMPI-UHFFFAOYSA-N 2 1 342.512 4.276 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccncc1 ZINC000453079037 1031565953 /nfs/dbraw/zinc/56/59/53/1031565953.db2.gz CIZXMCBSNUAAKK-APWZRJJASA-N 2 1 329.513 4.096 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccncc1 ZINC000453079037 1031565970 /nfs/dbraw/zinc/56/59/70/1031565970.db2.gz CIZXMCBSNUAAKK-APWZRJJASA-N 2 1 329.513 4.096 20 0 EIADMP CC(C)OCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453194481 1031702372 /nfs/dbraw/zinc/70/23/72/1031702372.db2.gz NNTVXDIWILJMOG-BHDDXSALSA-N 2 1 344.543 4.224 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c(C)s1 ZINC000128088674 1031725004 /nfs/dbraw/zinc/72/50/04/1031725004.db2.gz AIRVXDGFLMGPBL-OAHLLOKOSA-N 2 1 329.513 4.388 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722217 1031810385 /nfs/dbraw/zinc/81/03/85/1031810385.db2.gz XZJVDXRCUWTYPC-UHFFFAOYSA-N 2 1 337.389 4.049 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722217 1031810388 /nfs/dbraw/zinc/81/03/88/1031810388.db2.gz XZJVDXRCUWTYPC-UHFFFAOYSA-N 2 1 337.389 4.049 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000453346495 1031873584 /nfs/dbraw/zinc/87/35/84/1031873584.db2.gz KJUNJEBNFSURMU-YCXXCVGLSA-N 2 1 334.891 4.077 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453346495 1031873590 /nfs/dbraw/zinc/87/35/90/1031873590.db2.gz KJUNJEBNFSURMU-YCXXCVGLSA-N 2 1 334.891 4.077 20 0 EIADMP CC(C)CCOc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000453349728 1031876424 /nfs/dbraw/zinc/87/64/24/1031876424.db2.gz LWPZXBKNKPUGJH-OHSMVPPVSA-N 2 1 330.516 4.387 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531963219 1031884088 /nfs/dbraw/zinc/88/40/88/1031884088.db2.gz CTLJBTYWOUYBOW-XYPHTWIQSA-N 2 1 328.422 4.475 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531963219 1031884091 /nfs/dbraw/zinc/88/40/91/1031884091.db2.gz CTLJBTYWOUYBOW-XYPHTWIQSA-N 2 1 328.422 4.475 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Br)s1 ZINC000453404705 1031939743 /nfs/dbraw/zinc/93/97/43/1031939743.db2.gz BPBUQMMDGBWDMP-NSHDSACASA-N 2 1 331.323 4.036 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1csc(-c2ccccc2F)n1 ZINC000453416385 1031951754 /nfs/dbraw/zinc/95/17/54/1031951754.db2.gz XMMUMLIGZXHUEB-AWEZNQCLSA-N 2 1 347.503 4.474 20 0 EIADMP Clc1ccc2c(c1Cl)CC[C@H]2[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000152482622 1031984133 /nfs/dbraw/zinc/98/41/33/1031984133.db2.gz VEJXYTHYOAXBBJ-BDJLRTHQSA-N 2 1 325.283 4.055 20 0 EIADMP Cc1cc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c2ccccc2[nH+]1 ZINC000432930768 1033437860 /nfs/dbraw/zinc/43/78/60/1033437860.db2.gz ZZVLXFMMDDIARA-UHFFFAOYSA-N 2 1 346.478 4.460 20 0 EIADMP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+]CC4CCSCC4)[C@@H]3C2)cc1 ZINC000512612344 1033492251 /nfs/dbraw/zinc/49/22/51/1033492251.db2.gz OMBCFARABUWQKZ-HBMCJLEFSA-N 2 1 344.568 4.020 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(SC(F)F)cc1 ZINC000178706751 1033695677 /nfs/dbraw/zinc/69/56/77/1033695677.db2.gz MZRNSDINBRDMDL-QWHCGFSZSA-N 2 1 339.455 4.493 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(SC(F)F)cc1 ZINC000178706762 1033697227 /nfs/dbraw/zinc/69/72/27/1033697227.db2.gz MZRNSDINBRDMDL-CHWSQXEVSA-N 2 1 339.455 4.493 20 0 EIADMP CC(C)[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CCOCC1 ZINC000411384095 1033870929 /nfs/dbraw/zinc/87/09/29/1033870929.db2.gz HDHNWKSVHBCKEI-UHFFFAOYSA-N 2 1 330.516 4.062 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000512800246 1033982462 /nfs/dbraw/zinc/98/24/62/1033982462.db2.gz YYCAAYSOQRXQIB-CQSZACIVSA-N 2 1 334.916 4.500 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000513053791 1034372641 /nfs/dbraw/zinc/37/26/41/1034372641.db2.gz YIPUERXUFQKWHR-FXAWDEMLSA-N 2 1 333.479 4.311 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000513216689 1034832701 /nfs/dbraw/zinc/83/27/01/1034832701.db2.gz GWTBOYIXNDELRX-IJXRJRJASA-N 2 1 332.557 4.303 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000513216689 1034832703 /nfs/dbraw/zinc/83/27/03/1034832703.db2.gz GWTBOYIXNDELRX-IJXRJRJASA-N 2 1 332.557 4.303 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CSc3ccccc32)CC1 ZINC000513208003 1034835841 /nfs/dbraw/zinc/83/58/41/1034835841.db2.gz KNNBKALTEUMZDL-MNEFBYGVSA-N 2 1 330.541 4.466 20 0 EIADMP CCOc1ccccc1C[N@@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC000513496144 1034986823 /nfs/dbraw/zinc/98/68/23/1034986823.db2.gz AEHPDHWKPPWMKO-UHFFFAOYSA-N 2 1 338.495 4.182 20 0 EIADMP COc1ccccc1C[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513500033 1034999043 /nfs/dbraw/zinc/99/90/43/1034999043.db2.gz KMYKOPSBVDGDAS-QUCCMNQESA-N 2 1 338.495 4.086 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]C4CCSCC4)[C@H]3C2)cc1 ZINC000513683638 1035099905 /nfs/dbraw/zinc/09/99/05/1035099905.db2.gz LUBPYKMVIWMFOB-SESVDKBCSA-N 2 1 344.568 4.162 20 0 EIADMP C[N@H+](Cc1cccc(Cl)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501030099 1035348243 /nfs/dbraw/zinc/34/82/43/1035348243.db2.gz KOWAXALREFVCOJ-UHFFFAOYSA-N 2 1 329.875 4.083 20 0 EIADMP C[N@H+](C[C@@H]1CC[NH2+]C1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000647890779 1035393947 /nfs/dbraw/zinc/39/39/47/1035393947.db2.gz RGEXVLPMSSQZMA-AUUYWEPGSA-N 2 1 332.850 4.110 20 0 EIADMP C[N@@H+](C[C@@H]1CC[NH2+]C1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000647890779 1035393952 /nfs/dbraw/zinc/39/39/52/1035393952.db2.gz RGEXVLPMSSQZMA-AUUYWEPGSA-N 2 1 332.850 4.110 20 0 EIADMP Fc1ccc(Cl)c(Cl)c1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204735349 1035406311 /nfs/dbraw/zinc/40/63/11/1035406311.db2.gz PWPYYYIVHCJFFT-UHFFFAOYSA-N 2 1 331.262 4.098 20 0 EIADMP Fc1ccc(Cl)c(Cl)c1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204735349 1035406313 /nfs/dbraw/zinc/40/63/13/1035406313.db2.gz PWPYYYIVHCJFFT-UHFFFAOYSA-N 2 1 331.262 4.098 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000501423736 1035443195 /nfs/dbraw/zinc/44/31/95/1035443195.db2.gz OJDHFAZUHJSFJS-QZFKAFNDSA-N 2 1 340.433 4.430 20 0 EIADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3nc(-c4ccccc4Cl)cs3)C[C@@H]21 ZINC000420302381 1035503143 /nfs/dbraw/zinc/50/31/43/1035503143.db2.gz FUOFVAXWRFCLFU-IVMMDQJWSA-N 2 1 347.915 4.023 20 0 EIADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4ccccc4Cl)cs3)C[C@@H]21 ZINC000420302381 1035503151 /nfs/dbraw/zinc/50/31/51/1035503151.db2.gz FUOFVAXWRFCLFU-IVMMDQJWSA-N 2 1 347.915 4.023 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420302786 1035505393 /nfs/dbraw/zinc/50/53/93/1035505393.db2.gz GOBOQPVHVMSESW-OSAQELSMSA-N 2 1 333.863 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@@H]([C@@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420302786 1035505407 /nfs/dbraw/zinc/50/54/07/1035505407.db2.gz GOBOQPVHVMSESW-OSAQELSMSA-N 2 1 333.863 4.034 20 0 EIADMP c1csc([C@@H]2c3ccsc3CC[N@@H+]2CC[C@@H]2CCC[NH2+]C2)c1 ZINC000420320518 1035511857 /nfs/dbraw/zinc/51/18/57/1035511857.db2.gz QKXLOIGOHNMZMQ-KSSFIOAISA-N 2 1 332.538 4.147 20 0 EIADMP Brc1ccc([C@H]2CCC[N@H+]2CC[C@H]2CCC[NH2+]C2)s1 ZINC000420372161 1035555419 /nfs/dbraw/zinc/55/54/19/1035555419.db2.gz LGSBFONKUOMVFO-CHWSQXEVSA-N 2 1 343.334 4.037 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ncc(C[NH+](C)C)s2)C[C@@H](c2ccccc2)C1 ZINC000414507619 1036222824 /nfs/dbraw/zinc/22/28/24/1036222824.db2.gz BHLYRRVTUOUMIR-RYQLBKOJSA-N 2 1 343.540 4.267 20 0 EIADMP FC(F)C1CCC([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000669614284 1036242714 /nfs/dbraw/zinc/24/27/14/1036242714.db2.gz ZGNMGWXMSNSPFP-LMDPOFIKSA-N 2 1 336.470 4.312 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CC23CCSCC3)cc1 ZINC000421374269 1036324950 /nfs/dbraw/zinc/32/49/50/1036324950.db2.gz HGLZTJSBLGMTCT-QAPCUYQASA-N 2 1 341.524 4.365 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3cccc(C4CC4)c3)CC2)n2c1CCCC2 ZINC000421405998 1036374097 /nfs/dbraw/zinc/37/40/97/1036374097.db2.gz ZKBRPJWWHITUJA-UHFFFAOYSA-N 2 1 335.495 4.476 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2ccc(F)cc2F)CCCC1 ZINC000486079825 1036466974 /nfs/dbraw/zinc/46/69/74/1036466974.db2.gz QGLMYQLUFRVJFR-CLCXKQKWSA-N 2 1 336.470 4.095 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000572243019 1036469765 /nfs/dbraw/zinc/46/97/65/1036469765.db2.gz HHUBFJPLNPPRPW-IAGOWNOFSA-N 2 1 333.545 4.012 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@H+](C)[C@H]2CCCC[C@H]2c2ccccc2)s1 ZINC000414535011 1036563381 /nfs/dbraw/zinc/56/33/81/1036563381.db2.gz VYRZTDZVOQIZBP-OALUTQOASA-N 2 1 343.540 4.363 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@@H+](C)[C@H]2CCCC[C@H]2c2ccccc2)s1 ZINC000414535011 1036563415 /nfs/dbraw/zinc/56/34/15/1036563415.db2.gz VYRZTDZVOQIZBP-OALUTQOASA-N 2 1 343.540 4.363 20 0 EIADMP CC[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1(SC)CCC1 ZINC000589503842 1036805178 /nfs/dbraw/zinc/80/51/78/1036805178.db2.gz YBSNPHSYFPEUOM-IBGZPJMESA-N 2 1 332.557 4.116 20 0 EIADMP CC[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC1(SC)CCC1 ZINC000589503842 1036805179 /nfs/dbraw/zinc/80/51/79/1036805179.db2.gz YBSNPHSYFPEUOM-IBGZPJMESA-N 2 1 332.557 4.116 20 0 EIADMP CC[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC1(SC)CCC1 ZINC000589503842 1036805181 /nfs/dbraw/zinc/80/51/81/1036805181.db2.gz YBSNPHSYFPEUOM-IBGZPJMESA-N 2 1 332.557 4.116 20 0 EIADMP C[C@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000486719640 1036825981 /nfs/dbraw/zinc/82/59/81/1036825981.db2.gz HMXVBOGXCOTLFH-HOCLYGCPSA-N 2 1 329.463 4.050 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc3[nH]cnc3c2)C1 ZINC000589642041 1036858072 /nfs/dbraw/zinc/85/80/72/1036858072.db2.gz ZEUMBBCITINOLJ-KRWDZBQOSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc3nc[nH]c3c2)C1 ZINC000589642041 1036858074 /nfs/dbraw/zinc/85/80/74/1036858074.db2.gz ZEUMBBCITINOLJ-KRWDZBQOSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc3nc[nH]c3c2)C1 ZINC000589642041 1036858076 /nfs/dbraw/zinc/85/80/76/1036858076.db2.gz ZEUMBBCITINOLJ-KRWDZBQOSA-N 2 1 348.494 4.085 20 0 EIADMP Clc1ccc(C2([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)cc1Cl ZINC000272025615 1037083454 /nfs/dbraw/zinc/08/34/54/1037083454.db2.gz YRSFKTINSHIBJO-KBPBESRZSA-N 2 1 325.283 4.199 20 0 EIADMP Clc1ccc(C2([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CC2)cc1Cl ZINC000272025615 1037083468 /nfs/dbraw/zinc/08/34/68/1037083468.db2.gz YRSFKTINSHIBJO-KBPBESRZSA-N 2 1 325.283 4.199 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000272298755 1037152330 /nfs/dbraw/zinc/15/23/30/1037152330.db2.gz GNLATBODLQRPQL-HBFSDRIKSA-N 2 1 340.515 4.025 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000591711908 1037558613 /nfs/dbraw/zinc/55/86/13/1037558613.db2.gz CDLUMEJZJKLGKA-INIZCTEOSA-N 2 1 330.447 4.296 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000591711908 1037558628 /nfs/dbraw/zinc/55/86/28/1037558628.db2.gz CDLUMEJZJKLGKA-INIZCTEOSA-N 2 1 330.447 4.296 20 0 EIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)CS1 ZINC000488434575 1037593103 /nfs/dbraw/zinc/59/31/03/1037593103.db2.gz JEAZSXIEQXQFOE-AABGKKOBSA-N 2 1 346.584 4.061 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CS[C@@H](C(C)C)C2)CC1 ZINC000488449920 1037607124 /nfs/dbraw/zinc/60/71/24/1037607124.db2.gz PJYSOXGRURLBFB-VQTJNVASSA-N 2 1 332.557 4.079 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414656111 1037693073 /nfs/dbraw/zinc/69/30/73/1037693073.db2.gz MJLWOYBJKPEERZ-WCRBZPEASA-N 2 1 336.479 4.077 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414656111 1037693079 /nfs/dbraw/zinc/69/30/79/1037693079.db2.gz MJLWOYBJKPEERZ-WCRBZPEASA-N 2 1 336.479 4.077 20 0 EIADMP CSCCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000592366606 1037774177 /nfs/dbraw/zinc/77/41/77/1037774177.db2.gz CCTQLDOBWLTQHF-LJQANCHMSA-N 2 1 332.557 4.307 20 0 EIADMP CSCCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000592366606 1037774182 /nfs/dbraw/zinc/77/41/82/1037774182.db2.gz CCTQLDOBWLTQHF-LJQANCHMSA-N 2 1 332.557 4.307 20 0 EIADMP Cc1nc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)oc1-c1ccc(Cl)cc1 ZINC000422625616 1037784080 /nfs/dbraw/zinc/78/40/80/1037784080.db2.gz BZDKDVQCACVCHK-XEZPLFJOSA-N 2 1 347.890 4.109 20 0 EIADMP Cc1nc(C[N@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)oc1-c1ccc(Cl)cc1 ZINC000422625616 1037784102 /nfs/dbraw/zinc/78/41/02/1037784102.db2.gz BZDKDVQCACVCHK-XEZPLFJOSA-N 2 1 347.890 4.109 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CN[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422885707 1037853581 /nfs/dbraw/zinc/85/35/81/1037853581.db2.gz UZHWUEWLEJXHDK-ZQMYSKGWSA-N 2 1 349.522 4.295 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CN[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422885702 1037854867 /nfs/dbraw/zinc/85/48/67/1037854867.db2.gz UZHWUEWLEJXHDK-NLSFWIRASA-N 2 1 349.522 4.295 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)c1cccc(OC(F)(F)F)c1 ZINC000422928647 1037873404 /nfs/dbraw/zinc/87/34/04/1037873404.db2.gz LVGQDLNBRIVMCG-GOPGUHFVSA-N 2 1 336.357 4.381 20 0 EIADMP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423052557 1037938112 /nfs/dbraw/zinc/93/81/12/1037938112.db2.gz QSANYEQCZBHXHY-HUBLWGQQSA-N 2 1 333.476 4.042 20 0 EIADMP CC[N@@H+](Cc1ccc(Oc2cccnc2)c(C)c1)[C@H]1CCC[NH2+]CC1 ZINC000414720188 1038003910 /nfs/dbraw/zinc/00/39/10/1038003910.db2.gz XLLXKIFZYSJGIF-IBGZPJMESA-N 2 1 339.483 4.146 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000503940530 1038026638 /nfs/dbraw/zinc/02/66/38/1038026638.db2.gz ABVQAJAAEWPXAK-NTCAYCPXSA-N 2 1 340.433 4.382 20 0 EIADMP CCSc1ccc([C@H](C)[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000423181472 1038033185 /nfs/dbraw/zinc/03/31/85/1038033185.db2.gz CXYPWNUSYKBOMJ-INIZCTEOSA-N 2 1 329.513 4.024 20 0 EIADMP CCSc1ccccc1[C@H](C)[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000423191568 1038047424 /nfs/dbraw/zinc/04/74/24/1038047424.db2.gz SXRQOMWQSBUYFE-INIZCTEOSA-N 2 1 329.513 4.024 20 0 EIADMP CSc1cccc([C@H]([NH2+]CC[C@H](C)[NH3+])c2ccc(F)c(F)c2)c1 ZINC000423223656 1038067742 /nfs/dbraw/zinc/06/77/42/1038067742.db2.gz HARKXQRFMCBTMZ-SGTLLEGYSA-N 2 1 336.451 4.103 20 0 EIADMP CCC([NH3+])(CC)C[NH2+][C@H](C)c1sc(Cc2ccccc2)nc1C ZINC000423287467 1038090920 /nfs/dbraw/zinc/09/09/20/1038090920.db2.gz MLXUJWOHFWPFQC-CQSZACIVSA-N 2 1 331.529 4.210 20 0 EIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+][C@H](C[NH3+])C1CC1 ZINC000423268038 1038094617 /nfs/dbraw/zinc/09/46/17/1038094617.db2.gz DHFDXIINPPMPHN-MEBBXXQBSA-N 2 1 335.904 4.160 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCc3cc(N)ccc32)cc1 ZINC000423344725 1038136741 /nfs/dbraw/zinc/13/67/41/1038136741.db2.gz FMNZFCLQCZPLAZ-NYHFZMIOSA-N 2 1 346.478 4.491 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423374373 1038157083 /nfs/dbraw/zinc/15/70/83/1038157083.db2.gz JVXIMSJXLCFBIW-BFYDXBDKSA-N 2 1 328.431 4.409 20 0 EIADMP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc3c(c2)C[NH2+]C3)CC1 ZINC000423364415 1038176768 /nfs/dbraw/zinc/17/67/68/1038176768.db2.gz APTNSZFUDYWHDY-UHFFFAOYSA-N 3 1 343.559 4.059 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc2c1CCCN2 ZINC000423422167 1038210932 /nfs/dbraw/zinc/21/09/32/1038210932.db2.gz YKFWFZVBRHMVBX-XMSQKQJNSA-N 2 1 349.522 4.045 20 0 EIADMP C[C@@H]([NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)[C@H](C)[NH3+] ZINC000423454649 1038254232 /nfs/dbraw/zinc/25/42/32/1038254232.db2.gz ZHRIHOYPAZFEAQ-WDMOLILDSA-N 2 1 335.904 4.166 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(OC(F)F)c2)C1 ZINC000539050701 1038797206 /nfs/dbraw/zinc/79/72/06/1038797206.db2.gz QBZXBNXLVIXRNG-HZPDHXFCSA-N 2 1 340.458 4.307 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000539062198 1038808090 /nfs/dbraw/zinc/80/80/90/1038808090.db2.gz UAVTUBRMVJENGW-PFHNCQMRSA-N 2 1 346.518 4.073 20 0 EIADMP CO[C@H]1C[C@H]2C[C@@H]([NH2+][C@H](C)c3ccc(-n4cc[nH+]c4C)cc3)C[C@H]2C1 ZINC000424307194 1038813564 /nfs/dbraw/zinc/81/35/64/1038813564.db2.gz XAMHQQCIEMMKDK-VPRICQMDSA-N 2 1 339.483 4.035 20 0 EIADMP CO[C@H]1C[C@H]2C[C@H]([NH2+][C@@H](C)c3ccc(-n4cc[nH+]c4C)cc3)C[C@H]2C1 ZINC000424307189 1038814076 /nfs/dbraw/zinc/81/40/76/1038814076.db2.gz XAMHQQCIEMMKDK-UZONEZLJSA-N 2 1 339.483 4.035 20 0 EIADMP Brc1cccc(C2([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CCC2)c1 ZINC000252734255 1038860174 /nfs/dbraw/zinc/86/01/74/1038860174.db2.gz GLCNSMUQVVOPGN-IRXDYDNUSA-N 2 1 349.316 4.045 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539201326 1038878109 /nfs/dbraw/zinc/87/81/09/1038878109.db2.gz WTWIIUSWZHCSHY-KBXCAEBGSA-N 2 1 340.433 4.478 20 0 EIADMP C[N@@H+](Cc1cccc2[nH]ccc21)C1CCN(Cc2ccccc2)CC1 ZINC000119332681 1038886808 /nfs/dbraw/zinc/88/68/08/1038886808.db2.gz KXPUVJKOIUMWSA-UHFFFAOYSA-N 2 1 333.479 4.264 20 0 EIADMP C[N@H+](Cc1cccc2[nH]ccc21)C1CC[NH+](Cc2ccccc2)CC1 ZINC000119332681 1038886812 /nfs/dbraw/zinc/88/68/12/1038886812.db2.gz KXPUVJKOIUMWSA-UHFFFAOYSA-N 2 1 333.479 4.264 20 0 EIADMP C[N@@H+](Cc1cccc2[nH]ccc21)C1CC[NH+](Cc2ccccc2)CC1 ZINC000119332681 1038886819 /nfs/dbraw/zinc/88/68/19/1038886819.db2.gz KXPUVJKOIUMWSA-UHFFFAOYSA-N 2 1 333.479 4.264 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CCSC[C@H]2c2cccc(Cl)c2)CC1 ZINC001168327561 1038898003 /nfs/dbraw/zinc/89/80/03/1038898003.db2.gz OQZBDRJLLGDFBC-ABHNRTSZSA-N 2 1 338.948 4.303 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537620567 1038954037 /nfs/dbraw/zinc/95/40/37/1038954037.db2.gz YZBVTCGVENBGLC-GOSISDBHSA-N 2 1 326.484 4.012 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537620567 1038954071 /nfs/dbraw/zinc/95/40/71/1038954071.db2.gz YZBVTCGVENBGLC-GOSISDBHSA-N 2 1 326.484 4.012 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537620567 1038954100 /nfs/dbraw/zinc/95/41/00/1038954100.db2.gz YZBVTCGVENBGLC-GOSISDBHSA-N 2 1 326.484 4.012 20 0 EIADMP FC(F)(F)c1cccc(C2([NH2+]C3CC[NH+](CC4CC4)CC3)CC2)c1 ZINC001168360158 1038959743 /nfs/dbraw/zinc/95/97/43/1038959743.db2.gz KTYNXVYOAJIIMC-UHFFFAOYSA-N 2 1 338.417 4.159 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccc(Br)cc2)C1 ZINC000481027708 1038969484 /nfs/dbraw/zinc/96/94/84/1038969484.db2.gz WRTCKLVHDILORN-PBHICJAKSA-N 2 1 339.321 4.222 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)sc1C ZINC000088594449 1038976644 /nfs/dbraw/zinc/97/66/44/1038976644.db2.gz WKNQSUDYMFLBOQ-UHFFFAOYSA-N 2 1 343.540 4.104 20 0 EIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537620905 1038977225 /nfs/dbraw/zinc/97/72/25/1038977225.db2.gz ITTHKUMTCAMYAX-LJQANCHMSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537620905 1038977273 /nfs/dbraw/zinc/97/72/73/1038977273.db2.gz ITTHKUMTCAMYAX-LJQANCHMSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537620905 1038977303 /nfs/dbraw/zinc/97/73/03/1038977303.db2.gz ITTHKUMTCAMYAX-LJQANCHMSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537620905 1038977328 /nfs/dbraw/zinc/97/73/28/1038977328.db2.gz ITTHKUMTCAMYAX-LJQANCHMSA-N 2 1 330.516 4.172 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2cccc(Br)c21 ZINC000119706770 1038993649 /nfs/dbraw/zinc/99/36/49/1038993649.db2.gz ZNGGJANLINMNIY-SJKOYZFVSA-N 2 1 349.316 4.214 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)[C@@H]2CCC[C@H]21 ZINC000552057361 1039075695 /nfs/dbraw/zinc/07/56/95/1039075695.db2.gz QDNPBNQPRRABEN-YTQUADARSA-N 2 1 328.431 4.048 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1cccc(F)c1 ZINC000481184835 1039086759 /nfs/dbraw/zinc/08/67/59/1039086759.db2.gz GAMOIFNXJKCGGH-PGRDOPGGSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1cccc(F)c1 ZINC000481184835 1039086779 /nfs/dbraw/zinc/08/67/79/1039086779.db2.gz GAMOIFNXJKCGGH-PGRDOPGGSA-N 2 1 340.486 4.259 20 0 EIADMP CN(CC[C@H]1CCCC[N@H+]1C)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000537632306 1039215806 /nfs/dbraw/zinc/21/58/06/1039215806.db2.gz JKGFGELRMVYSNP-GOSISDBHSA-N 2 1 346.906 4.036 20 0 EIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000537632306 1039215831 /nfs/dbraw/zinc/21/58/31/1039215831.db2.gz JKGFGELRMVYSNP-GOSISDBHSA-N 2 1 346.906 4.036 20 0 EIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000537632306 1039215846 /nfs/dbraw/zinc/21/58/46/1039215846.db2.gz JKGFGELRMVYSNP-GOSISDBHSA-N 2 1 346.906 4.036 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000537632306 1039215856 /nfs/dbraw/zinc/21/58/56/1039215856.db2.gz JKGFGELRMVYSNP-GOSISDBHSA-N 2 1 346.906 4.036 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000537632306 1039215873 /nfs/dbraw/zinc/21/58/73/1039215873.db2.gz JKGFGELRMVYSNP-GOSISDBHSA-N 2 1 346.906 4.036 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccc(Br)s1 ZINC000477931948 1039220737 /nfs/dbraw/zinc/22/07/37/1039220737.db2.gz DKVLTWPILGXHMS-LBPRGKRZSA-N 2 1 345.350 4.283 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1cccc(C(F)(F)F)c1 ZINC000481325249 1039293386 /nfs/dbraw/zinc/29/33/86/1039293386.db2.gz VBJJTDJWJMBBMT-YOEHRIQHSA-N 2 1 328.422 4.478 20 0 EIADMP COC(C)(C)C[C@@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000552244438 1039310047 /nfs/dbraw/zinc/31/00/47/1039310047.db2.gz AHHRXHYIHVNDAN-QHGAOEGBSA-N 2 1 332.532 4.223 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550798004 1039313017 /nfs/dbraw/zinc/31/30/17/1039313017.db2.gz UZERYWRDMFHCAU-IKGGRYGDSA-N 2 1 328.422 4.389 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550798004 1039313033 /nfs/dbraw/zinc/31/30/33/1039313033.db2.gz UZERYWRDMFHCAU-IKGGRYGDSA-N 2 1 328.422 4.389 20 0 EIADMP C[C@@H]1C[C@H](N(C)Cc2ccc(Cl)o2)CC[N@H+]1Cc1ccccc1 ZINC000552256656 1039318121 /nfs/dbraw/zinc/31/81/21/1039318121.db2.gz WJTLDRFBMCGRFR-NVXWUHKLSA-N 2 1 332.875 4.418 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(F)cc2C(F)(F)F)C[C@@H]1C ZINC000552290462 1039344909 /nfs/dbraw/zinc/34/49/09/1039344909.db2.gz JSZPCAZOOMYOTK-SWLSCSKDSA-N 2 1 332.385 4.149 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@@H]1C ZINC000552290462 1039344928 /nfs/dbraw/zinc/34/49/28/1039344928.db2.gz JSZPCAZOOMYOTK-SWLSCSKDSA-N 2 1 332.385 4.149 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@@H]1C ZINC000552290462 1039344942 /nfs/dbraw/zinc/34/49/42/1039344942.db2.gz JSZPCAZOOMYOTK-SWLSCSKDSA-N 2 1 332.385 4.149 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@@H]1C ZINC000552290462 1039344957 /nfs/dbraw/zinc/34/49/57/1039344957.db2.gz JSZPCAZOOMYOTK-SWLSCSKDSA-N 2 1 332.385 4.149 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@@H]1C ZINC000552290462 1039344973 /nfs/dbraw/zinc/34/49/73/1039344973.db2.gz JSZPCAZOOMYOTK-SWLSCSKDSA-N 2 1 332.385 4.149 20 0 EIADMP CCCCc1noc([C@@H](C)[NH+]2CCC(CCC[NH+]3CCCC3)CC2)n1 ZINC000121780556 1039418642 /nfs/dbraw/zinc/41/86/42/1039418642.db2.gz RGNPZZRPBCRUMI-QGZVFWFLSA-N 2 1 348.535 4.061 20 0 EIADMP Clc1ccc(C2CCC([N@H+]3CCc4[nH+]ccn4CC3)CC2)cc1 ZINC001168347189 1039464649 /nfs/dbraw/zinc/46/46/49/1039464649.db2.gz HXXILUAHHHRLTA-UHFFFAOYSA-N 2 1 329.875 4.121 20 0 EIADMP Clc1ccc(C2CCC([N@@H+]3CCc4[nH+]ccn4CC3)CC2)cc1 ZINC001168347189 1039464674 /nfs/dbraw/zinc/46/46/74/1039464674.db2.gz HXXILUAHHHRLTA-UHFFFAOYSA-N 2 1 329.875 4.121 20 0 EIADMP C[N@H+](C[C@@H]1CCCC(F)(F)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000514074978 1039554753 /nfs/dbraw/zinc/55/47/53/1039554753.db2.gz XQQVDCGHCXAUBF-GOSISDBHSA-N 2 1 336.470 4.408 20 0 EIADMP C[N@@H+](C[C@@H]1CCCC(F)(F)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000514074978 1039554775 /nfs/dbraw/zinc/55/47/75/1039554775.db2.gz XQQVDCGHCXAUBF-GOSISDBHSA-N 2 1 336.470 4.408 20 0 EIADMP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)o2)CC1 ZINC000550846634 1039589131 /nfs/dbraw/zinc/58/91/31/1039589131.db2.gz KWJOSLIQEZQOSL-UHFFFAOYSA-N 2 1 332.875 4.455 20 0 EIADMP CC1(c2ccccc2)CC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000545961341 1039596354 /nfs/dbraw/zinc/59/63/54/1039596354.db2.gz VZDGCJWOUJSVIB-UHFFFAOYSA-N 2 1 334.507 4.361 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@H+]1C ZINC000122161484 1039604741 /nfs/dbraw/zinc/60/47/41/1039604741.db2.gz QHKXXMRBHYNJQP-YOEHRIQHSA-N 2 1 340.433 4.199 20 0 EIADMP C[C@@H](c1nc(C(C)(C)C)no1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000122155274 1039605345 /nfs/dbraw/zinc/60/53/45/1039605345.db2.gz KLMSIVDFVFBYDW-INIZCTEOSA-N 2 1 348.535 4.016 20 0 EIADMP C[N@H+](Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CC2CC2)CC1 ZINC000534690223 1039682814 /nfs/dbraw/zinc/68/28/14/1039682814.db2.gz FVBOMCIBMKHKSN-UHFFFAOYSA-N 2 1 326.406 4.012 20 0 EIADMP C[N@@H+](Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CC2CC2)CC1 ZINC000534690223 1039682864 /nfs/dbraw/zinc/68/28/64/1039682864.db2.gz FVBOMCIBMKHKSN-UHFFFAOYSA-N 2 1 326.406 4.012 20 0 EIADMP C[C@@H]1C[C@@H](Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC[N@H+]1C ZINC000899874946 1039757788 /nfs/dbraw/zinc/75/77/88/1039757788.db2.gz QKHDSSPNTCLBMC-NEPJUHHUSA-N 2 1 339.361 4.028 20 0 EIADMP CC(C)CSCCC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434669342 1039804240 /nfs/dbraw/zinc/80/42/40/1039804240.db2.gz IIKCUWRBGWYUEE-UHFFFAOYSA-N 2 1 335.561 4.178 20 0 EIADMP COc1ccc2cc(C[N@H+]3CC[C@H](C[NH+](C)CC4CC4)C3)ccc2c1 ZINC000537647429 1039805652 /nfs/dbraw/zinc/80/56/52/1039805652.db2.gz QEGSYDFFWRBRFI-LJQANCHMSA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc2cc(C[NH+]3CC[C@H](C[N@H+](C)CC4CC4)C3)ccc2c1 ZINC000537647429 1039805658 /nfs/dbraw/zinc/80/56/58/1039805658.db2.gz QEGSYDFFWRBRFI-LJQANCHMSA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc2cc(C[NH+]3CC[C@H](C[N@@H+](C)CC4CC4)C3)ccc2c1 ZINC000537647429 1039805662 /nfs/dbraw/zinc/80/56/62/1039805662.db2.gz QEGSYDFFWRBRFI-LJQANCHMSA-N 2 1 338.495 4.012 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537647469 1039808699 /nfs/dbraw/zinc/80/86/99/1039808699.db2.gz OGEZZRWBZKTVDE-GOSISDBHSA-N 2 1 326.484 4.012 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C[C@@H]3CCc4ccccc4C3)CC2)cc1 ZINC000643377319 1039847332 /nfs/dbraw/zinc/84/73/32/1039847332.db2.gz CLKPLHBSPWZAJN-OAQYLSRUSA-N 2 1 348.534 4.088 20 0 EIADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000550992200 1039857071 /nfs/dbraw/zinc/85/70/71/1039857071.db2.gz CCWSVMLWNGMBKW-CYBMUJFWSA-N 2 1 334.813 4.179 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000550992200 1039857075 /nfs/dbraw/zinc/85/70/75/1039857075.db2.gz CCWSVMLWNGMBKW-CYBMUJFWSA-N 2 1 334.813 4.179 20 0 EIADMP Cc1nc([C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cs1 ZINC000552920142 1039868086 /nfs/dbraw/zinc/86/80/86/1039868086.db2.gz SSSAPUUFJWJSTJ-GJYPPUQNSA-N 2 1 343.540 4.403 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)Cc2ccccc2C(F)(F)F)C1 ZINC000481925958 1039902306 /nfs/dbraw/zinc/90/23/06/1039902306.db2.gz NPJTUSBBKCEGNF-CVEARBPZSA-N 2 1 342.449 4.346 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCO[C@@H]2C(C)(C)C)C[C@H]1c1ccccc1 ZINC000551051605 1039922496 /nfs/dbraw/zinc/92/24/96/1039922496.db2.gz SLWLKRAOPIFNML-TUFLPTIASA-N 2 1 344.543 4.253 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCCO[C@@H]2C(C)(C)C)C[C@H]1c1ccccc1 ZINC000551051605 1039922520 /nfs/dbraw/zinc/92/25/20/1039922520.db2.gz SLWLKRAOPIFNML-TUFLPTIASA-N 2 1 344.543 4.253 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCO1 ZINC000551147351 1040007154 /nfs/dbraw/zinc/00/71/54/1040007154.db2.gz BWVJFXLBJGDXPS-DOIPELPJSA-N 2 1 330.516 4.005 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCO1 ZINC000551147351 1040007170 /nfs/dbraw/zinc/00/71/70/1040007170.db2.gz BWVJFXLBJGDXPS-DOIPELPJSA-N 2 1 330.516 4.005 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000311066153 1040014683 /nfs/dbraw/zinc/01/46/83/1040014683.db2.gz YDGHYKQIIYHNNI-AVRDEDQJSA-N 2 1 340.486 4.259 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)C[C@H]1c1ccccc1 ZINC000551176644 1040020766 /nfs/dbraw/zinc/02/07/66/1040020766.db2.gz YRWVBNJCMUQONC-OZIGNCPNSA-N 2 1 338.470 4.497 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)C[C@H]1c1ccccc1 ZINC000551176644 1040020786 /nfs/dbraw/zinc/02/07/86/1040020786.db2.gz YRWVBNJCMUQONC-OZIGNCPNSA-N 2 1 338.470 4.497 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]CCCc1c(Cl)cccc1Cl ZINC000482163775 1040054307 /nfs/dbraw/zinc/05/43/07/1040054307.db2.gz MPYNOKRKTHZBDP-ZDUSSCGKSA-N 2 1 340.298 4.357 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](CN[C@H](C)c2ccccc2Br)C1 ZINC000482362197 1040202596 /nfs/dbraw/zinc/20/25/96/1040202596.db2.gz VSZBVVZWTSTGKC-CABCVRRESA-N 2 1 339.321 4.220 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc3ccccc3)C1)CC2 ZINC000482436776 1040245598 /nfs/dbraw/zinc/24/55/98/1040245598.db2.gz JKFZVVXQHNJRHN-OFNKIYASSA-N 2 1 334.507 4.137 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1F ZINC000482448467 1040258440 /nfs/dbraw/zinc/25/84/40/1040258440.db2.gz ODIXJCIWRLEVIY-WMZOPIPTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1F ZINC000482448467 1040258456 /nfs/dbraw/zinc/25/84/56/1040258456.db2.gz ODIXJCIWRLEVIY-WMZOPIPTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1F ZINC000482459761 1040265370 /nfs/dbraw/zinc/26/53/70/1040265370.db2.gz OMFOSNPKVFPARB-IEBWSBKVSA-N 2 1 326.459 4.041 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1F ZINC000482459761 1040265383 /nfs/dbraw/zinc/26/53/83/1040265383.db2.gz OMFOSNPKVFPARB-IEBWSBKVSA-N 2 1 326.459 4.041 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC3(CCCC3)O2)CC[N@@H+]1Cc1ccccc1 ZINC000379655497 1040317623 /nfs/dbraw/zinc/31/76/23/1040317623.db2.gz MBXNYHLZRZDSLD-GIVPXCGWSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC3(CCCC3)O2)CC[N@H+]1Cc1ccccc1 ZINC000379655497 1040317635 /nfs/dbraw/zinc/31/76/35/1040317635.db2.gz MBXNYHLZRZDSLD-GIVPXCGWSA-N 2 1 342.527 4.121 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3scnc3C)cc2)CC1 ZINC000667494277 1040378094 /nfs/dbraw/zinc/37/80/94/1040378094.db2.gz UKYNUAUVYZJMFY-UHFFFAOYSA-N 2 1 329.513 4.035 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3scnc3C)cc2)CC1 ZINC000667494277 1040378111 /nfs/dbraw/zinc/37/81/11/1040378111.db2.gz UKYNUAUVYZJMFY-UHFFFAOYSA-N 2 1 329.513 4.035 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)C1 ZINC000435742448 1040596299 /nfs/dbraw/zinc/59/62/99/1040596299.db2.gz NMMVJGFXELBHPM-INMHGKMJSA-N 2 1 332.454 4.494 20 0 EIADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@H]1c1ccc[nH]1 ZINC000435768250 1040607338 /nfs/dbraw/zinc/60/73/38/1040607338.db2.gz BRUWLBUEXVROKF-FQEVSTJZSA-N 2 1 325.500 4.310 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@H]1c1ccc[nH]1 ZINC000435768250 1040607353 /nfs/dbraw/zinc/60/73/53/1040607353.db2.gz BRUWLBUEXVROKF-FQEVSTJZSA-N 2 1 325.500 4.310 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000435768250 1040607362 /nfs/dbraw/zinc/60/73/62/1040607362.db2.gz BRUWLBUEXVROKF-FQEVSTJZSA-N 2 1 325.500 4.310 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000435768250 1040607372 /nfs/dbraw/zinc/60/73/72/1040607372.db2.gz BRUWLBUEXVROKF-FQEVSTJZSA-N 2 1 325.500 4.310 20 0 EIADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@@H]1c1ccc[nH]1 ZINC000435768251 1040608332 /nfs/dbraw/zinc/60/83/32/1040608332.db2.gz BRUWLBUEXVROKF-HXUWFJFHSA-N 2 1 325.500 4.310 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@@H]1c1ccc[nH]1 ZINC000435768251 1040608339 /nfs/dbraw/zinc/60/83/39/1040608339.db2.gz BRUWLBUEXVROKF-HXUWFJFHSA-N 2 1 325.500 4.310 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000435768251 1040608348 /nfs/dbraw/zinc/60/83/48/1040608348.db2.gz BRUWLBUEXVROKF-HXUWFJFHSA-N 2 1 325.500 4.310 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000435768251 1040608359 /nfs/dbraw/zinc/60/83/59/1040608359.db2.gz BRUWLBUEXVROKF-HXUWFJFHSA-N 2 1 325.500 4.310 20 0 EIADMP COCCC[NH+]1CCC([NH2+][C@@H](c2cc3ccccc3o2)C(C)C)CC1 ZINC000553935528 1040643839 /nfs/dbraw/zinc/64/38/39/1040643839.db2.gz FYOXTJFCBPMHAW-OAQYLSRUSA-N 2 1 344.499 4.220 20 0 EIADMP Cc1cccc2c1[nH+]cc(C)c2N1CC[NH+]([C@@H](C)c2cccnc2)CC1 ZINC000462494934 1040667041 /nfs/dbraw/zinc/66/70/41/1040667041.db2.gz BKNMVMUZIVXOQB-SFHVURJKSA-N 2 1 346.478 4.130 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(C)c2C)[C@@H](C)C1 ZINC000483124214 1040718462 /nfs/dbraw/zinc/71/84/62/1040718462.db2.gz GJCOTELRKQFGFP-CUWPLCDZSA-N 2 1 332.532 4.091 20 0 EIADMP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[NH+](C)C)CCC3)cc1 ZINC000479876997 1040739198 /nfs/dbraw/zinc/73/91/98/1040739198.db2.gz WGTJGBRDBCCXLY-MRXNPFEDSA-N 2 1 329.513 4.037 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)ccc1SC ZINC000479898540 1040757921 /nfs/dbraw/zinc/75/79/21/1040757921.db2.gz DKBTUCXQLORHEH-HOTGVXAUSA-N 2 1 336.545 4.332 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)ccc1SC ZINC000479898540 1040757937 /nfs/dbraw/zinc/75/79/37/1040757937.db2.gz DKBTUCXQLORHEH-HOTGVXAUSA-N 2 1 336.545 4.332 20 0 EIADMP CN1CCC([NH+]2CCC(CC[N@@H+](C)CCC3CCCCC3)CC2)CC1 ZINC000483267029 1040797526 /nfs/dbraw/zinc/79/75/26/1040797526.db2.gz LIOOYYQHSSVUGO-UHFFFAOYSA-N 3 1 349.607 4.085 20 0 EIADMP C[N@H+](CCC1CCCCC1)CCC1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000483267029 1040797547 /nfs/dbraw/zinc/79/75/47/1040797547.db2.gz LIOOYYQHSSVUGO-UHFFFAOYSA-N 3 1 349.607 4.085 20 0 EIADMP C[N@@H+](CCC1CCCCC1)CCC1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000483267029 1040797566 /nfs/dbraw/zinc/79/75/66/1040797566.db2.gz LIOOYYQHSSVUGO-UHFFFAOYSA-N 3 1 349.607 4.085 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000539852482 1040848960 /nfs/dbraw/zinc/84/89/60/1040848960.db2.gz ROAXZRBFKQDKJM-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000539852482 1040848969 /nfs/dbraw/zinc/84/89/69/1040848969.db2.gz ROAXZRBFKQDKJM-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3cc(C)c(F)c(C)c3)CC2)[nH+]c1 ZINC000483494958 1040875171 /nfs/dbraw/zinc/87/51/71/1040875171.db2.gz CFOGCUNFYFKASZ-QGZVFWFLSA-N 2 1 341.474 4.466 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCOc3cccc4ccccc43)CC[C@@H]21 ZINC000483485335 1040875187 /nfs/dbraw/zinc/87/51/87/1040875187.db2.gz RQPXRQZARCKAHI-CTNGQTDRSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCOc3cccc4ccccc43)CC[C@@H]21 ZINC000483485335 1040875191 /nfs/dbraw/zinc/87/51/91/1040875191.db2.gz RQPXRQZARCKAHI-CTNGQTDRSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCOc3cccc4ccccc43)CC[C@@H]21 ZINC000483485335 1040875195 /nfs/dbraw/zinc/87/51/95/1040875195.db2.gz RQPXRQZARCKAHI-CTNGQTDRSA-N 2 1 338.495 4.025 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000537939339 1040903995 /nfs/dbraw/zinc/90/39/95/1040903995.db2.gz MBVYCCPJRSHGJZ-JENIJYKNSA-N 2 1 341.474 4.172 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000462796984 1040950022 /nfs/dbraw/zinc/95/00/22/1040950022.db2.gz ALEGNUVKWCEITL-STZQEDGTSA-N 2 1 344.543 4.212 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1 ZINC000537967956 1040972732 /nfs/dbraw/zinc/97/27/32/1040972732.db2.gz JBVNGAMMIQMOEF-DEPWHIHDSA-N 2 1 325.500 4.390 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(SCC(F)F)cc1 ZINC000483735972 1040990722 /nfs/dbraw/zinc/99/07/22/1040990722.db2.gz XOWGQNLGAYOVEB-VNHYZAJKSA-N 2 1 328.472 4.177 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(SCC(F)F)cc1 ZINC000483735972 1040990751 /nfs/dbraw/zinc/99/07/51/1040990751.db2.gz XOWGQNLGAYOVEB-VNHYZAJKSA-N 2 1 328.472 4.177 20 0 EIADMP FC(F)(F)c1cc(Cl)cc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000436284958 1041033113 /nfs/dbraw/zinc/03/31/13/1041033113.db2.gz CGHBUHQHXCIOJS-GJZGRUSLSA-N 2 1 332.797 4.075 20 0 EIADMP FC(F)(F)c1cc(Cl)cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000436284958 1041033126 /nfs/dbraw/zinc/03/31/26/1041033126.db2.gz CGHBUHQHXCIOJS-GJZGRUSLSA-N 2 1 332.797 4.075 20 0 EIADMP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@H](C1CC1)[NH+](C)C ZINC000462889226 1041050728 /nfs/dbraw/zinc/05/07/28/1041050728.db2.gz RNWZCZBPCCIJKO-YWZLYKJASA-N 2 1 327.516 4.154 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CCC[N@@H+](C)C(C)C ZINC000480189121 1041064478 /nfs/dbraw/zinc/06/44/78/1041064478.db2.gz BRDUOTFAJYKDQJ-INIZCTEOSA-N 2 1 345.556 4.423 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000480189121 1041064489 /nfs/dbraw/zinc/06/44/89/1041064489.db2.gz BRDUOTFAJYKDQJ-INIZCTEOSA-N 2 1 345.556 4.423 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)CCCC(F)(F)F)CC2)[nH+]c1 ZINC000480204270 1041075182 /nfs/dbraw/zinc/07/51/82/1041075182.db2.gz SESAHMDRWGTUNU-CQSZACIVSA-N 2 1 329.410 4.070 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000480257844 1041126123 /nfs/dbraw/zinc/12/61/23/1041126123.db2.gz FODZEXFDCBIUCA-OAHLLOKOSA-N 2 1 338.948 4.427 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@@H]3C)cc2)cs1 ZINC000480272829 1041151709 /nfs/dbraw/zinc/15/17/09/1041151709.db2.gz DYRDXGVCGBITEV-XMDUPGNXSA-N 2 1 343.540 4.498 20 0 EIADMP Cc1ccc(SC2(C[NH2+][C@H]3CC[N@H+](C)C[C@@H]3C)CCCC2)cc1 ZINC000484308111 1041205320 /nfs/dbraw/zinc/20/53/20/1041205320.db2.gz LYLMDENCGWLWEA-HKUYNNGSSA-N 2 1 332.557 4.330 20 0 EIADMP Cc1ccc(SC2(C[NH2+][C@@H]3CC[N@H+](C)C[C@H]3C)CCCC2)cc1 ZINC000484308112 1041205817 /nfs/dbraw/zinc/20/58/17/1041205817.db2.gz LYLMDENCGWLWEA-IEBWSBKVSA-N 2 1 332.557 4.330 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(OCC(C)C)cc1 ZINC000540170152 1041213713 /nfs/dbraw/zinc/21/37/13/1041213713.db2.gz ZBLONICDPGCQLL-IRXDYDNUSA-N 2 1 329.488 4.213 20 0 EIADMP COC1(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)CCCCC1 ZINC000480342637 1041230175 /nfs/dbraw/zinc/23/01/75/1041230175.db2.gz HYWCDTXUWUOHPM-SJLPKXTDSA-N 2 1 336.545 4.070 20 0 EIADMP COC1(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CCCCC1 ZINC000480342637 1041230193 /nfs/dbraw/zinc/23/01/93/1041230193.db2.gz HYWCDTXUWUOHPM-SJLPKXTDSA-N 2 1 336.545 4.070 20 0 EIADMP COc1cccc(C[C@H](C)[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000540181510 1041244581 /nfs/dbraw/zinc/24/45/81/1041244581.db2.gz LBEIFLGKQXWEFK-IRXDYDNUSA-N 2 1 349.478 4.471 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@H]3CCC[C@@H]([NH+](C)C)C3)c(C)c2c1 ZINC000484470379 1041247129 /nfs/dbraw/zinc/24/71/29/1041247129.db2.gz SUOIRRBGUYCXMX-HRCADAONSA-N 2 1 330.472 4.273 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)o1 ZINC000484496303 1041304251 /nfs/dbraw/zinc/30/42/51/1041304251.db2.gz HGGIDRGDQFUQRD-BQFCYCMXSA-N 2 1 326.484 4.395 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]C[C@@H](C)C[NH+]3CCCC3)oc21 ZINC000538397486 1041316045 /nfs/dbraw/zinc/31/60/45/1041316045.db2.gz IYMHEOIPXCZIRK-CVEARBPZSA-N 2 1 330.472 4.214 20 0 EIADMP Cc1ccc(C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)cc1F ZINC000463140706 1041362852 /nfs/dbraw/zinc/36/28/52/1041362852.db2.gz HOMXQMHBXANTTQ-UHFFFAOYSA-N 2 1 344.449 4.070 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2C[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463155553 1041386961 /nfs/dbraw/zinc/38/69/61/1041386961.db2.gz OAXCISMVKFWALT-HWHRFOGPSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2C[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000463155553 1041386970 /nfs/dbraw/zinc/38/69/70/1041386970.db2.gz OAXCISMVKFWALT-HWHRFOGPSA-N 2 1 334.507 4.433 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)ccc1F ZINC000463194654 1041410292 /nfs/dbraw/zinc/41/02/92/1041410292.db2.gz VVMFOPRRRRWGJI-SFHVURJKSA-N 2 1 340.486 4.492 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12)c1ccc(SCC(F)F)cc1 ZINC000480615338 1041425702 /nfs/dbraw/zinc/42/57/02/1041425702.db2.gz RWGWYGULZVYRMM-RRQGHBQHSA-N 2 1 340.483 4.321 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(SCC(F)F)cc1 ZINC000480615338 1041425709 /nfs/dbraw/zinc/42/57/09/1041425709.db2.gz RWGWYGULZVYRMM-RRQGHBQHSA-N 2 1 340.483 4.321 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc(F)c(F)c(F)c1 ZINC000480606330 1041431256 /nfs/dbraw/zinc/43/12/56/1041431256.db2.gz DDHUWCMPJAZXFO-KGLIPLIRSA-N 2 1 328.422 4.267 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccc(OC(F)F)c1 ZINC000480622501 1041437455 /nfs/dbraw/zinc/43/74/55/1041437455.db2.gz YNWFIJDBFSTDKB-CVEARBPZSA-N 2 1 340.458 4.451 20 0 EIADMP c1cc2cc(CC[NH2+]C3CC[NH+](CCc4ccccc4)CC3)ccc2[nH]1 ZINC000463257978 1041456616 /nfs/dbraw/zinc/45/66/16/1041456616.db2.gz QEAWVTVAROBZGZ-UHFFFAOYSA-N 2 1 347.506 4.007 20 0 EIADMP C[C@@H](Nc1cccc2cc[nH+]cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000538627994 1041459161 /nfs/dbraw/zinc/45/91/61/1041459161.db2.gz MMOMNZSYJIDZJF-MRXNPFEDSA-N 2 1 335.451 4.348 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463251315 1041463675 /nfs/dbraw/zinc/46/36/75/1041463675.db2.gz DKBMSXZHQLWYFJ-UBHSMVFVSA-N 2 1 344.543 4.224 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463251315 1041463681 /nfs/dbraw/zinc/46/36/81/1041463681.db2.gz DKBMSXZHQLWYFJ-UBHSMVFVSA-N 2 1 344.543 4.224 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463279448 1041469798 /nfs/dbraw/zinc/46/97/98/1041469798.db2.gz PWRXMIUKMWEERX-SFHVURJKSA-N 2 1 342.449 4.260 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000195138209 1041486760 /nfs/dbraw/zinc/48/67/60/1041486760.db2.gz NYQSPSIALCMJEX-AEFFLSMTSA-N 2 1 342.458 4.007 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000195138209 1041486764 /nfs/dbraw/zinc/48/67/64/1041486764.db2.gz NYQSPSIALCMJEX-AEFFLSMTSA-N 2 1 342.458 4.007 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000195135327 1041486924 /nfs/dbraw/zinc/48/69/24/1041486924.db2.gz VLLZXWUJLQVAST-RDJZCZTQSA-N 2 1 330.422 4.138 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463289559 1041488354 /nfs/dbraw/zinc/48/83/54/1041488354.db2.gz QEXRHVADPOCVGX-HKUYNNGSSA-N 2 1 328.525 4.242 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463289559 1041488358 /nfs/dbraw/zinc/48/83/58/1041488358.db2.gz QEXRHVADPOCVGX-HKUYNNGSSA-N 2 1 328.525 4.242 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@H]1C ZINC000538719070 1041489939 /nfs/dbraw/zinc/48/99/39/1041489939.db2.gz JPKJEUARIVNSLD-KDOFPFPSSA-N 2 1 346.906 4.035 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@H]1C ZINC000538719070 1041489942 /nfs/dbraw/zinc/48/99/42/1041489942.db2.gz JPKJEUARIVNSLD-KDOFPFPSSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@H]1C ZINC000538719070 1041489943 /nfs/dbraw/zinc/48/99/43/1041489943.db2.gz JPKJEUARIVNSLD-KDOFPFPSSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@H]1C ZINC000538719070 1041489944 /nfs/dbraw/zinc/48/99/44/1041489944.db2.gz JPKJEUARIVNSLD-KDOFPFPSSA-N 2 1 346.906 4.035 20 0 EIADMP COc1ccc([C@H](CCC(C)C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480749108 1041505453 /nfs/dbraw/zinc/50/54/53/1041505453.db2.gz ZWJARYOOIGBSRA-UWJYYQICSA-N 2 1 330.516 4.246 20 0 EIADMP Cc1cccc(COc2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H](C)C3)cc2)c1 ZINC000480753977 1041510197 /nfs/dbraw/zinc/51/01/97/1041510197.db2.gz CPLQXMMXWSEYHZ-GHTZIAJQSA-N 2 1 338.495 4.146 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccccc2OC2CCCC2)[C@H](C)C1 ZINC000538738292 1041511211 /nfs/dbraw/zinc/51/12/11/1041511211.db2.gz LRPRUKRMVPGWLD-XLIONFOSSA-N 2 1 330.516 4.170 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2OC2CCCC2)[C@H](C)C1 ZINC000538738292 1041511221 /nfs/dbraw/zinc/51/12/21/1041511221.db2.gz LRPRUKRMVPGWLD-XLIONFOSSA-N 2 1 330.516 4.170 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2OC2CCCC2)[C@H](C)C1 ZINC000538738292 1041511227 /nfs/dbraw/zinc/51/12/27/1041511227.db2.gz LRPRUKRMVPGWLD-XLIONFOSSA-N 2 1 330.516 4.170 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2OC2CCCC2)[C@H](C)C1 ZINC000538738292 1041511231 /nfs/dbraw/zinc/51/12/31/1041511231.db2.gz LRPRUKRMVPGWLD-XLIONFOSSA-N 2 1 330.516 4.170 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@H](C)C1 ZINC000538738190 1041512487 /nfs/dbraw/zinc/51/24/87/1041512487.db2.gz FCFHPPVUSHNYAC-BEFAXECRSA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@H](C)C1 ZINC000538738190 1041512500 /nfs/dbraw/zinc/51/25/00/1041512500.db2.gz FCFHPPVUSHNYAC-BEFAXECRSA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@H](C)C1 ZINC000538738190 1041512507 /nfs/dbraw/zinc/51/25/07/1041512507.db2.gz FCFHPPVUSHNYAC-BEFAXECRSA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@H](C)C1 ZINC000538738190 1041512515 /nfs/dbraw/zinc/51/25/15/1041512515.db2.gz FCFHPPVUSHNYAC-BEFAXECRSA-N 2 1 330.447 4.248 20 0 EIADMP COc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c2ccccc12 ZINC000538751049 1041526713 /nfs/dbraw/zinc/52/67/13/1041526713.db2.gz MZVVMGCGSREMSA-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c2ccccc12 ZINC000538751049 1041526726 /nfs/dbraw/zinc/52/67/26/1041526726.db2.gz MZVVMGCGSREMSA-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)c2ccccc12 ZINC000538751049 1041526736 /nfs/dbraw/zinc/52/67/36/1041526736.db2.gz MZVVMGCGSREMSA-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000540607284 1041559530 /nfs/dbraw/zinc/55/95/30/1041559530.db2.gz MCPBMULMMGNOMV-MAUKXSAKSA-N 2 1 339.310 4.481 20 0 EIADMP c1ccc(CC[C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000461799873 1041592655 /nfs/dbraw/zinc/59/26/55/1041592655.db2.gz XEAKXVZMZKISIX-WXFUMESZSA-N 2 1 348.534 4.447 20 0 EIADMP COc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1 ZINC000540962866 1041753724 /nfs/dbraw/zinc/75/37/24/1041753724.db2.gz XRCHRDRUYPJUDB-WIYYLYMNSA-N 2 1 338.495 4.004 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@H+](Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000540982766 1041766046 /nfs/dbraw/zinc/76/60/46/1041766046.db2.gz SJDMRFDKZVVJAU-HXUWFJFHSA-N 2 1 330.516 4.029 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000540982766 1041766052 /nfs/dbraw/zinc/76/60/52/1041766052.db2.gz SJDMRFDKZVVJAU-HXUWFJFHSA-N 2 1 330.516 4.029 20 0 EIADMP C[C@@H](Cc1ccsc1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000541234371 1041859700 /nfs/dbraw/zinc/85/97/00/1041859700.db2.gz DXGODMGBKMCXES-PXNSSMCTSA-N 2 1 328.525 4.133 20 0 EIADMP C[C@@H](Cc1ccsc1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000541234371 1041859702 /nfs/dbraw/zinc/85/97/02/1041859702.db2.gz DXGODMGBKMCXES-PXNSSMCTSA-N 2 1 328.525 4.133 20 0 EIADMP C[C@@H](Cc1ccsc1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000541234371 1041859703 /nfs/dbraw/zinc/85/97/03/1041859703.db2.gz DXGODMGBKMCXES-PXNSSMCTSA-N 2 1 328.525 4.133 20 0 EIADMP CC[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)CC(F)(F)F ZINC000402582648 1041872479 /nfs/dbraw/zinc/87/24/79/1041872479.db2.gz UXLBBJCVRFERDM-MRXNPFEDSA-N 2 1 342.449 4.262 20 0 EIADMP C[C@@H](CC[NH2+][C@@H](C)c1ccccc1OC(F)F)[NH+]1CCCCC1 ZINC000541558864 1042001225 /nfs/dbraw/zinc/00/12/25/1042001225.db2.gz ZLJGBHLFMNIKSL-GJZGRUSLSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)CC(F)(F)F ZINC000402779443 1042029829 /nfs/dbraw/zinc/02/98/29/1042029829.db2.gz OPTRCZYNELXCEZ-YQQAZPJKSA-N 2 1 328.422 4.075 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)CC(F)(F)F ZINC000402779443 1042029832 /nfs/dbraw/zinc/02/98/32/1042029832.db2.gz OPTRCZYNELXCEZ-YQQAZPJKSA-N 2 1 328.422 4.075 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CC[C@H](Cc4ccccc4)C3)CC2)[nH+]c1 ZINC000438187457 1042081685 /nfs/dbraw/zinc/08/16/85/1042081685.db2.gz JAPIAAHJECBWBK-IFMALSPDSA-N 2 1 349.522 4.360 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000541908760 1042166003 /nfs/dbraw/zinc/16/60/03/1042166003.db2.gz NXOMZCBKWHEMJA-CQSZACIVSA-N 2 1 334.916 4.452 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000541908760 1042166006 /nfs/dbraw/zinc/16/60/06/1042166006.db2.gz NXOMZCBKWHEMJA-CQSZACIVSA-N 2 1 334.916 4.452 20 0 EIADMP C[N@@H+](CCOC1CCCCCC1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464831476 1042188790 /nfs/dbraw/zinc/18/87/90/1042188790.db2.gz AINANSGXTQPSSA-NRFANRHFSA-N 2 1 344.543 4.180 20 0 EIADMP C[NH+](CCOC1CCCCCC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464831476 1042188795 /nfs/dbraw/zinc/18/87/95/1042188795.db2.gz AINANSGXTQPSSA-NRFANRHFSA-N 2 1 344.543 4.180 20 0 EIADMP C[NH+](CCOC1CCCCCC1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464831476 1042188799 /nfs/dbraw/zinc/18/87/99/1042188799.db2.gz AINANSGXTQPSSA-NRFANRHFSA-N 2 1 344.543 4.180 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC[N@@H+]1C ZINC000426063892 1042247411 /nfs/dbraw/zinc/24/74/11/1042247411.db2.gz VTFZVTSWWVFMGN-CDHQVMDDSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC[N@H+]1C ZINC000426063892 1042247425 /nfs/dbraw/zinc/24/74/25/1042247425.db2.gz VTFZVTSWWVFMGN-CDHQVMDDSA-N 2 1 343.902 4.091 20 0 EIADMP OC[C@H]1CCC[N@H+]1CCCC[NH2+][C@H](c1ccccc1)C1CCCCC1 ZINC000542084065 1042270607 /nfs/dbraw/zinc/27/06/07/1042270607.db2.gz AJFCAXCQVRZOPK-FGZHOGPDSA-N 2 1 344.543 4.135 20 0 EIADMP C[C@H](NCCC[N@@H+]1CCc2ccccc2C1)c1nccc2ccccc21 ZINC000518014089 1042313389 /nfs/dbraw/zinc/31/33/89/1042313389.db2.gz DFYFNMONCVLKLK-SFHVURJKSA-N 2 1 345.490 4.334 20 0 EIADMP C[C@H](NCCC[N@H+]1CCc2ccccc2C1)c1nccc2ccccc21 ZINC000518014089 1042313393 /nfs/dbraw/zinc/31/33/93/1042313393.db2.gz DFYFNMONCVLKLK-SFHVURJKSA-N 2 1 345.490 4.334 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1nccc2ccccc21 ZINC000518014089 1042313397 /nfs/dbraw/zinc/31/33/97/1042313397.db2.gz DFYFNMONCVLKLK-SFHVURJKSA-N 2 1 345.490 4.334 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1nccc2ccccc21 ZINC000518014089 1042313401 /nfs/dbraw/zinc/31/34/01/1042313401.db2.gz DFYFNMONCVLKLK-SFHVURJKSA-N 2 1 345.490 4.334 20 0 EIADMP Fc1cccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)s2)c1 ZINC000509573139 1042385099 /nfs/dbraw/zinc/38/50/99/1042385099.db2.gz ZAKVTVPFASGJLJ-IAGOWNOFSA-N 2 1 330.472 4.271 20 0 EIADMP CC(C)CCOc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000518274381 1042447279 /nfs/dbraw/zinc/44/72/79/1042447279.db2.gz ZAZLMROLWQWQCW-HXUWFJFHSA-N 2 1 332.532 4.322 20 0 EIADMP C[C@@H]([NH2+]CCCc1c[nH+]cn1C)c1ccccc1OCc1ccccc1 ZINC000518394159 1042504549 /nfs/dbraw/zinc/50/45/49/1042504549.db2.gz NWWGXRLHVSZQOS-GOSISDBHSA-N 2 1 349.478 4.283 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2cc(F)ccc2C1 ZINC001168442473 1042505925 /nfs/dbraw/zinc/50/59/25/1042505925.db2.gz VMGFSJAHRAAOKM-HBMCJLEFSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@H]1CCc2cc(F)ccc2C1 ZINC001168442473 1042505932 /nfs/dbraw/zinc/50/59/32/1042505932.db2.gz VMGFSJAHRAAOKM-HBMCJLEFSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@H]1CCc2cc(F)ccc2C1 ZINC001168442473 1042505938 /nfs/dbraw/zinc/50/59/38/1042505938.db2.gz VMGFSJAHRAAOKM-HBMCJLEFSA-N 2 1 330.491 4.022 20 0 EIADMP C/C(=C/c1ccccc1)C[N@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000426391110 1042637433 /nfs/dbraw/zinc/63/74/33/1042637433.db2.gz OCPUZOCUSHAOJD-LGMDPLHJSA-N 2 1 332.451 4.111 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000439789397 1042768760 /nfs/dbraw/zinc/76/87/60/1042768760.db2.gz PKXGRTPVRGANEF-OAQYLSRUSA-N 2 1 344.543 4.036 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000506689527 1042778203 /nfs/dbraw/zinc/77/82/03/1042778203.db2.gz NTLWLAWEWHGSEW-UHFFFAOYSA-N 2 1 332.488 4.470 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000506689527 1042778211 /nfs/dbraw/zinc/77/82/11/1042778211.db2.gz NTLWLAWEWHGSEW-UHFFFAOYSA-N 2 1 332.488 4.470 20 0 EIADMP CCc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000309707880 1042819618 /nfs/dbraw/zinc/81/96/18/1042819618.db2.gz IMPNKUCFLQEITC-WMZOPIPTSA-N 2 1 328.525 4.311 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311145898 1042853873 /nfs/dbraw/zinc/85/38/73/1042853873.db2.gz ZLARZIMBKPEGNL-BPXKWBHBSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2ccccc2n1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311621658 1042863423 /nfs/dbraw/zinc/86/34/23/1042863423.db2.gz HIEGOLHNOFKRLJ-WIYYLYMNSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2ccccc2n1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311621658 1042863426 /nfs/dbraw/zinc/86/34/26/1042863426.db2.gz HIEGOLHNOFKRLJ-WIYYLYMNSA-N 2 1 345.490 4.235 20 0 EIADMP CC(C)Oc1ccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1Cl ZINC000493367852 1042901088 /nfs/dbraw/zinc/90/10/88/1042901088.db2.gz WBMFYIWTMYBVTO-SJLPKXTDSA-N 2 1 336.907 4.043 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH+](CC)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000507784521 1042928591 /nfs/dbraw/zinc/92/85/91/1042928591.db2.gz RNPZIUSHFZEVPR-FDFHNCONSA-N 2 1 344.543 4.036 20 0 EIADMP CCCC[N@@H+](CC)CCNC1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168008114 1043031909 /nfs/dbraw/zinc/03/19/09/1043031909.db2.gz CNYGBKDWAUXVMB-WOJBJXKFSA-N 2 1 345.575 4.140 20 0 EIADMP Cc1nc2ccc(C[NH2+][C@@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)cc2s1 ZINC000494196804 1043032224 /nfs/dbraw/zinc/03/22/24/1043032224.db2.gz ZQWZDBXORQQKLX-YOEHRIQHSA-N 2 1 343.540 4.347 20 0 EIADMP Cc1nc2ccc(C[NH2+][C@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)cc2s1 ZINC000494196801 1043032864 /nfs/dbraw/zinc/03/28/64/1043032864.db2.gz ZQWZDBXORQQKLX-PBHICJAKSA-N 2 1 343.540 4.347 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168008297 1043044567 /nfs/dbraw/zinc/04/45/67/1043044567.db2.gz XFBLKTQKRAJEJF-NBMJBFSESA-N 2 1 336.470 4.453 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000507827582 1043130209 /nfs/dbraw/zinc/13/02/09/1043130209.db2.gz RIFDCGAQRNPABO-QGZVFWFLSA-N 2 1 327.299 4.443 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310365541 1043131040 /nfs/dbraw/zinc/13/10/40/1043131040.db2.gz LZGXTHWSAHMIFR-IEBWSBKVSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310365541 1043131059 /nfs/dbraw/zinc/13/10/59/1043131059.db2.gz LZGXTHWSAHMIFR-IEBWSBKVSA-N 2 1 326.459 4.389 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCSc2c(Cl)cccc21 ZINC000164697201 1043152935 /nfs/dbraw/zinc/15/29/35/1043152935.db2.gz VJQCADKCNVAUNF-INIZCTEOSA-N 2 1 335.904 4.452 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3cc(O)cc(F)c3)cc2)C1 ZINC000185467212 1043187546 /nfs/dbraw/zinc/18/75/46/1043187546.db2.gz NRZRYQXBKZAWJY-MRXNPFEDSA-N 2 1 342.458 4.053 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]CC[C@@H]3CCCC[N@@H+]3C)oc21 ZINC000543518912 1043236562 /nfs/dbraw/zinc/23/65/62/1043236562.db2.gz SSAQEGDKPNAMNN-RDJZCZTQSA-N 2 1 330.472 4.357 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]CC[C@@H]3CCCC[N@H+]3C)oc21 ZINC000543518912 1043236577 /nfs/dbraw/zinc/23/65/77/1043236577.db2.gz SSAQEGDKPNAMNN-RDJZCZTQSA-N 2 1 330.472 4.357 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674007999 1043285644 /nfs/dbraw/zinc/28/56/44/1043285644.db2.gz VODYWMWFEQKFOG-KRWDZBQOSA-N 2 1 342.449 4.302 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674007999 1043285654 /nfs/dbraw/zinc/28/56/54/1043285654.db2.gz VODYWMWFEQKFOG-KRWDZBQOSA-N 2 1 342.449 4.302 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674007999 1043285660 /nfs/dbraw/zinc/28/56/60/1043285660.db2.gz VODYWMWFEQKFOG-KRWDZBQOSA-N 2 1 342.449 4.302 20 0 EIADMP c1ccc(C[C@H](C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000166784786 1043315552 /nfs/dbraw/zinc/31/55/52/1043315552.db2.gz XCNKJBJGAVRUTF-XPWALMASSA-N 2 1 334.507 4.229 20 0 EIADMP COCC(C)(C)CCC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639181384 1043329761 /nfs/dbraw/zinc/32/97/61/1043329761.db2.gz RUSCYKPNZQWFQT-CTNGQTDRSA-N 2 1 344.543 4.397 20 0 EIADMP COCC(C)(C)CCC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639181384 1043329776 /nfs/dbraw/zinc/32/97/76/1043329776.db2.gz RUSCYKPNZQWFQT-CTNGQTDRSA-N 2 1 344.543 4.397 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCSCC1 ZINC000187191530 1043333773 /nfs/dbraw/zinc/33/37/73/1043333773.db2.gz WQNYIXPVFPSBAI-BRIRTLKKSA-N 2 1 344.568 4.303 20 0 EIADMP C[C@@H]1C[C@@H](n2ccc3cc(C[NH3+])cnc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168012451 1043424003 /nfs/dbraw/zinc/42/40/03/1043424003.db2.gz AKJUIMFAVGGERF-UPHUGPLXSA-N 2 1 348.494 4.109 20 0 EIADMP COCC1(CC[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CCC1 ZINC000639205785 1043472859 /nfs/dbraw/zinc/47/28/59/1043472859.db2.gz MLWFTSMBIHYAPB-CTNGQTDRSA-N 2 1 342.527 4.151 20 0 EIADMP COCC1(CC[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CCC1 ZINC000639205785 1043472868 /nfs/dbraw/zinc/47/28/68/1043472868.db2.gz MLWFTSMBIHYAPB-CTNGQTDRSA-N 2 1 342.527 4.151 20 0 EIADMP C[N@@H+](Cc1scnc1Cl)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001137823670 1043485475 /nfs/dbraw/zinc/48/54/75/1043485475.db2.gz NJVJYYSLCFFJGV-UHFFFAOYSA-N 2 1 349.931 4.141 20 0 EIADMP C[N@H+](Cc1scnc1Cl)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001137823670 1043485490 /nfs/dbraw/zinc/48/54/90/1043485490.db2.gz NJVJYYSLCFFJGV-UHFFFAOYSA-N 2 1 349.931 4.141 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467363817 1043578681 /nfs/dbraw/zinc/57/86/81/1043578681.db2.gz GBQFDCAWLNURDZ-MOPGFXCFSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@@H]1C[N@@H+](CCCCn2ccnc2C)CC[C@@H]1c1ccccc1 ZINC000442394517 1043670384 /nfs/dbraw/zinc/67/03/84/1043670384.db2.gz SHOSLCGPXOTZGE-CTNGQTDRSA-N 2 1 325.500 4.487 20 0 EIADMP CC[C@@H]1C[N@H+](CCCCn2cc[nH+]c2C)CC[C@@H]1c1ccccc1 ZINC000442394517 1043670392 /nfs/dbraw/zinc/67/03/92/1043670392.db2.gz SHOSLCGPXOTZGE-CTNGQTDRSA-N 2 1 325.500 4.487 20 0 EIADMP CC[C@@H]1C[N@@H+](CCCCn2cc[nH+]c2C)CC[C@@H]1c1ccccc1 ZINC000442394517 1043670401 /nfs/dbraw/zinc/67/04/01/1043670401.db2.gz SHOSLCGPXOTZGE-CTNGQTDRSA-N 2 1 325.500 4.487 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(C(F)(F)F)cc1C ZINC000190998320 1043683086 /nfs/dbraw/zinc/68/30/86/1043683086.db2.gz YBHGQRGXMSGUJD-UHFFFAOYSA-N 2 1 325.378 4.089 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2csc(Cl)c2)[C@H](C)C1 ZINC000191291073 1043804170 /nfs/dbraw/zinc/80/41/70/1043804170.db2.gz WEHKHECIYLKJHY-YCPHGPKFSA-N 2 1 344.952 4.189 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2csc(Cl)c2)[C@H](C)C1 ZINC000191291073 1043804172 /nfs/dbraw/zinc/80/41/72/1043804172.db2.gz WEHKHECIYLKJHY-YCPHGPKFSA-N 2 1 344.952 4.189 20 0 EIADMP C[NH+](C)[C@H](C[NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)C1CC1 ZINC000442711330 1043816508 /nfs/dbraw/zinc/81/65/08/1043816508.db2.gz DQVPWBLFJQOHAS-CGTJXYLNSA-N 2 1 340.433 4.271 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H]2CCSc3ccc(OC)cc32)CC1 ZINC000191505219 1043822718 /nfs/dbraw/zinc/82/27/18/1043822718.db2.gz IPJNIFMEHBQREQ-GOSISDBHSA-N 2 1 334.529 4.086 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000442804914 1043837700 /nfs/dbraw/zinc/83/77/00/1043837700.db2.gz YIZJPBBMUHFTCE-XMSQKQJNSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000442804914 1043837708 /nfs/dbraw/zinc/83/77/08/1043837708.db2.gz YIZJPBBMUHFTCE-XMSQKQJNSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000442789838 1043841297 /nfs/dbraw/zinc/84/12/97/1043841297.db2.gz HUQZYOFYFXAZQF-JYPHPWERSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000442789838 1043841299 /nfs/dbraw/zinc/84/12/99/1043841299.db2.gz HUQZYOFYFXAZQF-JYPHPWERSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000442872457 1043873106 /nfs/dbraw/zinc/87/31/06/1043873106.db2.gz JNRWJFQWJJIIHR-WSTZPKSXSA-N 2 1 338.495 4.344 20 0 EIADMP COc1ccc(Cl)c(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000192178683 1043889710 /nfs/dbraw/zinc/88/97/10/1043889710.db2.gz HQHKYOXSRLNJGC-HUUCEWRRSA-N 2 1 336.907 4.091 20 0 EIADMP COc1ccc(Cl)c(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000192178683 1043889713 /nfs/dbraw/zinc/88/97/13/1043889713.db2.gz HQHKYOXSRLNJGC-HUUCEWRRSA-N 2 1 336.907 4.091 20 0 EIADMP Clc1csc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000193083145 1043998452 /nfs/dbraw/zinc/99/84/52/1043998452.db2.gz SYDAGSFTPDZDSG-MRXNPFEDSA-N 2 1 334.916 4.056 20 0 EIADMP CCC[C@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1ccsc1 ZINC000443100560 1044015865 /nfs/dbraw/zinc/01/58/65/1044015865.db2.gz ANOAWYZRERGNDK-FQEVSTJZSA-N 2 1 344.524 4.211 20 0 EIADMP CC(C)c1cnc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)o1 ZINC000733309220 1044175667 /nfs/dbraw/zinc/17/56/67/1044175667.db2.gz GCKVAHFQOUWGMO-UHFFFAOYSA-N 2 1 341.499 4.142 20 0 EIADMP CC(C)c1cnc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)o1 ZINC000733309220 1044175708 /nfs/dbraw/zinc/17/57/08/1044175708.db2.gz GCKVAHFQOUWGMO-UHFFFAOYSA-N 2 1 341.499 4.142 20 0 EIADMP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000193973941 1044226809 /nfs/dbraw/zinc/22/68/09/1044226809.db2.gz SYSNDIKJARECGP-HOCLYGCPSA-N 2 1 340.433 4.100 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](COC)c2ccc(Cl)cc2)c1 ZINC000194027298 1044243738 /nfs/dbraw/zinc/24/37/38/1044243738.db2.gz FLSOMWIQRYKOFG-HXUWFJFHSA-N 2 1 346.902 4.269 20 0 EIADMP CCSc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000765977019 1044243901 /nfs/dbraw/zinc/24/39/01/1044243901.db2.gz PGNTUBWUUPNAID-SJLPKXTDSA-N 2 1 348.556 4.093 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000358274946 1044261199 /nfs/dbraw/zinc/26/11/99/1044261199.db2.gz FLAWXESQKMFYAV-OAQYLSRUSA-N 2 1 332.451 4.303 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCc3ccc(F)cc32)CC1 ZINC000479416545 1044264627 /nfs/dbraw/zinc/26/46/27/1044264627.db2.gz FELPOFDWKRODDQ-QFIPXVFZSA-N 2 1 338.470 4.376 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H]1CCc2ccc(Cl)cc21 ZINC000429251299 1044283855 /nfs/dbraw/zinc/28/38/55/1044283855.db2.gz CPQNWUKIRYHYKI-SFHVURJKSA-N 2 1 331.891 4.498 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H]1CCc2ccc(Cl)cc21 ZINC000429251299 1044283868 /nfs/dbraw/zinc/28/38/68/1044283868.db2.gz CPQNWUKIRYHYKI-SFHVURJKSA-N 2 1 331.891 4.498 20 0 EIADMP COCC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000347930240 1044330337 /nfs/dbraw/zinc/33/03/37/1044330337.db2.gz KOMGPTOIUAIAAY-CUWPLCDZSA-N 2 1 330.516 4.007 20 0 EIADMP C[C@@H](C[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)Cc1ccccc1 ZINC000542518625 1044451206 /nfs/dbraw/zinc/45/12/06/1044451206.db2.gz YAQCJYSMFXEDPK-NFBKMPQASA-N 2 1 336.523 4.019 20 0 EIADMP CCCN1CCC([NH2+][C@@H](C)c2oc3ccc(OC)cc3c2C)CC1 ZINC000675733942 1044453569 /nfs/dbraw/zinc/45/35/69/1044453569.db2.gz RNASQHKHCSICCF-HNNXBMFYSA-N 2 1 330.472 4.275 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2oc3ccc(OC)cc3c2C)CC1 ZINC000675733942 1044453580 /nfs/dbraw/zinc/45/35/80/1044453580.db2.gz RNASQHKHCSICCF-HNNXBMFYSA-N 2 1 330.472 4.275 20 0 EIADMP C[N@H+](Cc1cc(Cl)cs1)C1CCN(Cc2ccccc2)CC1 ZINC000494963009 1044546863 /nfs/dbraw/zinc/54/68/63/1044546863.db2.gz GXELSFLLHGCESX-UHFFFAOYSA-N 2 1 334.916 4.498 20 0 EIADMP C[N@@H+](Cc1cc(Cl)cs1)C1CCN(Cc2ccccc2)CC1 ZINC000494963009 1044546880 /nfs/dbraw/zinc/54/68/80/1044546880.db2.gz GXELSFLLHGCESX-UHFFFAOYSA-N 2 1 334.916 4.498 20 0 EIADMP CCC[C@@H](CCc1ccccc1)[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000675881426 1044553121 /nfs/dbraw/zinc/55/31/21/1044553121.db2.gz LCZQCDJWUIRSJE-UNMCSNQZSA-N 2 1 344.543 4.021 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000494967771 1044564766 /nfs/dbraw/zinc/56/47/66/1044564766.db2.gz IVXJYVSJIXJWSD-FQEVSTJZSA-N 2 1 344.861 4.420 20 0 EIADMP Cc1ccccc1[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)C1CCCC1 ZINC000495081001 1044651328 /nfs/dbraw/zinc/65/13/28/1044651328.db2.gz FLTKWKNGFHJEMQ-IFMALSPDSA-N 2 1 344.543 4.053 20 0 EIADMP Cc1nc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(C)s1 ZINC000676488724 1044767477 /nfs/dbraw/zinc/76/74/77/1044767477.db2.gz CQDDDBDEVAPVIO-AWEZNQCLSA-N 2 1 329.513 4.207 20 0 EIADMP Brc1ccccc1[C@H]1CCC[N@@H+]1CC[C@H]1CCCC[NH2+]1 ZINC001205000523 1044768209 /nfs/dbraw/zinc/76/82/09/1044768209.db2.gz GOQSTBLDYPJKKE-RHSMWYFYSA-N 2 1 337.305 4.118 20 0 EIADMP Brc1ccccc1[C@H]1CCC[N@H+]1CC[C@H]1CCCC[NH2+]1 ZINC001205000523 1044768222 /nfs/dbraw/zinc/76/82/22/1044768222.db2.gz GOQSTBLDYPJKKE-RHSMWYFYSA-N 2 1 337.305 4.118 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(C(F)(F)F)s2)C1 ZINC000428874632 1044801754 /nfs/dbraw/zinc/80/17/54/1044801754.db2.gz ADXXFIMPOVGKBN-ZDUSSCGKSA-N 2 1 334.451 4.369 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)[C@H]1CCCOC1 ZINC000895663397 1044842517 /nfs/dbraw/zinc/84/25/17/1044842517.db2.gz KPSUGSYYLBWXJN-MXNKGDRCSA-N 2 1 342.527 4.149 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)[C@H]1CCCOC1 ZINC000895663397 1044842518 /nfs/dbraw/zinc/84/25/18/1044842518.db2.gz KPSUGSYYLBWXJN-MXNKGDRCSA-N 2 1 342.527 4.149 20 0 EIADMP CCC1(C[NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)CCOCC1 ZINC001168033988 1044907734 /nfs/dbraw/zinc/90/77/34/1044907734.db2.gz NWDXGNVTQIETQG-CEQLMSFQSA-N 2 1 344.543 4.224 20 0 EIADMP CCC(C)(C)c1ccc(C[N@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)cc1 ZINC000509022457 1044943691 /nfs/dbraw/zinc/94/36/91/1044943691.db2.gz PUPVVBJVJQUNND-NJDAHSKKSA-N 2 1 344.543 4.058 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCc2cccs2)CC[N@@H+]1Cc1ccccc1 ZINC000738330853 1045052712 /nfs/dbraw/zinc/05/27/12/1045052712.db2.gz JISLDNSHLCWVMT-MJGOQNOKSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCc2cccs2)CC[N@H+]1Cc1ccccc1 ZINC000738330853 1045052722 /nfs/dbraw/zinc/05/27/22/1045052722.db2.gz JISLDNSHLCWVMT-MJGOQNOKSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)CCc2cccs2)CC[NH+]1Cc1ccccc1 ZINC000738330853 1045052736 /nfs/dbraw/zinc/05/27/36/1045052736.db2.gz JISLDNSHLCWVMT-MJGOQNOKSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCc2cccs2)CC[NH+]1Cc1ccccc1 ZINC000738330853 1045052751 /nfs/dbraw/zinc/05/27/51/1045052751.db2.gz JISLDNSHLCWVMT-MJGOQNOKSA-N 2 1 328.525 4.276 20 0 EIADMP COC1(C[C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000429443347 1045143197 /nfs/dbraw/zinc/14/31/97/1045143197.db2.gz CQKFREACEJJMMX-ZVDOUQERSA-N 2 1 344.543 4.224 20 0 EIADMP FC(F)(F)CC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000923526909 1045150324 /nfs/dbraw/zinc/15/03/24/1045150324.db2.gz VQLNAZYMEYGNDT-DBPPKFAGSA-N 2 1 330.438 4.103 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1F ZINC000495721983 1045312469 /nfs/dbraw/zinc/31/24/69/1045312469.db2.gz AXHDATKRPAJKMO-HZPDHXFCSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1F ZINC000495721983 1045312480 /nfs/dbraw/zinc/31/24/80/1045312480.db2.gz AXHDATKRPAJKMO-HZPDHXFCSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1F ZINC000495721984 1045312613 /nfs/dbraw/zinc/31/26/13/1045312613.db2.gz AXHDATKRPAJKMO-JKSUJKDBSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1F ZINC000495721984 1045312622 /nfs/dbraw/zinc/31/26/22/1045312622.db2.gz AXHDATKRPAJKMO-JKSUJKDBSA-N 2 1 332.488 4.450 20 0 EIADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000236933365 1045371027 /nfs/dbraw/zinc/37/10/27/1045371027.db2.gz HLJKYZBMIXIPBV-MRXNPFEDSA-N 2 1 330.447 4.216 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000236933365 1045371036 /nfs/dbraw/zinc/37/10/36/1045371036.db2.gz HLJKYZBMIXIPBV-MRXNPFEDSA-N 2 1 330.447 4.216 20 0 EIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@H](C)C[C@H](C)C2)o1 ZINC000237685966 1045391798 /nfs/dbraw/zinc/39/17/98/1045391798.db2.gz JPJMHTFFZSXZIS-CALCHBBNSA-N 2 1 326.484 4.356 20 0 EIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2C[C@H](C)C[C@H](C)C2)o1 ZINC000237685966 1045391807 /nfs/dbraw/zinc/39/18/07/1045391807.db2.gz JPJMHTFFZSXZIS-CALCHBBNSA-N 2 1 326.484 4.356 20 0 EIADMP Fc1ccccc1C1CC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000237813859 1045395354 /nfs/dbraw/zinc/39/53/54/1045395354.db2.gz FALFRTBUISDKGH-UHFFFAOYSA-N 2 1 338.470 4.326 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000915681644 1045447296 /nfs/dbraw/zinc/44/72/96/1045447296.db2.gz FMOHFPITTWQQBT-VQTJNVASSA-N 2 1 330.516 4.362 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC(c2nc(C(C)(C)C)cs2)CC1 ZINC000767384196 1045524154 /nfs/dbraw/zinc/52/41/54/1045524154.db2.gz TYTIKTLSAGVVKA-INIZCTEOSA-N 2 1 335.561 4.104 20 0 EIADMP CC(C)(C)C[N@H+](C1CC(C)(C)N(O)C(C)(C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169984330 1045724715 /nfs/dbraw/zinc/72/47/15/1045724715.db2.gz JJPKLCUJMGESRO-WKILWMFISA-N 2 1 339.568 4.015 20 0 EIADMP C([NH2+][C@H]1CCCC12CCOCC2)C1([NH+]2CCCCC2)CCCCC1 ZINC000326300894 1045782034 /nfs/dbraw/zinc/78/20/34/1045782034.db2.gz HYFDXVGNWYFDOQ-IBGZPJMESA-N 2 1 334.548 4.114 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC([NH2+]Cc3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170158382 1045800234 /nfs/dbraw/zinc/80/02/34/1045800234.db2.gz OFLGZXBIVBNDAO-KDOFPFPSSA-N 2 1 340.433 4.448 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c(C)o1 ZINC000398010508 1045822302 /nfs/dbraw/zinc/82/23/02/1045822302.db2.gz CRNVXILITBIQAG-LDBYXDLTSA-N 2 1 326.484 4.458 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c(C)o1 ZINC000398010508 1045822303 /nfs/dbraw/zinc/82/23/03/1045822303.db2.gz CRNVXILITBIQAG-LDBYXDLTSA-N 2 1 326.484 4.458 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1F ZINC000398042684 1045826624 /nfs/dbraw/zinc/82/66/24/1045826624.db2.gz UAMJCKRRKQBFLD-WWMYMODYSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1F ZINC000398042684 1045826626 /nfs/dbraw/zinc/82/66/26/1045826626.db2.gz UAMJCKRRKQBFLD-WWMYMODYSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@H]1CCSc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248407255 1045871779 /nfs/dbraw/zinc/87/17/79/1045871779.db2.gz UDTWLPJFSYPALN-FCEWJHQRSA-N 2 1 330.541 4.466 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCC[C@H]2CCCCO2)C3)cc1 ZINC000248887158 1045887891 /nfs/dbraw/zinc/88/78/91/1045887891.db2.gz MKPOAEWZMZTNDP-YUMYIRISSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCCCCOc2ccc(Cl)cc2)CC[N@H+]1C ZINC000769418079 1045956958 /nfs/dbraw/zinc/95/69/58/1045956958.db2.gz TXKYLQFKIWMIBN-FUHWJXTLSA-N 2 1 338.923 4.352 20 0 EIADMP C[C@@H](Cc1ccccc1Cl)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001170250347 1045972372 /nfs/dbraw/zinc/97/23/72/1045972372.db2.gz KPKKZEFUQFTTAJ-HKUYNNGSSA-N 2 1 342.914 4.383 20 0 EIADMP CC(C)Oc1cccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC000769536615 1046012012 /nfs/dbraw/zinc/01/20/12/1046012012.db2.gz BXYRFZYOSUIWPE-UHFFFAOYSA-N 2 1 326.484 4.167 20 0 EIADMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000261658762 1046131291 /nfs/dbraw/zinc/13/12/91/1046131291.db2.gz BLLDDEIDVFBFJL-QAPCUYQASA-N 2 1 344.449 4.156 20 0 EIADMP COc1ccccc1-c1ccc([C@H](C)[N@@H+](C)CC2CC[NH2+]CC2)cc1 ZINC000261738887 1046139397 /nfs/dbraw/zinc/13/93/97/1046139397.db2.gz MMROLPSXEYMKCW-KRWDZBQOSA-N 2 1 338.495 4.355 20 0 EIADMP COCCC1(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCCC1 ZINC000508699885 1046325885 /nfs/dbraw/zinc/32/58/85/1046325885.db2.gz OYYMIPPBIMEFEE-FPOVZHCZSA-N 2 1 344.543 4.084 20 0 EIADMP c1ccc(C(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c2ccccc2)cc1 ZINC000508708705 1046351283 /nfs/dbraw/zinc/35/12/83/1046351283.db2.gz DSXVBAMNPLDKQP-HXUWFJFHSA-N 2 1 334.507 4.236 20 0 EIADMP C[C@@H]([NH2+]CCc1cccc(F)c1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710050 1046366365 /nfs/dbraw/zinc/36/63/65/1046366365.db2.gz KVEZBTYQWLFUND-APWZRJJASA-N 2 1 344.449 4.008 20 0 EIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cc(Cl)nc2ccccc12 ZINC000771306498 1046371113 /nfs/dbraw/zinc/37/11/13/1046371113.db2.gz APSQUMTYSMLXJV-INIZCTEOSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1cc(Cl)nc2ccccc12 ZINC000771306498 1046371147 /nfs/dbraw/zinc/37/11/47/1046371147.db2.gz APSQUMTYSMLXJV-INIZCTEOSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1cc(Cl)nc2ccccc12 ZINC000771306498 1046371165 /nfs/dbraw/zinc/37/11/65/1046371165.db2.gz APSQUMTYSMLXJV-INIZCTEOSA-N 2 1 331.891 4.194 20 0 EIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cc(Cl)nc2ccccc12 ZINC000771306498 1046371130 /nfs/dbraw/zinc/37/11/30/1046371130.db2.gz APSQUMTYSMLXJV-INIZCTEOSA-N 2 1 331.891 4.194 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CCC[C@H](C(F)(F)F)C3)CC2)[nH+]1 ZINC000127051630 1046600650 /nfs/dbraw/zinc/60/06/50/1046600650.db2.gz HBAFSUPOFUUDQL-HOCLYGCPSA-N 2 1 341.421 4.070 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cc(C)c(Br)s2)C[C@H]1C ZINC000536662000 1046632780 /nfs/dbraw/zinc/63/27/80/1046632780.db2.gz JXYWTJNXUBXDQY-CHWSQXEVSA-N 2 1 345.350 4.124 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(Br)s2)C[C@H]1C ZINC000536662000 1046632798 /nfs/dbraw/zinc/63/27/98/1046632798.db2.gz JXYWTJNXUBXDQY-CHWSQXEVSA-N 2 1 345.350 4.124 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(Br)s2)C[C@H]1C ZINC000536662000 1046632818 /nfs/dbraw/zinc/63/28/18/1046632818.db2.gz JXYWTJNXUBXDQY-CHWSQXEVSA-N 2 1 345.350 4.124 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CCN(Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536666736 1046642793 /nfs/dbraw/zinc/64/27/93/1046642793.db2.gz MQIWBHWDMFXXTL-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536666736 1046642800 /nfs/dbraw/zinc/64/28/00/1046642800.db2.gz MQIWBHWDMFXXTL-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536666736 1046642809 /nfs/dbraw/zinc/64/28/09/1046642809.db2.gz MQIWBHWDMFXXTL-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536666736 1046642815 /nfs/dbraw/zinc/64/28/15/1046642815.db2.gz MQIWBHWDMFXXTL-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536666736 1046642826 /nfs/dbraw/zinc/64/28/26/1046642826.db2.gz MQIWBHWDMFXXTL-MRXNPFEDSA-N 2 1 330.447 4.249 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1ccc(Br)cc1 ZINC000127321468 1046648314 /nfs/dbraw/zinc/64/83/14/1046648314.db2.gz FTISEXPPIDIHHL-CYBMUJFWSA-N 2 1 336.277 4.037 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1ccc(Br)cc1 ZINC000127321468 1046648320 /nfs/dbraw/zinc/64/83/20/1046648320.db2.gz FTISEXPPIDIHHL-CYBMUJFWSA-N 2 1 336.277 4.037 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3F)s2)C1 ZINC000536695080 1046687790 /nfs/dbraw/zinc/68/77/90/1046687790.db2.gz LCCISNZZJVXAQD-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3F)s2)C1 ZINC000536695080 1046687802 /nfs/dbraw/zinc/68/78/02/1046687802.db2.gz LCCISNZZJVXAQD-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3F)s2)C1 ZINC000536695080 1046687809 /nfs/dbraw/zinc/68/78/09/1046687809.db2.gz LCCISNZZJVXAQD-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3F)s2)C1 ZINC000536695080 1046687813 /nfs/dbraw/zinc/68/78/13/1046687813.db2.gz LCCISNZZJVXAQD-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC(C)(C[NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000459500440 1046727451 /nfs/dbraw/zinc/72/74/51/1046727451.db2.gz XZZTWUOXUQVSOD-UHFFFAOYSA-N 2 1 340.433 4.199 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3ccc(C4CC4)cc3)CC2)n2c1CCCC2 ZINC000459511120 1046747741 /nfs/dbraw/zinc/74/77/41/1046747741.db2.gz XWCVHCYBPJPFJU-UHFFFAOYSA-N 2 1 335.495 4.476 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cnc3ccccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379659213 1046750421 /nfs/dbraw/zinc/75/04/21/1046750421.db2.gz ZCQMMTVUJVWULD-XMSQKQJNSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cnc3ccccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379659213 1046750435 /nfs/dbraw/zinc/75/04/35/1046750435.db2.gz ZCQMMTVUJVWULD-XMSQKQJNSA-N 2 1 345.490 4.378 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3cc4ccccc4o3)CC2)[nH+]1 ZINC000128232876 1046786679 /nfs/dbraw/zinc/78/66/79/1046786679.db2.gz AYRDKDZZLRBANV-INIZCTEOSA-N 2 1 335.451 4.456 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)C1 ZINC000536838976 1046813953 /nfs/dbraw/zinc/81/39/53/1046813953.db2.gz MVCZNDXVEQTOME-KGLIPLIRSA-N 2 1 328.422 4.123 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)C1 ZINC000536838976 1046813960 /nfs/dbraw/zinc/81/39/60/1046813960.db2.gz MVCZNDXVEQTOME-KGLIPLIRSA-N 2 1 328.422 4.123 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC000536856456 1046825226 /nfs/dbraw/zinc/82/52/26/1046825226.db2.gz FCSLNQZRVWZAJA-OLZOCXBDSA-N 2 1 325.909 4.153 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc2ccccc2c1 ZINC000536859338 1046826551 /nfs/dbraw/zinc/82/65/51/1046826551.db2.gz RZNWUVUMFNCUKQ-CEXWTWQISA-N 2 1 340.511 4.380 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC(C)(C)c1c(Cl)cccc1Cl ZINC000536865813 1046831479 /nfs/dbraw/zinc/83/14/79/1046831479.db2.gz XXYXFRFIGLYFAS-DOMZBBRYSA-N 2 1 329.315 4.201 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2OC)C2CCCC2)C1 ZINC000536959183 1046870160 /nfs/dbraw/zinc/87/01/60/1046870160.db2.gz KUXJAFHGOMGCCV-DYESRHJHSA-N 2 1 330.516 4.248 20 0 EIADMP COc1ccccc1[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)C1CCCC1 ZINC000537016901 1046888416 /nfs/dbraw/zinc/88/84/16/1046888416.db2.gz ZETMDPSXBMXEPC-IIBYNOLFSA-N 2 1 341.499 4.357 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@H](c3ccccc3)C(C)C)CCCC2)CC1 ZINC000537000967 1046890946 /nfs/dbraw/zinc/89/09/46/1046890946.db2.gz YLZMDQWYFCGGQE-NRFANRHFSA-N 2 1 344.543 4.397 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](COc1ccccc1)c1ccccc1 ZINC000537116025 1046964168 /nfs/dbraw/zinc/96/41/68/1046964168.db2.gz DOGUHPFWWKSYNQ-QFIPXVFZSA-N 2 1 349.478 4.382 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](COc1ccccc1F)C(C)(C)C ZINC000537290565 1047073552 /nfs/dbraw/zinc/07/35/52/1047073552.db2.gz POKDERZBINUNGI-IBGZPJMESA-N 2 1 347.478 4.194 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000537304174 1047084363 /nfs/dbraw/zinc/08/43/63/1047084363.db2.gz ONCJFIBCMAMQBO-NRFANRHFSA-N 2 1 342.433 4.100 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497839061 1047115641 /nfs/dbraw/zinc/11/56/41/1047115641.db2.gz FTLPMRFFWXGHGJ-LAUBAEHRSA-N 2 1 330.491 4.472 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000537406723 1047200271 /nfs/dbraw/zinc/20/02/71/1047200271.db2.gz IAAGTFBSTJYNCM-PDGJWGCVSA-N 2 1 344.543 4.080 20 0 EIADMP FCc1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000789353832 1047401668 /nfs/dbraw/zinc/40/16/68/1047401668.db2.gz ZKGFPAFKTFBNOP-UHFFFAOYSA-N 2 1 327.447 4.069 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000556052701 1047418436 /nfs/dbraw/zinc/41/84/36/1047418436.db2.gz KWODHMSWKAOPGL-WOJBJXKFSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000556052701 1047418444 /nfs/dbraw/zinc/41/84/44/1047418444.db2.gz KWODHMSWKAOPGL-WOJBJXKFSA-N 2 1 328.887 4.308 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556076011 1047434374 /nfs/dbraw/zinc/43/43/74/1047434374.db2.gz HUNBFIGTEPIXGK-LEWJYISDSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556076011 1047434382 /nfs/dbraw/zinc/43/43/82/1047434382.db2.gz HUNBFIGTEPIXGK-LEWJYISDSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)o1 ZINC000556092718 1047443763 /nfs/dbraw/zinc/44/37/63/1047443763.db2.gz BZTLYFMANGBODN-SCWSEQNSSA-N 2 1 326.484 4.334 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)o1 ZINC000556092718 1047443767 /nfs/dbraw/zinc/44/37/67/1047443767.db2.gz BZTLYFMANGBODN-SCWSEQNSSA-N 2 1 326.484 4.334 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000556103325 1047454636 /nfs/dbraw/zinc/45/46/36/1047454636.db2.gz MMPJNUJPYYWOOR-SFTDATJTSA-N 2 1 344.543 4.399 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000556103325 1047454644 /nfs/dbraw/zinc/45/46/44/1047454644.db2.gz MMPJNUJPYYWOOR-SFTDATJTSA-N 2 1 344.543 4.399 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC[N@H+]2C2CC2)cc1 ZINC000897746548 1047481157 /nfs/dbraw/zinc/48/11/57/1047481157.db2.gz NLWSJCUAKIKCQL-FNZHQMIRSA-N 2 1 342.552 4.371 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC[N@@H+]2C2CC2)cc1 ZINC000897746548 1047481161 /nfs/dbraw/zinc/48/11/61/1047481161.db2.gz NLWSJCUAKIKCQL-FNZHQMIRSA-N 2 1 342.552 4.371 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)C[C@H](C)O1 ZINC000556155044 1047499132 /nfs/dbraw/zinc/49/91/32/1047499132.db2.gz QLBQZJBMKKFWHH-LXGFNABISA-N 2 1 330.516 4.107 20 0 EIADMP C[C@H](N[C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1cncs1 ZINC000897931037 1047501806 /nfs/dbraw/zinc/50/18/06/1047501806.db2.gz VABOCWNQNJKYNJ-QILLFSRXSA-N 2 1 327.497 4.162 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)C1CCOCC1 ZINC000129873107 1047521138 /nfs/dbraw/zinc/52/11/38/1047521138.db2.gz AHDQUUPDXITJRV-SFHVURJKSA-N 2 1 344.543 4.356 20 0 EIADMP CCCNc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556178519 1047540667 /nfs/dbraw/zinc/54/06/67/1047540667.db2.gz JGCOKBKUFLCMCK-FCHUYYIVSA-N 2 1 337.511 4.434 20 0 EIADMP CCCNc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556178519 1047540680 /nfs/dbraw/zinc/54/06/80/1047540680.db2.gz JGCOKBKUFLCMCK-FCHUYYIVSA-N 2 1 337.511 4.434 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccncc2)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000898321901 1047613596 /nfs/dbraw/zinc/61/35/96/1047613596.db2.gz DVUOAAQTSMSZTB-ZPMCFJSWSA-N 2 1 335.495 4.175 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccncc2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000898321901 1047613624 /nfs/dbraw/zinc/61/36/24/1047613624.db2.gz DVUOAAQTSMSZTB-ZPMCFJSWSA-N 2 1 335.495 4.175 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC000556260183 1047632725 /nfs/dbraw/zinc/63/27/25/1047632725.db2.gz KORQZFRFUVFYEZ-VIQWUECVSA-N 2 1 336.470 4.455 20 0 EIADMP Cc1ccccc1[C@@H](O)C[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000763435123 1047792081 /nfs/dbraw/zinc/79/20/81/1047792081.db2.gz ZJBLMAGGRXMRJD-UGKGYDQZSA-N 2 1 344.543 4.005 20 0 EIADMP CCOc1cc(C)ccc1CN[C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550681077 1047814199 /nfs/dbraw/zinc/81/41/99/1047814199.db2.gz UCEXDJJRBNXPSP-LEWJYISDSA-N 2 1 338.495 4.319 20 0 EIADMP CCOc1cc(C)ccc1CN[C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550681077 1047814200 /nfs/dbraw/zinc/81/42/00/1047814200.db2.gz UCEXDJJRBNXPSP-LEWJYISDSA-N 2 1 338.495 4.319 20 0 EIADMP COc1ncc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1Cl ZINC000556591828 1047835708 /nfs/dbraw/zinc/83/57/08/1047835708.db2.gz NEAROMYZHHBQKU-CABCVRRESA-N 2 1 339.911 4.049 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@]2(C)CC2(Cl)Cl)cc1 ZINC000824771216 1047923036 /nfs/dbraw/zinc/92/30/36/1047923036.db2.gz ACHWBVQJXDCZCS-LRDDRELGSA-N 2 1 338.282 4.415 20 0 EIADMP Cc1ccc2c(C[NH+]3CCCC[C@H]3C[C@@H]3CCC[N@@H+]3C)c[nH]c2c1 ZINC001136974962 1048005575 /nfs/dbraw/zinc/00/55/75/1048005575.db2.gz UODJLYRFOATTPF-OALUTQOASA-N 2 1 325.500 4.315 20 0 EIADMP Cc1ccc2c(C[N@H+]3CCCC[C@H]3C[C@@H]3CCC[NH+]3C)c[nH]c2c1 ZINC001136974962 1048005590 /nfs/dbraw/zinc/00/55/90/1048005590.db2.gz UODJLYRFOATTPF-OALUTQOASA-N 2 1 325.500 4.315 20 0 EIADMP Cc1ccc2c(C[N@@H+]3CCCC[C@H]3C[C@@H]3CCC[NH+]3C)c[nH]c2c1 ZINC001136974962 1048005606 /nfs/dbraw/zinc/00/56/06/1048005606.db2.gz UODJLYRFOATTPF-OALUTQOASA-N 2 1 325.500 4.315 20 0 EIADMP C[N@H+](Cc1cncc(Cl)c1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001136996420 1048048374 /nfs/dbraw/zinc/04/83/74/1048048374.db2.gz HQIWNUOFMUMHMH-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP CC1(C)[C@@H]2C[C@H]([NH+]3CCC4(CC[N@@H+](Cc5cccs5)C4)CC3)C[C@@H]21 ZINC001170751432 1048057219 /nfs/dbraw/zinc/05/72/19/1048057219.db2.gz DMCRUDZQDWSGTP-GGPHIMKMSA-N 2 1 344.568 4.471 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+]([C@H]1C[C@@H]3[C@H](C1)C3(C)C)CC2 ZINC001170752380 1048065343 /nfs/dbraw/zinc/06/53/43/1048065343.db2.gz IMINEGUHDLPFIH-RNQOJCNYSA-N 2 1 342.527 4.391 20 0 EIADMP COc1cccc(C2([NH2+]C3CC[NH+]([C@@H]4CCC[C@@H](C)C4)CC3)CC2)c1 ZINC000556914801 1048211630 /nfs/dbraw/zinc/21/16/30/1048211630.db2.gz CTWZEXFUAISYJR-YLJYHZDGSA-N 2 1 342.527 4.317 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(Cl)ccc2C1 ZINC001171113684 1048251546 /nfs/dbraw/zinc/25/15/46/1048251546.db2.gz VAQRJGBVGCJNMK-VAMGGRTRSA-N 2 1 334.935 4.425 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)C[C@@H]3CC3(Cl)Cl)C2)s1 ZINC000844327410 1048286715 /nfs/dbraw/zinc/28/67/15/1048286715.db2.gz CIFRSXNLMBQUAK-KGLIPLIRSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)C[C@@H]3CC3(Cl)Cl)C2)s1 ZINC000844327410 1048286725 /nfs/dbraw/zinc/28/67/25/1048286725.db2.gz CIFRSXNLMBQUAK-KGLIPLIRSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)C[C@@H]3CC3(Cl)Cl)C2)s1 ZINC000844327410 1048286733 /nfs/dbraw/zinc/28/67/33/1048286733.db2.gz CIFRSXNLMBQUAK-KGLIPLIRSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)C[C@@H]3CC3(Cl)Cl)C2)s1 ZINC000844327410 1048286738 /nfs/dbraw/zinc/28/67/38/1048286738.db2.gz CIFRSXNLMBQUAK-KGLIPLIRSA-N 2 1 347.355 4.004 20 0 EIADMP COc1ccc(Cl)c(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c1F ZINC001143895953 1048295551 /nfs/dbraw/zinc/29/55/51/1048295551.db2.gz MIIYIGZAXDALEN-UHFFFAOYSA-N 2 1 342.886 4.040 20 0 EIADMP COc1ccc(Cl)c(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)c1F ZINC001143895953 1048295568 /nfs/dbraw/zinc/29/55/68/1048295568.db2.gz MIIYIGZAXDALEN-UHFFFAOYSA-N 2 1 342.886 4.040 20 0 EIADMP C(=C\c1ccccc1)\C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499136339 1048330182 /nfs/dbraw/zinc/33/01/82/1048330182.db2.gz QMSQLGKQPZZYMG-ZMZCSGRZSA-N 2 1 332.491 4.485 20 0 EIADMP Cn1c[nH+]c2cc(N[C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)ccc21 ZINC000499136761 1048335381 /nfs/dbraw/zinc/33/53/81/1048335381.db2.gz RRTZPVQCAQARKB-ACDBMABISA-N 2 1 346.478 4.181 20 0 EIADMP Cn1c[nH+]c2cc(N[C@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)ccc21 ZINC000499136761 1048335398 /nfs/dbraw/zinc/33/53/98/1048335398.db2.gz RRTZPVQCAQARKB-ACDBMABISA-N 2 1 346.478 4.181 20 0 EIADMP Cc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000499219593 1048430913 /nfs/dbraw/zinc/43/09/13/1048430913.db2.gz QTHXSNCNKODMHD-WBDAEOGXSA-N 2 1 334.507 4.323 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CC2Cc4ccccc4C2)C3)cc1 ZINC000499224972 1048455979 /nfs/dbraw/zinc/45/59/79/1048455979.db2.gz YVOUHUFZVLWVOZ-BKFWDETESA-N 2 1 346.518 4.187 20 0 EIADMP c1ccn(-c2ccc(C[NH+]3CCC4(CCC[N@H+]4CC4CC4)CC3)cc2)c1 ZINC001144240874 1048533169 /nfs/dbraw/zinc/53/31/69/1048533169.db2.gz LFLAIXCJITYMAG-UHFFFAOYSA-N 2 1 349.522 4.318 20 0 EIADMP c1ccn(-c2ccc(C[NH+]3CCC4(CCC[N@@H+]4CC4CC4)CC3)cc2)c1 ZINC001144240874 1048533183 /nfs/dbraw/zinc/53/31/83/1048533183.db2.gz LFLAIXCJITYMAG-UHFFFAOYSA-N 2 1 349.522 4.318 20 0 EIADMP CC[N@@H+](C1CCN(C)CC1)[C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171160513 1048594460 /nfs/dbraw/zinc/59/44/60/1048594460.db2.gz BUBBKHXZQIIIBM-MRXNPFEDSA-N 2 1 341.326 4.267 20 0 EIADMP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1ccc(SC(F)F)c(OC)c1 ZINC000817960935 1049068791 /nfs/dbraw/zinc/06/87/91/1049068791.db2.gz UPYPZEGEDAKLDL-NSHDSACASA-N 2 1 332.460 4.178 20 0 EIADMP COc1cc([C@@H](C)[NH2+][C@@H](C[NH3+])C2CCCC2)ccc1SC(F)F ZINC000817980499 1049077346 /nfs/dbraw/zinc/07/73/46/1049077346.db2.gz CBJULTWCJDEGDJ-RISCZKNCSA-N 2 1 344.471 4.178 20 0 EIADMP CCO[C@@H]1C[C@H]([N@H+](C)CCCCn2cc[nH+]c2C)C12CCCCC2 ZINC000348185199 1049477483 /nfs/dbraw/zinc/47/74/83/1049477483.db2.gz ASLRHUHTGCOARH-RBUKOAKNSA-N 2 1 333.520 4.031 20 0 EIADMP CCO[C@@H]1C[C@H]([N@@H+](C)CCCCn2cc[nH+]c2C)C12CCCCC2 ZINC000348185199 1049477514 /nfs/dbraw/zinc/47/75/14/1049477514.db2.gz ASLRHUHTGCOARH-RBUKOAKNSA-N 2 1 333.520 4.031 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171357027 1049510589 /nfs/dbraw/zinc/51/05/89/1049510589.db2.gz GEMIGECWVKKYID-KZNAEPCWSA-N 2 1 336.470 4.050 20 0 EIADMP Cc1ccc(CC[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cn1 ZINC000820810579 1049554113 /nfs/dbraw/zinc/55/41/13/1049554113.db2.gz ZUKRRZNOYWQZMQ-NOTZXAQLSA-N 2 1 349.522 4.108 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)[C@H]2CCc3cccc(F)c3C2)CC1 ZINC001170968046 1049658986 /nfs/dbraw/zinc/65/89/86/1049658986.db2.gz BDNSHDTWTGEAAV-UFYCRDLUSA-N 2 1 344.518 4.445 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1OC ZINC000245419589 1049714409 /nfs/dbraw/zinc/71/44/09/1049714409.db2.gz BQCANOFDKOKIMO-IAGOWNOFSA-N 2 1 334.504 4.009 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc3ccccc3)C1)C2 ZINC001171551553 1049754233 /nfs/dbraw/zinc/75/42/33/1049754233.db2.gz QEMPQVNZFGECDU-FYYLOGMGSA-N 2 1 348.534 4.354 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(-c3ncco3)cc2)CC1(C)C ZINC001171631280 1049761348 /nfs/dbraw/zinc/76/13/48/1049761348.db2.gz XGLVBXOPXHUVAY-UHFFFAOYSA-N 2 1 327.472 4.083 20 0 EIADMP COc1cccc([C@H]2CC[N@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)c1 ZINC001171641329 1049778963 /nfs/dbraw/zinc/77/89/63/1049778963.db2.gz OVMQNEQJSJFDNV-KRWDZBQOSA-N 2 1 330.516 4.136 20 0 EIADMP [NH3+]CCc1c[nH+]cn1C1CCC(c2ccc(Br)cc2)CC1 ZINC001171644710 1049780701 /nfs/dbraw/zinc/78/07/01/1049780701.db2.gz KVQFTTSFTKBDEN-UHFFFAOYSA-N 2 1 348.288 4.046 20 0 EIADMP C[C@@H]([NH3+])Cc1cn([C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171733306 1049787230 /nfs/dbraw/zinc/78/72/30/1049787230.db2.gz QEARQCZLYKTWFO-LQWHRVPQSA-N 2 1 347.506 4.367 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCc2cccs2)CC[N@H+]1Cc1ccccc1 ZINC001171963625 1049825518 /nfs/dbraw/zinc/82/55/18/1049825518.db2.gz IICPWFNMWWCHSN-SFHVURJKSA-N 2 1 328.525 4.323 20 0 EIADMP COc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171962425 1049825628 /nfs/dbraw/zinc/82/56/28/1049825628.db2.gz CYOVIGXDNZBAFR-FQEVSTJZSA-N 2 1 338.495 4.228 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001171966409 1049826931 /nfs/dbraw/zinc/82/69/31/1049826931.db2.gz VBEFQJBELLSBHQ-NVXWUHKLSA-N 2 1 342.449 4.477 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cccc(O)c1 ZINC001171967888 1049828213 /nfs/dbraw/zinc/82/82/13/1049828213.db2.gz NXPATKNCGAOEEB-FXAWDEMLSA-N 2 1 338.495 4.486 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccc(O)c1 ZINC001171967888 1049828214 /nfs/dbraw/zinc/82/82/14/1049828214.db2.gz NXPATKNCGAOEEB-FXAWDEMLSA-N 2 1 338.495 4.486 20 0 EIADMP C[C@H](NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccnc1 ZINC000813881834 1049830658 /nfs/dbraw/zinc/83/06/58/1049830658.db2.gz VTHZOJRCJNEBRA-IRFPFTSISA-N 2 1 335.495 4.318 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccnc1 ZINC000813881834 1049830662 /nfs/dbraw/zinc/83/06/62/1049830662.db2.gz VTHZOJRCJNEBRA-IRFPFTSISA-N 2 1 335.495 4.318 20 0 EIADMP CC1(C)C[C@H]([NH+]2CCC[C@H](C(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171988796 1049832211 /nfs/dbraw/zinc/83/22/11/1049832211.db2.gz VRFUJMDJBBDNMD-ZWKOTPCHSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CCC[C@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171988796 1049832214 /nfs/dbraw/zinc/83/22/14/1049832214.db2.gz VRFUJMDJBBDNMD-ZWKOTPCHSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CCC[C@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171988796 1049832217 /nfs/dbraw/zinc/83/22/17/1049832217.db2.gz VRFUJMDJBBDNMD-ZWKOTPCHSA-N 2 1 336.470 4.407 20 0 EIADMP CCN(Cc1ccncc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977619 1049836747 /nfs/dbraw/zinc/83/67/47/1049836747.db2.gz SHISKEFPNWJLNH-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@H+](Cc1ccncc1)[C@@H]1CCN(Cc2ccccc2)C(C)(C)C1 ZINC001171977619 1049836750 /nfs/dbraw/zinc/83/67/50/1049836750.db2.gz SHISKEFPNWJLNH-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@@H+](Cc1ccncc1)[C@@H]1CCN(Cc2ccccc2)C(C)(C)C1 ZINC001171977619 1049836753 /nfs/dbraw/zinc/83/67/53/1049836753.db2.gz SHISKEFPNWJLNH-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@H+](Cc1ccncc1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171977619 1049836755 /nfs/dbraw/zinc/83/67/55/1049836755.db2.gz SHISKEFPNWJLNH-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@@H+](Cc1ccncc1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171977619 1049836756 /nfs/dbraw/zinc/83/67/56/1049836756.db2.gz SHISKEFPNWJLNH-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP CC[NH+](Cc1ccncc1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977619 1049836759 /nfs/dbraw/zinc/83/67/59/1049836759.db2.gz SHISKEFPNWJLNH-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP CC[NH+](Cc1ccncc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977619 1049836762 /nfs/dbraw/zinc/83/67/62/1049836762.db2.gz SHISKEFPNWJLNH-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCOC2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001171977208 1049836815 /nfs/dbraw/zinc/83/68/15/1049836815.db2.gz YORZTVBXUWGHEV-FQEVSTJZSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+](C)CCC[NH+]1CCCC1 ZINC001171975810 1049837581 /nfs/dbraw/zinc/83/75/81/1049837581.db2.gz ZUOHYOFHZNHSGI-HNNXBMFYSA-N 2 1 328.422 4.054 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2CCc3ncccc32)CC[N@H+]1Cc1ccccc1 ZINC001171977189 1049837910 /nfs/dbraw/zinc/83/79/10/1049837910.db2.gz YCEKTBGYEMBUJN-WIYYLYMNSA-N 2 1 335.495 4.102 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C(C)(C)O1 ZINC000245720024 1049838632 /nfs/dbraw/zinc/83/86/32/1049838632.db2.gz OOQTYJZGAFMGEI-IYWMVGAKSA-N 2 1 342.527 4.118 20 0 EIADMP CC[N@@H+](Cc1ccccn1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987989 1049841476 /nfs/dbraw/zinc/84/14/76/1049841476.db2.gz NRLZBCJEMXRNJT-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[NH+](Cc1ccccn1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987989 1049841481 /nfs/dbraw/zinc/84/14/81/1049841481.db2.gz NRLZBCJEMXRNJT-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070776 1049843270 /nfs/dbraw/zinc/84/32/70/1049843270.db2.gz AWJNNIBMTYBDAG-OXVGXARHSA-N 2 1 328.475 4.004 20 0 EIADMP F[C@@H]1C[C@@H]2C[C@H]1C[N@H+]2[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070776 1049843274 /nfs/dbraw/zinc/84/32/74/1049843274.db2.gz AWJNNIBMTYBDAG-OXVGXARHSA-N 2 1 328.475 4.004 20 0 EIADMP F[C@@H]1C[C@@H]2C[C@H]1C[NH+]2[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070776 1049843276 /nfs/dbraw/zinc/84/32/76/1049843276.db2.gz AWJNNIBMTYBDAG-OXVGXARHSA-N 2 1 328.475 4.004 20 0 EIADMP F[C@@H]1C[C@@H]2C[C@H]1C[NH+]2[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070776 1049843278 /nfs/dbraw/zinc/84/32/78/1049843278.db2.gz AWJNNIBMTYBDAG-OXVGXARHSA-N 2 1 328.475 4.004 20 0 EIADMP Cc1cccc(C(=[NH2+])N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172077735 1049846350 /nfs/dbraw/zinc/84/63/50/1049846350.db2.gz VVLVNVBRLOIYFQ-KOUNCHBCSA-N 2 1 347.506 4.496 20 0 EIADMP Cc1cccc(C(=[NH2+])N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172077734 1049846798 /nfs/dbraw/zinc/84/67/98/1049846798.db2.gz VVLVNVBRLOIYFQ-DKUWSORSSA-N 2 1 347.506 4.496 20 0 EIADMP CC(C)O[C@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172082430 1049847295 /nfs/dbraw/zinc/84/72/95/1049847295.db2.gz JWBQXKNRWMHQCY-CBPXPLCBSA-N 2 1 342.527 4.071 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H](N2CCc4cccnc4C2)C3)cc1 ZINC001172081924 1049847665 /nfs/dbraw/zinc/84/76/65/1049847665.db2.gz IGKDWSOKAXALES-ZBYYUNFXSA-N 2 1 347.506 4.025 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(c3ccccc3)CCCCC1)C2 ZINC001172100537 1049849563 /nfs/dbraw/zinc/84/95/63/1049849563.db2.gz DSRAGEFHZIBLGD-MZADTFQBSA-N 2 1 326.528 4.493 20 0 EIADMP CC(C)(C)OCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067891 1049851026 /nfs/dbraw/zinc/85/10/26/1049851026.db2.gz HPBDIYFXNXGZDA-MZADTFQBSA-N 2 1 344.543 4.367 20 0 EIADMP F[C@H]1CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172067063 1049851328 /nfs/dbraw/zinc/85/13/28/1049851328.db2.gz AEAWBMWKJZGXCZ-BURNTYAHSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172067063 1049851331 /nfs/dbraw/zinc/85/13/31/1049851331.db2.gz AEAWBMWKJZGXCZ-BURNTYAHSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172067063 1049851334 /nfs/dbraw/zinc/85/13/34/1049851334.db2.gz AEAWBMWKJZGXCZ-BURNTYAHSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172067063 1049851336 /nfs/dbraw/zinc/85/13/36/1049851336.db2.gz AEAWBMWKJZGXCZ-BURNTYAHSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@@H]1CCN([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C[C@H]1F ZINC001172067547 1049851418 /nfs/dbraw/zinc/85/14/18/1049851418.db2.gz CVYQMUQQDIDUCZ-BVJIBDCISA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)N3Cc2ccccc2)C[C@H]1F ZINC001172067547 1049851419 /nfs/dbraw/zinc/85/14/19/1049851419.db2.gz CVYQMUQQDIDUCZ-BVJIBDCISA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)N3Cc2ccccc2)C[C@H]1F ZINC001172067547 1049851423 /nfs/dbraw/zinc/85/14/23/1049851423.db2.gz CVYQMUQQDIDUCZ-BVJIBDCISA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C[C@H]1F ZINC001172067547 1049851426 /nfs/dbraw/zinc/85/14/26/1049851426.db2.gz CVYQMUQQDIDUCZ-BVJIBDCISA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C[C@H]1F ZINC001172067547 1049851428 /nfs/dbraw/zinc/85/14/28/1049851428.db2.gz CVYQMUQQDIDUCZ-BVJIBDCISA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C[C@H]1F ZINC001172067547 1049851430 /nfs/dbraw/zinc/85/14/30/1049851430.db2.gz CVYQMUQQDIDUCZ-BVJIBDCISA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C[C@H]1F ZINC001172067547 1049851432 /nfs/dbraw/zinc/85/14/32/1049851432.db2.gz CVYQMUQQDIDUCZ-BVJIBDCISA-N 2 1 330.491 4.252 20 0 EIADMP F[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172066825 1049851734 /nfs/dbraw/zinc/85/17/34/1049851734.db2.gz KJYDCJVWQXLQOM-ONUIULTDSA-N 2 1 330.491 4.442 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(n3ccc4ccccc43)CC1)C2 ZINC001172128780 1049852374 /nfs/dbraw/zinc/85/23/74/1049852374.db2.gz UCHQBBGITAYCBS-AERCQKQUSA-N 2 1 337.511 4.294 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(n3ccc4ccccc43)CC1)C2 ZINC001172128780 1049852376 /nfs/dbraw/zinc/85/23/76/1049852376.db2.gz UCHQBBGITAYCBS-AERCQKQUSA-N 2 1 337.511 4.294 20 0 EIADMP F[C@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172069821 1049852961 /nfs/dbraw/zinc/85/29/61/1049852961.db2.gz XVPIOUWFWIHORO-UZFIKNKDSA-N 2 1 330.491 4.442 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](n1c3ccccc3nc1[C@H]1CCCC[NH2+]1)C2 ZINC001172127731 1049853822 /nfs/dbraw/zinc/85/38/22/1049853822.db2.gz LFFHMQPUOPSZTD-SFNKJDCFSA-N 2 1 338.499 4.039 20 0 EIADMP COc1cccc(CC2(C[NH2+][C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CCC2)c1 ZINC001172110320 1049856388 /nfs/dbraw/zinc/85/63/88/1049856388.db2.gz JSKOEHNKVMEDOZ-OWZKRDHZSA-N 2 1 342.527 4.013 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cccc(C(F)(F)F)c1Cl)C2 ZINC001172104675 1049857151 /nfs/dbraw/zinc/85/71/51/1049857151.db2.gz FAZZGKADOYZSTR-ZSOGYDGISA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cccc(C(F)(F)F)c1Cl)C2 ZINC001172104675 1049857152 /nfs/dbraw/zinc/85/71/52/1049857152.db2.gz FAZZGKADOYZSTR-ZSOGYDGISA-N 2 1 346.824 4.464 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3ccc(Br)cc3)CC1)C2 ZINC001172104274 1049857623 /nfs/dbraw/zinc/85/76/23/1049857623.db2.gz BDWUUPZMRKMREG-OSYLJGHBSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3ccc(Br)cc3)CC1)C2 ZINC001172104274 1049857625 /nfs/dbraw/zinc/85/76/25/1049857625.db2.gz BDWUUPZMRKMREG-OSYLJGHBSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Oc3ccc(Cl)cc3)CC1)C2 ZINC001172116731 1049858163 /nfs/dbraw/zinc/85/81/63/1049858163.db2.gz CNFQQVHUKZVHOY-BCDXTJNWSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Oc3ccc(Cl)cc3)CC1)C2 ZINC001172116731 1049858167 /nfs/dbraw/zinc/85/81/67/1049858167.db2.gz CNFQQVHUKZVHOY-BCDXTJNWSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1c3ccccc3-c3ccccc31)C2 ZINC001172112054 1049858332 /nfs/dbraw/zinc/85/83/32/1049858332.db2.gz ZUUZKOADQZRZLS-NNZMDNLPSA-N 2 1 332.491 4.404 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3ccccc3Br)CC1)C2 ZINC001172113575 1049858669 /nfs/dbraw/zinc/85/86/69/1049858669.db2.gz DNNIGCSNFQZDOP-QKDCVEJESA-N 2 1 349.316 4.043 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3ccccc3Br)CC1)C2 ZINC001172113575 1049858674 /nfs/dbraw/zinc/85/86/74/1049858674.db2.gz DNNIGCSNFQZDOP-QKDCVEJESA-N 2 1 349.316 4.043 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CSc2ccccc2C1 ZINC001172206331 1049864368 /nfs/dbraw/zinc/86/43/68/1049864368.db2.gz ONPOOHUOZSJKIU-IPMKNSEASA-N 2 1 330.541 4.042 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@H]1CSc2ccccc2C1 ZINC001172206331 1049864369 /nfs/dbraw/zinc/86/43/69/1049864369.db2.gz ONPOOHUOZSJKIU-IPMKNSEASA-N 2 1 330.541 4.042 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@H]1CSc2ccccc2C1 ZINC001172206331 1049864372 /nfs/dbraw/zinc/86/43/72/1049864372.db2.gz ONPOOHUOZSJKIU-IPMKNSEASA-N 2 1 330.541 4.042 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccnc(Cl)c2F)c1 ZINC000823671949 1049868022 /nfs/dbraw/zinc/86/80/22/1049868022.db2.gz YMXATKXVGQCNLD-UHFFFAOYSA-N 2 1 335.854 4.006 20 0 EIADMP COCCC[NH+]1CCC([NH2+]C2(c3cccc(F)c3)CCCCC2)CC1 ZINC001172248032 1049872173 /nfs/dbraw/zinc/87/21/73/1049872173.db2.gz UDADPWAOAWGWPB-UHFFFAOYSA-N 2 1 348.506 4.076 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CCC([NH3+])(c2ccc(Cl)cc2)CC1 ZINC001172335057 1049886837 /nfs/dbraw/zinc/88/68/37/1049886837.db2.gz NVNNWPKZVPFNRE-HOTGVXAUSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC([NH3+])(c2cccc(Cl)c2)CC1 ZINC001172340936 1049888787 /nfs/dbraw/zinc/88/87/87/1049888787.db2.gz YAYCFRPGNUFRJJ-HZPDHXFCSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172356371 1049894552 /nfs/dbraw/zinc/89/45/52/1049894552.db2.gz XYMYHUHRNXEVIR-URVUXULASA-N 2 1 344.543 4.178 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172356371 1049894553 /nfs/dbraw/zinc/89/45/53/1049894553.db2.gz XYMYHUHRNXEVIR-URVUXULASA-N 2 1 344.543 4.178 20 0 EIADMP COc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)cc1 ZINC001172367737 1049897164 /nfs/dbraw/zinc/89/71/64/1049897164.db2.gz MVUZJYWYJNDXKQ-LVCYWYKZSA-N 2 1 344.543 4.116 20 0 EIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H](C)CCOCC(C)C)CC1 ZINC001172467484 1049919877 /nfs/dbraw/zinc/91/98/77/1049919877.db2.gz GXIJKOSJVFWSGZ-HXUWFJFHSA-N 2 1 346.559 4.424 20 0 EIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H](C)CCOCC(C)C)CC1 ZINC001172467483 1049920043 /nfs/dbraw/zinc/92/00/43/1049920043.db2.gz GXIJKOSJVFWSGZ-FQEVSTJZSA-N 2 1 346.559 4.424 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccncc2)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172555415 1049930979 /nfs/dbraw/zinc/93/09/79/1049930979.db2.gz ICGRZNQMERYDGF-SSGKUCQKSA-N 2 1 349.522 4.490 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCOCC2)C2CCC3(CCCC3)CC2)CC1 ZINC001172729267 1049969007 /nfs/dbraw/zinc/96/90/07/1049969007.db2.gz UOZLRYQNRDHURM-IYARVYRRSA-N 2 1 334.548 4.240 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc2c(c1)OCCCO2 ZINC000246856069 1050002767 /nfs/dbraw/zinc/00/27/67/1050002767.db2.gz CTIPVIOBBJWKRF-ZWKOTPCHSA-N 2 1 346.515 4.011 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc3ccccc3o2)[C@@H](C)C1 ZINC000248060407 1050041246 /nfs/dbraw/zinc/04/12/46/1050041246.db2.gz YIBAYZKGPSKXPD-LNLFQRSKSA-N 2 1 344.499 4.220 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cc3ccccc3o2)[C@@H](C)C1 ZINC000248060407 1050041251 /nfs/dbraw/zinc/04/12/51/1050041251.db2.gz YIBAYZKGPSKXPD-LNLFQRSKSA-N 2 1 344.499 4.220 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(F)c1 ZINC000248389219 1050052732 /nfs/dbraw/zinc/05/27/32/1050052732.db2.gz AQHHZEJOJDKOLQ-JYJNAYRXSA-N 2 1 334.479 4.138 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(F)c1 ZINC000248389219 1050052736 /nfs/dbraw/zinc/05/27/36/1050052736.db2.gz AQHHZEJOJDKOLQ-JYJNAYRXSA-N 2 1 334.479 4.138 20 0 EIADMP Cc1cncc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000248754474 1050076112 /nfs/dbraw/zinc/07/61/12/1050076112.db2.gz UWRVKOANJQPJJY-IEBWSBKVSA-N 2 1 337.511 4.473 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]Cc3ccc4c(c3)CCCC4)CC2)cc1 ZINC001177186325 1050167182 /nfs/dbraw/zinc/16/71/82/1050167182.db2.gz NKTNRXBVGSLGAQ-UHFFFAOYSA-N 2 1 348.534 4.362 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2cnc(-c3ccsc3)s2)C1 ZINC001177294052 1050178129 /nfs/dbraw/zinc/17/81/29/1050178129.db2.gz CQRDHTRVKRTSOO-GASCZTMLSA-N 2 1 349.569 4.329 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2cnc(-c3ccsc3)s2)C1 ZINC001177294052 1050178144 /nfs/dbraw/zinc/17/81/44/1050178144.db2.gz CQRDHTRVKRTSOO-GASCZTMLSA-N 2 1 349.569 4.329 20 0 EIADMP C[C@@H](Cc1c(F)cccc1Cl)[NH+]1CCC([NH3+])(c2ccccc2)CC1 ZINC001172848278 1050186176 /nfs/dbraw/zinc/18/61/76/1050186176.db2.gz SIRVFTKEZSPHRN-HNNXBMFYSA-N 2 1 346.877 4.360 20 0 EIADMP CCC[C@H](C[NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)c1ccccc1 ZINC001177363702 1050203536 /nfs/dbraw/zinc/20/35/36/1050203536.db2.gz ZFXFBIPISXCWLS-HXUWFJFHSA-N 2 1 334.467 4.249 20 0 EIADMP C[C@@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172882239 1050225760 /nfs/dbraw/zinc/22/57/60/1050225760.db2.gz MBMYGHIKWMIKOE-LLLHUVSDSA-N 2 1 338.948 4.426 20 0 EIADMP C[C@@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172882239 1050225773 /nfs/dbraw/zinc/22/57/73/1050225773.db2.gz MBMYGHIKWMIKOE-LLLHUVSDSA-N 2 1 338.948 4.426 20 0 EIADMP COCCCN1CCC([NH2+][C@H](c2ccccc2F)C2CCCC2)CC1 ZINC000091317652 1050254081 /nfs/dbraw/zinc/25/40/81/1050254081.db2.gz SYABDVFVNZNNJU-NRFANRHFSA-N 2 1 348.506 4.148 20 0 EIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC001177741690 1050290641 /nfs/dbraw/zinc/29/06/41/1050290641.db2.gz BUGDTWNNTRZNJW-HLAWJBBLSA-N 2 1 329.532 4.352 20 0 EIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC001177741690 1050290645 /nfs/dbraw/zinc/29/06/45/1050290645.db2.gz BUGDTWNNTRZNJW-HLAWJBBLSA-N 2 1 329.532 4.352 20 0 EIADMP CCOc1ccc(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)o1 ZINC001177749507 1050292709 /nfs/dbraw/zinc/29/27/09/1050292709.db2.gz XAXYUAOKVCIZRX-UHFFFAOYSA-N 2 1 342.483 4.200 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H](Oc3ccc(C)cc3)C2)CC1 ZINC001173112155 1050310374 /nfs/dbraw/zinc/31/03/74/1050310374.db2.gz RGUOUWLDKZGXCI-AOMIVXANSA-N 2 1 344.543 4.491 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H](c3nc(C(C)C)no3)C2)CC1 ZINC001173113035 1050311070 /nfs/dbraw/zinc/31/10/70/1050311070.db2.gz GZTWXZPDJDGMIH-WWDZGPRUSA-N 2 1 348.535 4.025 20 0 EIADMP CN(C)C1=[NH+]OC2(C1)CC[NH+](C1CCC3(CCCCC3)CC1)CC2 ZINC001173115671 1050312681 /nfs/dbraw/zinc/31/26/81/1050312681.db2.gz BCWGIANCYHOEKB-UHFFFAOYSA-N 2 1 333.520 4.010 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1F ZINC001177919738 1050328288 /nfs/dbraw/zinc/32/82/88/1050328288.db2.gz PHBBNQCMXZDDBH-KXBFYZLASA-N 2 1 348.487 4.069 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ccc1F ZINC001177919738 1050328293 /nfs/dbraw/zinc/32/82/93/1050328293.db2.gz PHBBNQCMXZDDBH-KXBFYZLASA-N 2 1 348.487 4.069 20 0 EIADMP CC(C)[N@H+]1CC[C@H]([NH2+]C2CCC(Oc3ccccc3)CC2)[C@H](C)C1 ZINC001173202547 1050345253 /nfs/dbraw/zinc/34/52/53/1050345253.db2.gz UJNSJROBNXYYKF-SDEKRAFDSA-N 2 1 330.516 4.085 20 0 EIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCc2[nH+]ccn2CC1 ZINC001173216593 1050350621 /nfs/dbraw/zinc/35/06/21/1050350621.db2.gz MBLHLQRMEXDKSB-IBGZPJMESA-N 2 1 345.490 4.352 20 0 EIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCc2[nH+]ccn2CC1 ZINC001173216593 1050350636 /nfs/dbraw/zinc/35/06/36/1050350636.db2.gz MBLHLQRMEXDKSB-IBGZPJMESA-N 2 1 345.490 4.352 20 0 EIADMP CCc1ccc(C[C@H](C)[NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)cc1 ZINC001173250628 1050376295 /nfs/dbraw/zinc/37/62/95/1050376295.db2.gz SRYHIEGUPMLFBC-KRWDZBQOSA-N 2 1 340.486 4.269 20 0 EIADMP [NH3+][C@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC[C@@H]1F ZINC001206196736 1050381054 /nfs/dbraw/zinc/38/10/54/1050381054.db2.gz CQPHKYSIVRZHES-OALUTQOASA-N 2 1 332.850 4.268 20 0 EIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC[C@@H]1F ZINC001206196736 1050381071 /nfs/dbraw/zinc/38/10/71/1050381071.db2.gz CQPHKYSIVRZHES-OALUTQOASA-N 2 1 332.850 4.268 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2(C)Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001178188074 1050400428 /nfs/dbraw/zinc/40/04/28/1050400428.db2.gz JRCDUFRZGGKXRE-WMZHIEFXSA-N 2 1 348.534 4.434 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2(C)Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001178188074 1050400431 /nfs/dbraw/zinc/40/04/31/1050400431.db2.gz JRCDUFRZGGKXRE-WMZHIEFXSA-N 2 1 348.534 4.434 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2cccc(F)c2F)C[N@H+]1Cc1ccccc1 ZINC001178208289 1050403114 /nfs/dbraw/zinc/40/31/14/1050403114.db2.gz KYQLEIDDVKHLAH-SJLPKXTDSA-N 2 1 344.449 4.355 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+][C@H]2CC[C@@H](C)SC2)C[N@H+]1Cc1ccccc1 ZINC001178207159 1050403851 /nfs/dbraw/zinc/40/38/51/1050403851.db2.gz APOXJDJCPXDXKK-HNJRGHQBSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2c1CCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001178331333 1050437406 /nfs/dbraw/zinc/43/74/06/1050437406.db2.gz QCNMOXNMEMRELY-GCJKJVERSA-N 2 1 334.507 4.176 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(Br)cs2)C1 ZINC000253355223 1050455133 /nfs/dbraw/zinc/45/51/33/1050455133.db2.gz FBVDPBPAPAFXNI-OLZOCXBDSA-N 2 1 345.350 4.282 20 0 EIADMP CSCc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001178458102 1050475607 /nfs/dbraw/zinc/47/56/07/1050475607.db2.gz PTDPNSDNBIBCTM-LPHOPBHVSA-N 2 1 332.557 4.292 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001173548490 1050485833 /nfs/dbraw/zinc/48/58/33/1050485833.db2.gz CGMKKNLJRZBNCQ-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CC[C@]2(CC[N@H+](C)C2)C1 ZINC001173548490 1050485849 /nfs/dbraw/zinc/48/58/49/1050485849.db2.gz CGMKKNLJRZBNCQ-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC001173548490 1050485858 /nfs/dbraw/zinc/48/58/58/1050485858.db2.gz CGMKKNLJRZBNCQ-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001173549694 1050485903 /nfs/dbraw/zinc/48/59/03/1050485903.db2.gz IFRAEYXVJVMOGN-JCKWVBRZSA-N 2 1 341.326 4.198 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@H]2CCCN(C)[C@H]2C1 ZINC001173551666 1050489135 /nfs/dbraw/zinc/48/91/35/1050489135.db2.gz UQGOASXYAXMGKB-SIIHOXLZSA-N 2 1 341.326 4.341 20 0 EIADMP Cc1cc(C[N@@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)ccc1Oc1ccccc1 ZINC001206209688 1050535768 /nfs/dbraw/zinc/53/57/68/1050535768.db2.gz IBHJEAWSWLQLRE-MOPGFXCFSA-N 2 1 328.431 4.049 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1CCC3(CCc4ccccc43)CC1)C2 ZINC001173685092 1050537727 /nfs/dbraw/zinc/53/77/27/1050537727.db2.gz IEGGVIGJQPHPBJ-ISVUKBKDSA-N 2 1 338.539 4.418 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1CCC3(CCc4ccccc43)CC1)C2 ZINC001173685092 1050537740 /nfs/dbraw/zinc/53/77/40/1050537740.db2.gz IEGGVIGJQPHPBJ-ISVUKBKDSA-N 2 1 338.539 4.418 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+]C2CCC3(CCc4ccccc43)CC2)C1 ZINC001173687807 1050540251 /nfs/dbraw/zinc/54/02/51/1050540251.db2.gz TZKDMTVMDFLNQY-NLMOZGTASA-N 2 1 326.528 4.135 20 0 EIADMP CC1(C)CCC[C@H]1C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001178783726 1050552977 /nfs/dbraw/zinc/55/29/77/1050552977.db2.gz ZDCXJXLMTWCKJP-SFHVURJKSA-N 2 1 332.507 4.249 20 0 EIADMP C[C@@H](C[NH2+]Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C[NH+](C)C ZINC001178811775 1050559919 /nfs/dbraw/zinc/55/99/19/1050559919.db2.gz XTJJEBKIUCPPHJ-ZDUSSCGKSA-N 2 1 340.389 4.253 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]CC[C@H]3CCc4ccccc43)CC2)cc1 ZINC001178831705 1050567361 /nfs/dbraw/zinc/56/73/61/1050567361.db2.gz ZVBYOOIWXDJGHI-JOCHJYFZSA-N 2 1 348.534 4.403 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CC(Nc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001179520734 1050706139 /nfs/dbraw/zinc/70/61/39/1050706139.db2.gz OAKQQOFHDWXYSM-UGAAUXFBSA-N 2 1 349.522 4.272 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CC(Nc3ccccc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001179520734 1050706154 /nfs/dbraw/zinc/70/61/54/1050706154.db2.gz OAKQQOFHDWXYSM-UGAAUXFBSA-N 2 1 349.522 4.272 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCc2cccc(Cl)c2)C1 ZINC001180031082 1050858825 /nfs/dbraw/zinc/85/88/25/1050858825.db2.gz UNLDQOOUSDDBFI-PKOBYXMFSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCc2cccc(Cl)c2)C1 ZINC001180031082 1050858828 /nfs/dbraw/zinc/85/88/28/1050858828.db2.gz UNLDQOOUSDDBFI-PKOBYXMFSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCc2cccc(Cl)c2)C1 ZINC001180031082 1050858833 /nfs/dbraw/zinc/85/88/33/1050858833.db2.gz UNLDQOOUSDDBFI-PKOBYXMFSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCc2cccc(Cl)c2)C1 ZINC001180031082 1050858839 /nfs/dbraw/zinc/85/88/39/1050858839.db2.gz UNLDQOOUSDDBFI-PKOBYXMFSA-N 2 1 334.935 4.469 20 0 EIADMP COc1cc2ccccc2cc1CN(C)CC[C@@H]1CCCC[N@H+]1C ZINC001180099201 1050886915 /nfs/dbraw/zinc/88/69/15/1050886915.db2.gz WRFHEBVRDRMRPB-FQEVSTJZSA-N 2 1 326.484 4.155 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000619772492 1050910539 /nfs/dbraw/zinc/91/05/39/1050910539.db2.gz ICBSSGNXZLPLCN-OAHLLOKOSA-N 2 1 332.875 4.422 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000619772492 1050910557 /nfs/dbraw/zinc/91/05/57/1050910557.db2.gz ICBSSGNXZLPLCN-OAHLLOKOSA-N 2 1 332.875 4.422 20 0 EIADMP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001180302565 1050945506 /nfs/dbraw/zinc/94/55/06/1050945506.db2.gz ZLYNMXDPUBINFN-BRKWEVRTSA-N 2 1 326.528 4.455 20 0 EIADMP CC[C@H]1C[N@H+](C[C@@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)CCO1 ZINC001180540013 1051030081 /nfs/dbraw/zinc/03/00/81/1051030081.db2.gz FKTXUWFYFRVGHF-RBBKRZOGSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@H]1C[N@@H+](C[C@@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)CCO1 ZINC001180540013 1051030087 /nfs/dbraw/zinc/03/00/87/1051030087.db2.gz FKTXUWFYFRVGHF-RBBKRZOGSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@H]1C[NH+](C[C@@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)CCO1 ZINC001180540013 1051030095 /nfs/dbraw/zinc/03/00/95/1051030095.db2.gz FKTXUWFYFRVGHF-RBBKRZOGSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@H]1C[NH+](C[C@@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC001180540013 1051030105 /nfs/dbraw/zinc/03/01/05/1051030105.db2.gz FKTXUWFYFRVGHF-RBBKRZOGSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000414155135 1051142881 /nfs/dbraw/zinc/14/28/81/1051142881.db2.gz MNQPZASKSYZUIG-BVYCBKJFSA-N 2 1 337.511 4.218 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000414155135 1051142887 /nfs/dbraw/zinc/14/28/87/1051142887.db2.gz MNQPZASKSYZUIG-BVYCBKJFSA-N 2 1 337.511 4.218 20 0 EIADMP C[C@@H](CCOCc1ccccc1)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001181276819 1051195942 /nfs/dbraw/zinc/19/59/42/1051195942.db2.gz RQKBHDJMIWVGDA-SIKLNZKXSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@@H]1CCCC[C@H]1OCC[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190826079 1051286991 /nfs/dbraw/zinc/28/69/91/1051286991.db2.gz FCEIDLAOTIVWPG-QHAWAJNXSA-N 2 1 336.564 4.170 20 0 EIADMP C[C@@H]1CCCC[C@H]1OCC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190826079 1051287001 /nfs/dbraw/zinc/28/70/01/1051287001.db2.gz FCEIDLAOTIVWPG-QHAWAJNXSA-N 2 1 336.564 4.170 20 0 EIADMP CCCC[N@@H+](C[C@H](O)c1ccccc1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001174984961 1051304864 /nfs/dbraw/zinc/30/48/64/1051304864.db2.gz ULLHVZLUGLABHI-IBGZPJMESA-N 2 1 332.532 4.131 20 0 EIADMP Cc1ccc(CCC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c(C)c1 ZINC000620879553 1051412233 /nfs/dbraw/zinc/41/22/33/1051412233.db2.gz RAWBHXZUAPZANN-UHFFFAOYSA-N 2 1 336.523 4.490 20 0 EIADMP C[C@H](CC[NH2+][C@H]1CC[N@@H+](C)C[C@@H]1C)c1cccc(C(F)(F)F)c1 ZINC000155868417 1051469371 /nfs/dbraw/zinc/46/93/71/1051469371.db2.gz KTWOGAWJMHEAIV-KEYYUXOJSA-N 2 1 328.422 4.129 20 0 EIADMP COc1ccc(C2CCC([NH2+]CC[N@@H+]3CCCC3(C)C)CC2)cc1 ZINC001182310279 1051489123 /nfs/dbraw/zinc/48/91/23/1051489123.db2.gz WDZLGTLYVUJAHE-UHFFFAOYSA-N 2 1 330.516 4.185 20 0 EIADMP COc1ccc(C2CCC([NH2+]CC[N@H+]3CCCC3(C)C)CC2)cc1 ZINC001182310279 1051489129 /nfs/dbraw/zinc/48/91/29/1051489129.db2.gz WDZLGTLYVUJAHE-UHFFFAOYSA-N 2 1 330.516 4.185 20 0 EIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2c(Cl)cccc2C(F)(F)F)CC1 ZINC001205570120 1051519092 /nfs/dbraw/zinc/51/90/92/1051519092.db2.gz GGPZBTWBCWWJMX-CQSZACIVSA-N 2 1 338.776 4.012 20 0 EIADMP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000774300341 1051544863 /nfs/dbraw/zinc/54/48/63/1051544863.db2.gz DQYCVOBYKMIRFJ-UZLBHIALSA-N 2 1 329.532 4.454 20 0 EIADMP COc1ccccc1CCC[N@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001175353384 1051545849 /nfs/dbraw/zinc/54/58/49/1051545849.db2.gz XTWGFBNHNKMHFH-OAQYLSRUSA-N 2 1 344.543 4.214 20 0 EIADMP COc1ccccc1CCC[N@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001175353383 1051546070 /nfs/dbraw/zinc/54/60/70/1051546070.db2.gz XTWGFBNHNKMHFH-NRFANRHFSA-N 2 1 344.543 4.214 20 0 EIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC1 ZINC001205571827 1051557380 /nfs/dbraw/zinc/55/73/80/1051557380.db2.gz YQEVOZBHXNXWIE-CQSZACIVSA-N 2 1 339.669 4.300 20 0 EIADMP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC1 ZINC001205571827 1051557368 /nfs/dbraw/zinc/55/73/68/1051557368.db2.gz YQEVOZBHXNXWIE-CQSZACIVSA-N 2 1 339.669 4.300 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(NC2=CC[N@H+](Cc3ccccc3)CC2)cc1 ZINC001175505450 1051635024 /nfs/dbraw/zinc/63/50/24/1051635024.db2.gz CHQPSTUGKIUITG-UHFFFAOYSA-N 2 1 344.462 4.382 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(NC2=CC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001175505450 1051635035 /nfs/dbraw/zinc/63/50/35/1051635035.db2.gz CHQPSTUGKIUITG-UHFFFAOYSA-N 2 1 344.462 4.382 20 0 EIADMP c1ccc(C[N@@H+]2CC=C(Nc3c[nH+]ccc3N3CCCCC3)CC2)cc1 ZINC001175504824 1051636244 /nfs/dbraw/zinc/63/62/44/1051636244.db2.gz FUNVZJNRHORMOR-UHFFFAOYSA-N 2 1 348.494 4.274 20 0 EIADMP Cc1noc(C)c1[C@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000671111880 1051638092 /nfs/dbraw/zinc/63/80/92/1051638092.db2.gz RTONNJVBZIQJLO-VMEOHVCESA-N 2 1 341.499 4.385 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158098402 1051710468 /nfs/dbraw/zinc/71/04/68/1051710468.db2.gz HVYGODQRFLCXCG-DZGCQCFKSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000158098402 1051710484 /nfs/dbraw/zinc/71/04/84/1051710484.db2.gz HVYGODQRFLCXCG-DZGCQCFKSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158196201 1051724682 /nfs/dbraw/zinc/72/46/82/1051724682.db2.gz GRRPLLLPXRNGFU-QAPCUYQASA-N 2 1 343.540 4.035 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000158196201 1051724690 /nfs/dbraw/zinc/72/46/90/1051724690.db2.gz GRRPLLLPXRNGFU-QAPCUYQASA-N 2 1 343.540 4.035 20 0 EIADMP C[C@@H]1C[N@@H+](CCSc2cccc(Cl)c2)CCN1c1cc[nH+]cc1 ZINC001175775202 1051778573 /nfs/dbraw/zinc/77/85/73/1051778573.db2.gz PKGRPNGWJOMNDR-OAHLLOKOSA-N 2 1 347.915 4.038 20 0 EIADMP C[C@@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001183095480 1051785586 /nfs/dbraw/zinc/78/55/86/1051785586.db2.gz QFQVCZGBMOYIHX-HKUYNNGSSA-N 2 1 339.527 4.201 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@H](CC[N@H+]2C)C1 ZINC001183371727 1051837502 /nfs/dbraw/zinc/83/75/02/1051837502.db2.gz SDGHTPYUEYNMAU-HIROUSEGSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@H](CC[N@@H+]2C)C1 ZINC001183371727 1051837504 /nfs/dbraw/zinc/83/75/04/1051837504.db2.gz SDGHTPYUEYNMAU-HIROUSEGSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[N@@H+]1CC[C@@H]2[C@H](CC[NH+]2C)C1 ZINC001183371727 1051837506 /nfs/dbraw/zinc/83/75/06/1051837506.db2.gz SDGHTPYUEYNMAU-HIROUSEGSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[N@H+]1CC[C@@H]2[C@H](CC[NH+]2C)C1 ZINC001183371727 1051837509 /nfs/dbraw/zinc/83/75/09/1051837509.db2.gz SDGHTPYUEYNMAU-HIROUSEGSA-N 2 1 338.417 4.135 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2ccc(-c3ccccc3OC)cc2)CC1 ZINC000159280430 1051968897 /nfs/dbraw/zinc/96/88/97/1051968897.db2.gz OJWNBLIAQGIGJL-KRWDZBQOSA-N 2 1 338.495 4.497 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H]2C[C@@H](C)c3c2cccc3Br)CC1 ZINC000159306014 1051974253 /nfs/dbraw/zinc/97/42/53/1051974253.db2.gz YBNNYZJMNOIRLO-WBMJQRKESA-N 2 1 337.305 4.071 20 0 EIADMP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)ccc1C(F)(F)F ZINC001184301174 1051982880 /nfs/dbraw/zinc/98/28/80/1051982880.db2.gz GARQDWZFRRPWTE-ULQDDVLXSA-N 2 1 340.433 4.176 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCc4cc(Cl)ccc43)CC2)[nH+]c1 ZINC000163527853 1051993679 /nfs/dbraw/zinc/99/36/79/1051993679.db2.gz GUKQLQNYYLCIBN-LJQANCHMSA-N 2 1 341.886 4.289 20 0 EIADMP C[C@@H]1CCC[C@H](C[N@@H+]2CCC[NH+](Cc3ccccc3)CCOCC2)C1 ZINC001176496107 1052075881 /nfs/dbraw/zinc/07/58/81/1052075881.db2.gz NXKQABOALMPCLF-IRLDBZIGSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@@H]1CCC[C@H](C[N@H+]2CCC[NH+](Cc3ccccc3)CCOCC2)C1 ZINC001176496107 1052075889 /nfs/dbraw/zinc/07/58/89/1052075889.db2.gz NXKQABOALMPCLF-IRLDBZIGSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC[N@H+](Cc3ccccc3)CCOCC2)C1 ZINC001176496107 1052075895 /nfs/dbraw/zinc/07/58/95/1052075895.db2.gz NXKQABOALMPCLF-IRLDBZIGSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC[N@@H+](Cc3ccccc3)CCOCC2)C1 ZINC001176496107 1052075902 /nfs/dbraw/zinc/07/59/02/1052075902.db2.gz NXKQABOALMPCLF-IRLDBZIGSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@@H]1CCC[C@@H](C[N@@H+]2CCC[NH+](Cc3ccccc3)CCOCC2)C1 ZINC001176496106 1052076848 /nfs/dbraw/zinc/07/68/48/1052076848.db2.gz NXKQABOALMPCLF-IFMALSPDSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@@H]1CCC[C@@H](C[N@H+]2CCC[NH+](Cc3ccccc3)CCOCC2)C1 ZINC001176496106 1052076860 /nfs/dbraw/zinc/07/68/60/1052076860.db2.gz NXKQABOALMPCLF-IFMALSPDSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@@H]1CCC[C@@H](C[NH+]2CCC[N@H+](Cc3ccccc3)CCOCC2)C1 ZINC001176496106 1052076875 /nfs/dbraw/zinc/07/68/75/1052076875.db2.gz NXKQABOALMPCLF-IFMALSPDSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@@H]1CCC[C@@H](C[NH+]2CCC[N@@H+](Cc3ccccc3)CCOCC2)C1 ZINC001176496106 1052076891 /nfs/dbraw/zinc/07/68/91/1052076891.db2.gz NXKQABOALMPCLF-IFMALSPDSA-N 2 1 344.543 4.037 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+]Cc3cccc(Cl)c3)CC2)cc1 ZINC001177099226 1052230385 /nfs/dbraw/zinc/23/03/85/1052230385.db2.gz VVGMAOJNSMMROA-UHFFFAOYSA-N 2 1 346.877 4.276 20 0 EIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)c(C)c1 ZINC000622603328 1052343966 /nfs/dbraw/zinc/34/39/66/1052343966.db2.gz DFPFBJFYFOYSPR-SFHVURJKSA-N 2 1 328.525 4.367 20 0 EIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c(C)c1 ZINC000622603328 1052343971 /nfs/dbraw/zinc/34/39/71/1052343971.db2.gz DFPFBJFYFOYSPR-SFHVURJKSA-N 2 1 328.525 4.367 20 0 EIADMP CCCOc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1OC ZINC000623360115 1052631963 /nfs/dbraw/zinc/63/19/63/1052631963.db2.gz VYPOJYINYHAJPS-DOTOQJQBSA-N 2 1 334.504 4.007 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1OC ZINC000623360115 1052631968 /nfs/dbraw/zinc/63/19/68/1052631968.db2.gz VYPOJYINYHAJPS-DOTOQJQBSA-N 2 1 334.504 4.007 20 0 EIADMP C[C@@H]([NH2+]C1(CN[C@H]2CC[N@@H+](C)C(C)(C)C2)CCCC1)c1ccccc1 ZINC000623427615 1052654644 /nfs/dbraw/zinc/65/46/44/1052654644.db2.gz FTQLKYLPBODQAX-QUCCMNQESA-N 2 1 343.559 4.112 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cccc(OC(F)(F)F)c1 ZINC000178258011 1052703822 /nfs/dbraw/zinc/70/38/22/1052703822.db2.gz IZQFQBYIKNCSMB-CYBMUJFWSA-N 2 1 342.405 4.110 20 0 EIADMP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000623755265 1052780055 /nfs/dbraw/zinc/78/00/55/1052780055.db2.gz ABWLZIDAEWAULR-DOXZYTNZSA-N 2 1 343.902 4.415 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(F)cc2C(F)(F)F)CC1 ZINC000623853885 1052826413 /nfs/dbraw/zinc/82/64/13/1052826413.db2.gz KPLDEAZYEFUAHO-GFCCVEGCSA-N 2 1 332.385 4.370 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000624120222 1052867320 /nfs/dbraw/zinc/86/73/20/1052867320.db2.gz UPLSCUDDTUKNME-PBHICJAKSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)[C@H](C)c1nc2ccccc2s1 ZINC000624121278 1052867762 /nfs/dbraw/zinc/86/77/62/1052867762.db2.gz SCYUWCGFGVJXEN-JYJNAYRXSA-N 2 1 331.529 4.110 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000624123493 1052868365 /nfs/dbraw/zinc/86/83/65/1052868365.db2.gz NFEYHAZOUFTXRR-ROUUACIJSA-N 2 1 339.483 4.256 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000624123493 1052868366 /nfs/dbraw/zinc/86/83/66/1052868366.db2.gz NFEYHAZOUFTXRR-ROUUACIJSA-N 2 1 339.483 4.256 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]C[C@@H]3CCCC[N@H+](C)C3)oc21 ZINC000624122397 1052868543 /nfs/dbraw/zinc/86/85/43/1052868543.db2.gz QJUCJAJSSBETOF-CVEARBPZSA-N 2 1 330.472 4.214 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]C[C@@H]3CCCC[N@@H+](C)C3)oc21 ZINC000624122397 1052868547 /nfs/dbraw/zinc/86/85/47/1052868547.db2.gz QJUCJAJSSBETOF-CVEARBPZSA-N 2 1 330.472 4.214 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cccc(F)c1F ZINC000183216282 1052967043 /nfs/dbraw/zinc/96/70/43/1052967043.db2.gz AEQASKKXURQALZ-HNNXBMFYSA-N 2 1 330.422 4.411 20 0 EIADMP COc1cc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)ccc1C ZINC000194266605 1053037912 /nfs/dbraw/zinc/03/79/12/1053037912.db2.gz XXYMYOXNBCXWML-UHFFFAOYSA-N 2 1 326.484 4.134 20 0 EIADMP c1cc(C[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc(C2CCCC2)c1 ZINC000850135862 1053075012 /nfs/dbraw/zinc/07/50/12/1053075012.db2.gz RTFJKECQTFNMQN-QFIPXVFZSA-N 2 1 342.527 4.077 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)CSC(C)(C)C)cc1F ZINC000765326641 1053502707 /nfs/dbraw/zinc/50/27/07/1053502707.db2.gz RHHJJEXNWMKSNH-CYBMUJFWSA-N 2 1 335.492 4.330 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2COc3ccccc3C2)cc1 ZINC000765333873 1053507886 /nfs/dbraw/zinc/50/78/86/1053507886.db2.gz MIIZSKQGEJQHOQ-FUHWJXTLSA-N 2 1 347.462 4.083 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1cccc(F)c1 ZINC000765361057 1053516169 /nfs/dbraw/zinc/51/61/69/1053516169.db2.gz VDLWRZFSXBFLNH-JBYIUTFZSA-N 2 1 340.486 4.429 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cc(C)cnc1Cl ZINC000921513131 1053557089 /nfs/dbraw/zinc/55/70/89/1053557089.db2.gz NXTYCCXLOGVOPI-UHFFFAOYSA-N 2 1 331.891 4.175 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)CC1(C)C ZINC000865830384 1053602001 /nfs/dbraw/zinc/60/20/01/1053602001.db2.gz MAVYYFBEUVWZIV-KURKYZTESA-N 2 1 336.907 4.023 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@@H]2CCCO2)[C@@H]1c1cccs1 ZINC000866271591 1053671565 /nfs/dbraw/zinc/67/15/65/1053671565.db2.gz ANQJYFWZSCWSIL-PIKOESSRSA-N 2 1 348.556 4.068 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@@H]2CCCO2)[C@@H]1c1cccs1 ZINC000866271591 1053671568 /nfs/dbraw/zinc/67/15/68/1053671568.db2.gz ANQJYFWZSCWSIL-PIKOESSRSA-N 2 1 348.556 4.068 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)CCc1cncc2ccccc21 ZINC000866272772 1053672576 /nfs/dbraw/zinc/67/25/76/1053672576.db2.gz UBYDMFNJMPDNRE-KRWDZBQOSA-N 2 1 336.483 4.131 20 0 EIADMP COc1cccc(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000386321887 1053680328 /nfs/dbraw/zinc/68/03/28/1053680328.db2.gz IPTNWEZEEYDFEY-NRFANRHFSA-N 2 1 338.495 4.087 20 0 EIADMP CCCC[N@@H+](CCCCn1ccnc1C)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545910 1053696905 /nfs/dbraw/zinc/69/69/05/1053696905.db2.gz UOEQNFSCEFPSLP-UHFFFAOYSA-N 2 1 348.579 4.383 20 0 EIADMP CCCC[N@H+](CCCCn1cc[nH+]c1C)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545910 1053696910 /nfs/dbraw/zinc/69/69/10/1053696910.db2.gz UOEQNFSCEFPSLP-UHFFFAOYSA-N 3 1 348.579 4.383 20 0 EIADMP CCCC[N@@H+](CCCCn1cc[nH+]c1C)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545910 1053696914 /nfs/dbraw/zinc/69/69/14/1053696914.db2.gz UOEQNFSCEFPSLP-UHFFFAOYSA-N 3 1 348.579 4.383 20 0 EIADMP C[C@@H](Cc1cccs1)[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000690007583 1053740882 /nfs/dbraw/zinc/74/08/82/1053740882.db2.gz SPBAGCJURPZFBJ-FXAWDEMLSA-N 2 1 328.525 4.181 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1 ZINC000866517080 1053764184 /nfs/dbraw/zinc/76/41/84/1053764184.db2.gz WAROPZHTIJWHND-YQHFOJDRSA-N 3 1 340.515 4.094 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCC23CCOCC3)cc1 ZINC000866528603 1053768123 /nfs/dbraw/zinc/76/81/23/1053768123.db2.gz GPBMVBUXBDQUJZ-QFBILLFUSA-N 2 1 339.483 4.038 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCC[C@@]1(C)Cc1ccc(Cl)c(F)c1 ZINC001197002435 1053821079 /nfs/dbraw/zinc/82/10/79/1053821079.db2.gz AERMPVKAKTYMQQ-SFHVURJKSA-N 2 1 335.854 4.081 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCC[C@@]1(C)Cc1ccc(Cl)c(F)c1 ZINC001197002435 1053821082 /nfs/dbraw/zinc/82/10/82/1053821082.db2.gz AERMPVKAKTYMQQ-SFHVURJKSA-N 2 1 335.854 4.081 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429515148 1053853407 /nfs/dbraw/zinc/85/34/07/1053853407.db2.gz AYHXBRLUSRFHAI-UTKZUKDTSA-N 2 1 326.459 4.041 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429515145 1053853583 /nfs/dbraw/zinc/85/35/83/1053853583.db2.gz AYHXBRLUSRFHAI-DYESRHJHSA-N 2 1 326.459 4.041 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2F)c2ccccc2)CC[N@@H+]1C ZINC000429522087 1053960125 /nfs/dbraw/zinc/96/01/25/1053960125.db2.gz SHSLCSGVHHYLPI-LKUPVBHCSA-N 2 1 326.459 4.182 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2F)c2ccccc2)CC[N@H+]1C ZINC000429522087 1053960135 /nfs/dbraw/zinc/96/01/35/1053960135.db2.gz SHSLCSGVHHYLPI-LKUPVBHCSA-N 2 1 326.459 4.182 20 0 EIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1CC[C@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026248 1054059099 /nfs/dbraw/zinc/05/90/99/1054059099.db2.gz BPFQQULXDYHFPO-LSDHHAIUSA-N 2 1 340.433 4.156 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CC[C@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026248 1054059108 /nfs/dbraw/zinc/05/91/08/1054059108.db2.gz BPFQQULXDYHFPO-LSDHHAIUSA-N 2 1 340.433 4.156 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CC[C@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026248 1054059114 /nfs/dbraw/zinc/05/91/14/1054059114.db2.gz BPFQQULXDYHFPO-LSDHHAIUSA-N 2 1 340.433 4.156 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CC[C@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026248 1054059117 /nfs/dbraw/zinc/05/91/17/1054059117.db2.gz BPFQQULXDYHFPO-LSDHHAIUSA-N 2 1 340.433 4.156 20 0 EIADMP CC[C@H](CCC(F)(F)F)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000872022677 1054336979 /nfs/dbraw/zinc/33/69/79/1054336979.db2.gz XTAFRMFIXYMURL-QGZVFWFLSA-N 2 1 342.449 4.404 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cccc(O)c2F)c1 ZINC000872025784 1054341567 /nfs/dbraw/zinc/34/15/67/1054341567.db2.gz SVVDXFNLOPJXMT-OAHLLOKOSA-N 2 1 330.447 4.224 20 0 EIADMP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000872066303 1054375168 /nfs/dbraw/zinc/37/51/68/1054375168.db2.gz GWMCKXHFCUYFPH-IRXDYDNUSA-N 2 1 328.422 4.219 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)[C@@H]1CCCOC1 ZINC000872068495 1054376422 /nfs/dbraw/zinc/37/64/22/1054376422.db2.gz GVBHATRFRANPIW-QHAWAJNXSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)[C@@H]1CCCOC1 ZINC000872068495 1054376432 /nfs/dbraw/zinc/37/64/32/1054376432.db2.gz GVBHATRFRANPIW-QHAWAJNXSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)sc1C ZINC001199275263 1054379334 /nfs/dbraw/zinc/37/93/34/1054379334.db2.gz GZSBHBJJRUBWKT-HNNXBMFYSA-N 2 1 343.540 4.424 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)sc1C ZINC001199275263 1054379343 /nfs/dbraw/zinc/37/93/43/1054379343.db2.gz GZSBHBJJRUBWKT-HNNXBMFYSA-N 2 1 343.540 4.424 20 0 EIADMP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2ccsc2C(F)(F)F)C1 ZINC001199329167 1054392484 /nfs/dbraw/zinc/39/24/84/1054392484.db2.gz OIRUBPTVYDLVEA-CHWSQXEVSA-N 2 1 334.451 4.225 20 0 EIADMP Cc1cc(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c2c(n1)CCCC2 ZINC001199336202 1054395148 /nfs/dbraw/zinc/39/51/48/1054395148.db2.gz IZCDXSPYJFSUBS-SFHVURJKSA-N 2 1 329.532 4.013 20 0 EIADMP Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000873206966 1054509342 /nfs/dbraw/zinc/50/93/42/1054509342.db2.gz GYGIFIKACZOJHI-ZDUSSCGKSA-N 2 1 349.569 4.475 20 0 EIADMP CSc1ccc(CN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC001200880368 1054566653 /nfs/dbraw/zinc/56/66/53/1054566653.db2.gz SIMJNHSDFTZRMG-DOTOQJQBSA-N 2 1 330.497 4.144 20 0 EIADMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](C[C@@H](C)CCC=C(C)C)C2 ZINC001201486256 1054815359 /nfs/dbraw/zinc/81/53/59/1054815359.db2.gz HWJDCUUUPYLZGV-NNWRFLSQSA-N 2 1 348.575 4.049 20 0 EIADMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](C[C@@H](C)CCC=C(C)C)C2 ZINC001201486256 1054815363 /nfs/dbraw/zinc/81/53/63/1054815363.db2.gz HWJDCUUUPYLZGV-NNWRFLSQSA-N 2 1 348.575 4.049 20 0 EIADMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](C[C@@H](C)CCC=C(C)C)C2 ZINC001201486256 1054815366 /nfs/dbraw/zinc/81/53/66/1054815366.db2.gz HWJDCUUUPYLZGV-NNWRFLSQSA-N 2 1 348.575 4.049 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2nc3ccccc3o2)C[N@H+]1Cc1ccccc1 ZINC001201492513 1054818400 /nfs/dbraw/zinc/81/84/00/1054818400.db2.gz QHDZOIDOAGCAKO-IEBWSBKVSA-N 2 1 349.478 4.218 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+]Cc2cccc(F)c2)C[N@H+]1Cc1ccccc1 ZINC001201492554 1054819138 /nfs/dbraw/zinc/81/91/38/1054819138.db2.gz RJRIQKQDHLBWOC-PXNSSMCTSA-N 2 1 326.459 4.216 20 0 EIADMP Fc1cc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)ccc1Cl ZINC000065889598 1054976794 /nfs/dbraw/zinc/97/67/94/1054976794.db2.gz SPQDIKJHMJQSGR-UHFFFAOYSA-N 2 1 332.850 4.017 20 0 EIADMP Fc1cc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)ccc1Cl ZINC000065889598 1054976807 /nfs/dbraw/zinc/97/68/07/1054976807.db2.gz SPQDIKJHMJQSGR-UHFFFAOYSA-N 2 1 332.850 4.017 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cccc(Cl)c2N)CC1 ZINC000877037966 1055006706 /nfs/dbraw/zinc/00/67/06/1055006706.db2.gz FDOMLYYUQLGTIX-OAHLLOKOSA-N 2 1 343.902 4.237 20 0 EIADMP C[C@]1(C[NH2+]C/C=C\c2ccc(F)cc2)CC[N@@H+](Cc2ccccc2)C1 ZINC001202220999 1055092396 /nfs/dbraw/zinc/09/23/96/1055092396.db2.gz XUTUWIFFHNUYMW-HUPBUCHYSA-N 2 1 338.470 4.341 20 0 EIADMP C[C@H](N[C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccns1 ZINC000877659440 1055101847 /nfs/dbraw/zinc/10/18/47/1055101847.db2.gz SCQYPBLABBJNKZ-QILLFSRXSA-N 2 1 327.497 4.162 20 0 EIADMP C[C@H]([NH2+][C@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1)c1ccns1 ZINC000877659440 1055101853 /nfs/dbraw/zinc/10/18/53/1055101853.db2.gz SCQYPBLABBJNKZ-QILLFSRXSA-N 2 1 327.497 4.162 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+]Cc2cn(C(F)F)c3ccccc23)c2ccccc21 ZINC000863547141 1055227872 /nfs/dbraw/zinc/22/78/72/1055227872.db2.gz PGSVZKBODZIIOY-SJORKVTESA-N 2 1 327.378 4.271 20 0 EIADMP C[C@@H]([NH2+]CCCc1cccs1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000542818642 1056116508 /nfs/dbraw/zinc/11/65/08/1056116508.db2.gz XZRXJUXHEZVART-IEBWSBKVSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@H](CC[NH2+]Cc1cnc2ccccc2c1)[N@H+](C)Cc1ccccc1 ZINC000379627301 1059647803 /nfs/dbraw/zinc/64/78/03/1059647803.db2.gz MTNUKOISYODTRH-GOSISDBHSA-N 2 1 333.479 4.235 20 0 EIADMP C[C@H](CC[NH2+]Cc1cnc2ccccc2c1)[N@@H+](C)Cc1ccccc1 ZINC000379627301 1059647822 /nfs/dbraw/zinc/64/78/22/1059647822.db2.gz MTNUKOISYODTRH-GOSISDBHSA-N 2 1 333.479 4.235 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000188148621 1060127988 /nfs/dbraw/zinc/12/79/88/1060127988.db2.gz UNCDKBBRJUTRME-KBRIMQKVSA-N 2 1 326.406 4.025 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3cnccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379619224 1060137908 /nfs/dbraw/zinc/13/79/08/1060137908.db2.gz BFNASELXOMSVQN-FDDCHVKYSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3cnccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379619224 1060137917 /nfs/dbraw/zinc/13/79/17/1060137917.db2.gz BFNASELXOMSVQN-FDDCHVKYSA-N 2 1 345.490 4.378 20 0 EIADMP Cc1nc(C)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000383343405 1060247944 /nfs/dbraw/zinc/24/79/44/1060247944.db2.gz LNEFHQLOZUKONT-DNVCBOLYSA-N 2 1 343.540 4.323 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2cnccc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000388982830 1060282059 /nfs/dbraw/zinc/28/20/59/1060282059.db2.gz RCJPPVGROIXVEJ-MBSDFSHPSA-N 2 1 345.490 4.235 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C)cnn1-c1ccccc1 ZINC000766384330 1060315200 /nfs/dbraw/zinc/31/52/00/1060315200.db2.gz KNCXUNRFFCUYKS-GOSISDBHSA-N 2 1 342.531 4.340 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000766460877 1060368569 /nfs/dbraw/zinc/36/85/69/1060368569.db2.gz HVGUYIKLKULYRY-YQVWRLOYSA-N 2 1 334.573 4.407 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000766460877 1060368592 /nfs/dbraw/zinc/36/85/92/1060368592.db2.gz HVGUYIKLKULYRY-YQVWRLOYSA-N 2 1 334.573 4.407 20 0 EIADMP CCCC[C@@H]([NH3+])Cc1cn([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc12 ZINC001169109483 1060658374 /nfs/dbraw/zinc/65/83/74/1060658374.db2.gz JDNYHUBZMNHQQG-YSTOQKLRSA-N 2 1 339.527 4.499 20 0 EIADMP C[N@H+]1CCCC[C@@H]1c1ccc(N[C@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)nc1 ZINC001169141810 1060663194 /nfs/dbraw/zinc/66/31/94/1060663194.db2.gz KWSLKQMCLDDPLD-UEXGIBASSA-N 2 1 344.547 4.194 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(c3nc4ccccc4s3)CC1)C2 ZINC001169142403 1060663712 /nfs/dbraw/zinc/66/37/12/1060663712.db2.gz UDWPWWFHCNBERN-BJWYYQGGSA-N 2 1 341.524 4.101 20 0 EIADMP C[N@H+]1CC[C@H](c2ccc(N[C@H]3CC(C)(C)C[C@](C)(C[NH3+])C3)cc2)C1 ZINC001169148772 1060668435 /nfs/dbraw/zinc/66/84/35/1060668435.db2.gz ZYHNFNMFNAQZES-HFSMHLIXSA-N 2 1 329.532 4.061 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+](Cc1ccccc1)C1CCSCC1)C2 ZINC001169153051 1060670239 /nfs/dbraw/zinc/67/02/39/1060670239.db2.gz GHHHZLQGKYZGOJ-PMOLBWCYSA-N 2 1 330.541 4.009 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+](Cc1ccccc1)C1CCSCC1)C2 ZINC001169153051 1060670248 /nfs/dbraw/zinc/67/02/48/1060670248.db2.gz GHHHZLQGKYZGOJ-PMOLBWCYSA-N 2 1 330.541 4.009 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+](Cc1ccccc1)C1CCSCC1)C2 ZINC001169153051 1060670259 /nfs/dbraw/zinc/67/02/59/1060670259.db2.gz GHHHZLQGKYZGOJ-PMOLBWCYSA-N 2 1 330.541 4.009 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+](Cc1ccccc1)C1CCSCC1)C2 ZINC001169153051 1060670270 /nfs/dbraw/zinc/67/02/70/1060670270.db2.gz GHHHZLQGKYZGOJ-PMOLBWCYSA-N 2 1 330.541 4.009 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154262 1060671233 /nfs/dbraw/zinc/67/12/33/1060671233.db2.gz PCDDHHYQTQGNMG-VSZNYVQBSA-N 2 1 338.417 4.468 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154262 1060671240 /nfs/dbraw/zinc/67/12/40/1060671240.db2.gz PCDDHHYQTQGNMG-VSZNYVQBSA-N 2 1 338.417 4.468 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154262 1060671246 /nfs/dbraw/zinc/67/12/46/1060671246.db2.gz PCDDHHYQTQGNMG-VSZNYVQBSA-N 2 1 338.417 4.468 20 0 EIADMP CC[NH+]1CCC([N@H+](C[C@H](O)c2ccc3ccccc3c2)C(C)C)CC1 ZINC001169261938 1060709052 /nfs/dbraw/zinc/70/90/52/1060709052.db2.gz RQCYIPIHYOSWBP-QFIPXVFZSA-N 2 1 340.511 4.068 20 0 EIADMP CC[NH+]1CCC([N@@H+](C[C@H](O)c2ccc3ccccc3c2)C(C)C)CC1 ZINC001169261938 1060709071 /nfs/dbraw/zinc/70/90/71/1060709071.db2.gz RQCYIPIHYOSWBP-QFIPXVFZSA-N 2 1 340.511 4.068 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(c3cccc(C)c3)CCC(F)(F)CC2)CC1 ZINC001169240969 1060717549 /nfs/dbraw/zinc/71/75/49/1060717549.db2.gz NXUSLBHBCZJZFI-UHFFFAOYSA-N 2 1 336.470 4.474 20 0 EIADMP Cc1cc(C)[nH+]c(N2CCC[C@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)c1 ZINC001164992861 722191903 /nfs/dbraw/zinc/19/19/03/722191903.db2.gz BJKCNIULDPLDHI-NRFANRHFSA-N 2 1 339.458 4.082 20 0 EIADMP Cc1cc(C)[nH+]c(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c1 ZINC001164992861 722191905 /nfs/dbraw/zinc/19/19/05/722191905.db2.gz BJKCNIULDPLDHI-NRFANRHFSA-N 2 1 339.458 4.082 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@@H]3CCc4ccccc43)C2)c1 ZINC000532219513 1032101431 /nfs/dbraw/zinc/10/14/31/1032101431.db2.gz WYNUXRUDTBNCGV-OXJNMPFZSA-N 2 1 326.509 4.237 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3CCc4ccccc43)C2)c1 ZINC000532219513 1032101437 /nfs/dbraw/zinc/10/14/37/1032101437.db2.gz WYNUXRUDTBNCGV-OXJNMPFZSA-N 2 1 326.509 4.237 20 0 EIADMP c1ccc2c(c1)CCSC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000532249242 1032109126 /nfs/dbraw/zinc/10/91/26/1032109126.db2.gz OESMTJRMVRBWNT-OAQYLSRUSA-N 2 1 344.568 4.404 20 0 EIADMP c1ccc2c(c1)CCSC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000532249233 1032110574 /nfs/dbraw/zinc/11/05/74/1032110574.db2.gz OESMTJRMVRBWNT-NRFANRHFSA-N 2 1 344.568 4.404 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@H]3C)s2)cc1 ZINC000532249385 1032111164 /nfs/dbraw/zinc/11/11/64/1032111164.db2.gz WYXNNSZKMKCTEY-ZRGWGRIASA-N 2 1 344.524 4.242 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@@H]3CCCOc4ccccc43)C2)cc1 ZINC000195137044 1032204959 /nfs/dbraw/zinc/20/49/59/1032204959.db2.gz XKYCQGHQBXWCFM-PZJWPPBQSA-N 2 1 336.479 4.012 20 0 EIADMP Cc1[nH]c2ccccc2c1C1=CCN(CC[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000532726848 1032278938 /nfs/dbraw/zinc/27/89/38/1032278938.db2.gz GPYQFUPCQCROKB-IBGZPJMESA-N 2 1 337.511 4.440 20 0 EIADMP Cc1[nH]c2ccccc2c1C1=CC[NH+](CC[C@@H]2CCCC[N@H+]2C)CC1 ZINC000532726848 1032278944 /nfs/dbraw/zinc/27/89/44/1032278944.db2.gz GPYQFUPCQCROKB-IBGZPJMESA-N 2 1 337.511 4.440 20 0 EIADMP Cc1[nH]c2ccccc2c1C1=CC[NH+](CC[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000532726848 1032278966 /nfs/dbraw/zinc/27/89/66/1032278966.db2.gz GPYQFUPCQCROKB-IBGZPJMESA-N 2 1 337.511 4.440 20 0 EIADMP Cc1[nH]c2ccccc2c1C1=CC[N@H+](CC[C@@H]2CCCC[NH+]2C)CC1 ZINC000532726848 1032278977 /nfs/dbraw/zinc/27/89/77/1032278977.db2.gz GPYQFUPCQCROKB-IBGZPJMESA-N 2 1 337.511 4.440 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529543739 1032434869 /nfs/dbraw/zinc/43/48/69/1032434869.db2.gz NDWNDUSWBSNAGA-RYRKJORJSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1CC(F)(F)C1 ZINC000529549924 1032439033 /nfs/dbraw/zinc/43/90/33/1032439033.db2.gz OJAXJPYMDXNLIB-HNNXBMFYSA-N 2 1 348.437 4.435 20 0 EIADMP C[N@H+](Cc1ccc2cc[nH]c2c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000529535979 1032442321 /nfs/dbraw/zinc/44/23/21/1032442321.db2.gz VHLRMZPUHIRLBJ-FQEVSTJZSA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1ccc2cc[nH]c2c1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000529535979 1032442326 /nfs/dbraw/zinc/44/23/26/1032442326.db2.gz VHLRMZPUHIRLBJ-FQEVSTJZSA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1ccc2cc[nH]c2c1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000529535979 1032442330 /nfs/dbraw/zinc/44/23/30/1032442330.db2.gz VHLRMZPUHIRLBJ-FQEVSTJZSA-N 2 1 333.479 4.122 20 0 EIADMP C[C@H](c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427245 1032487513 /nfs/dbraw/zinc/48/75/13/1032487513.db2.gz FFOPRUKBJWKTEV-NVXWUHKLSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427245 1032487520 /nfs/dbraw/zinc/48/75/20/1032487520.db2.gz FFOPRUKBJWKTEV-NVXWUHKLSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2c(Cl)cccc2OC(F)F)cc1 ZINC000666755334 1032499557 /nfs/dbraw/zinc/49/95/57/1032499557.db2.gz QMNKFVQZOSJMJU-LLVKDONJSA-N 2 1 340.801 4.251 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3ccc4ccccc4n3)CC2)[nH+]c1 ZINC000178755700 1032539836 /nfs/dbraw/zinc/53/98/36/1032539836.db2.gz PGQJQFOFSFHDJL-QGZVFWFLSA-N 2 1 346.478 4.258 20 0 EIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000178704046 1032544376 /nfs/dbraw/zinc/54/43/76/1032544376.db2.gz MAJNGMHTKGTTQP-CHWSQXEVSA-N 2 1 334.533 4.241 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000178703092 1032544662 /nfs/dbraw/zinc/54/46/62/1032544662.db2.gz CIWZXSMVMCLSCV-OLZOCXBDSA-N 2 1 325.378 4.197 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)c1 ZINC000180043486 1032582757 /nfs/dbraw/zinc/58/27/57/1032582757.db2.gz RFXJUMIBPGBXPW-QFIPXVFZSA-N 2 1 331.463 4.022 20 0 EIADMP FC1(F)CC(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)C1 ZINC000450651197 1032620180 /nfs/dbraw/zinc/62/01/80/1032620180.db2.gz SACHYJTVMUUDJA-UHFFFAOYSA-N 2 1 334.454 4.020 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+]2CCC(c3[nH]cc[nH+]3)CC2)o1 ZINC000512389041 1032623033 /nfs/dbraw/zinc/62/30/33/1032623033.db2.gz DRBRPWYNZOFZKP-UHFFFAOYSA-N 2 1 339.414 4.497 20 0 EIADMP CCC1(C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CCOCC1 ZINC000512396973 1032663433 /nfs/dbraw/zinc/66/34/33/1032663433.db2.gz XVRRFJOWCCLKSY-TZIWHRDSSA-N 2 1 344.543 4.084 20 0 EIADMP CC[N@@H+](Cc1ccc(-c2nc([C@@H]([NH3+])CC(C)C)no2)cc1)C(C)C ZINC000339394860 1018835029 /nfs/dbraw/zinc/83/50/29/1018835029.db2.gz PLDABSMVLYNPDR-KRWDZBQOSA-N 2 1 330.476 4.013 20 0 EIADMP Cc1csc([C@H](C)C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000274735592 1019087414 /nfs/dbraw/zinc/08/74/14/1019087414.db2.gz DAOHAAWPIFJESE-SUMDDJOVSA-N 2 1 343.540 4.055 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000432791262 1032811705 /nfs/dbraw/zinc/81/17/05/1032811705.db2.gz ZGEZQCSHNQVDCI-AWEZNQCLSA-N 2 1 334.410 4.141 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000432791262 1032811709 /nfs/dbraw/zinc/81/17/09/1032811709.db2.gz ZGEZQCSHNQVDCI-AWEZNQCLSA-N 2 1 334.410 4.141 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000512454023 1032822147 /nfs/dbraw/zinc/82/21/47/1032822147.db2.gz NKIGCFLPSIFGOR-SFTDATJTSA-N 2 1 336.479 4.079 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000512454023 1032822151 /nfs/dbraw/zinc/82/21/51/1032822151.db2.gz NKIGCFLPSIFGOR-SFTDATJTSA-N 2 1 336.479 4.079 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000432801949 1032831641 /nfs/dbraw/zinc/83/16/41/1032831641.db2.gz YMMFTPCOSUWKFC-INIZCTEOSA-N 2 1 348.437 4.357 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000432801949 1032831647 /nfs/dbraw/zinc/83/16/47/1032831647.db2.gz YMMFTPCOSUWKFC-INIZCTEOSA-N 2 1 348.437 4.357 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OCC)c(OCC)c2)CC1 ZINC000236781164 1032831695 /nfs/dbraw/zinc/83/16/95/1032831695.db2.gz KDXRQXCFEGYTKD-MRXNPFEDSA-N 2 1 334.504 4.009 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(Br)c1 ZINC000037318620 1020019488 /nfs/dbraw/zinc/01/94/88/1020019488.db2.gz NZJICACZFJIRCM-KRWDZBQOSA-N 2 1 337.305 4.117 20 0 EIADMP FC(F)(F)c1ccc2c(N[C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc[nH+]c2c1 ZINC000443677835 1020206860 /nfs/dbraw/zinc/20/68/60/1020206860.db2.gz ZPYZJBSAZVFLGR-UONOGXRCSA-N 2 1 335.373 4.292 20 0 EIADMP FC(F)(F)c1ccc2c(N[C@H]3CC[N@H+]4CCC[C@@H]4C3)cc[nH+]c2c1 ZINC000443677835 1020206872 /nfs/dbraw/zinc/20/68/72/1020206872.db2.gz ZPYZJBSAZVFLGR-UONOGXRCSA-N 2 1 335.373 4.292 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Br)s2)CC1 ZINC000038003235 1020368500 /nfs/dbraw/zinc/36/85/00/1020368500.db2.gz IFRNGGQXIQOODU-LBPRGKRZSA-N 2 1 345.350 4.426 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2csc(C3CC3)n2)CC1 ZINC000340194052 1020606513 /nfs/dbraw/zinc/60/65/13/1020606513.db2.gz HTACRSLOEGPJBH-MRXNPFEDSA-N 2 1 347.572 4.497 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2csc(C3CC3)n2)CC1 ZINC000340194052 1020606517 /nfs/dbraw/zinc/60/65/17/1020606517.db2.gz HTACRSLOEGPJBH-MRXNPFEDSA-N 2 1 347.572 4.497 20 0 EIADMP C[C@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)CS1 ZINC000655714693 1020912355 /nfs/dbraw/zinc/91/23/55/1020912355.db2.gz AMQNEZATMXAVIC-QFBILLFUSA-N 2 1 344.524 4.285 20 0 EIADMP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000655839885 1021005915 /nfs/dbraw/zinc/00/59/15/1021005915.db2.gz XZKRYTGXSNQLPB-VAMGGRTRSA-N 2 1 342.527 4.119 20 0 EIADMP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000655839885 1021005922 /nfs/dbraw/zinc/00/59/22/1021005922.db2.gz XZKRYTGXSNQLPB-VAMGGRTRSA-N 2 1 342.527 4.119 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000539080272 1021312174 /nfs/dbraw/zinc/31/21/74/1021312174.db2.gz TZPXPGUIHXGXPZ-NWDGAFQWSA-N 2 1 326.271 4.485 20 0 EIADMP Cc1ccc(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)nc1C ZINC000414164486 1022006700 /nfs/dbraw/zinc/00/67/00/1022006700.db2.gz KFTLPUZEEZMEAM-UHFFFAOYSA-N 2 1 337.511 4.231 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1nc(-c2ccccc2)cs1 ZINC000414184747 1022061606 /nfs/dbraw/zinc/06/16/06/1022061606.db2.gz OGHHKRXIAGNJHC-JKSUJKDBSA-N 2 1 329.513 4.193 20 0 EIADMP Cc1cc([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)sc1Br ZINC000414193286 1022084953 /nfs/dbraw/zinc/08/49/53/1022084953.db2.gz SYLISOSGWOFARE-STQMWFEESA-N 2 1 345.350 4.202 20 0 EIADMP C([NH2+]C1CCC2(CCCO2)CC1)[C@@H]1CCC[N@H+]1CC1CCCCC1 ZINC000580501677 1022120179 /nfs/dbraw/zinc/12/01/79/1022120179.db2.gz KZWJVFBYYQPSCA-KBWCOIMZSA-N 2 1 334.548 4.113 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2Cc4ccccc42)C3)cc1 ZINC000245731169 1033034097 /nfs/dbraw/zinc/03/40/97/1033034097.db2.gz QFHAFYNRQRYZEP-YUMYIRISSA-N 2 1 332.491 4.112 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000892575069 1022266219 /nfs/dbraw/zinc/26/62/19/1022266219.db2.gz RHEOKXRNUOHWQV-INIZCTEOSA-N 2 1 341.499 4.067 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)cnc1F ZINC000892579936 1022302874 /nfs/dbraw/zinc/30/28/74/1022302874.db2.gz DEGMKNPEERHLLD-MRXNPFEDSA-N 2 1 341.474 4.051 20 0 EIADMP CSC1(CNc2cc[nH+]c3cc(Cl)ccc23)CC[NH+](C)CC1 ZINC000580682743 1022377686 /nfs/dbraw/zinc/37/76/86/1022377686.db2.gz CCLLCJPQWZDHKS-UHFFFAOYSA-N 2 1 335.904 4.128 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3cccc4cnccc43)CC2)n2c1CCCC2 ZINC000684026793 1022378437 /nfs/dbraw/zinc/37/84/37/1022378437.db2.gz NTQKBPREIOFISU-UHFFFAOYSA-N 2 1 346.478 4.147 20 0 EIADMP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)C1 ZINC000651300801 1022401422 /nfs/dbraw/zinc/40/14/22/1022401422.db2.gz GENWZPIAOBJHOG-INDMIFKZSA-N 2 1 334.454 4.207 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)[C@@H]2CCN(C)C[C@H]2C)cc1OCC ZINC000580801445 1022510872 /nfs/dbraw/zinc/51/08/72/1022510872.db2.gz JFPYGVJEIBKKAX-IEBWSBKVSA-N 2 1 348.531 4.036 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@H]2C)cc1OCC ZINC000580801445 1022510938 /nfs/dbraw/zinc/51/09/38/1022510938.db2.gz JFPYGVJEIBKKAX-IEBWSBKVSA-N 2 1 348.531 4.036 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@H]2C)cc1OCC ZINC000580801445 1022510960 /nfs/dbraw/zinc/51/09/60/1022510960.db2.gz JFPYGVJEIBKKAX-IEBWSBKVSA-N 2 1 348.531 4.036 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2C[C@@H](c3ccccc3)C2(C)C)cn1 ZINC000181012263 1022575847 /nfs/dbraw/zinc/57/58/47/1022575847.db2.gz ONYHJGJCUAZPLE-PMACEKPBSA-N 2 1 346.478 4.248 20 0 EIADMP Cc1csc([C@H](C)C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)n1 ZINC000186568742 1022675438 /nfs/dbraw/zinc/67/54/38/1022675438.db2.gz LQVTZTOONZTEKR-UKRRQHHQSA-N 2 1 340.496 4.400 20 0 EIADMP CC(C)Oc1ccc(CC[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000892630867 1022700539 /nfs/dbraw/zinc/70/05/39/1022700539.db2.gz KGYXLYSEOYINIC-OHSMVPPVSA-N 2 1 330.516 4.010 20 0 EIADMP c1sc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)nc1-c1ccccc1 ZINC000647542955 1022778659 /nfs/dbraw/zinc/77/86/59/1022778659.db2.gz FGGLESDVRQDVKT-ROUUACIJSA-N 2 1 341.524 4.022 20 0 EIADMP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000581005978 1022795235 /nfs/dbraw/zinc/79/52/35/1022795235.db2.gz LLXMZVULGLUTLH-NUEKZKHPSA-N 2 1 345.487 4.044 20 0 EIADMP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ncc(C)s2)ccc1OC ZINC000183034947 1022840069 /nfs/dbraw/zinc/84/00/69/1022840069.db2.gz ZDQCZXHAYPNEEJ-HNNXBMFYSA-N 2 1 347.528 4.153 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000545461203 1022870572 /nfs/dbraw/zinc/87/05/72/1022870572.db2.gz SEMYOSDJWXHMQS-CDHQVMDDSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC[N@H+]1C ZINC000545461203 1022870577 /nfs/dbraw/zinc/87/05/77/1022870577.db2.gz SEMYOSDJWXHMQS-CDHQVMDDSA-N 2 1 343.902 4.091 20 0 EIADMP CC[C@H](C)c1ccc([C@H](C)[NH2+]CCCCN2CC[NH+](CC)CC2)cc1 ZINC000623861779 1022870968 /nfs/dbraw/zinc/87/09/68/1022870968.db2.gz CHJIOPAQVVMQSB-PMACEKPBSA-N 2 1 345.575 4.268 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2nc3ccccc3[nH]2)CC1 ZINC000548157623 1022928607 /nfs/dbraw/zinc/92/86/07/1022928607.db2.gz CRSKPGJNUYBPQF-KRWDZBQOSA-N 2 1 340.515 4.039 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2nc3ccccc3[nH]2)CC1 ZINC000548157623 1022928632 /nfs/dbraw/zinc/92/86/32/1022928632.db2.gz CRSKPGJNUYBPQF-KRWDZBQOSA-N 2 1 340.515 4.039 20 0 EIADMP Cc1nc(C)c([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)s1 ZINC000178224683 1023072951 /nfs/dbraw/zinc/07/29/51/1023072951.db2.gz XWMRDFNXFLRCEQ-HUUCEWRRSA-N 2 1 331.529 4.321 20 0 EIADMP Cc1nc(C)c([C@@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)s1 ZINC000178224683 1023072964 /nfs/dbraw/zinc/07/29/64/1023072964.db2.gz XWMRDFNXFLRCEQ-HUUCEWRRSA-N 2 1 331.529 4.321 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000624120499 1023086414 /nfs/dbraw/zinc/08/64/14/1023086414.db2.gz ALQHHGVSMURXMY-GJZGRUSLSA-N 2 1 344.421 4.010 20 0 EIADMP c1csc([C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000090015592 1023263945 /nfs/dbraw/zinc/26/39/45/1023263945.db2.gz XZKIXSHNOMYCNU-QRVBRYPASA-N 2 1 326.509 4.248 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000584819125 1023346067 /nfs/dbraw/zinc/34/60/67/1023346067.db2.gz DWIHZDUNRLXAJE-GHTZIAJQSA-N 2 1 326.459 4.041 20 0 EIADMP CC[NH+](CC)CCC[N@@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000549140714 1023370085 /nfs/dbraw/zinc/37/00/85/1023370085.db2.gz INIDHGFUUCSLLB-INIZCTEOSA-N 2 1 331.529 4.208 20 0 EIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000549140714 1023370095 /nfs/dbraw/zinc/37/00/95/1023370095.db2.gz INIDHGFUUCSLLB-INIZCTEOSA-N 2 1 331.529 4.208 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](Cc2ccccc2)c2ccc(OC)cc2)CC1 ZINC000581577625 1023380673 /nfs/dbraw/zinc/38/06/73/1023380673.db2.gz NGMZFHGXLGWLRU-QFIPXVFZSA-N 2 1 338.495 4.053 20 0 EIADMP Cc1nn(C(C)C)c(C)c1C[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000892774875 1023391903 /nfs/dbraw/zinc/39/19/03/1023391903.db2.gz QHWVNCZGCNAQNN-UHFFFAOYSA-N 2 1 346.563 4.215 20 0 EIADMP COc1cccc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1Cl ZINC000660256993 1023392636 /nfs/dbraw/zinc/39/26/36/1023392636.db2.gz PJCOXNNWJCHXKI-ZBFHGGJFSA-N 2 1 336.907 4.091 20 0 EIADMP COc1cccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1Cl ZINC000660256993 1023392645 /nfs/dbraw/zinc/39/26/45/1023392645.db2.gz PJCOXNNWJCHXKI-ZBFHGGJFSA-N 2 1 336.907 4.091 20 0 EIADMP C[N@@H+](CCCc1cc(-c2ccccc2)no1)CC[C@@H]1CCCC[NH+]1C ZINC000472687124 1023411972 /nfs/dbraw/zinc/41/19/72/1023411972.db2.gz YSMGVDZOYJTRKC-IBGZPJMESA-N 2 1 341.499 4.080 20 0 EIADMP FC(F)(F)c1ccccc1C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415090232 1023434325 /nfs/dbraw/zinc/43/43/25/1023434325.db2.gz XRRFONWZUVSFFI-WMZOPIPTSA-N 2 1 334.385 4.288 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CCOc3ccc4ccccc4c3)CC[NH2+]2)cc1 ZINC000415086975 1023436617 /nfs/dbraw/zinc/43/66/17/1023436617.db2.gz SJQINOZRQMWVLN-GMAHTHKFSA-N 2 1 346.474 4.302 20 0 EIADMP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C[C@@H]([NH3+])CC(C)C)s2)cc1 ZINC000415096616 1023441242 /nfs/dbraw/zinc/44/12/42/1023441242.db2.gz BTOWOFXXGQXBIL-CJNGLKHVSA-N 2 1 347.528 4.151 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000415121017 1023451184 /nfs/dbraw/zinc/45/11/84/1023451184.db2.gz YSKPEYXAAKBRNR-ZTQAJYAQSA-N 2 1 330.422 4.151 20 0 EIADMP CC[C@@H](c1ccc(Br)cc1)[N@@H+](C)C[C@@H]1CCCN(C)C1 ZINC000472737615 1023476006 /nfs/dbraw/zinc/47/60/06/1023476006.db2.gz KLPBVDSFEFTOMX-PBHICJAKSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@@H](c1ccc(Br)cc1)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000472737615 1023476009 /nfs/dbraw/zinc/47/60/09/1023476009.db2.gz KLPBVDSFEFTOMX-PBHICJAKSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@@H](c1ccc(Br)cc1)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000472737615 1023476017 /nfs/dbraw/zinc/47/60/17/1023476017.db2.gz KLPBVDSFEFTOMX-PBHICJAKSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@@H](c1ccc(Br)cc1)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000472737615 1023476019 /nfs/dbraw/zinc/47/60/19/1023476019.db2.gz KLPBVDSFEFTOMX-PBHICJAKSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@@H](c1ccc(Br)cc1)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000472737615 1023476022 /nfs/dbraw/zinc/47/60/22/1023476022.db2.gz KLPBVDSFEFTOMX-PBHICJAKSA-N 2 1 339.321 4.174 20 0 EIADMP C[C@H](C[N@@H+](C)[C@H]1CCN(C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097668 1023499751 /nfs/dbraw/zinc/49/97/51/1023499751.db2.gz MWQQZHXQQMZTDO-CPUCHLNUSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[N@H+](C)[C@H]1CC[NH+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097668 1023499757 /nfs/dbraw/zinc/49/97/57/1023499757.db2.gz MWQQZHXQQMZTDO-CPUCHLNUSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[N@@H+](C)[C@H]1CC[NH+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097668 1023499760 /nfs/dbraw/zinc/49/97/60/1023499760.db2.gz MWQQZHXQQMZTDO-CPUCHLNUSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[NH+](C)[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097668 1023499762 /nfs/dbraw/zinc/49/97/62/1023499762.db2.gz MWQQZHXQQMZTDO-CPUCHLNUSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[NH+](C)[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097668 1023499767 /nfs/dbraw/zinc/49/97/67/1023499767.db2.gz MWQQZHXQQMZTDO-CPUCHLNUSA-N 2 1 328.422 4.223 20 0 EIADMP c1nc(C[N@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)sc1-c1ccccc1 ZINC000656783627 1023518067 /nfs/dbraw/zinc/51/80/67/1023518067.db2.gz RLJFTLSRMHHNMX-SFHVURJKSA-N 2 1 341.524 4.022 20 0 EIADMP Clc1cc2cccnc2c(C[N@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c1 ZINC000656784449 1023528994 /nfs/dbraw/zinc/52/89/94/1023528994.db2.gz DFWAMTQJEURUNL-KRWDZBQOSA-N 2 1 343.902 4.100 20 0 EIADMP [NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@H+]2Cc2cccc(C3CCCC3)c2)C1 ZINC000656785848 1023529200 /nfs/dbraw/zinc/52/92/00/1023529200.db2.gz KEENGOPTWCDCCA-VSKRKVRLSA-N 2 1 342.527 4.205 20 0 EIADMP c1csc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)cs2)c1 ZINC000656785123 1023530208 /nfs/dbraw/zinc/53/02/08/1023530208.db2.gz JAMHLFXSPOEXLV-OAHLLOKOSA-N 2 1 347.553 4.083 20 0 EIADMP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC000656786436 1023532021 /nfs/dbraw/zinc/53/20/21/1023532021.db2.gz MNUMTVRDIVJSBK-VSKRKVRLSA-N 2 1 342.527 4.063 20 0 EIADMP C[C@@H]1OCC[C@@H]1[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000549261835 1023583865 /nfs/dbraw/zinc/58/38/65/1023583865.db2.gz PKNWWFYWKOILJI-OVQBEFFGSA-N 2 1 348.918 4.021 20 0 EIADMP C[C@@H]1OCC[C@H]1[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000549261828 1023584092 /nfs/dbraw/zinc/58/40/92/1023584092.db2.gz PKNWWFYWKOILJI-ABZDAADZSA-N 2 1 348.918 4.021 20 0 EIADMP CC[C@H](Cc1cccs1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000684410404 1023660385 /nfs/dbraw/zinc/66/03/85/1023660385.db2.gz XPGGXCXUAWJJDX-RTBURBONSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2cnccc2c1 ZINC000398135721 1023699755 /nfs/dbraw/zinc/69/97/55/1023699755.db2.gz KYXLTWZHIKTRGV-JPYJTQIMSA-N 2 1 345.490 4.235 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CO2 ZINC000581962209 1023939082 /nfs/dbraw/zinc/93/90/82/1023939082.db2.gz PLZIPDQNBSZQFV-XAPVIXHLSA-N 2 1 348.490 4.214 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3Cc1ccccc1)CO2 ZINC000581962209 1023939088 /nfs/dbraw/zinc/93/90/88/1023939088.db2.gz PLZIPDQNBSZQFV-XAPVIXHLSA-N 2 1 348.490 4.214 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCSC(F)(F)F)cc1 ZINC000178418735 1024104587 /nfs/dbraw/zinc/10/45/87/1024104587.db2.gz YRNNEXHWGASQEW-LLVKDONJSA-N 2 1 329.391 4.084 20 0 EIADMP Cc1cc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)ccc1Br ZINC000091469693 1024270956 /nfs/dbraw/zinc/27/09/56/1024270956.db2.gz NQXQDCRHLBQVEM-UHFFFAOYSA-N 2 1 339.321 4.110 20 0 EIADMP CC[NH+](CC)CC1CC[NH+](Cc2csc(Br)c2)CC1 ZINC000047973697 1024376701 /nfs/dbraw/zinc/37/67/01/1024376701.db2.gz MHXUUSOQXUDANS-UHFFFAOYSA-N 2 1 345.350 4.064 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(F)c(Cl)c1Cl ZINC000432248408 1024749057 /nfs/dbraw/zinc/74/90/57/1024749057.db2.gz ZKWNCDBHYLAFTB-SNVBAGLBSA-N 2 1 330.234 4.063 20 0 EIADMP COC1CCC(CC[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000548485643 1024839022 /nfs/dbraw/zinc/83/90/22/1024839022.db2.gz ASZZJZHNAJOVFY-FFKUYJCKSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1cscn1 ZINC000535777396 1024935578 /nfs/dbraw/zinc/93/55/78/1024935578.db2.gz FGNCJOQWENFDDQ-BRWVUGGUSA-N 2 1 343.540 4.472 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2csc(-c3ccccc3)n2)CC1 ZINC000535811419 1024957972 /nfs/dbraw/zinc/95/79/72/1024957972.db2.gz YUOXEYSKFYFVEN-UHFFFAOYSA-N 2 1 343.540 4.362 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@H](CCC(C)C)C3CC3)CCCC2)CC1 ZINC000549610236 1025313030 /nfs/dbraw/zinc/31/30/30/1025313030.db2.gz DEOWQHPMIXQGTD-HXUWFJFHSA-N 2 1 336.564 4.214 20 0 EIADMP c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467855 1025397854 /nfs/dbraw/zinc/39/78/54/1025397854.db2.gz IHXZCJNXTRBZSS-ICSRJNTNSA-N 2 1 340.511 4.145 20 0 EIADMP c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467855 1025397874 /nfs/dbraw/zinc/39/78/74/1025397874.db2.gz IHXZCJNXTRBZSS-ICSRJNTNSA-N 2 1 340.511 4.145 20 0 EIADMP COCC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C ZINC000511002528 1025416267 /nfs/dbraw/zinc/41/62/67/1025416267.db2.gz UAKPAWVGMGZFIA-RLLQIKCJSA-N 2 1 332.532 4.080 20 0 EIADMP COCC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C ZINC000511002528 1025416274 /nfs/dbraw/zinc/41/62/74/1025416274.db2.gz UAKPAWVGMGZFIA-RLLQIKCJSA-N 2 1 332.532 4.080 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2occc2c1 ZINC000511995492 1025598304 /nfs/dbraw/zinc/59/83/04/1025598304.db2.gz ABNDZKZARBUYFV-UTKZUKDTSA-N 2 1 334.463 4.433 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H](Sc2ccncc2)C1 ZINC001167826938 1025631295 /nfs/dbraw/zinc/63/12/95/1025631295.db2.gz SDMRAAGPEFDRGV-HKUYNNGSSA-N 2 1 335.561 4.149 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(Cl)cc1F ZINC000925784313 1025636353 /nfs/dbraw/zinc/63/63/53/1025636353.db2.gz QSZBZIXOVDPAKX-ABAIWWIYSA-N 2 1 334.813 4.011 20 0 EIADMP CCC[C@H](CCc1ccccc1)[NH2+]Cc1ncc(C[NH+](C)C)s1 ZINC000512022470 1025763107 /nfs/dbraw/zinc/76/31/07/1025763107.db2.gz GGQROFGUKNIASL-QGZVFWFLSA-N 2 1 331.529 4.096 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001167833355 1025784314 /nfs/dbraw/zinc/78/43/14/1025784314.db2.gz APSSOASVHKWFRF-RBBKRZOGSA-N 2 1 345.575 4.093 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000390891444 1025837193 /nfs/dbraw/zinc/83/71/93/1025837193.db2.gz ZJWWJSKSEMXASF-QZTJIDSGSA-N 2 1 336.470 4.312 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000390891444 1025837194 /nfs/dbraw/zinc/83/71/94/1025837194.db2.gz ZJWWJSKSEMXASF-QZTJIDSGSA-N 2 1 336.470 4.312 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)CC2 ZINC001167967946 1025889447 /nfs/dbraw/zinc/88/94/47/1025889447.db2.gz MCNNUEVTRQXSQF-AQDPXUSMSA-N 2 1 330.903 4.322 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1cncc(F)c1 ZINC000157645215 1025901224 /nfs/dbraw/zinc/90/12/24/1025901224.db2.gz KVWHHRTWTGHHJN-SJORKVTESA-N 2 1 341.474 4.303 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(Cl)cc1Cl ZINC000344089060 1025992353 /nfs/dbraw/zinc/99/23/53/1025992353.db2.gz LKGRBGSUKLPBPM-WBMJQRKESA-N 2 1 338.282 4.493 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000432447185 1026027943 /nfs/dbraw/zinc/02/79/43/1026027943.db2.gz OKURUDITGZEMKQ-KBPBESRZSA-N 2 1 345.314 4.145 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000301216788 1026054255 /nfs/dbraw/zinc/05/42/55/1026054255.db2.gz ZGYBRBIMGYDIHW-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP C[N@H+]1CCC[C@@H](CNc2[nH+]ccc3[nH]ccc32)[C@@H]1c1cccs1 ZINC000663660333 1026063472 /nfs/dbraw/zinc/06/34/72/1026063472.db2.gz MBTLFTLPVWLIHX-SUMWQHHRSA-N 2 1 326.469 4.119 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000431353864 1026148597 /nfs/dbraw/zinc/14/85/97/1026148597.db2.gz XCSHWZKNYSTUFS-QKLQHJQFSA-N 2 1 328.500 4.240 20 0 EIADMP Clc1cnccc1[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CC1 ZINC001167974827 1026201445 /nfs/dbraw/zinc/20/14/45/1026201445.db2.gz AXCHOWXZSONJDO-KVMCETHSSA-N 2 1 345.918 4.181 20 0 EIADMP Clc1cnccc1[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C1CC1 ZINC001167974827 1026201459 /nfs/dbraw/zinc/20/14/59/1026201459.db2.gz AXCHOWXZSONJDO-KVMCETHSSA-N 2 1 345.918 4.181 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1 ZINC000657346507 1026205012 /nfs/dbraw/zinc/20/50/12/1026205012.db2.gz DWGAZGDALCLOEB-AWEZNQCLSA-N 2 1 340.496 4.049 20 0 EIADMP COc1ccccc1C1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CCC1 ZINC001167975128 1026222347 /nfs/dbraw/zinc/22/23/47/1026222347.db2.gz IBQGJIKMBWWMCQ-YQQQUEKLSA-N 2 1 340.511 4.069 20 0 EIADMP COc1ccccc1C1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CCC1 ZINC001167975128 1026222365 /nfs/dbraw/zinc/22/23/65/1026222365.db2.gz IBQGJIKMBWWMCQ-YQQQUEKLSA-N 2 1 340.511 4.069 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(CC2=Cc3ccccc3OC2)C1 ZINC000512192741 1026345003 /nfs/dbraw/zinc/34/50/03/1026345003.db2.gz BUEFTMLBGBGJEH-RTBURBONSA-N 2 1 340.511 4.049 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCSc2cc(C)c(C)cc21 ZINC000187246231 1026359731 /nfs/dbraw/zinc/35/97/31/1026359731.db2.gz GDBRWQJQYFSGLV-SFHVURJKSA-N 2 1 329.513 4.415 20 0 EIADMP CCc1nc2c(s1)[C@H]([N@H+](C)CCCCn1cc[nH+]c1C)CCC2 ZINC000163326759 1026371621 /nfs/dbraw/zinc/37/16/21/1026371621.db2.gz TVJQJDOVXRRWQS-MRXNPFEDSA-N 2 1 332.517 4.000 20 0 EIADMP CCc1nc2c(s1)[C@H]([N@@H+](C)CCCCn1cc[nH+]c1C)CCC2 ZINC000163326759 1026371636 /nfs/dbraw/zinc/37/16/36/1026371636.db2.gz TVJQJDOVXRRWQS-MRXNPFEDSA-N 2 1 332.517 4.000 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccccc1OC ZINC000163528507 1026378390 /nfs/dbraw/zinc/37/83/90/1026378390.db2.gz YHTOIARNCJWKFO-IBGZPJMESA-N 2 1 339.483 4.108 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000582328342 1026454943 /nfs/dbraw/zinc/45/49/43/1026454943.db2.gz VBLBLQNFEDQMQK-DOTOQJQBSA-N 2 1 342.449 4.346 20 0 EIADMP CC[N@H+](CCCc1c[nH+]cn1C)C(c1ccccc1)c1ccccc1 ZINC000563348742 1026600034 /nfs/dbraw/zinc/60/00/34/1026600034.db2.gz ACDPRCQVFXHRRF-UHFFFAOYSA-N 2 1 333.479 4.464 20 0 EIADMP CC[N@@H+](CCCc1c[nH+]cn1C)C(c1ccccc1)c1ccccc1 ZINC000563348742 1026600043 /nfs/dbraw/zinc/60/00/43/1026600043.db2.gz ACDPRCQVFXHRRF-UHFFFAOYSA-N 2 1 333.479 4.464 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(OC(C)C)c(Cl)c1 ZINC000342603550 1026723919 /nfs/dbraw/zinc/72/39/19/1026723919.db2.gz XRWIUKNNUPPPAD-CQSZACIVSA-N 2 1 335.879 4.373 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000507498290 1026812763 /nfs/dbraw/zinc/81/27/63/1026812763.db2.gz UXBRHBDLRBXQHR-HQAQVQPGSA-N 2 1 349.522 4.205 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000638799909 1026862344 /nfs/dbraw/zinc/86/23/44/1026862344.db2.gz LSQTZDRTOQXONF-CBQOVEMMSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3cccnc32)C1 ZINC000684953662 1026888624 /nfs/dbraw/zinc/88/86/24/1026888624.db2.gz QQSJSTXCMJWDET-GCJKJVERSA-N 2 1 349.522 4.481 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1cccc(F)c1 ZINC000188029543 1026941536 /nfs/dbraw/zinc/94/15/36/1026941536.db2.gz VXUSSODYLGGNAM-LJQANCHMSA-N 2 1 327.447 4.239 20 0 EIADMP CCOC1CCC([NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168036226 1027152063 /nfs/dbraw/zinc/15/20/63/1027152063.db2.gz UPKTYJQKFCTTPJ-PYOJYGLTSA-N 2 1 344.543 4.365 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+]CCc3ccnc4ccccc34)CC2)cc1 ZINC000657590221 1027206794 /nfs/dbraw/zinc/20/67/94/1027206794.db2.gz YAPICGJRBAQAOL-UHFFFAOYSA-N 2 1 345.490 4.032 20 0 EIADMP Cc1cc(NC[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302504982 1027322910 /nfs/dbraw/zinc/32/29/10/1027322910.db2.gz WBRVNHILBAMCQG-KSSFIOAISA-N 2 1 333.838 4.287 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000342858361 1027330515 /nfs/dbraw/zinc/33/05/15/1027330515.db2.gz DIZKKPMVCJCRRL-QGZVFWFLSA-N 2 1 348.288 4.181 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000342858361 1027330537 /nfs/dbraw/zinc/33/05/37/1027330537.db2.gz DIZKKPMVCJCRRL-QGZVFWFLSA-N 2 1 348.288 4.181 20 0 EIADMP Cc1cccc(C)c1OCCC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441391663 1027515127 /nfs/dbraw/zinc/51/51/27/1027515127.db2.gz BIJGRLVQHCEYQJ-CTNGQTDRSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441391663 1027515140 /nfs/dbraw/zinc/51/51/40/1027515140.db2.gz BIJGRLVQHCEYQJ-CTNGQTDRSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441391663 1027515145 /nfs/dbraw/zinc/51/51/45/1027515145.db2.gz BIJGRLVQHCEYQJ-CTNGQTDRSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441391663 1027515156 /nfs/dbraw/zinc/51/51/56/1027515156.db2.gz BIJGRLVQHCEYQJ-CTNGQTDRSA-N 2 1 342.527 4.021 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000152458163 1027611317 /nfs/dbraw/zinc/61/13/17/1027611317.db2.gz BUMVDAZIDIQCHM-VXGBXAGGSA-N 2 1 344.833 4.076 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000152458163 1027611322 /nfs/dbraw/zinc/61/13/22/1027611322.db2.gz BUMVDAZIDIQCHM-VXGBXAGGSA-N 2 1 344.833 4.076 20 0 EIADMP CCOC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000474874641 1027716691 /nfs/dbraw/zinc/71/66/91/1027716691.db2.gz BVESUQMUTGBEAR-GBAJDQEWSA-N 2 1 344.543 4.082 20 0 EIADMP CCc1cccc(F)c1C[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000474938057 1027815823 /nfs/dbraw/zinc/81/58/23/1027815823.db2.gz DSUKXCJTZMRMRF-UHFFFAOYSA-N 2 1 341.474 4.132 20 0 EIADMP C[N@H+]1CCCC12CCN(Cc1ccc(-c3cccs3)cc1)CC2 ZINC000444671014 1027952645 /nfs/dbraw/zinc/95/26/45/1027952645.db2.gz HLLLVMZHIKTJEA-UHFFFAOYSA-N 2 1 326.509 4.475 20 0 EIADMP C[N@@H+]1CCCC12CC[NH+](Cc1ccc(-c3cccs3)cc1)CC2 ZINC000444671014 1027952660 /nfs/dbraw/zinc/95/26/60/1027952660.db2.gz HLLLVMZHIKTJEA-UHFFFAOYSA-N 2 1 326.509 4.475 20 0 EIADMP C[N@H+]1CCCC12CC[NH+](Cc1ccc(-c3cccs3)cc1)CC2 ZINC000444671014 1027952666 /nfs/dbraw/zinc/95/26/66/1027952666.db2.gz HLLLVMZHIKTJEA-UHFFFAOYSA-N 2 1 326.509 4.475 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](CC(F)(F)F)c1ccccc1C ZINC000444777949 1028061647 /nfs/dbraw/zinc/06/16/47/1028061647.db2.gz UKWYKYPKUFYCPJ-INIZCTEOSA-N 2 1 325.378 4.173 20 0 EIADMP c1ccc2c(c1)cccc2OCC[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000523452280 1028103710 /nfs/dbraw/zinc/10/37/10/1028103710.db2.gz HOQUMLOSRGCCQA-FQEVSTJZSA-N 2 1 338.495 4.169 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000583174990 1028174557 /nfs/dbraw/zinc/17/45/57/1028174557.db2.gz LTXNOSJHYOIEIJ-VOGRQWBCSA-N 2 1 338.442 4.107 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000583174990 1028174570 /nfs/dbraw/zinc/17/45/70/1028174570.db2.gz LTXNOSJHYOIEIJ-VOGRQWBCSA-N 2 1 338.442 4.107 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)CCCCc1ccccc1 ZINC000346149404 1028282429 /nfs/dbraw/zinc/28/24/29/1028282429.db2.gz WYHTVZXHXDKVTE-UHFFFAOYSA-N 2 1 334.467 4.030 20 0 EIADMP C[N@H+](Cc1ccccc1)C1(C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CCCCC1 ZINC000714226956 1028290778 /nfs/dbraw/zinc/29/07/78/1028290778.db2.gz AUEDBBQILFINEZ-WKCHPHFGSA-N 2 1 326.528 4.457 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1(C[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)CCCCC1 ZINC000714226956 1028290799 /nfs/dbraw/zinc/29/07/99/1028290799.db2.gz AUEDBBQILFINEZ-WKCHPHFGSA-N 2 1 326.528 4.457 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000346174936 1028305898 /nfs/dbraw/zinc/30/58/98/1028305898.db2.gz NDGDSKISBYBQGQ-JOCHJYFZSA-N 2 1 344.462 4.228 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cccnc1Cl ZINC000162911887 1028551102 /nfs/dbraw/zinc/55/11/02/1028551102.db2.gz MNAKUYXIGIIODH-HNNXBMFYSA-N 2 1 329.875 4.182 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC[N@H+]1C ZINC000443983780 1028691889 /nfs/dbraw/zinc/69/18/89/1028691889.db2.gz FXZFFQDJODLJKW-YJBOKZPZSA-N 2 1 328.431 4.190 20 0 EIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cnc(C(F)(F)F)s1 ZINC000444003987 1028723686 /nfs/dbraw/zinc/72/36/86/1028723686.db2.gz PLORCEVWLPETJA-JSGCOSHPSA-N 2 1 349.466 4.152 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC000537976241 1028742174 /nfs/dbraw/zinc/74/21/74/1028742174.db2.gz PRNPXOXWDJRLOH-AVRDEDQJSA-N 2 1 333.479 4.401 20 0 EIADMP C[C@H]([NH2+]CCSCc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000192637927 1028867256 /nfs/dbraw/zinc/86/72/56/1028867256.db2.gz MMFSLYUYMOXJKV-PKOBYXMFSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cnc(-c2ccco2)s1 ZINC000278395103 1029103326 /nfs/dbraw/zinc/10/33/26/1029103326.db2.gz MYZJOTPYWWUYFT-OAHLLOKOSA-N 2 1 333.501 4.147 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)ccc1SC ZINC000131215376 1029292325 /nfs/dbraw/zinc/29/23/25/1029292325.db2.gz JFOPAWGYIQDROB-OAHLLOKOSA-N 2 1 336.545 4.188 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1OCCC ZINC000248026748 1029490467 /nfs/dbraw/zinc/49/04/67/1029490467.db2.gz PIDLMNWVBWRNJE-LNLFQRSKSA-N 2 1 348.531 4.398 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OCCC ZINC000248026748 1029490473 /nfs/dbraw/zinc/49/04/73/1029490473.db2.gz PIDLMNWVBWRNJE-LNLFQRSKSA-N 2 1 348.531 4.398 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000623348124 1029547265 /nfs/dbraw/zinc/54/72/65/1029547265.db2.gz SIAIYKUISMMJOZ-OCCSQVGLSA-N 2 1 330.394 4.109 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](CC)CC1 ZINC000657824197 1029585702 /nfs/dbraw/zinc/58/57/02/1029585702.db2.gz DMEUJWLQRHDPMF-MRXNPFEDSA-N 2 1 328.422 4.100 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccc(C(F)F)nc1 ZINC000657827541 1029607115 /nfs/dbraw/zinc/60/71/15/1029607115.db2.gz NEOIFDVFSOGQLE-HNNXBMFYSA-N 2 1 345.437 4.118 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccc(C(F)F)nc1 ZINC000657827541 1029607120 /nfs/dbraw/zinc/60/71/20/1029607120.db2.gz NEOIFDVFSOGQLE-HNNXBMFYSA-N 2 1 345.437 4.118 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CC2CC(F)(F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168063900 1029616235 /nfs/dbraw/zinc/61/62/35/1029616235.db2.gz NUYPBONUNMUUME-HGKCTWBKSA-N 2 1 336.470 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)CC2CC(F)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168063900 1029616246 /nfs/dbraw/zinc/61/62/46/1029616246.db2.gz NUYPBONUNMUUME-HGKCTWBKSA-N 2 1 336.470 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CC2CC(F)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168063900 1029616258 /nfs/dbraw/zinc/61/62/58/1029616258.db2.gz NUYPBONUNMUUME-HGKCTWBKSA-N 2 1 336.470 4.405 20 0 EIADMP COC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000347319976 1029618911 /nfs/dbraw/zinc/61/89/11/1029618911.db2.gz JGINQJRPRMRSIJ-LAUBAEHRSA-N 2 1 349.478 4.089 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(C(F)F)nc1 ZINC000657829967 1029642175 /nfs/dbraw/zinc/64/21/75/1029642175.db2.gz KCKQMJSIOXDGTG-AWEZNQCLSA-N 2 1 325.447 4.324 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(C(F)F)nc1 ZINC000657829967 1029642179 /nfs/dbraw/zinc/64/21/79/1029642179.db2.gz KCKQMJSIOXDGTG-AWEZNQCLSA-N 2 1 325.447 4.324 20 0 EIADMP c1ccc([C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)[C@H]2CCCO2)cc1 ZINC000584188392 1029664725 /nfs/dbraw/zinc/66/47/25/1029664725.db2.gz FAMZOTAYDYSAJN-YADHBBJMSA-N 2 1 342.527 4.293 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C2CC(CF)(CF)C2)C1 ZINC000657838665 1029716431 /nfs/dbraw/zinc/71/64/31/1029716431.db2.gz WYPYFDUQKDYYKE-MRXNPFEDSA-N 2 1 336.470 4.096 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000708510419 1029742881 /nfs/dbraw/zinc/74/28/81/1029742881.db2.gz JXVSRBSVBCUHFN-OXJNMPFZSA-N 2 1 344.449 4.482 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNCc1ccc(Cl)cc1F ZINC000708519307 1029743161 /nfs/dbraw/zinc/74/31/61/1029743161.db2.gz HNRPWTURFWUPRO-MAUKXSAKSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)cc1F ZINC000708519307 1029743166 /nfs/dbraw/zinc/74/31/66/1029743166.db2.gz HNRPWTURFWUPRO-MAUKXSAKSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)cc1F ZINC000708519307 1029743173 /nfs/dbraw/zinc/74/31/73/1029743173.db2.gz HNRPWTURFWUPRO-MAUKXSAKSA-N 2 1 346.877 4.337 20 0 EIADMP CCC[N@H+](C)C[C@H]1CC[NH+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000081578985 1029805332 /nfs/dbraw/zinc/80/53/32/1029805332.db2.gz BCNGPHKXTYHYNY-LSDHHAIUSA-N 2 1 326.431 4.013 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000081578985 1029805333 /nfs/dbraw/zinc/80/53/33/1029805333.db2.gz BCNGPHKXTYHYNY-LSDHHAIUSA-N 2 1 326.431 4.013 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000081578985 1029805335 /nfs/dbraw/zinc/80/53/35/1029805335.db2.gz BCNGPHKXTYHYNY-LSDHHAIUSA-N 2 1 326.431 4.013 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+]([C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000081578985 1029805337 /nfs/dbraw/zinc/80/53/37/1029805337.db2.gz BCNGPHKXTYHYNY-LSDHHAIUSA-N 2 1 326.431 4.013 20 0 EIADMP C[N@@H+]1CCC[C@@H]2CN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)CC[C@@H]21 ZINC000301798194 1029810245 /nfs/dbraw/zinc/81/02/45/1029810245.db2.gz QVVGMCNSYLWLPV-DYVFJYSZSA-N 2 1 349.400 4.174 20 0 EIADMP C[N@H+]1CCC[C@@H]2CN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)CC[C@@H]21 ZINC000301798194 1029810248 /nfs/dbraw/zinc/81/02/48/1029810248.db2.gz QVVGMCNSYLWLPV-DYVFJYSZSA-N 2 1 349.400 4.174 20 0 EIADMP C[N@@H+]1CCC[C@H]2CN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)CC[C@@H]21 ZINC000301798196 1029810743 /nfs/dbraw/zinc/81/07/43/1029810743.db2.gz QVVGMCNSYLWLPV-GUYCJALGSA-N 2 1 349.400 4.174 20 0 EIADMP C[N@H+]1CCC[C@H]2CN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)CC[C@@H]21 ZINC000301798196 1029810747 /nfs/dbraw/zinc/81/07/47/1029810747.db2.gz QVVGMCNSYLWLPV-GUYCJALGSA-N 2 1 349.400 4.174 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)s1 ZINC000708528743 1029812978 /nfs/dbraw/zinc/81/29/78/1029812978.db2.gz IGKGJNJDPDFCDV-HOCLYGCPSA-N 2 1 334.916 4.259 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000090457522 1029861621 /nfs/dbraw/zinc/86/16/21/1029861621.db2.gz UHSDJFUHKCZLQZ-TZIWHRDSSA-N 2 1 344.543 4.226 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000090457522 1029861624 /nfs/dbraw/zinc/86/16/24/1029861624.db2.gz UHSDJFUHKCZLQZ-TZIWHRDSSA-N 2 1 344.543 4.226 20 0 EIADMP Cc1[nH+]ccn1CC[NH+]1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000091100561 1029880649 /nfs/dbraw/zinc/88/06/49/1029880649.db2.gz UDMQRHPMNULXSV-UHFFFAOYSA-N 2 1 337.389 4.090 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccc(C(F)(F)F)cc1)C(C)C ZINC000091313911 1029883221 /nfs/dbraw/zinc/88/32/21/1029883221.db2.gz CIJGSURNKSOTBA-INIZCTEOSA-N 2 1 325.378 4.197 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1cccnc1 ZINC000091313587 1029883359 /nfs/dbraw/zinc/88/33/59/1029883359.db2.gz TXPDWNSVXUDSTC-PXNSSMCTSA-N 2 1 343.540 4.342 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccnc1 ZINC000091313587 1029883360 /nfs/dbraw/zinc/88/33/60/1029883360.db2.gz TXPDWNSVXUDSTC-PXNSSMCTSA-N 2 1 343.540 4.342 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657877304 1030154480 /nfs/dbraw/zinc/15/44/80/1030154480.db2.gz PUYOODWCPKWMGA-VXGBXAGGSA-N 2 1 345.712 4.095 20 0 EIADMP FC(F)c1ccc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)cc1 ZINC000525981808 1030167867 /nfs/dbraw/zinc/16/78/67/1030167867.db2.gz RCWFIZGAKVIQJL-UHFFFAOYSA-N 2 1 330.422 4.162 20 0 EIADMP FC(F)c1ccc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)cc1 ZINC000525981808 1030167880 /nfs/dbraw/zinc/16/78/80/1030167880.db2.gz RCWFIZGAKVIQJL-UHFFFAOYSA-N 2 1 330.422 4.162 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCCc3c(C)ccc(C)c32)cn1 ZINC000186117328 1030251926 /nfs/dbraw/zinc/25/19/26/1030251926.db2.gz URNLLXOKSPYABQ-FQEVSTJZSA-N 2 1 346.478 4.360 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]C2CC(c3cc(F)cc(F)c3)C2)C1 ZINC000685421386 1030298184 /nfs/dbraw/zinc/29/81/84/1030298184.db2.gz CSCKROIEMRIMPL-XRTORIHISA-N 2 1 336.470 4.313 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000392263985 1030332210 /nfs/dbraw/zinc/33/22/10/1030332210.db2.gz LDILFFDDEFKRBG-GOSISDBHSA-N 2 1 336.479 4.178 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@H]2C)o1 ZINC000685470260 1030351068 /nfs/dbraw/zinc/35/10/68/1030351068.db2.gz BYSVLDNMPCHONK-DNVCBOLYSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@H]2C)o1 ZINC000685470260 1030351086 /nfs/dbraw/zinc/35/10/86/1030351086.db2.gz BYSVLDNMPCHONK-DNVCBOLYSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)o1 ZINC000685470260 1030351094 /nfs/dbraw/zinc/35/10/94/1030351094.db2.gz BYSVLDNMPCHONK-DNVCBOLYSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)o1 ZINC000685470260 1030351113 /nfs/dbraw/zinc/35/11/13/1030351113.db2.gz BYSVLDNMPCHONK-DNVCBOLYSA-N 2 1 330.447 4.166 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000657893067 1030390347 /nfs/dbraw/zinc/39/03/47/1030390347.db2.gz ZSXOBQNORMPBTL-DYEKYZERSA-N 2 1 348.840 4.362 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000657893067 1030390366 /nfs/dbraw/zinc/39/03/66/1030390366.db2.gz ZSXOBQNORMPBTL-DYEKYZERSA-N 2 1 348.840 4.362 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1cccc2cccnc21 ZINC000708571136 1030391908 /nfs/dbraw/zinc/39/19/08/1030391908.db2.gz QRYGAPPCCUQJCV-GCJKJVERSA-N 2 1 345.490 4.093 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)c1cc2cnccc2o1)[N@H+](C)Cc1ccccc1 ZINC000657898543 1030404305 /nfs/dbraw/zinc/40/43/05/1030404305.db2.gz DBMULIXHZUMEJH-IAGOWNOFSA-N 2 1 337.467 4.389 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)c1cc2cnccc2o1)[N@@H+](C)Cc1ccccc1 ZINC000657898543 1030404326 /nfs/dbraw/zinc/40/43/26/1030404326.db2.gz DBMULIXHZUMEJH-IAGOWNOFSA-N 2 1 337.467 4.389 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ncc(C(C)(C)C)s2)C1 ZINC000447939244 1030432472 /nfs/dbraw/zinc/43/24/72/1030432472.db2.gz JMDYOHQHSGEEFU-IYBDPMFKSA-N 2 1 337.577 4.288 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@H]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000530460226 1030437265 /nfs/dbraw/zinc/43/72/65/1030437265.db2.gz WUSCCFFUABZEHW-YOEHRIQHSA-N 2 1 338.282 4.195 20 0 EIADMP CCOC1CCC([NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000657907436 1030455658 /nfs/dbraw/zinc/45/56/58/1030455658.db2.gz LUOSNXNSQHMMSV-DXHCPDEFSA-N 2 1 344.543 4.080 20 0 EIADMP Cc1ccc(C[C@H]([NH2+]CCc2c[nH+]cn2C)c2ccc(C)cc2)cc1 ZINC000530513312 1030504062 /nfs/dbraw/zinc/50/40/62/1030504062.db2.gz FUXBJSWQEFVWJW-QFIPXVFZSA-N 2 1 333.479 4.153 20 0 EIADMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cnn1C(C)C ZINC000191325741 1030617371 /nfs/dbraw/zinc/61/73/71/1030617371.db2.gz MBGSLERZSIJHSX-INIZCTEOSA-N 2 1 332.536 4.220 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)C[C@H]1C ZINC000530663210 1030617623 /nfs/dbraw/zinc/61/76/23/1030617623.db2.gz YNSHKOXVEPOUSC-GDBMZVCRSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c3cccnc23)C[C@H]1C ZINC000530663210 1030617638 /nfs/dbraw/zinc/61/76/38/1030617638.db2.gz YNSHKOXVEPOUSC-GDBMZVCRSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c3cccnc23)C[C@H]1C ZINC000530663210 1030617656 /nfs/dbraw/zinc/61/76/56/1030617656.db2.gz YNSHKOXVEPOUSC-GDBMZVCRSA-N 2 1 331.891 4.193 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCOc2ccc3ccccc3c2)C[C@H]1C ZINC000530662946 1030618132 /nfs/dbraw/zinc/61/81/32/1030618132.db2.gz RXDWRDXVDHATOU-XLIONFOSSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCOc2ccc3ccccc3c2)C[C@H]1C ZINC000530662946 1030618145 /nfs/dbraw/zinc/61/81/45/1030618145.db2.gz RXDWRDXVDHATOU-XLIONFOSSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCOc2ccc3ccccc3c2)C[C@H]1C ZINC000530662946 1030618162 /nfs/dbraw/zinc/61/81/62/1030618162.db2.gz RXDWRDXVDHATOU-XLIONFOSSA-N 2 1 326.484 4.023 20 0 EIADMP CCN1CCC([N@@H+](C)CCCOc2cccc3ccccc32)CC1 ZINC000530666383 1030619429 /nfs/dbraw/zinc/61/94/29/1030619429.db2.gz WRLHZGTWSPDFMY-UHFFFAOYSA-N 2 1 326.484 4.025 20 0 EIADMP CC[NH+]1CCC([N@H+](C)CCCOc2cccc3ccccc32)CC1 ZINC000530666383 1030619433 /nfs/dbraw/zinc/61/94/33/1030619433.db2.gz WRLHZGTWSPDFMY-UHFFFAOYSA-N 2 1 326.484 4.025 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)CCCOc2cccc3ccccc32)CC1 ZINC000530666383 1030619439 /nfs/dbraw/zinc/61/94/39/1030619439.db2.gz WRLHZGTWSPDFMY-UHFFFAOYSA-N 2 1 326.484 4.025 20 0 EIADMP COCC1(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCCCC1 ZINC000685665274 1030664810 /nfs/dbraw/zinc/66/48/10/1030664810.db2.gz QERVGKLNGHBMDL-PZJWPPBQSA-N 2 1 344.543 4.084 20 0 EIADMP Cc1nccn1CCCC[N@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000451878312 1030756690 /nfs/dbraw/zinc/75/66/90/1030756690.db2.gz MJVXPJVWZFUZCY-LJQANCHMSA-N 2 1 337.471 4.075 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000451878312 1030756730 /nfs/dbraw/zinc/75/67/30/1030756730.db2.gz MJVXPJVWZFUZCY-LJQANCHMSA-N 2 1 337.471 4.075 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCSCC1 ZINC000658004258 1030769982 /nfs/dbraw/zinc/76/99/82/1030769982.db2.gz PBXLDHLCXHURNF-RBUKOAKNSA-N 2 1 332.557 4.162 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCSCC1 ZINC000658004258 1030770012 /nfs/dbraw/zinc/77/00/12/1030770012.db2.gz PBXLDHLCXHURNF-RBUKOAKNSA-N 2 1 332.557 4.162 20 0 EIADMP CCC(CC)(C[NH2+][C@H]1CCC12CCOCC2)[NH2+][C@H](C)c1ccccc1 ZINC000548859478 1030821366 /nfs/dbraw/zinc/82/13/66/1030821366.db2.gz JOBALWFAWQKZAL-QUCCMNQESA-N 2 1 344.543 4.445 20 0 EIADMP C[C@]1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)CC1(F)F ZINC000658219635 1030885158 /nfs/dbraw/zinc/88/51/58/1030885158.db2.gz CJANBTSUOQPLGU-WJFTUGDTSA-N 2 1 334.454 4.065 20 0 EIADMP Cc1ccccc1[C@@H]([NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)C1CCCC1 ZINC000658296204 1030960932 /nfs/dbraw/zinc/96/09/32/1030960932.db2.gz RAJJTKBUXWJVEW-UNMCSNQZSA-N 2 1 342.527 4.069 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000532477057 1031204187 /nfs/dbraw/zinc/20/41/87/1031204187.db2.gz MPKQUSUOBDUGEJ-CBGDNZLLSA-N 2 1 342.552 4.391 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc3ncccc3c2)C[C@@H]1c1ccccc1 ZINC000340377431 1031209357 /nfs/dbraw/zinc/20/93/57/1031209357.db2.gz ISHIMDVOQBLPKL-RBBKRZOGSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc3ncccc3c2)C[C@@H]1c1ccccc1 ZINC000340377431 1031209378 /nfs/dbraw/zinc/20/93/78/1031209378.db2.gz ISHIMDVOQBLPKL-RBBKRZOGSA-N 2 1 331.463 4.160 20 0 EIADMP CC(C)c1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@H](C)c1nc2ccccc2o1 ZINC000375825400 1031309188 /nfs/dbraw/zinc/30/91/88/1031309188.db2.gz RMIXFEJOHQUTMQ-CVEARBPZSA-N 2 1 338.455 4.373 20 0 EIADMP CC(C)c1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@H](C)c1nc2ccccc2o1 ZINC000375825400 1031309208 /nfs/dbraw/zinc/30/92/08/1031309208.db2.gz RMIXFEJOHQUTMQ-CVEARBPZSA-N 2 1 338.455 4.373 20 0 EIADMP CC[N@H+](Cc1cc2cccnc2o1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000449038588 1031375070 /nfs/dbraw/zinc/37/50/70/1031375070.db2.gz VYPNWYRPLNDNKY-LJQANCHMSA-N 2 1 349.478 4.172 20 0 EIADMP Cn1ncc2c1CCC[C@H]2[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449075056 1031429979 /nfs/dbraw/zinc/42/99/79/1031429979.db2.gz MFVUBIKKZSZNJM-GOSISDBHSA-N 2 1 346.563 4.066 20 0 EIADMP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C1CCCC1 ZINC000449128846 1031466359 /nfs/dbraw/zinc/46/63/59/1031466359.db2.gz YNTXYUQRMKBXFN-HXUWFJFHSA-N 2 1 347.547 4.452 20 0 EIADMP Cc1cccc(CC[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000449159990 1031500408 /nfs/dbraw/zinc/50/04/08/1031500408.db2.gz KEGCUCZBTCJQNU-ICSRJNTNSA-N 2 1 328.525 4.272 20 0 EIADMP Cc1cccc(CC[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1 ZINC000449159990 1031500417 /nfs/dbraw/zinc/50/04/17/1031500417.db2.gz KEGCUCZBTCJQNU-ICSRJNTNSA-N 2 1 328.525 4.272 20 0 EIADMP COc1cccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@@H]3C)cc2)c1 ZINC000531725043 1031525975 /nfs/dbraw/zinc/52/59/75/1031525975.db2.gz GKOGDKVOLNRRMT-GSHUGGBRSA-N 2 1 338.495 4.181 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2cc3cccnc3o2)C[N@H+]1Cc1ccccc1 ZINC000449217118 1031551701 /nfs/dbraw/zinc/55/17/01/1031551701.db2.gz WZNDHCAMSUOETM-MJGOQNOKSA-N 2 1 349.478 4.218 20 0 EIADMP COc1cc(C)ccc1C[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000449218384 1031551746 /nfs/dbraw/zinc/55/17/46/1031551746.db2.gz HUIOWSSHNJGUKG-UHFFFAOYSA-N 2 1 326.484 4.134 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+]Cc2ncc(-c3ccccc3)s2)c1 ZINC000092367455 1031556804 /nfs/dbraw/zinc/55/68/04/1031556804.db2.gz GNCHTSRIPPYZBY-UHFFFAOYSA-N 2 1 337.492 4.162 20 0 EIADMP C[C@@H]([NH2+]C[C@@H](C)c1cc(F)cc(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000449232834 1031565133 /nfs/dbraw/zinc/56/51/33/1031565133.db2.gz JGOXTYFLVQFORB-OAGGEKHMSA-N 2 1 336.470 4.311 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccncc1 ZINC000453079041 1031564966 /nfs/dbraw/zinc/56/49/66/1031564966.db2.gz CIZXMCBSNUAAKK-QFBILLFUSA-N 2 1 329.513 4.096 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccncc1 ZINC000453079041 1031564990 /nfs/dbraw/zinc/56/49/90/1031564990.db2.gz CIZXMCBSNUAAKK-QFBILLFUSA-N 2 1 329.513 4.096 20 0 EIADMP Cc1nccn1CCC[N@H+](CC(C)C)[C@H]1CCCc2cccnc21 ZINC000126884622 1031666456 /nfs/dbraw/zinc/66/64/56/1031666456.db2.gz RIHFREFOVVWDQO-IBGZPJMESA-N 2 1 326.488 4.012 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](CC(C)C)[C@H]1CCCc2cccnc21 ZINC000126884622 1031666468 /nfs/dbraw/zinc/66/64/68/1031666468.db2.gz RIHFREFOVVWDQO-IBGZPJMESA-N 2 1 326.488 4.012 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](CC(C)C)[C@H]1CCCc2cccnc21 ZINC000126884622 1031666488 /nfs/dbraw/zinc/66/64/88/1031666488.db2.gz RIHFREFOVVWDQO-IBGZPJMESA-N 2 1 326.488 4.012 20 0 EIADMP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000449560532 1031847461 /nfs/dbraw/zinc/84/74/61/1031847461.db2.gz MHYGMZJLCYFGNS-RLAWYHOSSA-N 2 1 327.299 4.139 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(CCc2ccc(O)cc2)CC1 ZINC000536609295 1031874025 /nfs/dbraw/zinc/87/40/25/1031874025.db2.gz MQFVTAWLOADWSE-UHFFFAOYSA-N 2 1 341.499 4.022 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2cc(F)cc(F)c2)cc1 ZINC000531963533 1031884171 /nfs/dbraw/zinc/88/41/71/1031884171.db2.gz OWNKXILHMJJZQB-CQSZACIVSA-N 2 1 341.405 4.352 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000531972412 1031909193 /nfs/dbraw/zinc/90/91/93/1031909193.db2.gz RIVLNIKSUXKXEW-DYESRHJHSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cccc(Br)c21 ZINC000453366821 1031910073 /nfs/dbraw/zinc/91/00/73/1031910073.db2.gz SWLNWJYQITZZPD-FVSUXCLVSA-N 2 1 349.316 4.212 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)cc1 ZINC000453417285 1031952069 /nfs/dbraw/zinc/95/20/69/1031952069.db2.gz KCOWSAHJEAKWAT-WBVHZDCISA-N 2 1 327.472 4.037 20 0 EIADMP Cc1cc(C)c(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cn1 ZINC000449736986 1031971933 /nfs/dbraw/zinc/97/19/33/1031971933.db2.gz XQERLRUNKFADEF-UHFFFAOYSA-N 2 1 331.548 4.467 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCC2CC(F)(F)C2)CC1 ZINC000453428131 1031981338 /nfs/dbraw/zinc/98/13/38/1031981338.db2.gz PMXIWDGWOFUOIR-UHFFFAOYSA-N 2 1 336.470 4.455 20 0 EIADMP CCc1nc(C(C)C)ccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000549860679 1033328620 /nfs/dbraw/zinc/32/86/20/1033328620.db2.gz RFYYPBPXUMFMEH-SFHVURJKSA-N 2 1 329.532 4.075 20 0 EIADMP CCc1nc(C(C)C)ccc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000549860679 1033328634 /nfs/dbraw/zinc/32/86/34/1033328634.db2.gz RFYYPBPXUMFMEH-SFHVURJKSA-N 2 1 329.532 4.075 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cccc(O)c2Cl)c1 ZINC000645146696 1033833293 /nfs/dbraw/zinc/83/32/93/1033833293.db2.gz CKTSTANAQNGFPA-UHFFFAOYSA-N 2 1 332.875 4.177 20 0 EIADMP c1cc(C[N@H+](Cc2ccncc2)C2CC2)cc(C[NH+]2CCCCC2)c1 ZINC000411426717 1033884204 /nfs/dbraw/zinc/88/42/04/1033884204.db2.gz YUJWYDZRRCRFML-UHFFFAOYSA-N 2 1 335.495 4.232 20 0 EIADMP COc1cc(-c2ccccc2)ccc1CN(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000512774656 1033907627 /nfs/dbraw/zinc/90/76/27/1033907627.db2.gz YUTVMOZOYAHDGY-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP Cc1cnc(C(C)(C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)s1 ZINC000411518862 1033957967 /nfs/dbraw/zinc/95/79/67/1033957967.db2.gz KFJSUKOSORTJAP-UHFFFAOYSA-N 2 1 343.540 4.462 20 0 EIADMP c1ccc(C[NH+]2CCC3(CC[N@H+](CCCc4ccncc4)C3)CC2)cc1 ZINC000433172338 1033979080 /nfs/dbraw/zinc/97/90/80/1033979080.db2.gz HFBOAQTXKZMGCD-UHFFFAOYSA-N 2 1 349.522 4.002 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2cc[nH+]c3ccccc23)cc1 ZINC000433407214 1034331038 /nfs/dbraw/zinc/33/10/38/1034331038.db2.gz AITXKIOKVWICSA-OAHLLOKOSA-N 2 1 328.419 4.324 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CSc3ccccc32)CC1 ZINC000513208002 1034836376 /nfs/dbraw/zinc/83/63/76/1034836376.db2.gz KNNBKALTEUMZDL-LZQZEXGQSA-N 2 1 330.541 4.466 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2ccc(Cl)o2)C[N@H+]1Cc1ccccc1 ZINC000513501546 1034999297 /nfs/dbraw/zinc/99/92/97/1034999297.db2.gz TVTQRHXIURNJQL-WBVHZDCISA-N 2 1 332.875 4.323 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000513667927 1035089007 /nfs/dbraw/zinc/08/90/07/1035089007.db2.gz UXDGOHLJMJDWTC-FHWLQOOXSA-N 2 1 337.511 4.197 20 0 EIADMP C[N@@H+](CCCc1cccc(F)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501054159 1035362343 /nfs/dbraw/zinc/36/23/43/1035362343.db2.gz UGPRSDKQKBNREG-UHFFFAOYSA-N 2 1 341.474 4.002 20 0 EIADMP C[N@@H+](CCC[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1)C1CCCCC1 ZINC000501379494 1035436433 /nfs/dbraw/zinc/43/64/33/1035436433.db2.gz BBZVFUPJFKATMS-QUCCMNQESA-N 2 1 329.532 4.352 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000501466379 1035449604 /nfs/dbraw/zinc/44/96/04/1035449604.db2.gz JNXGAHNQKXKFCR-YYKIQEHNSA-N 2 1 326.406 4.181 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CCC[C@H]([C@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420283200 1035498093 /nfs/dbraw/zinc/49/80/93/1035498093.db2.gz BSEMODCKBXHAOC-NOLJZWGESA-N 2 1 347.890 4.424 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CCC[C@H]([C@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420283200 1035498097 /nfs/dbraw/zinc/49/80/97/1035498097.db2.gz BSEMODCKBXHAOC-NOLJZWGESA-N 2 1 347.890 4.424 20 0 EIADMP c1csc(C[N@H+](CCCC2CCCC2)[C@@H]2CC23CC[NH2+]CC3)n1 ZINC000420319151 1035512795 /nfs/dbraw/zinc/51/27/95/1035512795.db2.gz XESXRUHOFXCLRU-QGZVFWFLSA-N 2 1 333.545 4.058 20 0 EIADMP c1csc([C@H]2c3ccsc3CC[N@@H+]2CC[C@H]2CCC[NH2+]C2)c1 ZINC000420320521 1035513648 /nfs/dbraw/zinc/51/36/48/1035513648.db2.gz QKXLOIGOHNMZMQ-RDTXWAMCSA-N 2 1 332.538 4.147 20 0 EIADMP CC(C)CCc1nc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cs1 ZINC000501770915 1035576453 /nfs/dbraw/zinc/57/64/53/1035576453.db2.gz QYLACXPLKBBWIA-UHFFFAOYSA-N 2 1 337.577 4.286 20 0 EIADMP c1cnc2c(c1)cccc2C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491053936 1035797017 /nfs/dbraw/zinc/79/70/17/1035797017.db2.gz ACMSWCCASFFPOM-IBGZPJMESA-N 2 1 337.511 4.323 20 0 EIADMP C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000502258115 1036014517 /nfs/dbraw/zinc/01/45/17/1036014517.db2.gz QYEBPULHCLQPJZ-XQPJFTJZSA-N 2 1 329.532 4.064 20 0 EIADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000502258115 1036014536 /nfs/dbraw/zinc/01/45/36/1036014536.db2.gz QYEBPULHCLQPJZ-XQPJFTJZSA-N 2 1 329.532 4.064 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)s1 ZINC000414505845 1036188234 /nfs/dbraw/zinc/18/82/34/1036188234.db2.gz VLOXQWUEKYYQFG-HOCLYGCPSA-N 2 1 349.931 4.284 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)oc1C ZINC000502476730 1036256839 /nfs/dbraw/zinc/25/68/39/1036256839.db2.gz YRGTYGGBRPCHRW-UWVAXJGDSA-N 2 1 326.484 4.458 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000502476730 1036256858 /nfs/dbraw/zinc/25/68/58/1036256858.db2.gz YRGTYGGBRPCHRW-UWVAXJGDSA-N 2 1 326.484 4.458 20 0 EIADMP CN1CC[C@@H](C[N@@H+](C)Cc2cccc(C3CC3)c2)[C@@H]1c1cccnc1 ZINC000421349560 1036293381 /nfs/dbraw/zinc/29/33/81/1036293381.db2.gz XYJRWCGXJHVYMP-VXKWHMMOSA-N 2 1 335.495 4.084 20 0 EIADMP CCOC1CC2(C1)CC[N@H+](CC(C)(C)C[NH+](C)Cc1ccccc1)C2 ZINC000572047461 1036400137 /nfs/dbraw/zinc/40/01/37/1036400137.db2.gz ILQVRFRYNGRMTD-UHFFFAOYSA-N 2 1 344.543 4.036 20 0 EIADMP CCOC1CC2(C1)CC[N@@H+](CC(C)(C)C[NH+](C)Cc1ccccc1)C2 ZINC000572047461 1036400161 /nfs/dbraw/zinc/40/01/61/1036400161.db2.gz ILQVRFRYNGRMTD-UHFFFAOYSA-N 2 1 344.543 4.036 20 0 EIADMP CCOC1CC2(C1)CC[NH+](CC(C)(C)C[N@H+](C)Cc1ccccc1)C2 ZINC000572047461 1036400178 /nfs/dbraw/zinc/40/01/78/1036400178.db2.gz ILQVRFRYNGRMTD-UHFFFAOYSA-N 2 1 344.543 4.036 20 0 EIADMP CCOC1CC2(C1)CC[NH+](CC(C)(C)C[N@@H+](C)Cc1ccccc1)C2 ZINC000572047461 1036400200 /nfs/dbraw/zinc/40/02/00/1036400200.db2.gz ILQVRFRYNGRMTD-UHFFFAOYSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@H](NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502683277 1036501988 /nfs/dbraw/zinc/50/19/88/1036501988.db2.gz IPBDNSKAWDHTIS-KSZLIROESA-N 2 1 332.536 4.017 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502683277 1036502007 /nfs/dbraw/zinc/50/20/07/1036502007.db2.gz IPBDNSKAWDHTIS-KSZLIROESA-N 2 1 332.536 4.017 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502683277 1036502032 /nfs/dbraw/zinc/50/20/32/1036502032.db2.gz IPBDNSKAWDHTIS-KSZLIROESA-N 2 1 332.536 4.017 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000502696047 1036515630 /nfs/dbraw/zinc/51/56/30/1036515630.db2.gz BMJSLHZGLUHBPA-COPCDDAFSA-N 2 1 344.543 4.213 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000502725582 1036583756 /nfs/dbraw/zinc/58/37/56/1036583756.db2.gz XUVKLZSTDGHCGE-DXIQSLLYSA-N 2 1 344.543 4.213 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+][C@H]3CCC[C@@H]3C(C)(C)C)sc2C1 ZINC000414541471 1036640191 /nfs/dbraw/zinc/64/01/91/1036640191.db2.gz WBWNMHVZSHEJSH-GJZGRUSLSA-N 2 1 335.561 4.214 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+][C@H]3CCC[C@@H]3C(C)(C)C)sc2C1 ZINC000414541471 1036640200 /nfs/dbraw/zinc/64/02/00/1036640200.db2.gz WBWNMHVZSHEJSH-GJZGRUSLSA-N 2 1 335.561 4.214 20 0 EIADMP Clc1ccccc1C1CC[NH+](C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168389568 1036758337 /nfs/dbraw/zinc/75/83/37/1036758337.db2.gz RVSJZLOTJFSZSV-UHFFFAOYSA-N 2 1 332.919 4.394 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000486719641 1036826462 /nfs/dbraw/zinc/82/64/62/1036826462.db2.gz HMXVBOGXCOTLFH-ZBFHGGJFSA-N 2 1 329.463 4.050 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000572849124 1036843853 /nfs/dbraw/zinc/84/38/53/1036843853.db2.gz HJSZLDZBDSSWJK-RVDMUPIBSA-N 2 1 340.433 4.382 20 0 EIADMP CCOc1ccc([C@@H]2CCC[N@H+]2C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168392695 1036853184 /nfs/dbraw/zinc/85/31/84/1036853184.db2.gz SBRLOHALUCJXJE-NRFANRHFSA-N 2 1 328.500 4.097 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNCc3ccc(Cl)o3)cc2)C1 ZINC000589832004 1036878637 /nfs/dbraw/zinc/87/86/37/1036878637.db2.gz ULZRYFUVYBXSLB-HNNXBMFYSA-N 2 1 332.875 4.455 20 0 EIADMP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(Cl)o3)cc2)C1 ZINC000589832004 1036878638 /nfs/dbraw/zinc/87/86/38/1036878638.db2.gz ULZRYFUVYBXSLB-HNNXBMFYSA-N 2 1 332.875 4.455 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc(Cl)o3)cc2)C1 ZINC000589832004 1036878640 /nfs/dbraw/zinc/87/86/40/1036878640.db2.gz ULZRYFUVYBXSLB-HNNXBMFYSA-N 2 1 332.875 4.455 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C/C=C/c1ccncc1 ZINC000486944395 1036898917 /nfs/dbraw/zinc/89/89/17/1036898917.db2.gz PMNQBJUKCOWGFW-FNQPIQQGSA-N 2 1 335.495 4.259 20 0 EIADMP Cc1ccsc1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499147374 1036926159 /nfs/dbraw/zinc/92/61/59/1036926159.db2.gz PXPXOHKJJSHVOD-REPLKXPHSA-N 2 1 326.509 4.342 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311088390 1037080426 /nfs/dbraw/zinc/08/04/26/1037080426.db2.gz NJNYOPFCJYHFPH-LVCYWYKZSA-N 2 1 340.486 4.257 20 0 EIADMP COCC[C@H]([NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccco1 ZINC000272536349 1037215117 /nfs/dbraw/zinc/21/51/17/1037215117.db2.gz JXAXVJXMHKDYAQ-KXBFYZLASA-N 2 1 339.439 4.202 20 0 EIADMP c1cc2[nH+]ccc(NCC3CC[NH+](Cc4ccncc4)CC3)c2s1 ZINC000664283942 1037260983 /nfs/dbraw/zinc/26/09/83/1037260983.db2.gz YPFKQEZRMMYHHD-UHFFFAOYSA-N 2 1 338.480 4.015 20 0 EIADMP CC(C)(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168417414 1037354489 /nfs/dbraw/zinc/35/44/89/1037354489.db2.gz PLMHUOKVEAGBSI-VAMGGRTRSA-N 2 1 332.507 4.301 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)CCc1cc(Cl)ccc1Cl ZINC000488160909 1037380957 /nfs/dbraw/zinc/38/09/57/1037380957.db2.gz AAXROFUGTOQTPB-UHFFFAOYSA-N 2 1 326.271 4.063 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)CCc1cc(Cl)ccc1Cl ZINC000488160909 1037380982 /nfs/dbraw/zinc/38/09/82/1037380982.db2.gz AAXROFUGTOQTPB-UHFFFAOYSA-N 2 1 326.271 4.063 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000760831243 1037446596 /nfs/dbraw/zinc/44/65/96/1037446596.db2.gz XJUJRWLDEMORDH-LJQANCHMSA-N 2 1 325.500 4.222 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)CS1 ZINC000488420094 1037576125 /nfs/dbraw/zinc/57/61/25/1037576125.db2.gz IAGOROWBFALXAD-BQFCYCMXSA-N 2 1 338.586 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CS1 ZINC000488420094 1037576147 /nfs/dbraw/zinc/57/61/47/1037576147.db2.gz IAGOROWBFALXAD-BQFCYCMXSA-N 2 1 338.586 4.080 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000573596131 1037596581 /nfs/dbraw/zinc/59/65/81/1037596581.db2.gz CXUZOHUXCCXLCQ-IUYQLWOBSA-N 2 1 340.433 4.430 20 0 EIADMP C[C@H]([NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000488551028 1037663345 /nfs/dbraw/zinc/66/33/45/1037663345.db2.gz ZOHQJIUJKFPPCB-LEAZDLGRSA-N 2 1 346.584 4.407 20 0 EIADMP CC[C@@H](C(=O)Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)[NH+](CC)CC ZINC000605425138 1037779502 /nfs/dbraw/zinc/77/95/02/1037779502.db2.gz WFQOCXCEMFBPLS-XLIONFOSSA-N 2 1 345.531 4.120 20 0 EIADMP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000422854971 1037847298 /nfs/dbraw/zinc/84/72/98/1037847298.db2.gz BNYLTAPPZRQWLB-WCQYABFASA-N 2 1 332.517 4.015 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCc3cc(Br)ccc32)c2ccccc21 ZINC000422935981 1037872791 /nfs/dbraw/zinc/87/27/91/1037872791.db2.gz LMCZVGPQUQZCLY-KURKYZTESA-N 2 1 343.268 4.171 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)c1cccc(OC(F)(F)F)c1 ZINC000422928648 1037873719 /nfs/dbraw/zinc/87/37/19/1037873719.db2.gz LVGQDLNBRIVMCG-JECHBYEQSA-N 2 1 336.357 4.381 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H](Cc2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423127487 1037974528 /nfs/dbraw/zinc/97/45/28/1037974528.db2.gz UBKOBEJXPQQDNE-OLMNPRSZSA-N 2 1 334.385 4.142 20 0 EIADMP COCCC[C@@H](C[NH2+][C@@H](C)c1c[nH+]ccc1N)c1ccc(Cl)cc1 ZINC000423108395 1037984981 /nfs/dbraw/zinc/98/49/81/1037984981.db2.gz RDOQSNXLDIRKOU-HOCLYGCPSA-N 2 1 347.890 4.009 20 0 EIADMP CCOc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1Cl ZINC000423110473 1037988215 /nfs/dbraw/zinc/98/82/15/1037988215.db2.gz UTPCLYPIKPRQKW-PKOBYXMFSA-N 2 1 344.886 4.322 20 0 EIADMP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423146210 1038000140 /nfs/dbraw/zinc/00/01/40/1038000140.db2.gz OPPUROHPGBOIAQ-OYRIPWCXSA-N 2 1 328.887 4.134 20 0 EIADMP Cc1sc(C2([NH2+][C@@H](C)C[C@@H](C)[NH3+])CCC2)nc1-c1ccccc1F ZINC000423144225 1038018217 /nfs/dbraw/zinc/01/82/17/1038018217.db2.gz GJRFNVZILBAVFD-OLZOCXBDSA-N 2 1 347.503 4.352 20 0 EIADMP [NH3+]C[C@H]([NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C1CC1 ZINC000423284208 1038091103 /nfs/dbraw/zinc/09/11/03/1038091103.db2.gz WQEHQIBQDKDWQT-HOCLYGCPSA-N 2 1 347.915 4.168 20 0 EIADMP C[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423311346 1038107782 /nfs/dbraw/zinc/10/77/82/1038107782.db2.gz BWKODGGMDFRMSG-ISVAXAHUSA-N 2 1 340.311 4.112 20 0 EIADMP C[C@H]([NH2+][C@H]1CCCc2cc(N)ccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000423362804 1038177807 /nfs/dbraw/zinc/17/78/07/1038177807.db2.gz YGTOHOUOXBFCQJ-NYDSKATKSA-N 2 1 349.522 4.146 20 0 EIADMP C[C@H](O)[C@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1ccccc1 ZINC000658355916 1038340127 /nfs/dbraw/zinc/34/01/27/1038340127.db2.gz IQKQUUZYOVBTMP-PXNSSMCTSA-N 2 1 346.559 4.377 20 0 EIADMP Cc1noc(C)c1[C@@H](C)[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000924965669 1038368695 /nfs/dbraw/zinc/36/86/95/1038368695.db2.gz YKZAKHPFDMBPKI-MRXNPFEDSA-N 2 1 341.499 4.374 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]CCC[N@H+](C)C(C)C)cc1 ZINC000608053365 1038522633 /nfs/dbraw/zinc/52/26/33/1038522633.db2.gz LWDHNXTWGMRFSC-UHFFFAOYSA-N 2 1 326.484 4.182 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]CCC[N@@H+](C)C(C)C)cc1 ZINC000608053365 1038522813 /nfs/dbraw/zinc/52/28/13/1038522813.db2.gz LWDHNXTWGMRFSC-UHFFFAOYSA-N 2 1 326.484 4.182 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(c3ccc(C(C)(C)C)cc3)CC2)CC[N@@H+]1C ZINC000151078297 1038634868 /nfs/dbraw/zinc/63/48/68/1038634868.db2.gz CLVGUPCZOWJHMD-XLIONFOSSA-N 2 1 343.559 4.025 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CCN(c3ccc(C(C)(C)C)cc3)CC2)CC[N@H+]1C ZINC000151078297 1038634874 /nfs/dbraw/zinc/63/48/74/1038634874.db2.gz CLVGUPCZOWJHMD-XLIONFOSSA-N 2 1 343.559 4.025 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H](Cc1ccncc1)c1cccs1 ZINC000424266214 1038763374 /nfs/dbraw/zinc/76/33/74/1038763374.db2.gz WPYQMWFMOSTQSA-HKUYNNGSSA-N 2 1 343.540 4.281 20 0 EIADMP Cc1c(Cl)c(C[N@@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)nc2ccccc12 ZINC000424289146 1038769238 /nfs/dbraw/zinc/76/92/38/1038769238.db2.gz LTBVRURZFFSRAT-CQSZACIVSA-N 2 1 343.902 4.161 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000539050703 1038797668 /nfs/dbraw/zinc/79/76/68/1038797668.db2.gz QBZXBNXLVIXRNG-JKSUJKDBSA-N 2 1 340.458 4.307 20 0 EIADMP CC(C)[C@@H](CCc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000480770557 1038808466 /nfs/dbraw/zinc/80/84/66/1038808466.db2.gz OOVQGMGCPSIRMN-FXAWDEMLSA-N 2 1 334.935 4.371 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@H](C)C1 ZINC000539093786 1038834144 /nfs/dbraw/zinc/83/41/44/1038834144.db2.gz TWODIFIATSLHCX-WIYYLYMNSA-N 2 1 338.495 4.052 20 0 EIADMP Brc1ccc(C2([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CCC2)cc1 ZINC000252734722 1038863322 /nfs/dbraw/zinc/86/33/22/1038863322.db2.gz ZEUIZNQQZUQMGP-SJORKVTESA-N 2 1 349.316 4.045 20 0 EIADMP C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000480898881 1038866484 /nfs/dbraw/zinc/86/64/84/1038866484.db2.gz OEVRLNLJTOIYHI-HUUCEWRRSA-N 2 1 348.437 4.317 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC001168328140 1038934924 /nfs/dbraw/zinc/93/49/24/1038934924.db2.gz XCHGYKVUVIIETQ-ZLPCBKJTSA-N 2 1 340.433 4.368 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cnn(C(C)(C)C)c2)CC1 ZINC000537619447 1038943207 /nfs/dbraw/zinc/94/32/07/1038943207.db2.gz DCAMSRZJTZGCCO-GOSISDBHSA-N 2 1 346.563 4.115 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2oc3ccc(OC)cc3c2C)C1 ZINC000481019940 1038960499 /nfs/dbraw/zinc/96/04/99/1038960499.db2.gz GWVZSYGTDQAYPF-HZPDHXFCSA-N 2 1 330.472 4.132 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2oc3ccc(OC)cc3c2C)C1 ZINC000481019940 1038960531 /nfs/dbraw/zinc/96/05/31/1038960531.db2.gz GWVZSYGTDQAYPF-HZPDHXFCSA-N 2 1 330.472 4.132 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccccc2Br)C1 ZINC000481042586 1038972141 /nfs/dbraw/zinc/97/21/41/1038972141.db2.gz TUIWILSVCXFCBL-WMLDXEAASA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccccc2Br)C1 ZINC000481042586 1038972167 /nfs/dbraw/zinc/97/21/67/1038972167.db2.gz TUIWILSVCXFCBL-WMLDXEAASA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000481041002 1038989201 /nfs/dbraw/zinc/98/92/01/1038989201.db2.gz RXZBAZFQRMVTPS-LSDHHAIUSA-N 2 1 342.499 4.426 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2cccc(Br)c21 ZINC000119706661 1038993039 /nfs/dbraw/zinc/99/30/39/1038993039.db2.gz ZNGGJANLINMNIY-SJCJKPOMSA-N 2 1 349.316 4.214 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)[C@H]2CCC[C@H]21 ZINC000552052887 1039104313 /nfs/dbraw/zinc/10/43/13/1039104313.db2.gz IUMLOVMOTVXYCR-OWCLPIDISA-N 2 1 326.937 4.187 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(Cl)c2F)CCCC1 ZINC000477861514 1039143208 /nfs/dbraw/zinc/14/32/08/1039143208.db2.gz NOAWQAHFHZGAKD-WMLDXEAASA-N 2 1 338.898 4.221 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000481298672 1039235283 /nfs/dbraw/zinc/23/52/83/1039235283.db2.gz INBDZTSAJOQWME-UTKZUKDTSA-N 2 1 344.449 4.180 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)C1 ZINC000481324777 1039294559 /nfs/dbraw/zinc/29/45/59/1039294559.db2.gz RXLGEGRTTKDYGV-PKTZIBPZSA-N 2 1 336.523 4.162 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(F)cc2C(F)(F)F)C[C@H]1C ZINC000552290460 1039343188 /nfs/dbraw/zinc/34/31/88/1039343188.db2.gz JSZPCAZOOMYOTK-DOMZBBRYSA-N 2 1 332.385 4.149 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@H]1C ZINC000552290460 1039343212 /nfs/dbraw/zinc/34/32/12/1039343212.db2.gz JSZPCAZOOMYOTK-DOMZBBRYSA-N 2 1 332.385 4.149 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@H]1C ZINC000552290460 1039343234 /nfs/dbraw/zinc/34/32/34/1039343234.db2.gz JSZPCAZOOMYOTK-DOMZBBRYSA-N 2 1 332.385 4.149 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@H]1C ZINC000552290460 1039343250 /nfs/dbraw/zinc/34/32/50/1039343250.db2.gz JSZPCAZOOMYOTK-DOMZBBRYSA-N 2 1 332.385 4.149 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@H]1C ZINC000552290460 1039343274 /nfs/dbraw/zinc/34/32/74/1039343274.db2.gz JSZPCAZOOMYOTK-DOMZBBRYSA-N 2 1 332.385 4.149 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(N[C@@H]2CC[NH+](C)[C@@H]3CCC[C@@H]32)cc1 ZINC000552276352 1039354737 /nfs/dbraw/zinc/35/47/37/1039354737.db2.gz UNCGNKJUYDYSCW-BRKWEVRTSA-N 2 1 341.543 4.346 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(N[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)cc1 ZINC000552276352 1039354750 /nfs/dbraw/zinc/35/47/50/1039354750.db2.gz UNCGNKJUYDYSCW-BRKWEVRTSA-N 2 1 341.543 4.346 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(N[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)cc1 ZINC000552276352 1039354759 /nfs/dbraw/zinc/35/47/59/1039354759.db2.gz UNCGNKJUYDYSCW-BRKWEVRTSA-N 2 1 341.543 4.346 20 0 EIADMP CCC[C@@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CCOC)c1ccccc1 ZINC000552392093 1039443456 /nfs/dbraw/zinc/44/34/56/1039443456.db2.gz GGYJHKJKEKNJBM-CCDCCJRHSA-N 2 1 344.543 4.144 20 0 EIADMP CCC[C@@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2CCOC)c1ccccc1 ZINC000552392093 1039443480 /nfs/dbraw/zinc/44/34/80/1039443480.db2.gz GGYJHKJKEKNJBM-CCDCCJRHSA-N 2 1 344.543 4.144 20 0 EIADMP CCC[C@@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CCOC)c1ccccc1 ZINC000552392093 1039443502 /nfs/dbraw/zinc/44/35/02/1039443502.db2.gz GGYJHKJKEKNJBM-CCDCCJRHSA-N 2 1 344.543 4.144 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H](c2ccc(F)cc2)CC1 ZINC000481513512 1039537585 /nfs/dbraw/zinc/53/75/85/1039537585.db2.gz FLIUKSXAJFFZKU-SFHVURJKSA-N 2 1 329.463 4.381 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H](c2ccc(F)cc2)CC1 ZINC000481513512 1039537603 /nfs/dbraw/zinc/53/76/03/1039537603.db2.gz FLIUKSXAJFFZKU-SFHVURJKSA-N 2 1 329.463 4.381 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537647595 1039805378 /nfs/dbraw/zinc/80/53/78/1039805378.db2.gz UGDBPQQKVSLKMY-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537647595 1039805382 /nfs/dbraw/zinc/80/53/82/1039805382.db2.gz UGDBPQQKVSLKMY-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000430110655 1039850578 /nfs/dbraw/zinc/85/05/78/1039850578.db2.gz ZSFFOHDWTDLZHQ-MJGOQNOKSA-N 2 1 336.470 4.122 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000430110655 1039850580 /nfs/dbraw/zinc/85/05/80/1039850580.db2.gz ZSFFOHDWTDLZHQ-MJGOQNOKSA-N 2 1 336.470 4.122 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000430110655 1039850585 /nfs/dbraw/zinc/85/05/85/1039850585.db2.gz ZSFFOHDWTDLZHQ-MJGOQNOKSA-N 2 1 336.470 4.122 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000430110655 1039850587 /nfs/dbraw/zinc/85/05/87/1039850587.db2.gz ZSFFOHDWTDLZHQ-MJGOQNOKSA-N 2 1 336.470 4.122 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000430115483 1039851627 /nfs/dbraw/zinc/85/16/27/1039851627.db2.gz BFGYMFMUZONHCK-OTMARIDSSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000430115483 1039851629 /nfs/dbraw/zinc/85/16/29/1039851629.db2.gz BFGYMFMUZONHCK-OTMARIDSSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000430115483 1039851634 /nfs/dbraw/zinc/85/16/34/1039851634.db2.gz BFGYMFMUZONHCK-OTMARIDSSA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000430115483 1039851638 /nfs/dbraw/zinc/85/16/38/1039851638.db2.gz BFGYMFMUZONHCK-OTMARIDSSA-N 2 1 338.417 4.136 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCCNc2cccc(F)c2)C[C@@H]1c1ccccc1 ZINC000551170355 1040014475 /nfs/dbraw/zinc/01/44/75/1040014475.db2.gz SVFBJGBZJQMLIK-LEWJYISDSA-N 2 1 341.474 4.053 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCNc2cccc(F)c2)C[C@@H]1c1ccccc1 ZINC000551170355 1040014494 /nfs/dbraw/zinc/01/44/94/1040014494.db2.gz SVFBJGBZJQMLIK-LEWJYISDSA-N 2 1 341.474 4.053 20 0 EIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551186151 1040033134 /nfs/dbraw/zinc/03/31/34/1040033134.db2.gz FFGAVOSBIPYIAO-AWEZNQCLSA-N 2 1 349.931 4.285 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551186151 1040033145 /nfs/dbraw/zinc/03/31/45/1040033145.db2.gz FFGAVOSBIPYIAO-AWEZNQCLSA-N 2 1 349.931 4.285 20 0 EIADMP C[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1ccccc1 ZINC000482219340 1040078276 /nfs/dbraw/zinc/07/82/76/1040078276.db2.gz BHCAFWLQTMUHAY-FQEVSTJZSA-N 2 1 336.523 4.162 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)[C@@]1(C)CCCO1 ZINC000551268554 1040134811 /nfs/dbraw/zinc/13/48/11/1040134811.db2.gz XYHOSQDLBSAECN-LVCYWYKZSA-N 2 1 330.516 4.108 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000551273213 1040140770 /nfs/dbraw/zinc/14/07/70/1040140770.db2.gz VFVYEWZFCSNSIK-PVSGBFIBSA-N 2 1 334.507 4.290 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000482360660 1040200339 /nfs/dbraw/zinc/20/03/39/1040200339.db2.gz PWNPKNDLFDULPH-HUUCEWRRSA-N 2 1 344.421 4.356 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000482434326 1040242093 /nfs/dbraw/zinc/24/20/93/1040242093.db2.gz FNKLMMJLDYXELO-MJGOQNOKSA-N 2 1 326.459 4.041 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)ccc1F ZINC000482455946 1040257133 /nfs/dbraw/zinc/25/71/33/1040257133.db2.gz YUWCFVCFFNYDJI-WMZOPIPTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)ccc1F ZINC000482455946 1040257147 /nfs/dbraw/zinc/25/71/47/1040257147.db2.gz YUWCFVCFFNYDJI-WMZOPIPTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1F ZINC000482448464 1040257693 /nfs/dbraw/zinc/25/76/93/1040257693.db2.gz ODIXJCIWRLEVIY-AEFFLSMTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1F ZINC000482448464 1040257707 /nfs/dbraw/zinc/25/77/07/1040257707.db2.gz ODIXJCIWRLEVIY-AEFFLSMTSA-N 2 1 344.449 4.180 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)s1 ZINC000482462792 1040272150 /nfs/dbraw/zinc/27/21/50/1040272150.db2.gz XMIQLEIDEPGICQ-MJGOQNOKSA-N 2 1 328.525 4.272 20 0 EIADMP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCc2c1cc(Br)cc2Cl ZINC000535509425 1040312367 /nfs/dbraw/zinc/31/23/67/1040312367.db2.gz ZRVGIZTWZSSSTH-ZUZCIYMTSA-N 2 1 345.712 4.020 20 0 EIADMP FC(F)(F)Sc1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168356677 1040375990 /nfs/dbraw/zinc/37/59/90/1040375990.db2.gz SORKDHXQFGUETA-UHFFFAOYSA-N 2 1 344.446 4.263 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2Sc2ccccc2)CC[N@@H+]1C ZINC000482639581 1040403364 /nfs/dbraw/zinc/40/33/64/1040403364.db2.gz DRJZPEZXEKOMTC-WMZOPIPTSA-N 2 1 326.509 4.410 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2Sc2ccccc2)CC[N@H+]1C ZINC000482639581 1040403370 /nfs/dbraw/zinc/40/33/70/1040403370.db2.gz DRJZPEZXEKOMTC-WMZOPIPTSA-N 2 1 326.509 4.410 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc3ccncc3s2)CC1 ZINC000667501858 1040411993 /nfs/dbraw/zinc/41/19/93/1040411993.db2.gz NFFIOOSOTFULNL-UHFFFAOYSA-N 2 1 331.529 4.240 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000668147080 1040538025 /nfs/dbraw/zinc/53/80/25/1040538025.db2.gz ZCVDXXCQYKVRKR-DFNIBXOVSA-N 2 1 341.524 4.176 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000668147080 1040538039 /nfs/dbraw/zinc/53/80/39/1040538039.db2.gz ZCVDXXCQYKVRKR-DFNIBXOVSA-N 2 1 341.524 4.176 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000668147080 1040538058 /nfs/dbraw/zinc/53/80/58/1040538058.db2.gz ZCVDXXCQYKVRKR-DFNIBXOVSA-N 2 1 341.524 4.176 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000668147080 1040538073 /nfs/dbraw/zinc/53/80/73/1040538073.db2.gz ZCVDXXCQYKVRKR-DFNIBXOVSA-N 2 1 341.524 4.176 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](C)CC[C@H]32)cc1 ZINC000668172370 1040604628 /nfs/dbraw/zinc/60/46/28/1040604628.db2.gz MCQRXBFJLKWDCD-RBUKOAKNSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000668172370 1040604635 /nfs/dbraw/zinc/60/46/35/1040604635.db2.gz MCQRXBFJLKWDCD-RBUKOAKNSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@H]32)cc1 ZINC000668172370 1040604641 /nfs/dbraw/zinc/60/46/41/1040604641.db2.gz MCQRXBFJLKWDCD-RBUKOAKNSA-N 2 1 341.524 4.035 20 0 EIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCc2ccc(F)cc21 ZINC000483088706 1040697529 /nfs/dbraw/zinc/69/75/29/1040697529.db2.gz LILZWBICRUBQOU-XMSQKQJNSA-N 2 1 338.470 4.267 20 0 EIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CCc2ccc(F)cc21 ZINC000483088706 1040697541 /nfs/dbraw/zinc/69/75/41/1040697541.db2.gz LILZWBICRUBQOU-XMSQKQJNSA-N 2 1 338.470 4.267 20 0 EIADMP C[C@@]1(C[NH2+]Cc2cccc3cnccc32)CC[N@@H+](Cc2ccccc2)C1 ZINC000311581912 1040734163 /nfs/dbraw/zinc/73/41/63/1040734163.db2.gz DAEGVTZCQOBTKN-QHCPKHFHSA-N 2 1 345.490 4.237 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3cc(C)c(F)c(C)c3)CC2)[nH+]1 ZINC000483160749 1040747912 /nfs/dbraw/zinc/74/79/12/1040747912.db2.gz ZYOVPLNVNVMBAM-QGZVFWFLSA-N 2 1 341.474 4.466 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000483170760 1040753620 /nfs/dbraw/zinc/75/36/20/1040753620.db2.gz ABWYIOOICXBBPA-XCRHUMRWSA-N 2 1 340.433 4.476 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000483170760 1040753627 /nfs/dbraw/zinc/75/36/27/1040753627.db2.gz ABWYIOOICXBBPA-XCRHUMRWSA-N 2 1 340.433 4.476 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(F)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000539816871 1040808851 /nfs/dbraw/zinc/80/88/51/1040808851.db2.gz BKSUWNBVUFUJND-BLLLJJGKSA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(F)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000539816871 1040808853 /nfs/dbraw/zinc/80/88/53/1040808853.db2.gz BKSUWNBVUFUJND-BLLLJJGKSA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(F)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000539816871 1040808854 /nfs/dbraw/zinc/80/88/54/1040808854.db2.gz BKSUWNBVUFUJND-BLLLJJGKSA-N 2 1 332.385 4.007 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3c(O)cccc32)CC1 ZINC000483431999 1040857186 /nfs/dbraw/zinc/85/71/86/1040857186.db2.gz FWASCXAQGRWKJI-MAODMQOUSA-N 2 1 342.527 4.402 20 0 EIADMP c1c2ccncc2sc1C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000667592772 1040865443 /nfs/dbraw/zinc/86/54/43/1040865443.db2.gz DSBKZYCJCDUTLP-QGZVFWFLSA-N 2 1 343.540 4.384 20 0 EIADMP c1c2ccncc2sc1C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000667592772 1040865451 /nfs/dbraw/zinc/86/54/51/1040865451.db2.gz DSBKZYCJCDUTLP-QGZVFWFLSA-N 2 1 343.540 4.384 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@H](C)[N@@H+]2CCC[C@@H](C)C2)C1 ZINC000467341013 1040903587 /nfs/dbraw/zinc/90/35/87/1040903587.db2.gz BJNMISQDZKNWBF-MDNKFWRPSA-N 2 1 329.532 4.126 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@H](C)[N@H+]2CCC[C@@H](C)C2)C1 ZINC000467341013 1040903606 /nfs/dbraw/zinc/90/36/06/1040903606.db2.gz BJNMISQDZKNWBF-MDNKFWRPSA-N 2 1 329.532 4.126 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000537964910 1040935256 /nfs/dbraw/zinc/93/52/56/1040935256.db2.gz KGLPODONKJGHIU-RYUDHWBXSA-N 2 1 326.271 4.485 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)C1CC(F)(F)C1 ZINC000898519773 1040975116 /nfs/dbraw/zinc/97/51/16/1040975116.db2.gz RBKNZMMVEHXVCZ-PHXBYCTMSA-N 2 1 348.481 4.311 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000483734611 1040988330 /nfs/dbraw/zinc/98/83/30/1040988330.db2.gz WERCEWPDBOMWPZ-BMFZPTHFSA-N 2 1 326.937 4.283 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000483734611 1040988357 /nfs/dbraw/zinc/98/83/57/1040988357.db2.gz WERCEWPDBOMWPZ-BMFZPTHFSA-N 2 1 326.937 4.283 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccncc2Cl)CC1)CC(C)C ZINC000537998320 1040998457 /nfs/dbraw/zinc/99/84/57/1040998457.db2.gz PEOKHJYEGGHTGB-UHFFFAOYSA-N 2 1 337.939 4.315 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000483755956 1041000898 /nfs/dbraw/zinc/00/08/98/1041000898.db2.gz QCMNEYBSHUVOFM-BJLQDIEVSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000483755956 1041000904 /nfs/dbraw/zinc/00/09/04/1041000904.db2.gz QCMNEYBSHUVOFM-BJLQDIEVSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)Cc1cccs1 ZINC000483760326 1041003236 /nfs/dbraw/zinc/00/32/36/1041003236.db2.gz WSHSLUSKWHWXFS-WAOWUJCRSA-N 2 1 342.552 4.427 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)Cc1cccs1 ZINC000483760326 1041003244 /nfs/dbraw/zinc/00/32/44/1041003244.db2.gz WSHSLUSKWHWXFS-WAOWUJCRSA-N 2 1 342.552 4.427 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CCC[N@@H+](C)C(C)C ZINC000480176386 1041038939 /nfs/dbraw/zinc/03/89/39/1041038939.db2.gz DDMHWXZXZPMEMI-HNNXBMFYSA-N 2 1 331.529 4.499 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000480176386 1041038954 /nfs/dbraw/zinc/03/89/54/1041038954.db2.gz DDMHWXZXZPMEMI-HNNXBMFYSA-N 2 1 331.529 4.499 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000538116112 1041069618 /nfs/dbraw/zinc/06/96/18/1041069618.db2.gz DZHWNKNFWBEJFP-PKOBYXMFSA-N 2 1 328.525 4.099 20 0 EIADMP 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 1041082490 /nfs/dbraw/zinc/08/24/90/1041082490.db2.gz PKUMMOQJYBTHLZ-GZMRBYKVSA-N 2 1 340.433 4.270 20 0 EIADMP 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 1041084231 /nfs/dbraw/zinc/08/42/31/1041084231.db2.gz PKUMMOQJYBTHLZ-AQDKSWOWSA-N 2 1 340.433 4.270 20 0 EIADMP CC[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)s1 ZINC000540172346 1041217239 /nfs/dbraw/zinc/21/72/39/1041217239.db2.gz AHHVLYODOODIHU-QLFBSQMISA-N 2 1 344.952 4.332 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCC1 ZINC000540163763 1041226163 /nfs/dbraw/zinc/22/61/63/1041226163.db2.gz JQNRLHHFLQVDPH-GUYCJALGSA-N 2 1 341.326 4.345 20 0 EIADMP Clc1sccc1C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000480341783 1041231375 /nfs/dbraw/zinc/23/13/75/1041231375.db2.gz DEDFMPIVSGNYNA-CYBMUJFWSA-N 2 1 340.945 4.465 20 0 EIADMP Clc1sccc1C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000480341783 1041231395 /nfs/dbraw/zinc/23/13/95/1041231395.db2.gz DEDFMPIVSGNYNA-CYBMUJFWSA-N 2 1 340.945 4.465 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)C[C@@H]1C ZINC000667664403 1041233264 /nfs/dbraw/zinc/23/32/64/1041233264.db2.gz KDPCUOVIJUOZTH-HNAYVOBHSA-N 2 1 343.540 4.423 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)C[C@@H]1C ZINC000667664403 1041233285 /nfs/dbraw/zinc/23/32/85/1041233285.db2.gz KDPCUOVIJUOZTH-HNAYVOBHSA-N 2 1 343.540 4.423 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3scnc3C)cc2)C[C@@H]1C ZINC000667664403 1041233302 /nfs/dbraw/zinc/23/33/02/1041233302.db2.gz KDPCUOVIJUOZTH-HNAYVOBHSA-N 2 1 343.540 4.423 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(-c3scnc3C)cc2)C[C@@H]1C ZINC000667664403 1041233316 /nfs/dbraw/zinc/23/33/16/1041233316.db2.gz KDPCUOVIJUOZTH-HNAYVOBHSA-N 2 1 343.540 4.423 20 0 EIADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc[nH+]c2cc(F)ccc21 ZINC000463063264 1041296581 /nfs/dbraw/zinc/29/65/81/1041296581.db2.gz GPXDTBCOAXLMFE-GOSISDBHSA-N 2 1 349.453 4.332 20 0 EIADMP COc1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)ccc1C ZINC000463071235 1041316289 /nfs/dbraw/zinc/31/62/89/1041316289.db2.gz WJLMUXGXMMSYDA-WIYYLYMNSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1C ZINC000463071235 1041316297 /nfs/dbraw/zinc/31/62/97/1041316297.db2.gz WJLMUXGXMMSYDA-WIYYLYMNSA-N 2 1 338.495 4.146 20 0 EIADMP C[C@@H](Cc1ccccc1F)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463076175 1041321274 /nfs/dbraw/zinc/32/12/74/1041321274.db2.gz HNCNQRGJISZVDS-SFHVURJKSA-N 2 1 340.486 4.053 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000538408850 1041328169 /nfs/dbraw/zinc/32/81/69/1041328169.db2.gz UKAKJSONDKBXFK-MRXNPFEDSA-N 2 1 327.299 4.166 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCOC2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000463140787 1041359916 /nfs/dbraw/zinc/35/99/16/1041359916.db2.gz IILQDPBXVWTRJA-PZJWPPBQSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCOC2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000463140787 1041359929 /nfs/dbraw/zinc/35/99/29/1041359929.db2.gz IILQDPBXVWTRJA-PZJWPPBQSA-N 2 1 344.543 4.369 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)C(F)(F)F ZINC000554722033 1041363570 /nfs/dbraw/zinc/36/35/70/1041363570.db2.gz DJVVFMKVCLMZRO-YESZJQIVSA-N 2 1 340.433 4.075 20 0 EIADMP CCCCn1cc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)c(C)n1 ZINC000540318197 1041364828 /nfs/dbraw/zinc/36/48/28/1041364828.db2.gz NBTPLQABPBSWCW-DYESRHJHSA-N 2 1 346.563 4.124 20 0 EIADMP CCCCn1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)c(C)n1 ZINC000540317773 1041365081 /nfs/dbraw/zinc/36/50/81/1041365081.db2.gz FMTUXAMLDOYUGC-UTKZUKDTSA-N 2 1 346.563 4.124 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000463141438 1041375348 /nfs/dbraw/zinc/37/53/48/1041375348.db2.gz KCGUPNLZPBZXAY-UTKZUKDTSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2)CC[N@H+]1Cc1ccccc1 ZINC000463141438 1041375354 /nfs/dbraw/zinc/37/53/54/1041375354.db2.gz KCGUPNLZPBZXAY-UTKZUKDTSA-N 2 1 326.459 4.011 20 0 EIADMP CCc1ccc(C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)s1 ZINC000463140257 1041375605 /nfs/dbraw/zinc/37/56/05/1041375605.db2.gz KMSNFEOUQFFVHV-UHFFFAOYSA-N 2 1 346.515 4.246 20 0 EIADMP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463189773 1041406642 /nfs/dbraw/zinc/40/66/42/1041406642.db2.gz KYZRVALLUCBWLO-FKVLARQCSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463189773 1041406648 /nfs/dbraw/zinc/40/66/48/1041406648.db2.gz KYZRVALLUCBWLO-FKVLARQCSA-N 2 1 344.543 4.080 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000463194979 1041410082 /nfs/dbraw/zinc/41/00/82/1041410082.db2.gz XRJIQWGTOXKTKO-SESVDKBCSA-N 2 1 332.532 4.080 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000463194979 1041410084 /nfs/dbraw/zinc/41/00/84/1041410084.db2.gz XRJIQWGTOXKTKO-SESVDKBCSA-N 2 1 332.532 4.080 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)[C@@H](C)c1ccccc1 ZINC000463194921 1041410177 /nfs/dbraw/zinc/41/01/77/1041410177.db2.gz XBPCBQVNYBGVGH-UXHICEINSA-N 2 1 336.523 4.475 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cc(F)ccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463187842 1041417596 /nfs/dbraw/zinc/41/75/96/1041417596.db2.gz DYLNNYMVHDUEAC-JXFKEZNVSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cc(F)ccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463187842 1041417610 /nfs/dbraw/zinc/41/76/10/1041417610.db2.gz DYLNNYMVHDUEAC-JXFKEZNVSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000287312958 1041421596 /nfs/dbraw/zinc/42/15/96/1041421596.db2.gz LIMKKRDSAWGCDW-SOLBZPMBSA-N 2 1 325.456 4.007 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000287312958 1041421602 /nfs/dbraw/zinc/42/16/02/1041421602.db2.gz LIMKKRDSAWGCDW-SOLBZPMBSA-N 2 1 325.456 4.007 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)CCC2 ZINC000480612195 1041423243 /nfs/dbraw/zinc/42/32/43/1041423243.db2.gz OCCNKNBYHXUHJF-HZPDHXFCSA-N 2 1 335.561 4.185 20 0 EIADMP CCc1nc2c(s1)[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)CCC2 ZINC000480612190 1041424067 /nfs/dbraw/zinc/42/40/67/1041424067.db2.gz OCCNKNBYHXUHJF-CVEARBPZSA-N 2 1 335.561 4.185 20 0 EIADMP C[NH+]1CCC(NCc2ccccc2Oc2ccc(F)cc2Cl)CC1 ZINC000461402634 1041429991 /nfs/dbraw/zinc/42/99/91/1041429991.db2.gz NLEUCMTVSBESQG-UHFFFAOYSA-N 2 1 348.849 4.455 20 0 EIADMP Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000924668090 1041439402 /nfs/dbraw/zinc/43/94/02/1041439402.db2.gz OIPCMYGZFPIQCS-HOTGVXAUSA-N 2 1 341.499 4.374 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000463262586 1041458872 /nfs/dbraw/zinc/45/88/72/1041458872.db2.gz ZKCOIRDQSKPOTC-XMSQKQJNSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000463262586 1041458878 /nfs/dbraw/zinc/45/88/78/1041458878.db2.gz ZKCOIRDQSKPOTC-XMSQKQJNSA-N 2 1 347.506 4.353 20 0 EIADMP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@H](COCc1ccccc1)c1ccccc1 ZINC000540445426 1041461112 /nfs/dbraw/zinc/46/11/12/1041461112.db2.gz NJFDBDIAKRVGJV-FGZHOGPDSA-N 2 1 338.495 4.018 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@H](COCc1ccccc1)c1ccccc1 ZINC000540445426 1041461116 /nfs/dbraw/zinc/46/11/16/1041461116.db2.gz NJFDBDIAKRVGJV-FGZHOGPDSA-N 2 1 338.495 4.018 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)o1 ZINC000538719183 1041489461 /nfs/dbraw/zinc/48/94/61/1041489461.db2.gz QOFJBWBKYQYVHN-KRWDZBQOSA-N 2 1 342.458 4.312 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)o1 ZINC000538719183 1041489473 /nfs/dbraw/zinc/48/94/73/1041489473.db2.gz QOFJBWBKYQYVHN-KRWDZBQOSA-N 2 1 342.458 4.312 20 0 EIADMP CC[NH+](CC)CCCC1CC[NH+](Cc2ncc(C(C)(C)C)o2)CC1 ZINC000541090446 1041807296 /nfs/dbraw/zinc/80/72/96/1041807296.db2.gz SWQHZKRAHIWODY-UHFFFAOYSA-N 2 1 335.536 4.306 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000516932497 1041815396 /nfs/dbraw/zinc/81/53/96/1041815396.db2.gz RDAGSALKPOOJTC-CQSZACIVSA-N 2 1 337.492 4.135 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000516932497 1041815397 /nfs/dbraw/zinc/81/53/97/1041815397.db2.gz RDAGSALKPOOJTC-CQSZACIVSA-N 2 1 337.492 4.135 20 0 EIADMP C[C@H](C[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000437982498 1042003292 /nfs/dbraw/zinc/00/32/92/1042003292.db2.gz CNOGXOCTUSXDIB-QGZVFWFLSA-N 2 1 341.474 4.173 20 0 EIADMP C[C@H](CCC(F)(F)F)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000541555744 1042011553 /nfs/dbraw/zinc/01/15/53/1042011553.db2.gz IRZJHNOWVWWJBG-BFYDXBDKSA-N 2 1 328.422 4.218 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]CC[C@@H]3CCCC[N@@H+]3C)c(C)c2c1 ZINC000541653724 1042058173 /nfs/dbraw/zinc/05/81/73/1042058173.db2.gz PFBJTIKVSWWYTE-CVEARBPZSA-N 2 1 330.472 4.275 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]CC[C@@H]3CCCC[N@H+]3C)c(C)c2c1 ZINC000541653724 1042058176 /nfs/dbraw/zinc/05/81/76/1042058176.db2.gz PFBJTIKVSWWYTE-CVEARBPZSA-N 2 1 330.472 4.275 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cccc(OC(F)(F)F)c1 ZINC000517536464 1042070209 /nfs/dbraw/zinc/07/02/09/1042070209.db2.gz LZWZECPZWIHGDB-HNNXBMFYSA-N 2 1 344.421 4.329 20 0 EIADMP C[C@@H](Cc1ccccc1F)[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000438206038 1042087924 /nfs/dbraw/zinc/08/79/24/1042087924.db2.gz ZRTQPOIYRIIRPG-IRXDYDNUSA-N 2 1 346.515 4.320 20 0 EIADMP C[C@@H](Cc1ccccc1F)[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000438206038 1042087934 /nfs/dbraw/zinc/08/79/34/1042087934.db2.gz ZRTQPOIYRIIRPG-IRXDYDNUSA-N 2 1 346.515 4.320 20 0 EIADMP CCCC[C@@H](CC)C[N@H+]1CCCC2(CC[NH+](C[C@H](C)CO)CC2)C1 ZINC001280202245 1042126736 /nfs/dbraw/zinc/12/67/36/1042126736.db2.gz YLWSNBQDMYGJGC-VQTJNVASSA-N 2 1 338.580 4.009 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](CCOc2cccc(C(C)(C)C)c2)C1 ZINC000464779084 1042160282 /nfs/dbraw/zinc/16/02/82/1042160282.db2.gz PAEWVXZUFOUCAG-SFHVURJKSA-N 2 1 332.532 4.027 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCOc2cccc(C(C)(C)C)c2)C1 ZINC000464779084 1042160284 /nfs/dbraw/zinc/16/02/84/1042160284.db2.gz PAEWVXZUFOUCAG-SFHVURJKSA-N 2 1 332.532 4.027 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000464778305 1042160361 /nfs/dbraw/zinc/16/03/61/1042160361.db2.gz NQYYEIYNSUSEAI-GJZGRUSLSA-N 2 1 344.421 4.310 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000464778305 1042160371 /nfs/dbraw/zinc/16/03/71/1042160371.db2.gz NQYYEIYNSUSEAI-GJZGRUSLSA-N 2 1 344.421 4.310 20 0 EIADMP CC[N@@H+](CCCc1ccccc1)CC1CCN(c2ccccn2)CC1 ZINC000464800593 1042167431 /nfs/dbraw/zinc/16/74/31/1042167431.db2.gz ABZOJWQICRRFQS-UHFFFAOYSA-N 2 1 337.511 4.253 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464829231 1042186435 /nfs/dbraw/zinc/18/64/35/1042186435.db2.gz FDFZHJOKSBMKAG-SJLPKXTDSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464829231 1042186439 /nfs/dbraw/zinc/18/64/39/1042186439.db2.gz FDFZHJOKSBMKAG-SJLPKXTDSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464829231 1042186443 /nfs/dbraw/zinc/18/64/43/1042186443.db2.gz FDFZHJOKSBMKAG-SJLPKXTDSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464829231 1042186447 /nfs/dbraw/zinc/18/64/47/1042186447.db2.gz FDFZHJOKSBMKAG-SJLPKXTDSA-N 2 1 344.449 4.480 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2ccc(F)c(F)c2)cc1 ZINC000541951652 1042193100 /nfs/dbraw/zinc/19/31/00/1042193100.db2.gz GOTXSGUBPQURNX-CQSZACIVSA-N 2 1 341.405 4.352 20 0 EIADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@@H](c1ccccc1)C1CCCCC1 ZINC000542084068 1042270255 /nfs/dbraw/zinc/27/02/55/1042270255.db2.gz AJFCAXCQVRZOPK-VXKWHMMOSA-N 2 1 344.543 4.135 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@]2(C)CCCS2)CC1 ZINC000438826648 1042371342 /nfs/dbraw/zinc/37/13/42/1042371342.db2.gz OJRHHDCOGJGRKQ-MHJFOBGBSA-N 2 1 332.557 4.305 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCc2c3cc(C)ccc3[nH]c21 ZINC000438829874 1042371848 /nfs/dbraw/zinc/37/18/48/1042371848.db2.gz LQFYTPRVKZMNHY-HXUWFJFHSA-N 2 1 336.483 4.429 20 0 EIADMP COc1ccc(Oc2ccc(C[NH2+][C@H]3CC[N@@H+](C)[C@H](C)C3)cc2)cc1 ZINC000542322930 1042388434 /nfs/dbraw/zinc/38/84/34/1042388434.db2.gz NGRSGYTZFYGJTN-AEFFLSMTSA-N 2 1 340.467 4.060 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCN3)CC[N@H+]1Cc1ccccc1 ZINC000414974632 1042461509 /nfs/dbraw/zinc/46/15/09/1042461509.db2.gz DUDJKIOKKVBLDZ-XMSQKQJNSA-N 2 1 349.522 4.187 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1OC ZINC000173325000 1042565250 /nfs/dbraw/zinc/56/52/50/1042565250.db2.gz BQCANOFDKOKIMO-IRXDYDNUSA-N 2 1 334.504 4.009 20 0 EIADMP CC(C)(C)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167964626 1042641783 /nfs/dbraw/zinc/64/17/83/1042641783.db2.gz VEGFNNZHDJLGOF-SEJPIABJSA-N 2 1 326.528 4.479 20 0 EIADMP CCN1CCC([N@@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000506690780 1042788181 /nfs/dbraw/zinc/78/81/81/1042788181.db2.gz UTWMMLXTJUYJIW-UHFFFAOYSA-N 2 1 332.488 4.470 20 0 EIADMP CC[NH+]1CCC(N(C)Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000506690780 1042788187 /nfs/dbraw/zinc/78/81/87/1042788187.db2.gz UTWMMLXTJUYJIW-UHFFFAOYSA-N 2 1 332.488 4.470 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000506690780 1042788194 /nfs/dbraw/zinc/78/81/94/1042788194.db2.gz UTWMMLXTJUYJIW-UHFFFAOYSA-N 2 1 332.488 4.470 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000506690780 1042788200 /nfs/dbraw/zinc/78/82/00/1042788200.db2.gz UTWMMLXTJUYJIW-UHFFFAOYSA-N 2 1 332.488 4.470 20 0 EIADMP C[C@@H](c1ccccn1)[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000493106052 1042819703 /nfs/dbraw/zinc/81/97/03/1042819703.db2.gz OCODLTKKIXXSNL-SIKLNZKXSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccccn1)[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000493106052 1042819704 /nfs/dbraw/zinc/81/97/04/1042819704.db2.gz OCODLTKKIXXSNL-SIKLNZKXSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccccn1)[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000493106052 1042819706 /nfs/dbraw/zinc/81/97/06/1042819706.db2.gz OCODLTKKIXXSNL-SIKLNZKXSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccccn1)[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000493106052 1042819709 /nfs/dbraw/zinc/81/97/09/1042819709.db2.gz OCODLTKKIXXSNL-SIKLNZKXSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(Cl)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309875645 1042823229 /nfs/dbraw/zinc/82/32/29/1042823229.db2.gz SYKBHBQASWVKIU-APWZRJJASA-N 2 1 328.887 4.340 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310236028 1042831904 /nfs/dbraw/zinc/83/19/04/1042831904.db2.gz KSFFZNFLYDVSOF-WDSOQIARSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1Cl ZINC000177269919 1042833067 /nfs/dbraw/zinc/83/30/67/1042833067.db2.gz BBBIJXTZXCQYEZ-HNNXBMFYSA-N 2 1 332.875 4.131 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000177342995 1042835245 /nfs/dbraw/zinc/83/52/45/1042835245.db2.gz DFZLZGZUGJBJQP-GJYPPUQNSA-N 2 1 338.923 4.128 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccccc2Cl)[C@H](C)C1 ZINC000177342995 1042835248 /nfs/dbraw/zinc/83/52/48/1042835248.db2.gz DFZLZGZUGJBJQP-GJYPPUQNSA-N 2 1 338.923 4.128 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310537056 1042840071 /nfs/dbraw/zinc/84/00/71/1042840071.db2.gz RNGFZEDVUMOLHA-ZWOKBUDYSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(Br)cc1 ZINC000157477261 1042844434 /nfs/dbraw/zinc/84/44/34/1042844434.db2.gz LXWMPXBOUSZSKG-YMRXKLBXSA-N 2 1 331.257 4.245 20 0 EIADMP Cc1ccccc1C1CC([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000310925270 1042848222 /nfs/dbraw/zinc/84/82/22/1042848222.db2.gz RXZTWUCSTIKZMT-HWELCPFYSA-N 2 1 334.507 4.353 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311145901 1042853821 /nfs/dbraw/zinc/85/38/21/1042853821.db2.gz ZLARZIMBKPEGNL-XWFZLUIHSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000311236764 1042855542 /nfs/dbraw/zinc/85/55/42/1042855542.db2.gz UILJTIOHHLKWFH-MJGOQNOKSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000311236764 1042855546 /nfs/dbraw/zinc/85/55/46/1042855546.db2.gz UILJTIOHHLKWFH-MJGOQNOKSA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000507784918 1042934338 /nfs/dbraw/zinc/93/43/38/1042934338.db2.gz UERKNUIPWHBCQB-FCHUYYIVSA-N 2 1 344.543 4.036 20 0 EIADMP COC[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(Cl)cc1 ZINC000493884682 1042970806 /nfs/dbraw/zinc/97/08/06/1042970806.db2.gz ZNNQGCITJNPICD-VQIMIIECSA-N 2 1 338.923 4.272 20 0 EIADMP COC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(Cl)cc1 ZINC000493882621 1042971552 /nfs/dbraw/zinc/97/15/52/1042971552.db2.gz JOXROKYMEUDERV-QFBILLFUSA-N 2 1 338.923 4.129 20 0 EIADMP C[C@H]1CC([NH2+]Cc2ccc(Cl)nc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168008171 1043035951 /nfs/dbraw/zinc/03/59/51/1043035951.db2.gz WIVGNAQVRLYYQW-HOTGVXAUSA-N 2 1 343.902 4.266 20 0 EIADMP C[C@H]([NH2+]Cc1ccnc2ccccc12)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000388842124 1043061140 /nfs/dbraw/zinc/06/11/40/1043061140.db2.gz YFOLSSDRRPBLHW-GHTZIAJQSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cscc2Br)C1 ZINC000512147701 1043086000 /nfs/dbraw/zinc/08/60/00/1043086000.db2.gz UZVIILDFZOJLNQ-CYBMUJFWSA-N 2 1 345.350 4.112 20 0 EIADMP FC(F)Oc1ccc2ccccc2c1C[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000262148273 1043123083 /nfs/dbraw/zinc/12/30/83/1043123083.db2.gz ZQTDCHWYORUXMZ-UHFFFAOYSA-N 2 1 346.421 4.017 20 0 EIADMP Cc1cccc2c1[nH+]cc(C)c2N1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000185352491 1043175559 /nfs/dbraw/zinc/17/55/59/1043175559.db2.gz NGKAUNUREWFNJO-KRWDZBQOSA-N 2 1 334.467 4.044 20 0 EIADMP FC(F)(F)C1CCC(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)CC1 ZINC000185517814 1043193975 /nfs/dbraw/zinc/19/39/75/1043193975.db2.gz BEXRDIIRTOTKCV-CGZBRXJRSA-N 2 1 332.454 4.163 20 0 EIADMP FC(F)(F)C1CCC(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)CC1 ZINC000185517834 1043194473 /nfs/dbraw/zinc/19/44/73/1043194473.db2.gz BEXRDIIRTOTKCV-AQFXKWCLSA-N 2 1 332.454 4.163 20 0 EIADMP FC(F)(F)C1CCC(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000185522427 1043194677 /nfs/dbraw/zinc/19/46/77/1043194677.db2.gz WIUANNIINMIKRO-OQGULXLBSA-N 2 1 344.465 4.304 20 0 EIADMP FC(F)(F)C1CCC(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000185522427 1043194685 /nfs/dbraw/zinc/19/46/85/1043194685.db2.gz WIUANNIINMIKRO-OQGULXLBSA-N 2 1 344.465 4.304 20 0 EIADMP FC(F)(F)C1CCC(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000185522427 1043194694 /nfs/dbraw/zinc/19/46/94/1043194694.db2.gz WIUANNIINMIKRO-OQGULXLBSA-N 2 1 344.465 4.304 20 0 EIADMP Cc1cnc([C@@H](C)NCc2ccccc2C[N@H+]2CCCC[C@H]2C)cn1 ZINC000427821005 1043214913 /nfs/dbraw/zinc/21/49/13/1043214913.db2.gz AVIGCRHPHMTYTR-QZTJIDSGSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1cnc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)cn1 ZINC000427821005 1043214920 /nfs/dbraw/zinc/21/49/20/1043214920.db2.gz AVIGCRHPHMTYTR-QZTJIDSGSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1cnc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)cn1 ZINC000427821005 1043214929 /nfs/dbraw/zinc/21/49/29/1043214929.db2.gz AVIGCRHPHMTYTR-QZTJIDSGSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC000665249381 1043272761 /nfs/dbraw/zinc/27/27/61/1043272761.db2.gz PESIVLLKOTUQPJ-LBPRGKRZSA-N 2 1 333.476 4.180 20 0 EIADMP Fc1ccc(Oc2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000166042837 1043277378 /nfs/dbraw/zinc/27/73/78/1043277378.db2.gz ZYOQPAYLIYSHPN-RTBURBONSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1ccc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000166042837 1043277393 /nfs/dbraw/zinc/27/73/93/1043277393.db2.gz ZYOQPAYLIYSHPN-RTBURBONSA-N 2 1 340.442 4.334 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]C[C@@H](c2ccccc2)C(F)(F)F)CC1 ZINC000186851330 1043314999 /nfs/dbraw/zinc/31/49/99/1043314999.db2.gz ZTSCAHRDSHNFQT-INIZCTEOSA-N 2 1 328.422 4.185 20 0 EIADMP c1ccc(C[C@H](C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000166784566 1043315506 /nfs/dbraw/zinc/31/55/06/1043315506.db2.gz XCNKJBJGAVRUTF-DNVJHFABSA-N 2 1 334.507 4.229 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)C2CCSCC2)CC1 ZINC000187020585 1043322508 /nfs/dbraw/zinc/32/25/08/1043322508.db2.gz KTEDZLFQIYAVDJ-KRWDZBQOSA-N 2 1 332.557 4.081 20 0 EIADMP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000674045616 1043346415 /nfs/dbraw/zinc/34/64/15/1043346415.db2.gz JALTULAHXGPJLL-DBVUQKKJSA-N 2 1 347.522 4.024 20 0 EIADMP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000674045616 1043346436 /nfs/dbraw/zinc/34/64/36/1043346436.db2.gz JALTULAHXGPJLL-DBVUQKKJSA-N 2 1 347.522 4.024 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3cccnc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000674336106 1043603557 /nfs/dbraw/zinc/60/35/57/1043603557.db2.gz ZAMKKSBYZHQQOB-GCJKJVERSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3cccnc3c2)CC[N@H+]1Cc1ccccc1 ZINC000674336106 1043603563 /nfs/dbraw/zinc/60/35/63/1043603563.db2.gz ZAMKKSBYZHQQOB-GCJKJVERSA-N 2 1 345.490 4.378 20 0 EIADMP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000543051645 1043683376 /nfs/dbraw/zinc/68/33/76/1043683376.db2.gz JMVASEPCPSWSLN-QUCCMNQESA-N 2 1 343.902 4.093 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000543051645 1043683380 /nfs/dbraw/zinc/68/33/80/1043683380.db2.gz JMVASEPCPSWSLN-QUCCMNQESA-N 2 1 343.902 4.093 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cnn1C(C)C ZINC000191491640 1043820539 /nfs/dbraw/zinc/82/05/39/1043820539.db2.gz RPPYYGBKOWFJBI-SOLBZPMBSA-N 2 1 332.536 4.076 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cnn1C(C)C ZINC000191491640 1043820540 /nfs/dbraw/zinc/82/05/40/1043820540.db2.gz RPPYYGBKOWFJBI-SOLBZPMBSA-N 2 1 332.536 4.076 20 0 EIADMP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(O)c1 ZINC000442779925 1043832464 /nfs/dbraw/zinc/83/24/64/1043832464.db2.gz MEMAFWKKJBGKGW-FOUBCARRSA-N 2 1 338.495 4.199 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CCC(C(F)F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000442783432 1043835299 /nfs/dbraw/zinc/83/52/99/1043835299.db2.gz NCNOBHKSVNXMAD-RXQRSOPUSA-N 2 1 336.470 4.453 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CCC(C(F)F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000442783432 1043835303 /nfs/dbraw/zinc/83/53/03/1043835303.db2.gz NCNOBHKSVNXMAD-RXQRSOPUSA-N 2 1 336.470 4.453 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000442804913 1043837966 /nfs/dbraw/zinc/83/79/66/1043837966.db2.gz YIZJPBBMUHFTCE-PGRDOPGGSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000442804913 1043837969 /nfs/dbraw/zinc/83/79/69/1043837969.db2.gz YIZJPBBMUHFTCE-PGRDOPGGSA-N 2 1 347.506 4.211 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000657294215 1043876352 /nfs/dbraw/zinc/87/63/52/1043876352.db2.gz IQUUBXHRADBHAV-UHFFFAOYSA-N 2 1 329.513 4.081 20 0 EIADMP COCCC[NH+]1CCC([NH2+]Cc2ccc(-c3cccs3)cc2)CC1 ZINC000657343130 1043905381 /nfs/dbraw/zinc/90/53/81/1043905381.db2.gz JBVOIZKMYSSOKM-UHFFFAOYSA-N 2 1 344.524 4.006 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000174253032 1044244111 /nfs/dbraw/zinc/24/41/11/1044244111.db2.gz SBKVGASCTOKPFX-UHFFFAOYSA-N 2 1 336.479 4.079 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(-c2ccc(F)cc2)o1 ZINC000174453319 1044273135 /nfs/dbraw/zinc/27/31/35/1044273135.db2.gz NJQPMQYRNANHKI-UHFFFAOYSA-N 2 1 327.403 4.161 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]CC2CCC(C(F)(F)F)CC2)C1 ZINC000466360376 1044320476 /nfs/dbraw/zinc/32/04/76/1044320476.db2.gz CNDICPVHFOECHL-KLAILNCOSA-N 2 1 334.470 4.457 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)cc1 ZINC000348066888 1044388291 /nfs/dbraw/zinc/38/82/91/1044388291.db2.gz BTGUEEUVWHFNKK-GAZPGATBSA-N 2 1 339.483 4.035 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](CCc3ccncc3)CC1)CCC2 ZINC000166427743 1044463365 /nfs/dbraw/zinc/46/33/65/1044463365.db2.gz MVZRMACXLPCYGK-QHCPKHFHSA-N 2 1 349.522 4.064 20 0 EIADMP C(=C\c1ccncc1)\C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000494995293 1044584521 /nfs/dbraw/zinc/58/45/21/1044584521.db2.gz MCYNXSLYNLJONX-DAXSKMNVSA-N 2 1 347.506 4.083 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000327092291 1044591876 /nfs/dbraw/zinc/59/18/76/1044591876.db2.gz YMBWLHLSSLZTQX-GOSISDBHSA-N 2 1 338.495 4.053 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCSc1ccc(F)cc1 ZINC000191494657 1044627282 /nfs/dbraw/zinc/62/72/82/1044627282.db2.gz APBCCQGGIDKNFB-UHFFFAOYSA-N 2 1 335.492 4.089 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCSc1ccc(F)cc1 ZINC000191494657 1044627290 /nfs/dbraw/zinc/62/72/90/1044627290.db2.gz APBCCQGGIDKNFB-UHFFFAOYSA-N 2 1 335.492 4.089 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](Cc1ccccc1Cl)c1cccs1 ZINC000495066174 1044632245 /nfs/dbraw/zinc/63/22/45/1044632245.db2.gz GPZXWRZSTBDBJD-KRWDZBQOSA-N 2 1 345.899 4.480 20 0 EIADMP Cc1cc(F)cc(C[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC001143619163 1044642024 /nfs/dbraw/zinc/64/20/24/1044642024.db2.gz KPFCKGJDLBVRJM-LEWJYISDSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC001143619163 1044642028 /nfs/dbraw/zinc/64/20/28/1044642028.db2.gz KPFCKGJDLBVRJM-LEWJYISDSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)c1 ZINC001143619163 1044642040 /nfs/dbraw/zinc/64/20/40/1044642040.db2.gz KPFCKGJDLBVRJM-LEWJYISDSA-N 2 1 338.470 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)c1 ZINC001143619163 1044642052 /nfs/dbraw/zinc/64/20/52/1044642052.db2.gz KPFCKGJDLBVRJM-LEWJYISDSA-N 2 1 338.470 4.088 20 0 EIADMP Clc1nccc2cc(C[NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)sc21 ZINC000895359812 1044665928 /nfs/dbraw/zinc/66/59/28/1044665928.db2.gz KFMDWWYSBPBQHX-CQSZACIVSA-N 2 1 349.931 4.161 20 0 EIADMP Clc1nccc2cc(C[NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)sc21 ZINC000895359811 1044666602 /nfs/dbraw/zinc/66/66/02/1044666602.db2.gz KFMDWWYSBPBQHX-AWEZNQCLSA-N 2 1 349.931 4.161 20 0 EIADMP C[C@@H]1C[C@@H](n2c(C[NH3+])cc3ccncc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168030501 1044800419 /nfs/dbraw/zinc/80/04/19/1044800419.db2.gz WHPHSYXZIPBGDK-XEMDLRDOSA-N 2 1 348.494 4.109 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C[C@@H]3CCC4(CCC4)O3)CC[N@@H+]2C2CC2)cc1 ZINC000895677916 1044845005 /nfs/dbraw/zinc/84/50/05/1044845005.db2.gz TXMRSVJHRKMXOT-JBACZVJFSA-N 2 1 340.511 4.046 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C[C@@H]3CCC4(CCC4)O3)CC[N@H+]2C2CC2)cc1 ZINC000895677916 1044845008 /nfs/dbraw/zinc/84/50/08/1044845008.db2.gz TXMRSVJHRKMXOT-JBACZVJFSA-N 2 1 340.511 4.046 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@]34CCCO4)CC[N@H+]2C2CC2)cc1 ZINC000895681775 1044851626 /nfs/dbraw/zinc/85/16/26/1044851626.db2.gz WNNRSOKNCYIFEI-NMIHRBCNSA-N 2 1 340.511 4.046 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@]34CCCO4)CC[N@@H+]2C2CC2)cc1 ZINC000895681775 1044851629 /nfs/dbraw/zinc/85/16/29/1044851629.db2.gz WNNRSOKNCYIFEI-NMIHRBCNSA-N 2 1 340.511 4.046 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000673600440 1044854222 /nfs/dbraw/zinc/85/42/22/1044854222.db2.gz XCQRJQGARZZKLI-IHWMJMDHSA-N 2 1 326.406 4.040 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cnc(-c2ccc(C)cc2)s1 ZINC000115616391 1044964869 /nfs/dbraw/zinc/96/48/69/1044964869.db2.gz QBTMOIQWXKANKE-HNNXBMFYSA-N 2 1 340.496 4.049 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCSC4(CCC4)C3)CC2)cc1 ZINC000922840788 1044984596 /nfs/dbraw/zinc/98/45/96/1044984596.db2.gz SURCPBTWUXIYJS-HXUWFJFHSA-N 2 1 344.568 4.101 20 0 EIADMP c1csc(C[N@H+](CC2CCC3(CC3)CC2)[C@@H]2CC23CC[NH2+]CC3)n1 ZINC000923347538 1045069046 /nfs/dbraw/zinc/06/90/46/1045069046.db2.gz RXDRPDSJOXGKGD-QGZVFWFLSA-N 2 1 345.556 4.058 20 0 EIADMP CCc1ccc(C[N@@H+](C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cn1 ZINC000347777724 1045106951 /nfs/dbraw/zinc/10/69/51/1045106951.db2.gz JDQVHASJEZGXAN-GCJKJVERSA-N 2 1 337.511 4.129 20 0 EIADMP COC1(C[C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000429443337 1045142979 /nfs/dbraw/zinc/14/29/79/1045142979.db2.gz CQKFREACEJJMMX-IRFCIJBXSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)c1ccc2ccccc2c1 ZINC000495483849 1045149268 /nfs/dbraw/zinc/14/92/68/1045149268.db2.gz BCAPFDQQBBLEFR-GOSISDBHSA-N 2 1 338.495 4.135 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccc(F)c(F)c1 ZINC000495503687 1045164736 /nfs/dbraw/zinc/16/47/36/1045164736.db2.gz PCVLVUGBUOYOPL-HNNXBMFYSA-N 2 1 330.422 4.064 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccc(F)c(F)c1 ZINC000495503687 1045164743 /nfs/dbraw/zinc/16/47/43/1045164743.db2.gz PCVLVUGBUOYOPL-HNNXBMFYSA-N 2 1 330.422 4.064 20 0 EIADMP CCCc1nc(C)c(C[N@@H+](CC)Cc2ccc(C[NH+](C)C)cc2)o1 ZINC000626063386 1045168002 /nfs/dbraw/zinc/16/80/02/1045168002.db2.gz BYPXKDSSJSTSFI-UHFFFAOYSA-N 2 1 329.488 4.019 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2scnc2C2CC2)[C@H]1c1cccs1 ZINC000487272991 1045223362 /nfs/dbraw/zinc/22/33/62/1045223362.db2.gz SCFNNOWRBPJRBO-KSSFIOAISA-N 2 1 347.553 4.255 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2scnc2C2CC2)[C@H]1c1cccs1 ZINC000487272991 1045223372 /nfs/dbraw/zinc/22/33/72/1045223372.db2.gz SCFNNOWRBPJRBO-KSSFIOAISA-N 2 1 347.553 4.255 20 0 EIADMP c1ccc2c(c1)cccc2CSCC[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000611104255 1045250643 /nfs/dbraw/zinc/25/06/43/1045250643.db2.gz PSHBKXVINBBEIP-UXHICEINSA-N 2 1 340.536 4.289 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](CC)c2ccccc2OC(F)F)CC1 ZINC000161637074 1045302983 /nfs/dbraw/zinc/30/29/83/1045302983.db2.gz QXEOEZHVWXTZMD-MRXNPFEDSA-N 2 1 326.431 4.203 20 0 EIADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000236933639 1045370235 /nfs/dbraw/zinc/37/02/35/1045370235.db2.gz IVOQPSFCTJMHCQ-OAHLLOKOSA-N 2 1 332.875 4.422 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000236933639 1045370242 /nfs/dbraw/zinc/37/02/42/1045370242.db2.gz IVOQPSFCTJMHCQ-OAHLLOKOSA-N 2 1 332.875 4.422 20 0 EIADMP Cc1ccc(C[C@@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)s1 ZINC000237514929 1045387199 /nfs/dbraw/zinc/38/71/99/1045387199.db2.gz QHELRUFSBCFNFK-QGZVFWFLSA-N 2 1 342.552 4.284 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001168501372 1045498865 /nfs/dbraw/zinc/49/88/65/1045498865.db2.gz NWQGYCWPOPCJOZ-KRWDZBQOSA-N 2 1 332.507 4.486 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c(C)o1 ZINC000398010502 1045822332 /nfs/dbraw/zinc/82/23/32/1045822332.db2.gz CRNVXILITBIQAG-HZUJVAHNSA-N 2 1 326.484 4.458 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c(C)o1 ZINC000398010502 1045822333 /nfs/dbraw/zinc/82/23/33/1045822333.db2.gz CRNVXILITBIQAG-HZUJVAHNSA-N 2 1 326.484 4.458 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCCC1CCOCC1 ZINC000398044838 1045826868 /nfs/dbraw/zinc/82/68/68/1045826868.db2.gz VARXDJUVWPCKQY-KNQAVFIVSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCCC1CCOCC1 ZINC000398044838 1045826869 /nfs/dbraw/zinc/82/68/69/1045826869.db2.gz VARXDJUVWPCKQY-KNQAVFIVSA-N 2 1 344.543 4.084 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000246881443 1045834122 /nfs/dbraw/zinc/83/41/22/1045834122.db2.gz DAWSDYWFVDZYSA-HKUYNNGSSA-N 2 1 328.500 4.143 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000246881443 1045834125 /nfs/dbraw/zinc/83/41/25/1045834125.db2.gz DAWSDYWFVDZYSA-HKUYNNGSSA-N 2 1 328.500 4.143 20 0 EIADMP CC[C@H](c1ccncc1)[NH+](C)CCC[N@@H+](C)[C@H](CC)c1ccncc1 ZINC000247305148 1045847030 /nfs/dbraw/zinc/84/70/30/1045847030.db2.gz ZXELVIWYXZGMSU-NHCUHLMSSA-N 2 1 340.515 4.333 20 0 EIADMP CC[C@H](c1ccncc1)[NH+](C)CCC[N@H+](C)[C@H](CC)c1ccncc1 ZINC000247305148 1045847039 /nfs/dbraw/zinc/84/70/39/1045847039.db2.gz ZXELVIWYXZGMSU-NHCUHLMSSA-N 2 1 340.515 4.333 20 0 EIADMP C[C@H]([NH2+][C@H]1CCSc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248407253 1045872924 /nfs/dbraw/zinc/87/29/24/1045872924.db2.gz UDTWLPJFSYPALN-BXWFABGCSA-N 2 1 330.541 4.466 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCC[C@H]2CCCCO2)C3)cc1 ZINC000248887149 1045886999 /nfs/dbraw/zinc/88/69/99/1045886999.db2.gz MKPOAEWZMZTNDP-CIAFKFPVSA-N 2 1 342.527 4.121 20 0 EIADMP FC1(F)CCCC[C@@H]1C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170206012 1045926028 /nfs/dbraw/zinc/92/60/28/1045926028.db2.gz QGMUZIFQPJXYFS-WOJBJXKFSA-N 2 1 348.481 4.410 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001170206012 1045926037 /nfs/dbraw/zinc/92/60/37/1045926037.db2.gz QGMUZIFQPJXYFS-WOJBJXKFSA-N 2 1 348.481 4.410 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001170206012 1045926045 /nfs/dbraw/zinc/92/60/45/1045926045.db2.gz QGMUZIFQPJXYFS-WOJBJXKFSA-N 2 1 348.481 4.410 20 0 EIADMP COC(=[NH2+])c1cccc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001170333309 1046006637 /nfs/dbraw/zinc/00/66/37/1046006637.db2.gz NUUVZQBEDJJVTG-MZADTFQBSA-N 2 1 349.478 4.266 20 0 EIADMP COC(=[NH2+])c1cccc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001170333309 1046006650 /nfs/dbraw/zinc/00/66/50/1046006650.db2.gz NUUVZQBEDJJVTG-MZADTFQBSA-N 2 1 349.478 4.266 20 0 EIADMP COc1ccccc1-c1ccc([C@H](C)[N@@H+](C)C[C@@H]2CCC[NH2+]C2)cc1 ZINC000261745944 1046143780 /nfs/dbraw/zinc/14/37/80/1046143780.db2.gz BWMYVDZTRPWFBR-ZWKOTPCHSA-N 2 1 338.495 4.355 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2N(C)C)c1 ZINC000123976150 1046209485 /nfs/dbraw/zinc/20/94/85/1046209485.db2.gz KLTJIGWBZVBNRL-INIZCTEOSA-N 2 1 343.490 4.194 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)c1ccsc1 ZINC000648571123 1046216740 /nfs/dbraw/zinc/21/67/40/1046216740.db2.gz LMGSDXHAXNIPSE-IAGOWNOFSA-N 2 1 328.525 4.494 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccsc1 ZINC000648571124 1046216834 /nfs/dbraw/zinc/21/68/34/1046216834.db2.gz LMGSDXHAXNIPSE-IRXDYDNUSA-N 2 1 328.525 4.494 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000508695469 1046327393 /nfs/dbraw/zinc/32/73/93/1046327393.db2.gz PWCCCAMCYOWFHY-XGHSKXIFSA-N 2 1 342.527 4.187 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000508695469 1046327405 /nfs/dbraw/zinc/32/74/05/1046327405.db2.gz PWCCCAMCYOWFHY-XGHSKXIFSA-N 2 1 342.527 4.187 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2ccccc2COC)C[C@H]1C ZINC000508719524 1046378189 /nfs/dbraw/zinc/37/81/89/1046378189.db2.gz NYAFEXDQTIJWHJ-IUPPMXBZSA-N 2 1 330.516 4.041 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C(C)=C/c2ccccc2COC)C[C@H]1C ZINC000508719524 1046378201 /nfs/dbraw/zinc/37/82/01/1046378201.db2.gz NYAFEXDQTIJWHJ-IUPPMXBZSA-N 2 1 330.516 4.041 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C(C)=C/c2ccccc2COC)C[C@H]1C ZINC000508719524 1046378218 /nfs/dbraw/zinc/37/82/18/1046378218.db2.gz NYAFEXDQTIJWHJ-IUPPMXBZSA-N 2 1 330.516 4.041 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccccc2N2CCCCC2)CC1 ZINC000916838064 1046379149 /nfs/dbraw/zinc/37/91/49/1046379149.db2.gz DUIFKDKZXMUAHQ-UHFFFAOYSA-N 2 1 329.532 4.029 20 0 EIADMP C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508715709 1046380297 /nfs/dbraw/zinc/38/02/97/1046380297.db2.gz XHNHYORWEGNHNP-WIYYLYMNSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508715707 1046380603 /nfs/dbraw/zinc/38/06/03/1046380603.db2.gz XHNHYORWEGNHNP-NQIIRXRSSA-N 2 1 347.506 4.211 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000508722036 1046420257 /nfs/dbraw/zinc/42/02/57/1046420257.db2.gz QUTGCHMSSXOLLZ-RXVVDRJESA-N 2 1 338.495 4.004 20 0 EIADMP CCCCOc1cc(C[N@@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)ccc1OC ZINC000536658861 1046622665 /nfs/dbraw/zinc/62/26/65/1046622665.db2.gz PPTKFBNCRVCPAE-PKOBYXMFSA-N 2 1 348.531 4.036 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccccc3F)o2)[C@H](C)C1 ZINC000536659052 1046623505 /nfs/dbraw/zinc/62/35/05/1046623505.db2.gz AQNSURGEIHJDTB-BEFAXECRSA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)[C@H](C)C1 ZINC000536659052 1046623515 /nfs/dbraw/zinc/62/35/15/1046623515.db2.gz AQNSURGEIHJDTB-BEFAXECRSA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)[C@H](C)C1 ZINC000536659052 1046623522 /nfs/dbraw/zinc/62/35/22/1046623522.db2.gz AQNSURGEIHJDTB-BEFAXECRSA-N 2 1 330.447 4.248 20 0 EIADMP CCCCOc1cc(C[N@@H+](C)[C@H]2CC[NH+](CC)C[C@@H]2C)ccc1OC ZINC000536658858 1046624418 /nfs/dbraw/zinc/62/44/18/1046624418.db2.gz PPTKFBNCRVCPAE-HKUYNNGSSA-N 2 1 348.531 4.036 20 0 EIADMP CC[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)CC1CCN(c2ccccn2)CC1 ZINC000536661073 1046628616 /nfs/dbraw/zinc/62/86/16/1046628616.db2.gz WSLWEHBOAXVMTF-FCHUYYIVSA-N 2 1 349.522 4.424 20 0 EIADMP CC[N@@H+](C[C@H]1C[C@@H]1c1ccccc1)CC1CCN(c2ccccn2)CC1 ZINC000536661074 1046628697 /nfs/dbraw/zinc/62/86/97/1046628697.db2.gz WSLWEHBOAXVMTF-FGZHOGPDSA-N 2 1 349.522 4.424 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cc(C)c(C)cc2OC(F)F)C[C@H]1C ZINC000536662083 1046633331 /nfs/dbraw/zinc/63/33/31/1046633331.db2.gz NSCXMZUIAFZNCO-WBVHZDCISA-N 2 1 340.458 4.209 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)c1ccc(Br)cc1 ZINC000127321246 1046647536 /nfs/dbraw/zinc/64/75/36/1046647536.db2.gz FTISEXPPIDIHHL-ZDUSSCGKSA-N 2 1 336.277 4.037 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1ccc(Br)cc1 ZINC000127321246 1046647542 /nfs/dbraw/zinc/64/75/42/1046647542.db2.gz FTISEXPPIDIHHL-ZDUSSCGKSA-N 2 1 336.277 4.037 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3F)s2)C1 ZINC000536695079 1046688726 /nfs/dbraw/zinc/68/87/26/1046688726.db2.gz LCCISNZZJVXAQD-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3F)s2)C1 ZINC000536695079 1046688742 /nfs/dbraw/zinc/68/87/42/1046688742.db2.gz LCCISNZZJVXAQD-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3F)s2)C1 ZINC000536695079 1046688750 /nfs/dbraw/zinc/68/87/50/1046688750.db2.gz LCCISNZZJVXAQD-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3F)s2)C1 ZINC000536695079 1046688758 /nfs/dbraw/zinc/68/87/58/1046688758.db2.gz LCCISNZZJVXAQD-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP Cc1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc(C)c1O ZINC000379615161 1046702700 /nfs/dbraw/zinc/70/27/00/1046702700.db2.gz AFXKGXWHSUNYHN-WIYYLYMNSA-N 2 1 338.495 4.152 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000379632377 1046733743 /nfs/dbraw/zinc/73/37/43/1046733743.db2.gz NQKMOZAYOJRDOI-NEWSRXKRSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000379632377 1046733749 /nfs/dbraw/zinc/73/37/49/1046733749.db2.gz NQKMOZAYOJRDOI-NEWSRXKRSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3F)CC[N@@H+]1Cc1ccccc1 ZINC000379655815 1046759677 /nfs/dbraw/zinc/75/96/77/1046759677.db2.gz NEORSYVVVRCJQZ-TVTNDZMWSA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3F)CC[N@H+]1Cc1ccccc1 ZINC000379655815 1046759693 /nfs/dbraw/zinc/75/96/93/1046759693.db2.gz NEORSYVVVRCJQZ-TVTNDZMWSA-N 2 1 338.470 4.456 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000536834394 1046810861 /nfs/dbraw/zinc/81/08/61/1046810861.db2.gz USIHMEZJQBFJAG-XYPHTWIQSA-N 2 1 328.422 4.475 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000536834394 1046810862 /nfs/dbraw/zinc/81/08/62/1046810862.db2.gz USIHMEZJQBFJAG-XYPHTWIQSA-N 2 1 328.422 4.475 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000536859805 1046827307 /nfs/dbraw/zinc/82/73/07/1046827307.db2.gz WTZMNZPRZCTSPG-CCKFTAQKSA-N 2 1 331.891 4.407 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc(OC)cc3)cc2)[C@H](C)C1 ZINC000536874170 1046836449 /nfs/dbraw/zinc/83/64/49/1046836449.db2.gz CJHDNVFGNKGAKV-VGOFRKELSA-N 2 1 338.495 4.182 20 0 EIADMP Clc1ccc2c(n1)CC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000806140868 1047166628 /nfs/dbraw/zinc/16/66/28/1047166628.db2.gz CZYIETABHBLMPK-QGZVFWFLSA-N 2 1 333.907 4.109 20 0 EIADMP Clc1ccc2c(n1)[C@@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CC2 ZINC000788507879 1047208412 /nfs/dbraw/zinc/20/84/12/1047208412.db2.gz SMEXIFKBKHDTSS-SFHVURJKSA-N 2 1 341.886 4.108 20 0 EIADMP CC1=CC[C@@H](Nc2ccc([NH+]3CCC(C[NH+](C)C)CC3)cc2)CC1 ZINC000788729475 1047282812 /nfs/dbraw/zinc/28/28/12/1047282812.db2.gz KTXYKPIOVRHFMP-LJQANCHMSA-N 2 1 327.516 4.375 20 0 EIADMP COc1ccc(CCC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556058599 1047422002 /nfs/dbraw/zinc/42/20/02/1047422002.db2.gz ABNDWSSEBUJJAJ-RBBKRZOGSA-N 2 1 338.495 4.053 20 0 EIADMP COc1ccc(CCC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556058599 1047422013 /nfs/dbraw/zinc/42/20/13/1047422013.db2.gz ABNDWSSEBUJJAJ-RBBKRZOGSA-N 2 1 338.495 4.053 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)o1 ZINC000556092715 1047443711 /nfs/dbraw/zinc/44/37/11/1047443711.db2.gz BZTLYFMANGBODN-LDQXTDLNSA-N 2 1 326.484 4.334 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)o1 ZINC000556092715 1047443714 /nfs/dbraw/zinc/44/37/14/1047443714.db2.gz BZTLYFMANGBODN-LDQXTDLNSA-N 2 1 326.484 4.334 20 0 EIADMP CCS[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556104934 1047456718 /nfs/dbraw/zinc/45/67/18/1047456718.db2.gz MYKWVCTVYZPANO-VNTMZGSJSA-N 2 1 332.557 4.476 20 0 EIADMP CCS[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556104934 1047456730 /nfs/dbraw/zinc/45/67/30/1047456730.db2.gz MYKWVCTVYZPANO-VNTMZGSJSA-N 2 1 332.557 4.476 20 0 EIADMP C[C@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3ccccc3C(F)(F)F)CC2)C1 ZINC001170119649 1047472698 /nfs/dbraw/zinc/47/26/98/1047472698.db2.gz ZJEBULXZCJTYRV-UONOGXRCSA-N 2 1 326.406 4.144 20 0 EIADMP C[C@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170120362 1047477102 /nfs/dbraw/zinc/47/71/02/1047477102.db2.gz GBMJJHJTIQBRRH-XJKSGUPXSA-N 2 1 326.406 4.144 20 0 EIADMP C[C@H](N[C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1cncs1 ZINC000897931039 1047501553 /nfs/dbraw/zinc/50/15/53/1047501553.db2.gz VABOCWNQNJKYNJ-ZVZYQTTQSA-N 2 1 327.497 4.162 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCCNc2ccccc2F)C[C@@H]1c1ccccc1 ZINC000556172913 1047535427 /nfs/dbraw/zinc/53/54/27/1047535427.db2.gz CQLNYDPZCBFJIV-GHTZIAJQSA-N 2 1 341.474 4.053 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCNc2ccccc2F)C[C@@H]1c1ccccc1 ZINC000556172913 1047535451 /nfs/dbraw/zinc/53/54/51/1047535451.db2.gz CQLNYDPZCBFJIV-GHTZIAJQSA-N 2 1 341.474 4.053 20 0 EIADMP Cc1cccnc1C(C)(C)C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556195249 1047556129 /nfs/dbraw/zinc/55/61/29/1047556129.db2.gz UGFIPPFCMRIORP-PMACEKPBSA-N 2 1 337.511 4.093 20 0 EIADMP Cc1cccnc1C(C)(C)C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556195249 1047556149 /nfs/dbraw/zinc/55/61/49/1047556149.db2.gz UGFIPPFCMRIORP-PMACEKPBSA-N 2 1 337.511 4.093 20 0 EIADMP CCCC[C@H](COC)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000556233069 1047594825 /nfs/dbraw/zinc/59/48/25/1047594825.db2.gz FOCPHBYJUNQWIO-NYLDSWQDSA-N 2 1 332.532 4.224 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665019 1047810214 /nfs/dbraw/zinc/81/02/14/1047810214.db2.gz CMRGHDSDGSEBPD-FQELHTAISA-N 2 1 344.449 4.493 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665019 1047810215 /nfs/dbraw/zinc/81/02/15/1047810215.db2.gz CMRGHDSDGSEBPD-FQELHTAISA-N 2 1 344.449 4.493 20 0 EIADMP Cc1cccc(O[C@H](C)C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550666091 1047810679 /nfs/dbraw/zinc/81/06/79/1047810679.db2.gz UQPDQSWAOYQUKT-KAGYGMCKSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1cccc(O[C@H](C)C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550666091 1047810681 /nfs/dbraw/zinc/81/06/81/1047810681.db2.gz UQPDQSWAOYQUKT-KAGYGMCKSA-N 2 1 338.495 4.187 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2(Cc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000550701163 1047819796 /nfs/dbraw/zinc/81/97/96/1047819796.db2.gz STEZTFZBQUEVAB-FGZHOGPDSA-N 2 1 334.507 4.434 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(Cc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000550701163 1047819799 /nfs/dbraw/zinc/81/97/99/1047819799.db2.gz STEZTFZBQUEVAB-FGZHOGPDSA-N 2 1 334.507 4.434 20 0 EIADMP CSC1(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000814173864 1047866612 /nfs/dbraw/zinc/86/66/12/1047866612.db2.gz ZCSIKKJCOLEDNG-YQQQUEKLSA-N 2 1 330.541 4.057 20 0 EIADMP CC(C)COc1ccccc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000556686648 1047875156 /nfs/dbraw/zinc/87/51/56/1047875156.db2.gz ZSFXNVLCOKJVDK-UHFFFAOYSA-N 2 1 332.532 4.274 20 0 EIADMP CC(C)[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cn1 ZINC000498938068 1047993506 /nfs/dbraw/zinc/99/35/06/1047993506.db2.gz LIVDVIYWGYJSJO-FQEVSTJZSA-N 2 1 333.495 4.305 20 0 EIADMP Cc1ccc2c(C[N@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c[nH]c2c1 ZINC001136973102 1048015723 /nfs/dbraw/zinc/01/57/23/1048015723.db2.gz MGYQAXVHZNRHQX-LJQANCHMSA-N 2 1 325.500 4.317 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000824988013 1048018069 /nfs/dbraw/zinc/01/80/69/1048018069.db2.gz GAFOGGJIRFEOCB-FVPDABNVSA-N 2 1 340.433 4.412 20 0 EIADMP CC[NH+]1CCC([N@H+](C)[C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171082808 1048075303 /nfs/dbraw/zinc/07/53/03/1048075303.db2.gz NSHUMHYCFVREFU-MRXNPFEDSA-N 2 1 341.326 4.267 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171082808 1048075320 /nfs/dbraw/zinc/07/53/20/1048075320.db2.gz NSHUMHYCFVREFU-MRXNPFEDSA-N 2 1 341.326 4.267 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(SC(F)F)cc3)C2)CC1 ZINC000809754764 1048520341 /nfs/dbraw/zinc/52/03/41/1048520341.db2.gz ANKHPTJUDZVQPL-MRXNPFEDSA-N 2 1 340.483 4.165 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765047 1048526166 /nfs/dbraw/zinc/52/61/66/1048526166.db2.gz KSAVMGINNBJHAK-DOMZBBRYSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765047 1048526171 /nfs/dbraw/zinc/52/61/71/1048526171.db2.gz KSAVMGINNBJHAK-DOMZBBRYSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765047 1048526180 /nfs/dbraw/zinc/52/61/80/1048526180.db2.gz KSAVMGINNBJHAK-DOMZBBRYSA-N 2 1 332.435 4.071 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000809765047 1048526189 /nfs/dbraw/zinc/52/61/89/1048526189.db2.gz KSAVMGINNBJHAK-DOMZBBRYSA-N 2 1 332.435 4.071 20 0 EIADMP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc([C@@H]4CC[N@@H+](C)C4)cc3)c2c1 ZINC001171167783 1048615128 /nfs/dbraw/zinc/61/51/28/1048615128.db2.gz MQQKKLQDVXNWPC-IEBWSBKVSA-N 2 1 347.506 4.248 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cscc2C(F)(F)F)cc1 ZINC000811506999 1049118114 /nfs/dbraw/zinc/11/81/14/1049118114.db2.gz NPLBITOMNDSHDE-UHFFFAOYSA-N 2 1 342.430 4.461 20 0 EIADMP [NH3+]C1CCC(N(c2ccc3[nH]c[nH+]c3c2)[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC001170647516 1049314790 /nfs/dbraw/zinc/31/47/90/1049314790.db2.gz OXRCVAAYVAGHAM-LAWIFXJCSA-N 2 1 346.478 4.195 20 0 EIADMP CCO[C@H](CC[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C(C)C ZINC000348095194 1049412752 /nfs/dbraw/zinc/41/27/52/1049412752.db2.gz JREUFDBLXRZNML-OXQOHEQNSA-N 2 1 329.488 4.283 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCO[C@@H]2CC(C)C)cc1 ZINC000348195761 1049465973 /nfs/dbraw/zinc/46/59/73/1049465973.db2.gz YHEDXTFPPFFMPP-ZLGUVYLKSA-N 2 1 341.499 4.425 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171357408 1049511364 /nfs/dbraw/zinc/51/13/64/1049511364.db2.gz LPYVXVOSVYTSFN-WDSOQIARSA-N 2 1 348.481 4.337 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170681252 1049523941 /nfs/dbraw/zinc/52/39/41/1049523941.db2.gz NKUKVLOSACCJQK-KZNAEPCWSA-N 2 1 336.470 4.050 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](Cc1ccccc1C)c1ccco1 ZINC000820810615 1049555975 /nfs/dbraw/zinc/55/59/75/1049555975.db2.gz AIGGGYGHVCYPJN-HXUWFJFHSA-N 2 1 337.467 4.447 20 0 EIADMP CSC(C)(C)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000820813090 1049557975 /nfs/dbraw/zinc/55/79/75/1049557975.db2.gz YOROQKGICSMDDA-YQQQUEKLSA-N 2 1 332.557 4.303 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccc2c(c1)CCO2 ZINC000773079752 1049570280 /nfs/dbraw/zinc/57/02/80/1049570280.db2.gz YVNXBFMWAAPUND-PXNSSMCTSA-N 2 1 330.516 4.030 20 0 EIADMP C[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1cccc(F)c1 ZINC000812827007 1049588924 /nfs/dbraw/zinc/58/89/24/1049588924.db2.gz ZJIJSEBFPWWQKL-GOSISDBHSA-N 2 1 340.486 4.226 20 0 EIADMP CSCCCCC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716641418 1049702165 /nfs/dbraw/zinc/70/21/65/1049702165.db2.gz ZVBLVQHJQDBAAB-ZCNNSNEGSA-N 2 1 332.557 4.162 20 0 EIADMP Fc1cc2c(cc1F)C[C@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001171486353 1049717058 /nfs/dbraw/zinc/71/70/58/1049717058.db2.gz BPLIABWPBCWRNO-RTBURBONSA-N 2 1 348.481 4.163 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001171548533 1049751683 /nfs/dbraw/zinc/75/16/83/1049751683.db2.gz COYNBKVGWDYSMK-QFIPXVFZSA-N 2 1 334.507 4.107 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557400 1049754751 /nfs/dbraw/zinc/75/47/51/1049754751.db2.gz APYGVZYFYLSYRR-UFYCRDLUSA-N 2 1 328.544 4.470 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557456 1049754836 /nfs/dbraw/zinc/75/48/36/1049754836.db2.gz CEDMNRXDUBVDAG-HMXCVIKNSA-N 2 1 326.528 4.367 20 0 EIADMP C[NH+]1C(C)(C)CC([N@H+]2CCC[C@@H](OCc3ccccc3)C2)CC1(C)C ZINC001171639456 1049779678 /nfs/dbraw/zinc/77/96/78/1049779678.db2.gz KMIZEHLMSCAQPA-HXUWFJFHSA-N 2 1 344.543 4.319 20 0 EIADMP Cc1cccc2c(CC[NH3+])cn([C@H]3C[C@H](C)[N@H+](Cc4ccccc4)C3)c21 ZINC001171726356 1049785216 /nfs/dbraw/zinc/78/52/16/1049785216.db2.gz VERMBNJPXMICEV-RXVVDRJESA-N 2 1 347.506 4.286 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171731438 1049787252 /nfs/dbraw/zinc/78/72/52/1049787252.db2.gz BCAYVCOJERKCFZ-RCZSKKKRSA-N 2 1 349.522 4.258 20 0 EIADMP C[N@@H+]([C@@H]1Cc2cccc(F)c2C1)C1CC[NH+](C2CCCCC2)CC1 ZINC001171812148 1049809325 /nfs/dbraw/zinc/80/93/25/1049809325.db2.gz LIXFTXGDHWSXSL-LJQANCHMSA-N 2 1 330.491 4.022 20 0 EIADMP CCC[NH+](CCC)CCN[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964713 1049826696 /nfs/dbraw/zinc/82/66/96/1049826696.db2.gz HGELNKDAIZLUNH-OAQYLSRUSA-N 2 1 345.575 4.141 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171966223 1049826717 /nfs/dbraw/zinc/82/67/17/1049826717.db2.gz UGKMCHVEJQYOOE-SFHVURJKSA-N 2 1 344.449 4.498 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC001171966223 1049826719 /nfs/dbraw/zinc/82/67/19/1049826719.db2.gz UGKMCHVEJQYOOE-SFHVURJKSA-N 2 1 344.449 4.498 20 0 EIADMP C[C@@H](CCCC(C)(C)O)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171972610 1049834735 /nfs/dbraw/zinc/83/47/35/1049834735.db2.gz RRDFWUDAAWBPHJ-AZUAARDMSA-N 2 1 346.559 4.349 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCCc2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC001171972825 1049836241 /nfs/dbraw/zinc/83/62/41/1049836241.db2.gz SRQRDIYIQFTWOL-OAQYLSRUSA-N 2 1 337.511 4.047 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccc(N)cc1 ZINC001171977191 1049837105 /nfs/dbraw/zinc/83/71/05/1049837105.db2.gz YCKPOFSKWIREJF-UTKZUKDTSA-N 2 1 337.511 4.363 20 0 EIADMP CC1(C)C[C@H](N2CC[C@](C)(F)[C@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976024 1049837124 /nfs/dbraw/zinc/83/71/24/1049837124.db2.gz HQLDSDPMRPKLFW-GGPKGHCWSA-N 2 1 336.470 4.202 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2ccc3ncoc3c2)CC[N@H+]1Cc1ccccc1 ZINC001171977091 1049837216 /nfs/dbraw/zinc/83/72/16/1049837216.db2.gz XFWWJOSTDIEVJS-IBGZPJMESA-N 2 1 349.478 4.361 20 0 EIADMP CC1(C)C[C@@H](n2cc3ccc(C[NH3+])cc3n2)CC[N@H+]1Cc1ccccc1 ZINC001171976341 1049837681 /nfs/dbraw/zinc/83/76/81/1049837681.db2.gz RJPKADPWNVBUEV-FQEVSTJZSA-N 2 1 348.494 4.111 20 0 EIADMP CCCOC1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980372 1049839395 /nfs/dbraw/zinc/83/93/95/1049839395.db2.gz DVWSNFQCAGDUHN-FQEVSTJZSA-N 2 1 344.543 4.321 20 0 EIADMP C[NH2+]Cc1ccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)cc1 ZINC001171985746 1049840083 /nfs/dbraw/zinc/84/00/83/1049840083.db2.gz ZJJNVBQHDVHAAW-OAQYLSRUSA-N 2 1 337.511 4.261 20 0 EIADMP CC[N@@H+]1CC[C@H](Nc2cccc(Cn3cc[nH+]c3C(C)C)c2)[C@@H](C)C1 ZINC000245730100 1049841428 /nfs/dbraw/zinc/84/14/28/1049841428.db2.gz HZSOFGCGWHQBPD-PXNSSMCTSA-N 2 1 340.515 4.197 20 0 EIADMP CC[N@H+]1CC[C@H](Nc2cccc(Cn3cc[nH+]c3C(C)C)c2)[C@@H](C)C1 ZINC000245730100 1049841431 /nfs/dbraw/zinc/84/14/31/1049841431.db2.gz HZSOFGCGWHQBPD-PXNSSMCTSA-N 2 1 340.515 4.197 20 0 EIADMP CC1(C)C[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CCCO1 ZINC001172075186 1049844789 /nfs/dbraw/zinc/84/47/89/1049844789.db2.gz OLEYCVMRKDQPMX-WKCHPHFGSA-N 2 1 342.527 4.073 20 0 EIADMP CC1(C)C[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CCCO1 ZINC001172075186 1049844793 /nfs/dbraw/zinc/84/47/93/1049844793.db2.gz OLEYCVMRKDQPMX-WKCHPHFGSA-N 2 1 342.527 4.073 20 0 EIADMP CC1(C)C[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCO1 ZINC001172075186 1049844795 /nfs/dbraw/zinc/84/47/95/1049844795.db2.gz OLEYCVMRKDQPMX-WKCHPHFGSA-N 2 1 342.527 4.073 20 0 EIADMP CC1(C)C[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCO1 ZINC001172075186 1049844797 /nfs/dbraw/zinc/84/47/97/1049844797.db2.gz OLEYCVMRKDQPMX-WKCHPHFGSA-N 2 1 342.527 4.073 20 0 EIADMP FC[C@@H]1CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172074126 1049845491 /nfs/dbraw/zinc/84/54/91/1049845491.db2.gz FURMTDYIBZZTPI-BURNTYAHSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@@H]1CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172074126 1049845492 /nfs/dbraw/zinc/84/54/92/1049845492.db2.gz FURMTDYIBZZTPI-BURNTYAHSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172074126 1049845494 /nfs/dbraw/zinc/84/54/94/1049845494.db2.gz FURMTDYIBZZTPI-BURNTYAHSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172074126 1049845498 /nfs/dbraw/zinc/84/54/98/1049845498.db2.gz FURMTDYIBZZTPI-BURNTYAHSA-N 2 1 330.491 4.254 20 0 EIADMP [NH3+]CCc1ccc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001172062284 1049849652 /nfs/dbraw/zinc/84/96/52/1049849652.db2.gz LUCAPIZOWFWNDK-WBDAEOGXSA-N 2 1 349.522 4.185 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2Cc4ccccc4C2)C3)cc1 ZINC001172066677 1049850996 /nfs/dbraw/zinc/85/09/96/1049850996.db2.gz JRHBTYWCRLVJAT-JOZNFPNDSA-N 2 1 346.518 4.329 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCCOC2CCCC2)C3)cc1 ZINC000245778293 1049854421 /nfs/dbraw/zinc/85/44/21/1049854421.db2.gz YLGQGXSELFQXNX-WKCHPHFGSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1OC2(CC[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CC2)c2ccccc21 ZINC001172133959 1049854665 /nfs/dbraw/zinc/85/46/65/1049854665.db2.gz UUGCNAIWIKHFIE-INDMIFKZSA-N 2 1 340.511 4.084 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Cc3cccc(F)c3)CC1)C2 ZINC001172129310 1049854718 /nfs/dbraw/zinc/85/47/18/1049854718.db2.gz YGATZMOWHJHRGL-WKCHPHFGSA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Cc3cccc(F)c3)CC1)C2 ZINC001172129310 1049854722 /nfs/dbraw/zinc/85/47/22/1049854722.db2.gz YGATZMOWHJHRGL-WKCHPHFGSA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1cccc(Cl)c1Cl)C2 ZINC001172103980 1049857359 /nfs/dbraw/zinc/85/73/59/1049857359.db2.gz YJBWADCSVWNWMH-QDMKHBRRSA-N 2 1 327.299 4.141 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3cccc(Br)c3)CC1)C2 ZINC001172104734 1049857640 /nfs/dbraw/zinc/85/76/40/1049857640.db2.gz CPCBURKLVHPHAI-BJWYYQGGSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3cccc(Br)c3)CC1)C2 ZINC001172104734 1049857644 /nfs/dbraw/zinc/85/76/44/1049857644.db2.gz CPCBURKLVHPHAI-BJWYYQGGSA-N 2 1 349.316 4.043 20 0 EIADMP Cc1ccc2c(c1)C1(CC2)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CC1 ZINC001172115489 1049858377 /nfs/dbraw/zinc/85/83/77/1049858377.db2.gz GZTOBWOSJCYMRN-AERCQKQUSA-N 2 1 338.539 4.290 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](Cc1ccccc1)c1nccs1)C2 ZINC001172112226 1049859342 /nfs/dbraw/zinc/85/93/42/1049859342.db2.gz UFHQGPDPGPTCIZ-OKYOBFRVSA-N 2 1 341.524 4.032 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](Cc1ccccc1)c1nccs1)C2 ZINC001172112226 1049859344 /nfs/dbraw/zinc/85/93/44/1049859344.db2.gz UFHQGPDPGPTCIZ-OKYOBFRVSA-N 2 1 341.524 4.032 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccc1)C1CCSCC1)C2 ZINC001172123387 1049860107 /nfs/dbraw/zinc/86/01/07/1049860107.db2.gz CFDGTOLMNNUWNG-WKCHPHFGSA-N 2 1 344.568 4.400 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccc1)C1CCSCC1)C2 ZINC001172123387 1049860113 /nfs/dbraw/zinc/86/01/13/1049860113.db2.gz CFDGTOLMNNUWNG-WKCHPHFGSA-N 2 1 344.568 4.400 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+](Cc1ccccc1)C1CCSCC1)C2 ZINC001172123387 1049860119 /nfs/dbraw/zinc/86/01/19/1049860119.db2.gz CFDGTOLMNNUWNG-WKCHPHFGSA-N 2 1 344.568 4.400 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+](Cc1ccccc1)C1CCSCC1)C2 ZINC001172123387 1049860120 /nfs/dbraw/zinc/86/01/20/1049860120.db2.gz CFDGTOLMNNUWNG-WKCHPHFGSA-N 2 1 344.568 4.400 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@@H]3CCC[N@@H+](C(C)C)C3)oc21 ZINC000245918200 1049874577 /nfs/dbraw/zinc/87/45/77/1049874577.db2.gz QJNCDQYCENMTDK-CVEARBPZSA-N 2 1 330.472 4.212 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@@H]3CCC[N@H+](C(C)C)C3)oc21 ZINC000245918200 1049874582 /nfs/dbraw/zinc/87/45/82/1049874582.db2.gz QJNCDQYCENMTDK-CVEARBPZSA-N 2 1 330.472 4.212 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171030501 1049875134 /nfs/dbraw/zinc/87/51/34/1049875134.db2.gz MEGFNTRBVUJQJA-KZNAEPCWSA-N 2 1 332.919 4.179 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172315279 1049875464 /nfs/dbraw/zinc/87/54/64/1049875464.db2.gz BLJRQWGABSLJAU-PLSULTGPSA-N 2 1 344.543 4.365 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001172322109 1049878309 /nfs/dbraw/zinc/87/83/09/1049878309.db2.gz RUIJTUXHWIEHBU-ZJOUEHCJSA-N 2 1 332.532 4.082 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[N@@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC001172327957 1049885812 /nfs/dbraw/zinc/88/58/12/1049885812.db2.gz AENGEPFONOVMPI-RTBURBONSA-N 2 1 332.532 4.177 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001172352512 1049891961 /nfs/dbraw/zinc/89/19/61/1049891961.db2.gz ICKJDOXABLYJDN-OALUTQOASA-N 2 1 344.543 4.103 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001172352512 1049891968 /nfs/dbraw/zinc/89/19/68/1049891968.db2.gz ICKJDOXABLYJDN-OALUTQOASA-N 2 1 344.543 4.103 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171045966 1049898470 /nfs/dbraw/zinc/89/84/70/1049898470.db2.gz VXTDYPZLYUSGGW-GOSISDBHSA-N 2 1 334.935 4.250 20 0 EIADMP CC[C@@H](CC(C)C)[NH+]1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001172396477 1049907162 /nfs/dbraw/zinc/90/71/62/1049907162.db2.gz DFCJIUURFJMGCW-FQEVSTJZSA-N 2 1 329.532 4.194 20 0 EIADMP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC001172575649 1049941453 /nfs/dbraw/zinc/94/14/53/1049941453.db2.gz JOBGNSNWNYYBAT-KGLIPLIRSA-N 2 1 344.877 4.261 20 0 EIADMP CC1(C)CC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC(C)(C)O1 ZINC001172650329 1049955979 /nfs/dbraw/zinc/95/59/79/1049955979.db2.gz LRDUUSJZFYAWFJ-UHFFFAOYSA-N 2 1 344.543 4.019 20 0 EIADMP C[N@H+](C1CC[NH+](Cc2ccccc2)CC1)C1CC(C)(C)OC(C)(C)C1 ZINC001172656508 1049957124 /nfs/dbraw/zinc/95/71/24/1049957124.db2.gz NCBRSPOLFRZXGI-UHFFFAOYSA-N 2 1 344.543 4.319 20 0 EIADMP C[N@@H+](C1CC[NH+](Cc2ccccc2)CC1)C1CC(C)(C)OC(C)(C)C1 ZINC001172656508 1049957126 /nfs/dbraw/zinc/95/71/26/1049957126.db2.gz NCBRSPOLFRZXGI-UHFFFAOYSA-N 2 1 344.543 4.319 20 0 EIADMP CC(C)(C)C[N@@H+]([C@H]1Cc2ccc(Cl)cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172711926 1049971821 /nfs/dbraw/zinc/97/18/21/1049971821.db2.gz JOMYPMSRUGFIGJ-FHWLQOOXSA-N 2 1 334.935 4.425 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccc(OC(F)F)cc2)C1 ZINC000246969522 1050007578 /nfs/dbraw/zinc/00/75/78/1050007578.db2.gz IZPAJPSNOYOGFZ-RHSMWYFYSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@@H]1C[C@H](N[C@H](COc2ccccc2F)c2ccccc2)CC[N@H+]1C ZINC000247161626 1050016015 /nfs/dbraw/zinc/01/60/15/1050016015.db2.gz XUHMXRLUOFNMBL-YVWKXTFCSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](COc2ccccc2F)c2ccccc2)CCN1C ZINC000247161626 1050016022 /nfs/dbraw/zinc/01/60/22/1050016022.db2.gz XUHMXRLUOFNMBL-YVWKXTFCSA-N 2 1 342.458 4.018 20 0 EIADMP Cc1nc(-c2ccc(CC[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@H]3C)s2)cs1 ZINC000248050823 1050040357 /nfs/dbraw/zinc/04/03/57/1050040357.db2.gz WFPMFNCRTBEFOW-DVOMOZLQSA-N 2 1 349.569 4.041 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc3ccccc3o2)[C@@H](C)C1 ZINC000248060412 1050041689 /nfs/dbraw/zinc/04/16/89/1050041689.db2.gz YIBAYZKGPSKXPD-SCTDSRPQSA-N 2 1 344.499 4.220 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cc3ccccc3o2)[C@@H](C)C1 ZINC000248060412 1050041694 /nfs/dbraw/zinc/04/16/94/1050041694.db2.gz YIBAYZKGPSKXPD-SCTDSRPQSA-N 2 1 344.499 4.220 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2csc(Cl)c2)[C@H](C)C1 ZINC000248732223 1050075061 /nfs/dbraw/zinc/07/50/61/1050075061.db2.gz WEHKHECIYLKJHY-FMKPAKJESA-N 2 1 344.952 4.189 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2csc(Cl)c2)[C@H](C)C1 ZINC000248732223 1050075068 /nfs/dbraw/zinc/07/50/68/1050075068.db2.gz WEHKHECIYLKJHY-FMKPAKJESA-N 2 1 344.952 4.189 20 0 EIADMP Clc1cc2c(c(Cl)c1)CC[C@@H]2[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000089694787 1050128475 /nfs/dbraw/zinc/12/84/75/1050128475.db2.gz CVTNGXXNCLXSQP-KRWDZBQOSA-N 2 1 325.283 4.197 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172827726 1050166598 /nfs/dbraw/zinc/16/65/98/1050166598.db2.gz DJHSADCWHOYEPM-NJDAHSKKSA-N 2 1 328.544 4.470 20 0 EIADMP CCc1cnc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)s1 ZINC001177267016 1050182880 /nfs/dbraw/zinc/18/28/80/1050182880.db2.gz GUAHZBNLVQKQLP-INIZCTEOSA-N 2 1 343.540 4.370 20 0 EIADMP CCc1cnc(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)s1 ZINC001177267016 1050182884 /nfs/dbraw/zinc/18/28/84/1050182884.db2.gz GUAHZBNLVQKQLP-INIZCTEOSA-N 2 1 343.540 4.370 20 0 EIADMP CO[C@@H]1CCC[C@H]([N@@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)C1 ZINC001172943937 1050242300 /nfs/dbraw/zinc/24/23/00/1050242300.db2.gz VGVRMMORFWDIIV-OHJZQYHNSA-N 2 1 342.527 4.055 20 0 EIADMP CO[C@@H]1CCC[C@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@H+](C)C(C)C)[C@H]3C2)C1 ZINC001172943937 1050242316 /nfs/dbraw/zinc/24/23/16/1050242316.db2.gz VGVRMMORFWDIIV-OHJZQYHNSA-N 2 1 342.527 4.055 20 0 EIADMP CO[C@@H]1CCC[C@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@@H+](C)C(C)C)[C@H]3C2)C1 ZINC001172943937 1050242328 /nfs/dbraw/zinc/24/23/28/1050242328.db2.gz VGVRMMORFWDIIV-OHJZQYHNSA-N 2 1 342.527 4.055 20 0 EIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Br)cc2Cl)CC1 ZINC001206305372 1050246280 /nfs/dbraw/zinc/24/62/80/1050246280.db2.gz YASOSMHBNOJAIA-OAHLLOKOSA-N 2 1 345.712 4.053 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+]Cc3cccc4ccccc43)C2)cc1 ZINC001177668928 1050273004 /nfs/dbraw/zinc/27/30/04/1050273004.db2.gz KKSRWJJZCJEDFP-OAQYLSRUSA-N 2 1 344.502 4.494 20 0 EIADMP CCCOC1CCC([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001173090719 1050283706 /nfs/dbraw/zinc/28/37/06/1050283706.db2.gz GZGHHQSONSPDET-ITAUSPCMSA-N 2 1 344.543 4.226 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)ccc2OC)c1 ZINC001177737221 1050288535 /nfs/dbraw/zinc/28/85/35/1050288535.db2.gz LAQRAZFCAXPCND-UHFFFAOYSA-N 2 1 332.875 4.090 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCO[C@](C)(c3ccc(F)cc3)C2)CC1 ZINC001173112573 1050309725 /nfs/dbraw/zinc/30/97/25/1050309725.db2.gz CBYVICPSVABWCZ-CBNMVNINSA-N 2 1 348.506 4.026 20 0 EIADMP Cc1ccc(-c2ncc(C[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C)C3)s2)cc1 ZINC000092043711 1050310439 /nfs/dbraw/zinc/31/04/39/1050310439.db2.gz WSEJEIZJQDCDNC-MJGOQNOKSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C)C3)s2)cc1 ZINC000092043711 1050310450 /nfs/dbraw/zinc/31/04/50/1050310450.db2.gz WSEJEIZJQDCDNC-MJGOQNOKSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C)C3)s2)cc1 ZINC000092043711 1050310467 /nfs/dbraw/zinc/31/04/67/1050310467.db2.gz WSEJEIZJQDCDNC-MJGOQNOKSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C)C3)s2)cc1 ZINC000092043711 1050310477 /nfs/dbraw/zinc/31/04/77/1050310477.db2.gz WSEJEIZJQDCDNC-MJGOQNOKSA-N 2 1 341.524 4.035 20 0 EIADMP CCc1cc(NCc2ccccc2C[NH+]2CCC(C)CC2)nc(C)[nH+]1 ZINC001186373298 1050313665 /nfs/dbraw/zinc/31/36/65/1050313665.db2.gz MKCYACFQAAJLCS-UHFFFAOYSA-N 2 1 338.499 4.191 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC001173117494 1050315736 /nfs/dbraw/zinc/31/57/36/1050315736.db2.gz OBPBLDNYNATAGG-UHFFFAOYSA-N 3 1 349.607 4.368 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+](C)C2CCN(C3CCCCC3)CC2)CC1 ZINC001173117494 1050315745 /nfs/dbraw/zinc/31/57/45/1050315745.db2.gz OBPBLDNYNATAGG-UHFFFAOYSA-N 2 1 349.607 4.368 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](C)C2CCN(C3CCCCC3)CC2)CC1 ZINC001173117494 1050315757 /nfs/dbraw/zinc/31/57/57/1050315757.db2.gz OBPBLDNYNATAGG-UHFFFAOYSA-N 2 1 349.607 4.368 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 ZINC001177855568 1050317539 /nfs/dbraw/zinc/31/75/39/1050317539.db2.gz ZDJAZJKCIAAODB-CNNODRBYSA-N 2 1 344.518 4.391 20 0 EIADMP CC(C)[NH+](CCC[NH2+]Cc1cc(F)cc(C(F)(F)F)c1)C(C)C ZINC001177948962 1050346698 /nfs/dbraw/zinc/34/66/98/1050346698.db2.gz MPIYMHMEPMPSKV-UHFFFAOYSA-N 2 1 334.401 4.443 20 0 EIADMP CC(C)CSCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001178205132 1050404024 /nfs/dbraw/zinc/40/40/24/1050404024.db2.gz NZIRVVUYNYFZLY-AZUAARDMSA-N 2 1 334.573 4.408 20 0 EIADMP CC(C)CSCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001178205132 1050404032 /nfs/dbraw/zinc/40/40/32/1050404032.db2.gz NZIRVVUYNYFZLY-AZUAARDMSA-N 2 1 334.573 4.408 20 0 EIADMP Fc1ccccc1C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001178285383 1050429046 /nfs/dbraw/zinc/42/90/46/1050429046.db2.gz QAXIYOGTYUTDBU-KCZVDYSFSA-N 2 1 338.470 4.216 20 0 EIADMP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173343034 1050432005 /nfs/dbraw/zinc/43/20/05/1050432005.db2.gz GKYKFAJMGBBABW-NHCUHLMSSA-N 2 1 348.575 4.455 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001178463440 1050476719 /nfs/dbraw/zinc/47/67/19/1050476719.db2.gz PXZPQQLFEHBJEI-KRWDZBQOSA-N 2 1 326.484 4.203 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC001173545636 1050477360 /nfs/dbraw/zinc/47/73/60/1050477360.db2.gz CBXSTIYOYDDEPT-XNJGSVPQSA-N 2 1 329.315 4.244 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CC[N@@H+](C)C[C@H]1C ZINC001173545636 1050477371 /nfs/dbraw/zinc/47/73/71/1050477371.db2.gz CBXSTIYOYDDEPT-XNJGSVPQSA-N 2 1 329.315 4.244 20 0 EIADMP CCN1CCC([N@@H+](C)C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173688978 1050540014 /nfs/dbraw/zinc/54/00/14/1050540014.db2.gz CSJOHCFGXIULBD-UHFFFAOYSA-N 2 1 326.528 4.229 20 0 EIADMP CC[NH+]1CCC([N@H+](C)C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173688978 1050540031 /nfs/dbraw/zinc/54/00/31/1050540031.db2.gz CSJOHCFGXIULBD-UHFFFAOYSA-N 2 1 326.528 4.229 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173688978 1050540038 /nfs/dbraw/zinc/54/00/38/1050540038.db2.gz CSJOHCFGXIULBD-UHFFFAOYSA-N 2 1 326.528 4.229 20 0 EIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(SC(F)(F)F)cc1)C1CC1 ZINC001178873180 1050577641 /nfs/dbraw/zinc/57/76/41/1050577641.db2.gz QKHWLVKXJJRDHZ-UHFFFAOYSA-N 2 1 332.435 4.263 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1nc2c(s1)CCCC2 ZINC000093398278 1050585607 /nfs/dbraw/zinc/58/56/07/1050585607.db2.gz KSBHPZQJGDIKMT-CVEARBPZSA-N 2 1 335.561 4.185 20 0 EIADMP c1cncc(-c2cccc(C[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)c2)c1 ZINC000093683553 1050657909 /nfs/dbraw/zinc/65/79/09/1050657909.db2.gz AETPFLNUINTAGR-HXUWFJFHSA-N 2 1 335.495 4.056 20 0 EIADMP c1ccc(-c2cccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)c2)nc1 ZINC000093683705 1050658652 /nfs/dbraw/zinc/65/86/52/1050658652.db2.gz MDZOXWHVWOZCOR-FQEVSTJZSA-N 2 1 335.495 4.056 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001179338364 1050679777 /nfs/dbraw/zinc/67/97/77/1050679777.db2.gz GKMNTOZAAUPNIX-WMZHIEFXSA-N 2 1 348.534 4.292 20 0 EIADMP COc1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C(C)(C)C ZINC001179877577 1050813146 /nfs/dbraw/zinc/81/31/46/1050813146.db2.gz HQRCMDVOPLUTFI-IBGZPJMESA-N 2 1 344.543 4.301 20 0 EIADMP COc1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C(C)(C)C ZINC001179877577 1050813150 /nfs/dbraw/zinc/81/31/50/1050813150.db2.gz HQRCMDVOPLUTFI-IBGZPJMESA-N 2 1 344.543 4.301 20 0 EIADMP CC[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1(OC)CCCCC1 ZINC001179947912 1050827951 /nfs/dbraw/zinc/82/79/51/1050827951.db2.gz ZEZSXAKQSKSRFJ-NRFANRHFSA-N 2 1 344.543 4.180 20 0 EIADMP CC[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC1(OC)CCCCC1 ZINC001179947912 1050827960 /nfs/dbraw/zinc/82/79/60/1050827960.db2.gz ZEZSXAKQSKSRFJ-NRFANRHFSA-N 2 1 344.543 4.180 20 0 EIADMP CC[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC1(OC)CCCCC1 ZINC001179947912 1050827963 /nfs/dbraw/zinc/82/79/63/1050827963.db2.gz ZEZSXAKQSKSRFJ-NRFANRHFSA-N 2 1 344.543 4.180 20 0 EIADMP COCC[N@@H+](C)CCCC1CC[NH+](C[C@H](C)c2ccc(C)cc2)CC1 ZINC001180077800 1050877232 /nfs/dbraw/zinc/87/72/32/1050877232.db2.gz VMKWEUXEBNCHNP-FQEVSTJZSA-N 2 1 346.559 4.169 20 0 EIADMP COc1ccc(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1C(C)(C)C ZINC001180081955 1050877789 /nfs/dbraw/zinc/87/77/89/1050877789.db2.gz OUESVORYAKDYRS-IBGZPJMESA-N 2 1 344.543 4.156 20 0 EIADMP COc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1C(C)(C)C ZINC001180081955 1050877793 /nfs/dbraw/zinc/87/77/93/1050877793.db2.gz OUESVORYAKDYRS-IBGZPJMESA-N 2 1 344.543 4.156 20 0 EIADMP COc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1C(C)(C)C ZINC001180081955 1050877795 /nfs/dbraw/zinc/87/77/95/1050877795.db2.gz OUESVORYAKDYRS-IBGZPJMESA-N 2 1 344.543 4.156 20 0 EIADMP COc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1C(C)(C)C ZINC001180081955 1050877798 /nfs/dbraw/zinc/87/77/98/1050877798.db2.gz OUESVORYAKDYRS-IBGZPJMESA-N 2 1 344.543 4.156 20 0 EIADMP COc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1C(C)(C)C ZINC001180081955 1050877803 /nfs/dbraw/zinc/87/78/03/1050877803.db2.gz OUESVORYAKDYRS-IBGZPJMESA-N 2 1 344.543 4.156 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC001180097710 1050885980 /nfs/dbraw/zinc/88/59/80/1050885980.db2.gz GQUOPMRGVOSDNQ-KRWDZBQOSA-N 2 1 328.422 4.320 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC001180097710 1050885986 /nfs/dbraw/zinc/88/59/86/1050885986.db2.gz GQUOPMRGVOSDNQ-KRWDZBQOSA-N 2 1 328.422 4.320 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC001180097710 1050885991 /nfs/dbraw/zinc/88/59/91/1050885991.db2.gz GQUOPMRGVOSDNQ-KRWDZBQOSA-N 2 1 328.422 4.320 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC001180097710 1050886000 /nfs/dbraw/zinc/88/60/00/1050886000.db2.gz GQUOPMRGVOSDNQ-KRWDZBQOSA-N 2 1 328.422 4.320 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)C1 ZINC000619772503 1050908384 /nfs/dbraw/zinc/90/83/84/1050908384.db2.gz JGHQESKZPMLGOC-FQEVSTJZSA-N 2 1 337.511 4.276 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(C(F)F)c(F)c2)CC1 ZINC001180164848 1050910338 /nfs/dbraw/zinc/91/03/38/1050910338.db2.gz CJYWOWYDLBAIJE-UHFFFAOYSA-N 2 1 328.422 4.316 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)C1CCCC1 ZINC001180301653 1050945457 /nfs/dbraw/zinc/94/54/57/1050945457.db2.gz OUDFYHZMGVUPNG-KVJIRVJXSA-N 2 1 326.528 4.455 20 0 EIADMP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ncc(C)s2)ccc1OC ZINC000183034925 1050946846 /nfs/dbraw/zinc/94/68/46/1050946846.db2.gz ZDQCZXHAYPNEEJ-OAHLLOKOSA-N 2 1 347.528 4.153 20 0 EIADMP Cc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000620109487 1051024789 /nfs/dbraw/zinc/02/47/89/1051024789.db2.gz JLZQDFKRUGVFEU-QZTJIDSGSA-N 2 1 326.509 4.440 20 0 EIADMP CC(C)(C)[C@]1(C[NH2+][C@@H]2CSC2(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001181204821 1051180366 /nfs/dbraw/zinc/18/03/66/1051180366.db2.gz IMBBSNPNWGJUDA-NQIIRXRSSA-N 2 1 346.584 4.408 20 0 EIADMP CC(C)(C)CC[C@H](CO)[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001181222401 1051188646 /nfs/dbraw/zinc/18/86/46/1051188646.db2.gz GZUYDSHNDGPZKT-SFHLNBCPSA-N 2 1 344.543 4.131 20 0 EIADMP CC(C)(C)CC[C@H](CO)[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001181222401 1051188652 /nfs/dbraw/zinc/18/86/52/1051188652.db2.gz GZUYDSHNDGPZKT-SFHLNBCPSA-N 2 1 344.543 4.131 20 0 EIADMP Cc1ccc(CC[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1C ZINC001181257958 1051199880 /nfs/dbraw/zinc/19/98/80/1051199880.db2.gz WAOUIBZRVLOBEE-UHFFFAOYSA-N 2 1 337.511 4.258 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CC3([C@@H]4CCCCO4)CCC3)C2)CC1 ZINC001190651128 1051244718 /nfs/dbraw/zinc/24/47/18/1051244718.db2.gz JFEXTMCRUHUJDX-SFTDATJTSA-N 2 1 348.575 4.170 20 0 EIADMP Clc1ccc2ccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)nc2c1 ZINC001191071785 1051341954 /nfs/dbraw/zinc/34/19/54/1051341954.db2.gz ZVBPIAIKIDBUHB-INIZCTEOSA-N 2 1 343.902 4.196 20 0 EIADMP Clc1ccc2ccc(C[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)nc2c1 ZINC001191071785 1051341961 /nfs/dbraw/zinc/34/19/61/1051341961.db2.gz ZVBPIAIKIDBUHB-INIZCTEOSA-N 2 1 343.902 4.196 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1cncs1 ZINC000268805704 1051394710 /nfs/dbraw/zinc/39/47/10/1051394710.db2.gz IUSUXLSPIFRHLC-JKSUJKDBSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1cncs1 ZINC000268805704 1051394717 /nfs/dbraw/zinc/39/47/17/1051394717.db2.gz IUSUXLSPIFRHLC-JKSUJKDBSA-N 2 1 329.513 4.226 20 0 EIADMP CC(C)CCOCC[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191359273 1051441294 /nfs/dbraw/zinc/44/12/94/1051441294.db2.gz SXKLWBYIMWZHRI-JOCHJYFZSA-N 2 1 344.543 4.037 20 0 EIADMP CC(C)CCOCC[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001191359273 1051441300 /nfs/dbraw/zinc/44/13/00/1051441300.db2.gz SXKLWBYIMWZHRI-JOCHJYFZSA-N 2 1 344.543 4.037 20 0 EIADMP CC(C)CCOCC[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001191359273 1051441305 /nfs/dbraw/zinc/44/13/05/1051441305.db2.gz SXKLWBYIMWZHRI-JOCHJYFZSA-N 2 1 344.543 4.037 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)CCc2cc(Cl)cc(Cl)c2)CC1 ZINC001191417509 1051452718 /nfs/dbraw/zinc/45/27/18/1051452718.db2.gz OBELJKFOHZKGMK-UHFFFAOYSA-N 2 1 329.315 4.342 20 0 EIADMP Cc1c(C)c(C)c(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c(C)c1C ZINC001191444108 1051459738 /nfs/dbraw/zinc/45/97/38/1051459738.db2.gz IEJFIRAZNXXCQP-NRFANRHFSA-N 2 1 328.544 4.392 20 0 EIADMP Cc1c(C)c(C)c(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c(C)c1C ZINC001191444108 1051459745 /nfs/dbraw/zinc/45/97/45/1051459745.db2.gz IEJFIRAZNXXCQP-NRFANRHFSA-N 2 1 328.544 4.392 20 0 EIADMP Cc1c(C)c(C)c(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c(C)c1C ZINC001191444108 1051459752 /nfs/dbraw/zinc/45/97/52/1051459752.db2.gz IEJFIRAZNXXCQP-NRFANRHFSA-N 2 1 328.544 4.392 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)C(C)C ZINC000155820079 1051464495 /nfs/dbraw/zinc/46/44/95/1051464495.db2.gz VRMBSYHSQZJUPN-MRXNPFEDSA-N 2 1 345.531 4.076 20 0 EIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2c(Cl)cccc2C(F)(F)F)CC1 ZINC001205570118 1051518990 /nfs/dbraw/zinc/51/89/90/1051518990.db2.gz GGPZBTWBCWWJMX-AWEZNQCLSA-N 2 1 338.776 4.012 20 0 EIADMP CCCCCOc1cc(C)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000774228041 1051521249 /nfs/dbraw/zinc/52/12/49/1051521249.db2.gz WFSKWOGVUDYSKB-IHWFROFDSA-N 2 1 330.516 4.279 20 0 EIADMP CCCCCOc1cc(C)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000774228041 1051521260 /nfs/dbraw/zinc/52/12/60/1051521260.db2.gz WFSKWOGVUDYSKB-IHWFROFDSA-N 2 1 330.516 4.279 20 0 EIADMP C[C@]1(Cc2ccc(F)c(F)c2)CCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001175492712 1051618120 /nfs/dbraw/zinc/61/81/20/1051618120.db2.gz QOPDDQYDEPIVLX-HXUWFJFHSA-N 2 1 336.470 4.238 20 0 EIADMP Cc1noc(C)c1[C@@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000671111878 1051637918 /nfs/dbraw/zinc/63/79/18/1051637918.db2.gz RTONNJVBZIQJLO-APMMTJHUSA-N 2 1 341.499 4.385 20 0 EIADMP CC(C)C[N@@H+](CCc1nsc2ccccc21)CC1CC[NH+](C)CC1 ZINC001175601578 1051667525 /nfs/dbraw/zinc/66/75/25/1051667525.db2.gz OXBMLQFGWVNDIZ-UHFFFAOYSA-N 2 1 345.556 4.139 20 0 EIADMP CCc1cccc(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)c1 ZINC001182683869 1051671606 /nfs/dbraw/zinc/67/16/06/1051671606.db2.gz HNIRKEHWZVVIRX-ZRBLBEILSA-N 2 1 334.507 4.392 20 0 EIADMP CCC1([NH+]2CCCCC2)CC[NH+](C[C@@H]2CC3(CO2)CCCCC3)CC1 ZINC001175768660 1051774823 /nfs/dbraw/zinc/77/48/23/1051774823.db2.gz MXAYDWJPLRDEQF-FQEVSTJZSA-N 2 1 348.575 4.456 20 0 EIADMP C[C@H]1CC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)CC[C@H]1C[NH3+] ZINC001205604869 1051795263 /nfs/dbraw/zinc/79/52/63/1051795263.db2.gz YIORDIYVIJNARP-ZFWWWQNUSA-N 2 1 329.315 4.233 20 0 EIADMP Cc1cc(C[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)cs1 ZINC001193092683 1051876148 /nfs/dbraw/zinc/87/61/48/1051876148.db2.gz FYZBLEDBKOURSW-IGOJGBNBSA-N 2 1 328.525 4.303 20 0 EIADMP C[N@@H+]1CC[C@@H]2CC[C@H](C1)[NH+]2CC/C=C/c1ccc(Br)cc1 ZINC001176069195 1051904136 /nfs/dbraw/zinc/90/41/36/1051904136.db2.gz HNSWPTAKTBOLJJ-FCBDPGHLSA-N 2 1 349.316 4.021 20 0 EIADMP C[N@H+]1CC[C@@H]2CC[C@H](C1)[NH+]2CC/C=C/c1ccc(Br)cc1 ZINC001176069195 1051904147 /nfs/dbraw/zinc/90/41/47/1051904147.db2.gz HNSWPTAKTBOLJJ-FCBDPGHLSA-N 2 1 349.316 4.021 20 0 EIADMP C[NH+]1CC[C@@H]2CC[C@H](C1)[N@@H+]2CC/C=C/c1ccc(Br)cc1 ZINC001176069195 1051904153 /nfs/dbraw/zinc/90/41/53/1051904153.db2.gz HNSWPTAKTBOLJJ-FCBDPGHLSA-N 2 1 349.316 4.021 20 0 EIADMP C[NH+]1CC[C@@H]2CC[C@H](C1)[N@H+]2CC/C=C/c1ccc(Br)cc1 ZINC001176069195 1051904161 /nfs/dbraw/zinc/90/41/61/1051904161.db2.gz HNSWPTAKTBOLJJ-FCBDPGHLSA-N 2 1 349.316 4.021 20 0 EIADMP C[C@H]1CC[N@@H+](Cc2c(Cl)cccc2C(F)(F)F)CC[C@@H]1C[NH3+] ZINC001205628555 1051915282 /nfs/dbraw/zinc/91/52/82/1051915282.db2.gz VZXUTCYMPLUGOM-NWDGAFQWSA-N 2 1 334.813 4.166 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC(C)(C)CO1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001184045756 1051943354 /nfs/dbraw/zinc/94/33/54/1051943354.db2.gz QCTHVMYNINRUCM-CEWLAPEOSA-N 2 1 344.543 4.082 20 0 EIADMP C[NH+](C)[C@@H]1CC[C@@H]2C[N@@H+](Cc3cc(F)cc(C(F)(F)F)c3)C[C@H]2C1 ZINC001184303249 1051982238 /nfs/dbraw/zinc/98/22/38/1051982238.db2.gz NZSBTSAGSRRTRN-CKEIUWERSA-N 2 1 344.396 4.007 20 0 EIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H](CCc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC001184389488 1052002153 /nfs/dbraw/zinc/00/21/53/1052002153.db2.gz XKFWUXZHWNYIKD-ZJZGAYNASA-N 2 1 348.534 4.160 20 0 EIADMP C[NH+]1CCC2(CCC[N@@H+](CCSc3cccc(Cl)c3)C2)CC1 ZINC001193873173 1052022321 /nfs/dbraw/zinc/02/23/21/1052022321.db2.gz SZZALHPMHLCBOM-UHFFFAOYSA-N 2 1 338.948 4.240 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC2(CCO)CCCCC2)cc1 ZINC000165650073 1052072926 /nfs/dbraw/zinc/07/29/26/1052072926.db2.gz MXJPKKCNRVIILR-QGZVFWFLSA-N 2 1 341.499 4.164 20 0 EIADMP COc1cccc(C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)c2ccccc2)c1 ZINC000166340037 1052092497 /nfs/dbraw/zinc/09/24/97/1052092497.db2.gz RDWWKJWOKFOJKX-XJABCFGWSA-N 2 1 338.495 4.051 20 0 EIADMP COc1cccc(C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)c2ccccc2)c1 ZINC000166340037 1052092502 /nfs/dbraw/zinc/09/25/02/1052092502.db2.gz RDWWKJWOKFOJKX-XJABCFGWSA-N 2 1 338.495 4.051 20 0 EIADMP Cc1cccc(CC[NH+]2CCC(c3ccccc3)([NH+]3CCCC3)CC2)n1 ZINC001176566658 1052132805 /nfs/dbraw/zinc/13/28/05/1052132805.db2.gz AUSOKXVRWOVMOA-UHFFFAOYSA-N 2 1 349.522 4.020 20 0 EIADMP c1cc2c(s1)CCC[C@H]2[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000336707950 1052513287 /nfs/dbraw/zinc/51/32/87/1052513287.db2.gz JFXYQAFAHHBICT-IEBWSBKVSA-N 2 1 326.509 4.237 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000339069041 1052552111 /nfs/dbraw/zinc/55/21/11/1052552111.db2.gz QMTQCNBNPDQVNN-RZUBCFFCSA-N 2 1 344.543 4.256 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(CNc2c(C)c[nH+]c3c(C)cccc23)cn1 ZINC000185278898 1052566678 /nfs/dbraw/zinc/56/66/78/1052566678.db2.gz CGPMWLTYCCOWSA-UHFFFAOYSA-N 2 1 343.434 4.353 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000671298593 1052590646 /nfs/dbraw/zinc/59/06/46/1052590646.db2.gz RNQHKZKSIOUJQD-ROUUACIJSA-N 2 1 338.417 4.193 20 0 EIADMP C[C@@H]1C[C@@H](NCC2=Cc3ccccc3OC2)CC[N@H+]1Cc1ccccc1 ZINC000175978038 1052601736 /nfs/dbraw/zinc/60/17/36/1052601736.db2.gz IYXJESHBXMTHCL-GCJKJVERSA-N 2 1 348.490 4.105 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2=Cc3ccccc3OC2)CC[N@@H+]1Cc1ccccc1 ZINC000175978038 1052601738 /nfs/dbraw/zinc/60/17/38/1052601738.db2.gz IYXJESHBXMTHCL-GCJKJVERSA-N 2 1 348.490 4.105 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CN[C@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357837 1052632275 /nfs/dbraw/zinc/63/22/75/1052632275.db2.gz CAZRBZRLHWWQQM-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CN[C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357837 1052632278 /nfs/dbraw/zinc/63/22/78/1052632278.db2.gz CAZRBZRLHWWQQM-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CN[C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623357837 1052632280 /nfs/dbraw/zinc/63/22/80/1052632280.db2.gz CAZRBZRLHWWQQM-NQIIRXRSSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357837 1052632284 /nfs/dbraw/zinc/63/22/84/1052632284.db2.gz CAZRBZRLHWWQQM-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357837 1052632286 /nfs/dbraw/zinc/63/22/86/1052632286.db2.gz CAZRBZRLHWWQQM-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357837 1052632289 /nfs/dbraw/zinc/63/22/89/1052632289.db2.gz CAZRBZRLHWWQQM-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1C[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623357837 1052632294 /nfs/dbraw/zinc/63/22/94/1052632294.db2.gz CAZRBZRLHWWQQM-NQIIRXRSSA-N 3 1 343.559 4.023 20 0 EIADMP Cc1ccc(C[C@H](N[C@H]2CC[N@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420809 1052652072 /nfs/dbraw/zinc/65/20/72/1052652072.db2.gz PDUDXHPIRNJCFA-FPOVZHCZSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@H]([NH2+][C@H]2CCN(C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420809 1052652073 /nfs/dbraw/zinc/65/20/73/1052652073.db2.gz PDUDXHPIRNJCFA-FPOVZHCZSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@H]([NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420809 1052652075 /nfs/dbraw/zinc/65/20/75/1052652075.db2.gz PDUDXHPIRNJCFA-FPOVZHCZSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420809 1052652077 /nfs/dbraw/zinc/65/20/77/1052652077.db2.gz PDUDXHPIRNJCFA-FPOVZHCZSA-N 2 1 337.511 4.136 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000177933349 1052694255 /nfs/dbraw/zinc/69/42/55/1052694255.db2.gz RGILGGXUTLPYBU-LQWHRVPQSA-N 2 1 338.495 4.051 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cccc(OC(F)(F)F)c1 ZINC000178257998 1052703552 /nfs/dbraw/zinc/70/35/52/1052703552.db2.gz IZQFQBYIKNCSMB-ZDUSSCGKSA-N 2 1 342.405 4.110 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000178707747 1052711016 /nfs/dbraw/zinc/71/10/16/1052711016.db2.gz RFLTZDHNXCPGFC-OLZOCXBDSA-N 2 1 341.377 4.077 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@H](C)Cn2cc[nH+]c2C)c2ccccc12 ZINC000178698646 1052711301 /nfs/dbraw/zinc/71/13/01/1052711301.db2.gz VSZYMPOIUZTXHU-JKSUJKDBSA-N 2 1 337.467 4.340 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000178707825 1052711356 /nfs/dbraw/zinc/71/13/56/1052711356.db2.gz AIQQUUNKCQLZGG-QWHCGFSZSA-N 2 1 341.377 4.077 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(F)cc1C(F)(F)F ZINC000623866242 1052825759 /nfs/dbraw/zinc/82/57/59/1052825759.db2.gz PLKBZOAQDNWXEH-IACUBPJLSA-N 2 1 330.369 4.122 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)cc1C(F)(F)F ZINC000623866242 1052825760 /nfs/dbraw/zinc/82/57/60/1052825760.db2.gz PLKBZOAQDNWXEH-IACUBPJLSA-N 2 1 330.369 4.122 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(F)cc1C(F)(F)F ZINC000623866243 1052825884 /nfs/dbraw/zinc/82/58/84/1052825884.db2.gz PLKBZOAQDNWXEH-UBHSHLNASA-N 2 1 330.369 4.122 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)cc1C(F)(F)F ZINC000623866243 1052825886 /nfs/dbraw/zinc/82/58/86/1052825886.db2.gz PLKBZOAQDNWXEH-UBHSHLNASA-N 2 1 330.369 4.122 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(F)cc1C(F)(F)F ZINC000623866244 1052825990 /nfs/dbraw/zinc/82/59/90/1052825990.db2.gz PLKBZOAQDNWXEH-YUTCNCBUSA-N 2 1 330.369 4.122 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)cc1C(F)(F)F ZINC000623866244 1052825994 /nfs/dbraw/zinc/82/59/94/1052825994.db2.gz PLKBZOAQDNWXEH-YUTCNCBUSA-N 2 1 330.369 4.122 20 0 EIADMP COc1ccc(C2CCC([NH2+]C[C@H]3CCCC[N@@H+](C)C3)CC2)cc1 ZINC000624121874 1052867298 /nfs/dbraw/zinc/86/72/98/1052867298.db2.gz FCTUWUIVOPKRLN-PGYGNJIDSA-N 2 1 330.516 4.043 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000624125005 1052868185 /nfs/dbraw/zinc/86/81/85/1052868185.db2.gz QUOXXPWTDWFLTH-CHWSQXEVSA-N 2 1 332.385 4.227 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@H]3CCC[N@@H+](C(C)C)C3)oc21 ZINC000181700166 1052893439 /nfs/dbraw/zinc/89/34/39/1052893439.db2.gz QJNCDQYCENMTDK-JKSUJKDBSA-N 2 1 330.472 4.212 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@H]3CCC[N@H+](C(C)C)C3)oc21 ZINC000181700166 1052893442 /nfs/dbraw/zinc/89/34/42/1052893442.db2.gz QJNCDQYCENMTDK-JKSUJKDBSA-N 2 1 330.472 4.212 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)C12CCC2 ZINC000181810813 1052899269 /nfs/dbraw/zinc/89/92/69/1052899269.db2.gz KKYMESATDVQLSL-KANFNMMFSA-N 2 1 348.556 4.068 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)C12CCC2 ZINC000181810813 1052899271 /nfs/dbraw/zinc/89/92/71/1052899271.db2.gz KKYMESATDVQLSL-KANFNMMFSA-N 2 1 348.556 4.068 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@@H+]1C ZINC000182332279 1052927550 /nfs/dbraw/zinc/92/75/50/1052927550.db2.gz JGYFHJDQNDAZQV-CJNGLKHVSA-N 2 1 326.406 4.157 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@H+]1C ZINC000182332279 1052927554 /nfs/dbraw/zinc/92/75/54/1052927554.db2.gz JGYFHJDQNDAZQV-CJNGLKHVSA-N 2 1 326.406 4.157 20 0 EIADMP C[C@@H]([NH2+]Cc1cc(F)cc2cccnc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185722914 1053021616 /nfs/dbraw/zinc/02/16/16/1053021616.db2.gz FBDFHONQBNRCFN-WBVHZDCISA-N 2 1 341.474 4.117 20 0 EIADMP Fc1cc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1Cl ZINC000380910871 1053047245 /nfs/dbraw/zinc/04/72/45/1053047245.db2.gz LQOYBRAFXOJGPH-QGZVFWFLSA-N 2 1 332.850 4.091 20 0 EIADMP Cc1oc2ccccc2c1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381134585 1053054731 /nfs/dbraw/zinc/05/47/31/1053054731.db2.gz AEUCCACRWBUTMA-LJQANCHMSA-N 2 1 334.463 4.353 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000381210919 1053058453 /nfs/dbraw/zinc/05/84/53/1053058453.db2.gz UMPYGVHSJCBSQG-HMFYCAOWSA-N 2 1 338.495 4.084 20 0 EIADMP COC1([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000850470610 1053250109 /nfs/dbraw/zinc/25/01/09/1053250109.db2.gz GAIMRDDYZRJUQQ-XSLAUPDRSA-N 2 1 342.527 4.119 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)o1 ZINC000383543015 1053352590 /nfs/dbraw/zinc/35/25/90/1053352590.db2.gz UXPFVLFNVNGUBZ-ABSDTBQOSA-N 2 1 326.484 4.458 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCC[C@@]1(C)Cc1cccc(Cl)c1 ZINC001195756640 1053472451 /nfs/dbraw/zinc/47/24/51/1053472451.db2.gz HTRWWFFGYPSDDE-IBGZPJMESA-N 2 1 331.891 4.103 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+]1CCC[C@@]1(C)Cc1cccc(Cl)c1 ZINC001195756640 1053472455 /nfs/dbraw/zinc/47/24/55/1053472455.db2.gz HTRWWFFGYPSDDE-IBGZPJMESA-N 2 1 331.891 4.103 20 0 EIADMP CCC[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)C1CCCCC1 ZINC000765248735 1053475423 /nfs/dbraw/zinc/47/54/23/1053475423.db2.gz BQGDFHXELXRFLF-LJQANCHMSA-N 2 1 326.488 4.414 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)CSC(C)(C)C)cc1F ZINC000765326642 1053503136 /nfs/dbraw/zinc/50/31/36/1053503136.db2.gz RHHJJEXNWMKSNH-ZDUSSCGKSA-N 2 1 335.492 4.330 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000385671929 1053541875 /nfs/dbraw/zinc/54/18/75/1053541875.db2.gz DXSHQXWENFQPIQ-LVCYWYKZSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866248628 1053665089 /nfs/dbraw/zinc/66/50/89/1053665089.db2.gz FPCYQRHBPFCQTN-LBPRGKRZSA-N 2 1 333.863 4.149 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866289191 1053679597 /nfs/dbraw/zinc/67/95/97/1053679597.db2.gz FGTUJARCQPWYPK-GFCCVEGCSA-N 2 1 335.879 4.395 20 0 EIADMP CCCC[N@@H+](CCCOC(F)(F)F)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545110 1053697502 /nfs/dbraw/zinc/69/75/02/1053697502.db2.gz KZQJJCVLMZUEIF-UHFFFAOYSA-N 2 1 338.458 4.324 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1c(C)cc(C)nc1C ZINC001196623981 1053715310 /nfs/dbraw/zinc/71/53/10/1053715310.db2.gz WCYDIWFTANOBTR-UHFFFAOYSA-N 2 1 325.500 4.091 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC[C@H]2CCSC2)CC1 ZINC000866402254 1053715659 /nfs/dbraw/zinc/71/56/59/1053715659.db2.gz ISFCSLZUDDYPBF-HDYDNRTBSA-N 2 1 332.557 4.162 20 0 EIADMP CCOc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386432699 1053723450 /nfs/dbraw/zinc/72/34/50/1053723450.db2.gz OOEJLXSFWDMRGI-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP CCOc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386432699 1053723469 /nfs/dbraw/zinc/72/34/69/1053723469.db2.gz OOEJLXSFWDMRGI-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC23CCOCC3)cc1 ZINC000866528601 1053766891 /nfs/dbraw/zinc/76/68/91/1053766891.db2.gz GPBMVBUXBDQUJZ-APWZRJJASA-N 2 1 339.483 4.038 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCC23CCOCC3)cc1 ZINC000866528602 1053767562 /nfs/dbraw/zinc/76/75/62/1053767562.db2.gz GPBMVBUXBDQUJZ-LPHOPBHVSA-N 2 1 339.483 4.038 20 0 EIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@]1(C)C[N@@H+](CCC1CCCC1)C2 ZINC001196960032 1053814793 /nfs/dbraw/zinc/81/47/93/1053814793.db2.gz CDHZKJYCQVOTLF-SZPZYZBQSA-N 2 1 326.528 4.411 20 0 EIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@]1(C)C[N@H+](CCC1CCCC1)C2 ZINC001196960032 1053814802 /nfs/dbraw/zinc/81/48/02/1053814802.db2.gz CDHZKJYCQVOTLF-SZPZYZBQSA-N 2 1 326.528 4.411 20 0 EIADMP C[C@]12C[NH+](CCC3CCCC3)C[C@@]1(C)C[N@H+](Cc1ccccc1)C2 ZINC001196960032 1053814805 /nfs/dbraw/zinc/81/48/05/1053814805.db2.gz CDHZKJYCQVOTLF-SZPZYZBQSA-N 2 1 326.528 4.411 20 0 EIADMP C[C@]12C[NH+](CCC3CCCC3)C[C@@]1(C)C[N@@H+](Cc1ccccc1)C2 ZINC001196960032 1053814806 /nfs/dbraw/zinc/81/48/06/1053814806.db2.gz CDHZKJYCQVOTLF-SZPZYZBQSA-N 2 1 326.528 4.411 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000386686412 1053820533 /nfs/dbraw/zinc/82/05/33/1053820533.db2.gz ZCRDBFWRGGDAMF-LQWHRVPQSA-N 2 1 338.495 4.084 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000386686412 1053820534 /nfs/dbraw/zinc/82/05/34/1053820534.db2.gz ZCRDBFWRGGDAMF-LQWHRVPQSA-N 2 1 338.495 4.084 20 0 EIADMP C[N@H+]1CC[C@@H]2CN(CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031947 1053828575 /nfs/dbraw/zinc/82/85/75/1053828575.db2.gz NFLNZDJNOSRVLI-QAPCUYQASA-N 2 1 341.326 4.342 20 0 EIADMP C[N@@H+]1CC[C@@H]2C[NH+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031947 1053828582 /nfs/dbraw/zinc/82/85/82/1053828582.db2.gz NFLNZDJNOSRVLI-QAPCUYQASA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@@H]2C[NH+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031947 1053828587 /nfs/dbraw/zinc/82/85/87/1053828587.db2.gz NFLNZDJNOSRVLI-QAPCUYQASA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2C[N@H+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031947 1053828590 /nfs/dbraw/zinc/82/85/90/1053828590.db2.gz NFLNZDJNOSRVLI-QAPCUYQASA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2C[N@@H+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031947 1053828591 /nfs/dbraw/zinc/82/85/91/1053828591.db2.gz NFLNZDJNOSRVLI-QAPCUYQASA-N 2 1 341.326 4.342 20 0 EIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000765704678 1053850924 /nfs/dbraw/zinc/85/09/24/1053850924.db2.gz ZEQKDTGUVDKPLU-OFNKIYASSA-N 2 1 334.507 4.137 20 0 EIADMP CC1(C)CC[C@H](C[NH+]2CCC(c3ccccc3)([NH+]3CCCC3)CC2)O1 ZINC001198203133 1054095149 /nfs/dbraw/zinc/09/51/49/1054095149.db2.gz WOMWXFIBFOCJGO-HXUWFJFHSA-N 2 1 342.527 4.031 20 0 EIADMP CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cs1 ZINC000172341566 1054205666 /nfs/dbraw/zinc/20/56/66/1054205666.db2.gz SLWKEOZDJSNTSU-OAHLLOKOSA-N 2 1 347.528 4.058 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)cc1F ZINC000872027069 1054344696 /nfs/dbraw/zinc/34/46/96/1054344696.db2.gz JOCNCEXFWSOZAN-QFBILLFUSA-N 2 1 345.462 4.003 20 0 EIADMP CC[C@H](CCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000872032509 1054351287 /nfs/dbraw/zinc/35/12/87/1054351287.db2.gz VICIDGYXKIORFS-QZTJIDSGSA-N 2 1 342.449 4.262 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC001199198656 1054362208 /nfs/dbraw/zinc/36/22/08/1054362208.db2.gz QZEXLOSXODNXNF-KRWDZBQOSA-N 2 1 347.522 4.026 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC001199198656 1054362219 /nfs/dbraw/zinc/36/22/19/1054362219.db2.gz QZEXLOSXODNXNF-KRWDZBQOSA-N 2 1 347.522 4.026 20 0 EIADMP CC(C)C1CCC(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC1 ZINC001199237537 1054369975 /nfs/dbraw/zinc/36/99/75/1054369975.db2.gz CSTGEXLVWNNQSY-UHFFFAOYSA-N 2 1 328.544 4.487 20 0 EIADMP CC(C)C1CCC(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)CC1 ZINC001199237537 1054369987 /nfs/dbraw/zinc/36/99/87/1054369987.db2.gz CSTGEXLVWNNQSY-UHFFFAOYSA-N 2 1 328.544 4.487 20 0 EIADMP CC[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCO1 ZINC001199630290 1054435947 /nfs/dbraw/zinc/43/59/47/1054435947.db2.gz VKTKJEHVTOKXOB-IRLDBZIGSA-N 2 1 344.543 4.498 20 0 EIADMP C[NH+](C)CCC1CC[NH+](Cc2csc(-c3cccs3)n2)CC1 ZINC000056524203 1054472949 /nfs/dbraw/zinc/47/29/49/1054472949.db2.gz GQKJKRDNJKELTQ-UHFFFAOYSA-N 2 1 335.542 4.035 20 0 EIADMP [NH3+][C@@H](C[C@@H]1CCC[N@@H+](Cc2scnc2C2CC2)C1)C1CCCC1 ZINC000873232498 1054508900 /nfs/dbraw/zinc/50/89/00/1054508900.db2.gz RPIAAMVDYVWVOG-YOEHRIQHSA-N 2 1 333.545 4.140 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1)c1ccc(C(F)(F)F)nc1 ZINC000873297497 1054525222 /nfs/dbraw/zinc/52/52/22/1054525222.db2.gz XSGMZSVDXOPNFI-GZBFAFLISA-N 2 1 329.410 4.062 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccc(F)c2F)CC1 ZINC000060377504 1054680348 /nfs/dbraw/zinc/68/03/48/1054680348.db2.gz ZJMKKUHJMDEZJA-UHFFFAOYSA-N 2 1 344.449 4.309 20 0 EIADMP COc1cccc(C[N@H+]2CCC3(C2)CC[NH+](CC(C)(C)C)CC3)c1 ZINC001201434932 1054808500 /nfs/dbraw/zinc/80/85/00/1054808500.db2.gz FEHWECMOBFNXKR-UHFFFAOYSA-N 2 1 330.516 4.029 20 0 EIADMP Cc1cn2cc(NC3=C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)ccc2[nH+]1 ZINC001201475777 1054828626 /nfs/dbraw/zinc/82/86/26/1054828626.db2.gz WENNCNXZVWACOE-RTWAWAEBSA-N 2 1 344.462 4.375 20 0 EIADMP Cc1cn2cc(NC3=C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)ccc2[nH+]1 ZINC001201475777 1054828629 /nfs/dbraw/zinc/82/86/29/1054828629.db2.gz WENNCNXZVWACOE-RTWAWAEBSA-N 2 1 344.462 4.375 20 0 EIADMP c1ccc(CCC[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1 ZINC001201673811 1054872855 /nfs/dbraw/zinc/87/28/55/1054872855.db2.gz PTMLRQATNISFCL-HSZRJFAPSA-N 2 1 334.507 4.217 20 0 EIADMP c1ccc(CCC[N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC001201672749 1054873362 /nfs/dbraw/zinc/87/33/62/1054873362.db2.gz XEWPHMPDEHYQPR-DHIUTWEWSA-N 2 1 334.507 4.073 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc3c(ccnc3Cl)o2)C1 ZINC000876933409 1054986113 /nfs/dbraw/zinc/98/61/13/1054986113.db2.gz OKPYOSUFNPDUIJ-AWEZNQCLSA-N 2 1 335.879 4.083 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000173441746 1055002119 /nfs/dbraw/zinc/00/21/19/1055002119.db2.gz VORVKBZZMKRSCZ-ZDUSSCGKSA-N 2 1 325.378 4.341 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000173441762 1055006793 /nfs/dbraw/zinc/00/67/93/1055006793.db2.gz VORVKBZZMKRSCZ-CYBMUJFWSA-N 2 1 325.378 4.341 20 0 EIADMP Clc1nccc2oc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)cc21 ZINC000877079953 1055012963 /nfs/dbraw/zinc/01/29/63/1055012963.db2.gz CFKIRGZLQSBSKK-UHFFFAOYSA-N 2 1 347.890 4.368 20 0 EIADMP Cc1c(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)ccnc1F ZINC000862270819 1055042501 /nfs/dbraw/zinc/04/25/01/1055042501.db2.gz TTZDLMNGLMUVBP-INIZCTEOSA-N 2 1 341.474 4.193 20 0 EIADMP Clc1ccc([C@H](C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)OCC2CC2)cc1 ZINC000671764597 1055056718 /nfs/dbraw/zinc/05/67/18/1055056718.db2.gz GLEVDHRNUDVPAP-AQNXPRMDSA-N 2 1 348.918 4.024 20 0 EIADMP CC[C@@H](C)Oc1cc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)ccc1OC ZINC001202233113 1055108954 /nfs/dbraw/zinc/10/89/54/1055108954.db2.gz GAWDSVDIDYLMSZ-QGZVFWFLSA-N 2 1 348.531 4.084 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C12CCC2)[C@@H](C)c1ccccc1C(F)(F)F ZINC000863542828 1055223728 /nfs/dbraw/zinc/22/37/28/1055223728.db2.gz SPQGIQVTUNFHJR-WWGRRREGSA-N 2 1 326.406 4.072 20 0 EIADMP Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000180143839 1058379068 /nfs/dbraw/zinc/37/90/68/1058379068.db2.gz FXFACPCRCAEDRM-IXDOHACOSA-N 2 1 340.515 4.047 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000180233345 1058482351 /nfs/dbraw/zinc/48/23/51/1058482351.db2.gz BNTFNGAUONRNDG-GOSISDBHSA-N 2 1 333.479 4.249 20 0 EIADMP Cc1cc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc(C)c1OC(F)F ZINC000742717505 1058755831 /nfs/dbraw/zinc/75/58/31/1058755831.db2.gz JTOVKHJUXBXTGG-UHFFFAOYSA-N 2 1 338.442 4.011 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3cnccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379619229 1060136695 /nfs/dbraw/zinc/13/66/95/1060136695.db2.gz BFNASELXOMSVQN-MBSDFSHPSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3cnccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379619229 1060136728 /nfs/dbraw/zinc/13/67/28/1060136728.db2.gz BFNASELXOMSVQN-MBSDFSHPSA-N 2 1 345.490 4.378 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCCc3cc(Br)ccc31)C2 ZINC001169101517 1060637222 /nfs/dbraw/zinc/63/72/22/1060637222.db2.gz TZEYQEIFWNTAQB-KYHPRHEASA-N 2 1 349.316 4.041 20 0 EIADMP Cc1cc(C(F)(F)F)cc(N[C@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)[nH+]1 ZINC001169137304 1060653962 /nfs/dbraw/zinc/65/39/62/1060653962.db2.gz KRQXWCGWKZLIAA-XJKSGUPXSA-N 2 1 329.410 4.364 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4C)cc2)cc1 ZINC001169107462 1060658532 /nfs/dbraw/zinc/65/85/32/1060658532.db2.gz HJXNNMLGTVNXAC-MZADTFQBSA-N 2 1 336.479 4.077 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147035 1060665172 /nfs/dbraw/zinc/66/51/72/1060665172.db2.gz RMUHRKPLVPREKM-WCVJEAGWSA-N 2 1 339.310 4.408 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CC[C@@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147035 1060665177 /nfs/dbraw/zinc/66/51/77/1060665177.db2.gz RMUHRKPLVPREKM-WCVJEAGWSA-N 2 1 339.310 4.408 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CC[C@@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147035 1060665186 /nfs/dbraw/zinc/66/51/86/1060665186.db2.gz RMUHRKPLVPREKM-WCVJEAGWSA-N 2 1 339.310 4.408 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1cccc(Br)c1)C2 ZINC001169147573 1060666331 /nfs/dbraw/zinc/66/63/31/1060666331.db2.gz UYZZPIZTUFZZLE-VSZNYVQBSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1cccc(Br)c1)C2 ZINC001169147573 1060666336 /nfs/dbraw/zinc/66/63/36/1060666336.db2.gz UYZZPIZTUFZZLE-VSZNYVQBSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1cccc(Br)c1)C2 ZINC001169147573 1060666342 /nfs/dbraw/zinc/66/63/42/1060666342.db2.gz UYZZPIZTUFZZLE-VSZNYVQBSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1cccc(Br)c1)C2 ZINC001169147573 1060666346 /nfs/dbraw/zinc/66/63/46/1060666346.db2.gz UYZZPIZTUFZZLE-VSZNYVQBSA-N 2 1 349.316 4.211 20 0 EIADMP C[C@@H](c1ccc(Br)cc1)[N@@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169160467 1060673510 /nfs/dbraw/zinc/67/35/10/1060673510.db2.gz GHKCVAMGKXBLSQ-SJWGOKEGSA-N 2 1 337.305 4.067 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ccc([C@H]2CC[N@H+](C)C2)cc1 ZINC001169690520 1060902885 /nfs/dbraw/zinc/90/28/85/1060902885.db2.gz WSWYFEDAXUMUDI-GHTZIAJQSA-N 2 1 335.495 4.346 20 0 EIADMP C[N@@H+](CCCOc1cccc(C(C)(C)C)c1)CCC[NH+]1CCCC1 ZINC001169762056 1060952376 /nfs/dbraw/zinc/95/23/76/1060952376.db2.gz QNNOVHFSYULCQO-UHFFFAOYSA-N 2 1 332.532 4.171 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)C1 ZINC000532226714 1032106865 /nfs/dbraw/zinc/10/68/65/1032106865.db2.gz PIFNCDIYBBQZQN-IUODEOHRSA-N 2 1 343.298 4.139 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)C1 ZINC000532226714 1032106884 /nfs/dbraw/zinc/10/68/84/1032106884.db2.gz PIFNCDIYBBQZQN-IUODEOHRSA-N 2 1 343.298 4.139 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2Oc2cccc(F)c2)CC[N@@H+]1C ZINC000532226295 1032107391 /nfs/dbraw/zinc/10/73/91/1032107391.db2.gz WFIQHIDZCUJWOM-CRAIPNDOSA-N 2 1 328.431 4.190 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2Oc2cccc(F)c2)CC[N@H+]1C ZINC000532226295 1032107417 /nfs/dbraw/zinc/10/74/17/1032107417.db2.gz WFIQHIDZCUJWOM-CRAIPNDOSA-N 2 1 328.431 4.190 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(Br)s2)CC1 ZINC000038003236 1046167551 /nfs/dbraw/zinc/16/75/51/1046167551.db2.gz IFRNGGQXIQOODU-GFCCVEGCSA-N 2 1 345.350 4.426 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(Br)cs1 ZINC000194089578 1032198085 /nfs/dbraw/zinc/19/80/85/1032198085.db2.gz HLGNFXNWUSTWBA-NSHDSACASA-N 2 1 345.350 4.424 20 0 EIADMP Clc1cc2cccnc2c(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000172575425 1032327482 /nfs/dbraw/zinc/32/74/82/1032327482.db2.gz POVUZWURWFTYCH-IBGZPJMESA-N 2 1 343.902 4.339 20 0 EIADMP Clc1cc2cccnc2c(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000172575425 1032327495 /nfs/dbraw/zinc/32/74/95/1032327495.db2.gz POVUZWURWFTYCH-IBGZPJMESA-N 2 1 343.902 4.339 20 0 EIADMP C(=C/C[N@H+]1CCC[C@H]1c1ccncc1)\C[NH+]1CCC[C@H]1c1ccncc1 ZINC000245601468 1032333419 /nfs/dbraw/zinc/33/34/19/1032333419.db2.gz MMSJPTZXSMTSFJ-HNSCLNPNSA-N 2 1 348.494 4.007 20 0 EIADMP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2ccccc2C(C)(C)C)CC1 ZINC000532845864 1032357022 /nfs/dbraw/zinc/35/70/22/1032357022.db2.gz XGMPUVZVEXOWIW-LJQANCHMSA-N 2 1 345.575 4.052 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000173386127 1032360327 /nfs/dbraw/zinc/36/03/27/1032360327.db2.gz WQFJNABANNHMRJ-OLZOCXBDSA-N 2 1 325.378 4.197 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)C1CC(F)(F)C1 ZINC000529543534 1032435275 /nfs/dbraw/zinc/43/52/75/1032435275.db2.gz BBVXMKVYPLHOOT-HEHGZKQESA-N 2 1 328.472 4.154 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)C1CC(F)(F)C1 ZINC000529543534 1032435277 /nfs/dbraw/zinc/43/52/77/1032435277.db2.gz BBVXMKVYPLHOOT-HEHGZKQESA-N 2 1 328.472 4.154 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)C3CCCCC3)CC2)oc1C ZINC000177327686 1032502544 /nfs/dbraw/zinc/50/25/44/1032502544.db2.gz ISCNJFDGRKERDX-INIZCTEOSA-N 2 1 333.520 4.062 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)CC1CC[NH2+]CC1 ZINC000178981785 1032545767 /nfs/dbraw/zinc/54/57/67/1032545767.db2.gz DCFKTOJDCHSTLB-OAHLLOKOSA-N 2 1 329.513 4.111 20 0 EIADMP C[C@@H](c1ccc(CN2CCC3(CCC[N@H+]3C)CC2)cc1)C(F)(F)F ZINC000450646696 1032601345 /nfs/dbraw/zinc/60/13/45/1032601345.db2.gz SDRRPCMUTBSBAR-HNNXBMFYSA-N 2 1 340.433 4.413 20 0 EIADMP C[C@@H](c1ccc(C[NH+]2CCC3(CCC[N@@H+]3C)CC2)cc1)C(F)(F)F ZINC000450646696 1032601364 /nfs/dbraw/zinc/60/13/64/1032601364.db2.gz SDRRPCMUTBSBAR-HNNXBMFYSA-N 2 1 340.433 4.413 20 0 EIADMP C[C@@H](c1ccc(C[NH+]2CCC3(CCC[N@H+]3C)CC2)cc1)C(F)(F)F ZINC000450646696 1032601393 /nfs/dbraw/zinc/60/13/93/1032601393.db2.gz SDRRPCMUTBSBAR-HNNXBMFYSA-N 2 1 340.433 4.413 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](CC)c2ccc(F)cc2)[C@@H](C)C1 ZINC000121298503 1032623194 /nfs/dbraw/zinc/62/31/94/1032623194.db2.gz ADSMFFUVCAJAEV-VDGAXYAQSA-N 2 1 336.495 4.003 20 0 EIADMP CCC1(C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CCOCC1 ZINC000512396972 1032664797 /nfs/dbraw/zinc/66/47/97/1032664797.db2.gz XVRRFJOWCCLKSY-PZJWPPBQSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000643545770 1018896704 /nfs/dbraw/zinc/89/67/04/1018896704.db2.gz CDSFLOQCVWTDTL-WCQYABFASA-N 2 1 344.833 4.267 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1cscn1 ZINC000537944565 1019084783 /nfs/dbraw/zinc/08/47/83/1019084783.db2.gz GHSOJDIGEDRANI-RYRKJORJSA-N 2 1 329.513 4.094 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000274765450 1019411805 /nfs/dbraw/zinc/41/18/05/1019411805.db2.gz LECKHYPHVZWILZ-VXSCBNMQSA-N 2 1 344.543 4.080 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613704 1019462375 /nfs/dbraw/zinc/46/23/75/1019462375.db2.gz YMUBJSLFCPVHKF-DZGCQCFKSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@H](C[N@@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613704 1019462397 /nfs/dbraw/zinc/46/23/97/1019462397.db2.gz YMUBJSLFCPVHKF-DZGCQCFKSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@H](C[N@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613704 1019462427 /nfs/dbraw/zinc/46/24/27/1019462427.db2.gz YMUBJSLFCPVHKF-DZGCQCFKSA-N 2 1 327.299 4.125 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH+]2CCC[C@@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614634 1019487638 /nfs/dbraw/zinc/48/76/38/1019487638.db2.gz FCDSIUBPQNLEHT-WMLDXEAASA-N 2 1 342.405 4.064 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH+]2CCC[C@@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614634 1019487663 /nfs/dbraw/zinc/48/76/63/1019487663.db2.gz FCDSIUBPQNLEHT-WMLDXEAASA-N 2 1 342.405 4.064 20 0 EIADMP C[NH+]1CCC[C@H](C[N@@H+]2CCC[C@@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614634 1019487700 /nfs/dbraw/zinc/48/77/00/1019487700.db2.gz FCDSIUBPQNLEHT-WMLDXEAASA-N 2 1 342.405 4.064 20 0 EIADMP C[NH+]1CCC[C@H](C[N@H+]2CCC[C@@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614634 1019487726 /nfs/dbraw/zinc/48/77/26/1019487726.db2.gz FCDSIUBPQNLEHT-WMLDXEAASA-N 2 1 342.405 4.064 20 0 EIADMP c1cc(C[NH+]2CCOCC2)ccc1C[N@@H+]1CCC[C@@H]1C1CCCCC1 ZINC001167078269 1019575616 /nfs/dbraw/zinc/57/56/16/1019575616.db2.gz PREWCXNIGAVATR-JOCHJYFZSA-N 2 1 342.527 4.064 20 0 EIADMP c1cc(C[NH+]2CCOCC2)ccc1C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC001167078269 1019575632 /nfs/dbraw/zinc/57/56/32/1019575632.db2.gz PREWCXNIGAVATR-JOCHJYFZSA-N 2 1 342.527 4.064 20 0 EIADMP C[C@@H](c1cccc(Br)c1)[N@@H+](C)CCC[NH+]1CCCCC1 ZINC001209452986 1020363370 /nfs/dbraw/zinc/36/33/70/1020363370.db2.gz BHAOPFMVHLUCJN-HNNXBMFYSA-N 2 1 339.321 4.318 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cnc2ccccc2c1 ZINC000398182562 1020525460 /nfs/dbraw/zinc/52/54/60/1020525460.db2.gz XHRNVYBEYQWKRG-PGRDOPGGSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cnc2ccccc2c1 ZINC000398182562 1020525469 /nfs/dbraw/zinc/52/54/69/1020525469.db2.gz XHRNVYBEYQWKRG-PGRDOPGGSA-N 2 1 345.490 4.235 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+]([C@@H]3CCc4ccc(F)cc43)C2)CC1 ZINC001167256150 1020684697 /nfs/dbraw/zinc/68/46/97/1020684697.db2.gz UFIOHYIHHBURPV-LAUBAEHRSA-N 2 1 330.491 4.257 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+]([C@@H]3CCc4ccc(F)cc43)C2)CC1 ZINC001167256150 1020684701 /nfs/dbraw/zinc/68/47/01/1020684701.db2.gz UFIOHYIHHBURPV-LAUBAEHRSA-N 2 1 330.491 4.257 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)sc1Br ZINC000510257641 1020720455 /nfs/dbraw/zinc/72/04/55/1020720455.db2.gz MZLCQAMVNZTREI-LBPRGKRZSA-N 2 1 345.350 4.342 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc3[nH]ccc3c2)[C@H]1c1cccs1 ZINC000655742632 1020931378 /nfs/dbraw/zinc/93/13/78/1020931378.db2.gz AWZXFZCVMNLMIU-PXNSSMCTSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc3[nH]ccc3c2)[C@H]1c1cccs1 ZINC000655742632 1020931387 /nfs/dbraw/zinc/93/13/87/1020931387.db2.gz AWZXFZCVMNLMIU-PXNSSMCTSA-N 2 1 339.508 4.402 20 0 EIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C[C@H]3CCCO3)CC1)CC2 ZINC000655756717 1020943331 /nfs/dbraw/zinc/94/33/31/1020943331.db2.gz WUGYURVYYGTJHN-IRLDBZIGSA-N 2 1 342.527 4.030 20 0 EIADMP C[C@H](Cc1ccccn1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000655834516 1020997626 /nfs/dbraw/zinc/99/76/26/1020997626.db2.gz PHQMRUPKEOVFJT-MSYGRNIXSA-N 2 1 349.522 4.045 20 0 EIADMP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000655839152 1021005516 /nfs/dbraw/zinc/00/55/16/1021005516.db2.gz NXHGOVHJRSLDBU-YXOJAJARSA-N 2 1 342.527 4.118 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)[C@H]1CCCCO1 ZINC000655847158 1021012218 /nfs/dbraw/zinc/01/22/18/1021012218.db2.gz RLQTXFOCKCXWMK-PCCBWWKXSA-N 2 1 342.527 4.121 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)[C@H]1CCCCO1 ZINC000655847158 1021012223 /nfs/dbraw/zinc/01/22/23/1021012223.db2.gz RLQTXFOCKCXWMK-PCCBWWKXSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccncc1F ZINC000340475466 1021095284 /nfs/dbraw/zinc/09/52/84/1021095284.db2.gz RQXNUJXCUNCVMM-SJORKVTESA-N 2 1 341.474 4.446 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1ccncc1F ZINC000340475466 1021095290 /nfs/dbraw/zinc/09/52/90/1021095290.db2.gz RQXNUJXCUNCVMM-SJORKVTESA-N 2 1 341.474 4.446 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1C ZINC000683704987 1021125083 /nfs/dbraw/zinc/12/50/83/1021125083.db2.gz HVBOAOUOUSVLMZ-OAQYLSRUSA-N 2 1 338.495 4.005 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2ccc3cnccc3c2)CC1 ZINC000683766113 1021394591 /nfs/dbraw/zinc/39/45/91/1021394591.db2.gz XDMBELDXSZMZIR-UHFFFAOYSA-N 2 1 345.490 4.297 20 0 EIADMP COc1ccccc1[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000089554845 1021931801 /nfs/dbraw/zinc/93/18/01/1021931801.db2.gz WCCKGJKBPYDLLJ-NNMXDRDESA-N 2 1 336.479 4.001 20 0 EIADMP C[NH+](C/C=C/C[N@H+](C)Cc1ccc(F)cc1)Cc1ccc(F)cc1 ZINC000613391079 1021936672 /nfs/dbraw/zinc/93/66/72/1021936672.db2.gz JCXIERXLPYNVKR-ONEGZZNKSA-N 2 1 330.422 4.085 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3nccc4ccccc43)CC2)[nH+]1 ZINC000377812579 1022021596 /nfs/dbraw/zinc/02/15/96/1022021596.db2.gz YDPHLWUAVVMJKZ-KRWDZBQOSA-N 2 1 346.478 4.258 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)sc1Br ZINC000414193283 1022086984 /nfs/dbraw/zinc/08/69/84/1022086984.db2.gz SYLISOSGWOFARE-CHWSQXEVSA-N 2 1 345.350 4.202 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1csc(-c2ccccc2F)n1 ZINC000414193960 1022089633 /nfs/dbraw/zinc/08/96/33/1022089633.db2.gz UCIIGDPNIDCMKY-HUUCEWRRSA-N 2 1 347.503 4.332 20 0 EIADMP COc1cc(C[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)ccc1C ZINC000580514611 1022137421 /nfs/dbraw/zinc/13/74/21/1022137421.db2.gz YLPRAZMBMRAQEM-GOSISDBHSA-N 2 1 338.495 4.319 20 0 EIADMP C[C@@H]([NH2+]CC(C)(C)C(F)(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000549032159 1022159347 /nfs/dbraw/zinc/15/93/47/1022159347.db2.gz LNPKMDUPMZZCSE-GDBMZVCRSA-N 2 1 328.422 4.075 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(-c3cc[nH]n3)o2)cc1 ZINC000378004907 1022223974 /nfs/dbraw/zinc/22/39/74/1022223974.db2.gz RIBGUCRPFOFIQA-CQSZACIVSA-N 2 1 347.422 4.015 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000892579963 1022300557 /nfs/dbraw/zinc/30/05/57/1022300557.db2.gz FCZQXSMAZNVMKO-MRXNPFEDSA-N 2 1 341.499 4.067 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000892579963 1022300578 /nfs/dbraw/zinc/30/05/78/1022300578.db2.gz FCZQXSMAZNVMKO-MRXNPFEDSA-N 2 1 341.499 4.067 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)cnc1F ZINC000892579935 1022303663 /nfs/dbraw/zinc/30/36/63/1022303663.db2.gz DEGMKNPEERHLLD-INIZCTEOSA-N 2 1 341.474 4.051 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1 ZINC001167424316 1022316541 /nfs/dbraw/zinc/31/65/41/1022316541.db2.gz HDRVFCXYGZVGRE-IEBWSBKVSA-N 2 1 334.935 4.469 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3ccc4cnccc4c3)CC2)n2c1CCCC2 ZINC000684026750 1022377111 /nfs/dbraw/zinc/37/71/11/1022377111.db2.gz JRHDOQLOWCFRIU-UHFFFAOYSA-N 2 1 346.478 4.147 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000180233333 1022454183 /nfs/dbraw/zinc/45/41/83/1022454183.db2.gz BNTFNGAUONRNDG-SFHVURJKSA-N 2 1 333.479 4.249 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000275971694 1022471999 /nfs/dbraw/zinc/47/19/99/1022471999.db2.gz WZQRNMNSCJUHCH-HNNXBMFYSA-N 2 1 343.334 4.036 20 0 EIADMP FC(F)(F)Sc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000373941200 1022715693 /nfs/dbraw/zinc/71/56/93/1022715693.db2.gz DCBVOXZHNIBODL-ZIAGYGMSSA-N 2 1 330.419 4.015 20 0 EIADMP FC(F)(F)Sc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000373941200 1022715713 /nfs/dbraw/zinc/71/57/13/1022715713.db2.gz DCBVOXZHNIBODL-ZIAGYGMSSA-N 2 1 330.419 4.015 20 0 EIADMP FC(F)(F)Sc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000373941198 1022717831 /nfs/dbraw/zinc/71/78/31/1022717831.db2.gz DCBVOXZHNIBODL-KGLIPLIRSA-N 2 1 330.419 4.015 20 0 EIADMP FC(F)(F)Sc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000373941198 1022717850 /nfs/dbraw/zinc/71/78/50/1022717850.db2.gz DCBVOXZHNIBODL-KGLIPLIRSA-N 2 1 330.419 4.015 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2cc(-c3ccccc3)cs2)CC1 ZINC000472597814 1022738505 /nfs/dbraw/zinc/73/85/05/1022738505.db2.gz DHECAJXMCTZXSE-UHFFFAOYSA-N 2 1 326.509 4.475 20 0 EIADMP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000581005976 1022798322 /nfs/dbraw/zinc/79/83/22/1022798322.db2.gz LLXMZVULGLUTLH-CWRNSKLLSA-N 2 1 345.487 4.044 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000545457556 1022852730 /nfs/dbraw/zinc/85/27/30/1022852730.db2.gz GJENLTXWOBVXET-FQEVSTJZSA-N 2 1 343.902 4.093 20 0 EIADMP CSc1ccc2c(c1)[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)CCC2 ZINC000581251197 1022916012 /nfs/dbraw/zinc/91/60/12/1022916012.db2.gz HHKCZWIUHFFVPU-LIRRHRJNSA-N 2 1 329.513 4.217 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1cnn(C)c1 ZINC000156181849 1023092257 /nfs/dbraw/zinc/09/22/57/1023092257.db2.gz UJLZUMHKENOZQR-LAUBAEHRSA-N 2 1 340.515 4.035 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](CC)c2cccc(F)c2)[C@@H](C)C1 ZINC000188019266 1023133174 /nfs/dbraw/zinc/13/31/74/1023133174.db2.gz ZJIIEAWNBLZGIC-DBVUQKKJSA-N 2 1 336.495 4.003 20 0 EIADMP C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687841 1023189845 /nfs/dbraw/zinc/18/98/45/1023189845.db2.gz PXEIDOKANLTINQ-KXBFYZLASA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687841 1023189849 /nfs/dbraw/zinc/18/98/49/1023189849.db2.gz PXEIDOKANLTINQ-KXBFYZLASA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687841 1023189851 /nfs/dbraw/zinc/18/98/51/1023189851.db2.gz PXEIDOKANLTINQ-KXBFYZLASA-N 2 1 328.431 4.002 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)[C@@H]3C[C@H]3c3cccs3)CC2)[nH+]1 ZINC000417300766 1023248680 /nfs/dbraw/zinc/24/86/80/1023248680.db2.gz AYPNLCNLYVHTGB-BPQIPLTHSA-N 2 1 341.524 4.202 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000376672596 1023254111 /nfs/dbraw/zinc/25/41/11/1023254111.db2.gz OJELGPNBPZUIOD-DENIHFKCSA-N 2 1 335.495 4.035 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000584819127 1023346494 /nfs/dbraw/zinc/34/64/94/1023346494.db2.gz DWIHZDUNRLXAJE-RXVVDRJESA-N 2 1 326.459 4.041 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000892748887 1023365281 /nfs/dbraw/zinc/36/52/81/1023365281.db2.gz HYLAJOQBEBRREK-UHFFFAOYSA-N 2 1 341.499 4.211 20 0 EIADMP C[C@@H](NCc1nsc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000660258048 1023394946 /nfs/dbraw/zinc/39/49/46/1023394946.db2.gz YVVYQIVNLLVQSE-HUUCEWRRSA-N 2 1 329.513 4.039 20 0 EIADMP Brc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC000415075699 1023422744 /nfs/dbraw/zinc/42/27/44/1023422744.db2.gz BYFPQVJZYXVDJI-QZTJIDSGSA-N 2 1 345.284 4.032 20 0 EIADMP Cc1ccc(C)c(OC2CC[NH+](CC[C@H]3CCCC[N@@H+]3C)CC2)c1 ZINC000472759388 1023511888 /nfs/dbraw/zinc/51/18/88/1023511888.db2.gz KSDKAWSCMDLUBD-LJQANCHMSA-N 2 1 330.516 4.021 20 0 EIADMP c1nc(C[N@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)sc1-c1ccccc1 ZINC000656783626 1023518732 /nfs/dbraw/zinc/51/87/32/1023518732.db2.gz RLJFTLSRMHHNMX-GOSISDBHSA-N 2 1 341.524 4.022 20 0 EIADMP c1csc(-c2ncc(C[N@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)s2)c1 ZINC000656786410 1023526903 /nfs/dbraw/zinc/52/69/03/1023526903.db2.gz SFRIPJHBTBWQRJ-OAHLLOKOSA-N 2 1 347.553 4.083 20 0 EIADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC000656786434 1023532446 /nfs/dbraw/zinc/53/24/46/1023532446.db2.gz MNUMTVRDIVJSBK-BHDDXSALSA-N 2 1 342.527 4.063 20 0 EIADMP C[C@@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310081720 1023590619 /nfs/dbraw/zinc/59/06/19/1023590619.db2.gz JTWWQSHTFVIRIJ-UTKZUKDTSA-N 2 1 326.459 4.389 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[N@@H+]2CCC[C@@H]2c2cnn(C)c2C)cc1 ZINC000377694836 1023688349 /nfs/dbraw/zinc/68/83/49/1023688349.db2.gz FJIRYSDDHXCGJB-QVKFZJNVSA-N 2 1 349.482 4.121 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[N@H+]2CCC[C@@H]2c2cnn(C)c2C)cc1 ZINC000377694836 1023688351 /nfs/dbraw/zinc/68/83/51/1023688351.db2.gz FJIRYSDDHXCGJB-QVKFZJNVSA-N 2 1 349.482 4.121 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@H]1CCC[NH+]([C@H]2CCc3ccccc32)CC1 ZINC000377699660 1023695203 /nfs/dbraw/zinc/69/52/03/1023695203.db2.gz QIAUNHSTPBERPR-UNMCSNQZSA-N 2 1 335.495 4.055 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH+]([C@H]2CCc3ccccc32)CC1 ZINC000377699660 1023695207 /nfs/dbraw/zinc/69/52/07/1023695207.db2.gz QIAUNHSTPBERPR-UNMCSNQZSA-N 2 1 335.495 4.055 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)CC1 ZINC000377699660 1023695209 /nfs/dbraw/zinc/69/52/09/1023695209.db2.gz QIAUNHSTPBERPR-UNMCSNQZSA-N 2 1 335.495 4.055 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@H+]([C@H]2CCc3ccccc32)CC1 ZINC000377699660 1023695216 /nfs/dbraw/zinc/69/52/16/1023695216.db2.gz QIAUNHSTPBERPR-UNMCSNQZSA-N 2 1 335.495 4.055 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2cnccc2c1 ZINC000398135722 1023700263 /nfs/dbraw/zinc/70/02/63/1023700263.db2.gz KYXLTWZHIKTRGV-MBSDFSHPSA-N 2 1 345.490 4.235 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@H](c4cccnc4)C3)C2)cc1 ZINC000500382546 1023769483 /nfs/dbraw/zinc/76/94/83/1023769483.db2.gz HQVZFYDPXTVPIL-GIWBLDEGSA-N 2 1 349.522 4.220 20 0 EIADMP Cc1ccsc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390699138 1023781635 /nfs/dbraw/zinc/78/16/35/1023781635.db2.gz SMYLXXRDLJKCTC-IBGZPJMESA-N 2 1 328.525 4.447 20 0 EIADMP Cc1ccsc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390699138 1023781637 /nfs/dbraw/zinc/78/16/37/1023781637.db2.gz SMYLXXRDLJKCTC-IBGZPJMESA-N 2 1 328.525 4.447 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2cc3cnccc3o2)C[N@H+]1Cc1ccccc1 ZINC000651743247 1023965544 /nfs/dbraw/zinc/96/55/44/1023965544.db2.gz NHJUMPSJZARPAI-PKOBYXMFSA-N 2 1 349.478 4.218 20 0 EIADMP COc1cccc([C@H](C)[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000430710901 1023966114 /nfs/dbraw/zinc/96/61/14/1023966114.db2.gz UYBMRFRSVCJWNL-AZUAARDMSA-N 2 1 338.495 4.210 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NCc1cc2cnccc2o1 ZINC000651795506 1024034368 /nfs/dbraw/zinc/03/43/68/1024034368.db2.gz BUHKBXYITGJSKO-OAQYLSRUSA-N 2 1 349.478 4.218 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1cc2cnccc2o1 ZINC000651795506 1024034383 /nfs/dbraw/zinc/03/43/83/1024034383.db2.gz BUHKBXYITGJSKO-OAQYLSRUSA-N 2 1 349.478 4.218 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510671958 1024207851 /nfs/dbraw/zinc/20/78/51/1024207851.db2.gz ROOZVPMIOSWFJY-NVXWUHKLSA-N 2 1 342.449 4.348 20 0 EIADMP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000510719947 1024312288 /nfs/dbraw/zinc/31/22/88/1024312288.db2.gz KMJLHEZDTASOJB-AOIWGVFYSA-N 2 1 338.536 4.468 20 0 EIADMP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000510719947 1024312303 /nfs/dbraw/zinc/31/23/03/1024312303.db2.gz KMJLHEZDTASOJB-AOIWGVFYSA-N 2 1 338.536 4.468 20 0 EIADMP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000510719949 1024312809 /nfs/dbraw/zinc/31/28/09/1024312809.db2.gz KMJLHEZDTASOJB-JENIJYKNSA-N 2 1 338.536 4.468 20 0 EIADMP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000510719949 1024312824 /nfs/dbraw/zinc/31/28/24/1024312824.db2.gz KMJLHEZDTASOJB-JENIJYKNSA-N 2 1 338.536 4.468 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341696901 1024338405 /nfs/dbraw/zinc/33/84/05/1024338405.db2.gz MFSOCVSTZVBHIR-MAUKXSAKSA-N 2 1 336.907 4.264 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341696901 1024338422 /nfs/dbraw/zinc/33/84/22/1024338422.db2.gz MFSOCVSTZVBHIR-MAUKXSAKSA-N 2 1 336.907 4.264 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)ccc1Cl ZINC000510738280 1024378322 /nfs/dbraw/zinc/37/83/22/1024378322.db2.gz VGMPBVKTDJRKKI-GVDBMIGSSA-N 2 1 338.923 4.268 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1Cl ZINC000510738280 1024378337 /nfs/dbraw/zinc/37/83/37/1024378337.db2.gz VGMPBVKTDJRKKI-GVDBMIGSSA-N 2 1 338.923 4.268 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000510737092 1024379263 /nfs/dbraw/zinc/37/92/63/1024379263.db2.gz RVTIFRMEUHRMFC-KEYYUXOJSA-N 2 1 328.422 4.099 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000510737092 1024379274 /nfs/dbraw/zinc/37/92/74/1024379274.db2.gz RVTIFRMEUHRMFC-KEYYUXOJSA-N 2 1 328.422 4.099 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)o1 ZINC000092072518 1024594797 /nfs/dbraw/zinc/59/47/97/1024594797.db2.gz ZPQHQZNHRNACNO-OAHLLOKOSA-N 2 1 339.414 4.497 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccccc1OC(F)(F)F ZINC000164601018 1024669942 /nfs/dbraw/zinc/66/99/42/1024669942.db2.gz IPTJPFKSTGTQOX-CYBMUJFWSA-N 2 1 341.377 4.221 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](CNCc2ccc(Sc3ccccn3)o2)C1 ZINC000510874855 1024700413 /nfs/dbraw/zinc/70/04/13/1024700413.db2.gz QQQHDUPPFYFYPX-MRXNPFEDSA-N 2 1 345.512 4.036 20 0 EIADMP CC(C)c1ccc([C@H](C)[N@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)cc1 ZINC000652350438 1024701157 /nfs/dbraw/zinc/70/11/57/1024701157.db2.gz YMHSDDVBIKOYEF-LRGNLBRXSA-N 2 1 330.516 4.089 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000348835691 1024720965 /nfs/dbraw/zinc/72/09/65/1024720965.db2.gz AVRCSSOZFISROU-IERDGZPVSA-N 2 1 332.451 4.159 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+]Cc2csc(Cl)c2Cl)c1 ZINC000432253110 1024773984 /nfs/dbraw/zinc/77/39/84/1024773984.db2.gz JDHYYQKTVLBWIP-UHFFFAOYSA-N 2 1 329.296 4.406 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000164713852 1024830051 /nfs/dbraw/zinc/83/00/51/1024830051.db2.gz VHEAHHBPIQAFIX-KRWDZBQOSA-N 2 1 334.467 4.385 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510969980 1024871261 /nfs/dbraw/zinc/87/12/61/1024871261.db2.gz SRHPQNOYKMWVIL-PWRODBHTSA-N 2 1 344.543 4.082 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510969980 1024871262 /nfs/dbraw/zinc/87/12/62/1024871262.db2.gz SRHPQNOYKMWVIL-PWRODBHTSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1ccc(-c2nc(C[N@@H+]3CCC[C@@H](C)[C@H]3CCC[NH3+])cs2)o1 ZINC000662318117 1025072571 /nfs/dbraw/zinc/07/25/71/1025072571.db2.gz WHRPRQVGSRFCRI-CZUORRHYSA-N 2 1 333.501 4.051 20 0 EIADMP COCC[C@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(Cl)c(Cl)c1 ZINC000342056368 1025079093 /nfs/dbraw/zinc/07/90/93/1025079093.db2.gz HOIVARJXZMWINM-PBHICJAKSA-N 2 1 345.314 4.145 20 0 EIADMP CCC[C@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)c1ccccc1 ZINC000162220158 1025108377 /nfs/dbraw/zinc/10/83/77/1025108377.db2.gz BTMGNMQJKZSWOO-FQEVSTJZSA-N 2 1 338.499 4.193 20 0 EIADMP c1csc(-c2ncc(C[NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)s2)c1 ZINC000663346179 1025143024 /nfs/dbraw/zinc/14/30/24/1025143024.db2.gz QBQUUSNZEAKNDB-OAHLLOKOSA-N 2 1 347.553 4.083 20 0 EIADMP c1csc(-c2ncc(C[NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)s2)c1 ZINC000663346179 1025143031 /nfs/dbraw/zinc/14/30/31/1025143031.db2.gz QBQUUSNZEAKNDB-OAHLLOKOSA-N 2 1 347.553 4.083 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC000663466308 1025391233 /nfs/dbraw/zinc/39/12/33/1025391233.db2.gz QWSPOIUYEAHDQO-NJYVYQBISA-N 2 1 341.543 4.128 20 0 EIADMP Fc1ccc2c(c1)[C@H](NC[C@H]1CCC[N@@H+](CC3CC3)C1)CCS2 ZINC000663467759 1025407478 /nfs/dbraw/zinc/40/74/78/1025407478.db2.gz HZBSOABAFSPTNQ-CRAIPNDOSA-N 2 1 334.504 4.074 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@H+](CC3CC3)C1)CCS2 ZINC000663467759 1025407491 /nfs/dbraw/zinc/40/74/91/1025407491.db2.gz HZBSOABAFSPTNQ-CRAIPNDOSA-N 2 1 334.504 4.074 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC3CC3)C1)CCS2 ZINC000663467759 1025407494 /nfs/dbraw/zinc/40/74/94/1025407494.db2.gz HZBSOABAFSPTNQ-CRAIPNDOSA-N 2 1 334.504 4.074 20 0 EIADMP COc1cccc2cc([C@@H](C)NC[C@H]3CCC[N@@H+](CC4CC4)C3)oc21 ZINC000663467543 1025408157 /nfs/dbraw/zinc/40/81/57/1025408157.db2.gz GOGKQEJZHYMFEI-NVXWUHKLSA-N 2 1 342.483 4.214 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)oc21 ZINC000663467543 1025408173 /nfs/dbraw/zinc/40/81/73/1025408173.db2.gz GOGKQEJZHYMFEI-NVXWUHKLSA-N 2 1 342.483 4.214 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)oc21 ZINC000663467543 1025408182 /nfs/dbraw/zinc/40/81/82/1025408182.db2.gz GOGKQEJZHYMFEI-NVXWUHKLSA-N 2 1 342.483 4.214 20 0 EIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663470229 1025413306 /nfs/dbraw/zinc/41/33/06/1025413306.db2.gz TWWIHJDOQUGEGP-RHSMWYFYSA-N 2 1 335.561 4.348 20 0 EIADMP C[C@H]1C[N@H+](CCC[NH2+]Cc2ccc(-c3ccccc3)s2)CCCO1 ZINC000432349051 1025717733 /nfs/dbraw/zinc/71/77/33/1025717733.db2.gz UNEWOBXUTRPNNO-KRWDZBQOSA-N 2 1 344.524 4.006 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+]Cc2ccc(-c3ccccc3)s2)CCCO1 ZINC000432349051 1025717765 /nfs/dbraw/zinc/71/77/65/1025717765.db2.gz UNEWOBXUTRPNNO-KRWDZBQOSA-N 2 1 344.524 4.006 20 0 EIADMP CC[C@H](c1ccccc1)[NH+]1CCN(C[C@H]2CCCC[N@H+]2C(C)C)CC1 ZINC001167508354 1025754277 /nfs/dbraw/zinc/75/42/77/1025754277.db2.gz GQPYXPHHLCLNTL-FGZHOGPDSA-N 2 1 343.559 4.018 20 0 EIADMP CC[C@@H](c1ccccc1)[NH+]1CCN(C[C@H]2CCCC[N@H+]2C(C)C)CC1 ZINC001167508357 1025755324 /nfs/dbraw/zinc/75/53/24/1025755324.db2.gz GQPYXPHHLCLNTL-YADHBBJMSA-N 2 1 343.559 4.018 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](CC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001167838964 1025852662 /nfs/dbraw/zinc/85/26/62/1025852662.db2.gz XGONZEJYRFVWEM-IFMALSPDSA-N 2 1 345.575 4.093 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCOC[C@@H]1c1ccc(Cl)cc1 ZINC001167839898 1025855810 /nfs/dbraw/zinc/85/58/10/1025855810.db2.gz COSOXEBHSLPHAN-QFBILLFUSA-N 2 1 338.923 4.224 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCOC[C@@H]1c1ccc(Cl)cc1 ZINC001167839898 1025855824 /nfs/dbraw/zinc/85/58/24/1025855824.db2.gz COSOXEBHSLPHAN-QFBILLFUSA-N 2 1 338.923 4.224 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H](Cc2ccc(OC)cc2)C1 ZINC001167839905 1025856190 /nfs/dbraw/zinc/85/61/90/1025856190.db2.gz COTPULONLFKIGA-PZJWPPBQSA-N 2 1 346.559 4.460 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc(OC(F)F)cc1 ZINC000319773486 1025858908 /nfs/dbraw/zinc/85/89/08/1025858908.db2.gz FKIHICHZNXZGPQ-CABCVRRESA-N 2 1 326.431 4.203 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)C(c1ccccc1)c1ccccc1 ZINC000278955964 1025865307 /nfs/dbraw/zinc/86/53/07/1025865307.db2.gz LVLYXNODVCPAEX-OALUTQOASA-N 2 1 345.490 4.256 20 0 EIADMP CC[C@@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)c1cccc(Cl)c1 ZINC000344020033 1025880348 /nfs/dbraw/zinc/88/03/48/1025880348.db2.gz MWMXEDUVQMUYPL-GOSISDBHSA-N 2 1 336.907 4.026 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC=C(c2ccc(OC)cc2)CC1 ZINC001167841353 1025882442 /nfs/dbraw/zinc/88/24/42/1025882442.db2.gz KXJAGGWCGCGYPS-GOSISDBHSA-N 2 1 330.516 4.295 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H](Cc2cccc(OC)c2)C1 ZINC001167841623 1025886528 /nfs/dbraw/zinc/88/65/28/1025886528.db2.gz NEKYNVCMKZZVFX-TZIWHRDSSA-N 2 1 346.559 4.460 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCOC[C@@H]1c1ccccc1Cl ZINC001167842035 1025893026 /nfs/dbraw/zinc/89/30/26/1025893026.db2.gz WAVKUBISTMJBRW-VQIMIIECSA-N 2 1 338.923 4.224 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCOC[C@@H]1c1ccccc1Cl ZINC001167842035 1025893028 /nfs/dbraw/zinc/89/30/28/1025893028.db2.gz WAVKUBISTMJBRW-VQIMIIECSA-N 2 1 338.923 4.224 20 0 EIADMP C[C@@H]1C[N@H+](CCC[NH2+][C@H](c2cccs2)C2CCCC2)CCCO1 ZINC000432418664 1025893116 /nfs/dbraw/zinc/89/31/16/1025893116.db2.gz UIBJZMVKKCLDMT-APWZRJJASA-N 2 1 336.545 4.070 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@H](c2cccs2)C2CCCC2)CCCO1 ZINC000432418664 1025893117 /nfs/dbraw/zinc/89/31/17/1025893117.db2.gz UIBJZMVKKCLDMT-APWZRJJASA-N 2 1 336.545 4.070 20 0 EIADMP C[C@@H]1C[N@H+](CCC[NH2+][C@@H](c2cccs2)C2CCCC2)CCCO1 ZINC000432418667 1025893518 /nfs/dbraw/zinc/89/35/18/1025893518.db2.gz UIBJZMVKKCLDMT-VQIMIIECSA-N 2 1 336.545 4.070 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H](c2cccs2)C2CCCC2)CCCO1 ZINC000432418667 1025893521 /nfs/dbraw/zinc/89/35/21/1025893521.db2.gz UIBJZMVKKCLDMT-VQIMIIECSA-N 2 1 336.545 4.070 20 0 EIADMP CCn1cc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)cn1 ZINC000157652883 1025904034 /nfs/dbraw/zinc/90/40/34/1025904034.db2.gz LMFYQAPROZAPJH-ROUUACIJSA-N 2 1 340.515 4.128 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)sc1Br ZINC000375660402 1025904960 /nfs/dbraw/zinc/90/49/60/1025904960.db2.gz MWZQNBKVLIKFDE-YNEHKIRRSA-N 2 1 343.334 4.096 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)sc1Br ZINC000375660402 1025904972 /nfs/dbraw/zinc/90/49/72/1025904972.db2.gz MWZQNBKVLIKFDE-YNEHKIRRSA-N 2 1 343.334 4.096 20 0 EIADMP Clc1cc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)ccn1 ZINC001167968801 1025912043 /nfs/dbraw/zinc/91/20/43/1025912043.db2.gz VOOZSLFJTARSMU-AQDPXUSMSA-N 2 1 345.918 4.181 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cccc(OC(F)F)c1 ZINC000319783456 1025927325 /nfs/dbraw/zinc/92/73/25/1025927325.db2.gz GVGYZWIQMXHPNC-HUUCEWRRSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccncc1 ZINC000638718846 1026032905 /nfs/dbraw/zinc/03/29/05/1026032905.db2.gz MMLXTZDIKYUINP-PIPMEXSNSA-N 2 1 335.495 4.143 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccncc1 ZINC000638718846 1026032917 /nfs/dbraw/zinc/03/29/17/1026032917.db2.gz MMLXTZDIKYUINP-PIPMEXSNSA-N 2 1 335.495 4.143 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](CC)CC1)c1cc(F)cc(Br)c1 ZINC000344126956 1026039482 /nfs/dbraw/zinc/03/94/82/1026039482.db2.gz PNCRWKQESYVWES-INIZCTEOSA-N 2 1 343.284 4.113 20 0 EIADMP C[C@@H]([NH3+])Cc1cn(C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccccc12 ZINC001167969848 1026054094 /nfs/dbraw/zinc/05/40/94/1026054094.db2.gz GFLGTLFIRQWVMS-AZCLRUCKSA-N 2 1 337.511 4.109 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cc(F)cc(Br)c1 ZINC000344175753 1026093202 /nfs/dbraw/zinc/09/32/02/1026093202.db2.gz SSSQEXPQHGNLOW-XZJROXQQSA-N 2 1 343.284 4.112 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc(F)cc(Br)c1 ZINC000344175753 1026093222 /nfs/dbraw/zinc/09/32/22/1026093222.db2.gz SSSQEXPQHGNLOW-XZJROXQQSA-N 2 1 343.284 4.112 20 0 EIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cc(C)c1O ZINC000582089684 1026116269 /nfs/dbraw/zinc/11/62/69/1026116269.db2.gz QUHZQEVTWLRUNR-PKOBYXMFSA-N 2 1 344.524 4.243 20 0 EIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc(C)c1O ZINC000582089684 1026116281 /nfs/dbraw/zinc/11/62/81/1026116281.db2.gz QUHZQEVTWLRUNR-PKOBYXMFSA-N 2 1 344.524 4.243 20 0 EIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)cc(C)c1O ZINC000582089681 1026117193 /nfs/dbraw/zinc/11/71/93/1026117193.db2.gz QUHZQEVTWLRUNR-HKUYNNGSSA-N 2 1 344.524 4.243 20 0 EIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cc(C)c1O ZINC000582089681 1026117200 /nfs/dbraw/zinc/11/72/00/1026117200.db2.gz QUHZQEVTWLRUNR-HKUYNNGSSA-N 2 1 344.524 4.243 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1 ZINC000657346508 1026205377 /nfs/dbraw/zinc/20/53/77/1026205377.db2.gz DWGAZGDALCLOEB-CQSZACIVSA-N 2 1 340.496 4.049 20 0 EIADMP COc1cccc(CCC[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC000303950947 1026298095 /nfs/dbraw/zinc/29/80/95/1026298095.db2.gz VRMRGZNYEFNSAA-PZJWPPBQSA-N 2 1 344.543 4.214 20 0 EIADMP COc1cccc(CCC[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC000303950947 1026298110 /nfs/dbraw/zinc/29/81/10/1026298110.db2.gz VRMRGZNYEFNSAA-PZJWPPBQSA-N 2 1 344.543 4.214 20 0 EIADMP COc1cccc(CCC[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)c1 ZINC000303950947 1026298124 /nfs/dbraw/zinc/29/81/24/1026298124.db2.gz VRMRGZNYEFNSAA-PZJWPPBQSA-N 2 1 344.543 4.214 20 0 EIADMP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)Cc1ccc(F)cc1 ZINC001167977477 1026333128 /nfs/dbraw/zinc/33/31/28/1026333128.db2.gz CQUWGIVHLUVQPH-SEJPIABJSA-N 2 1 344.518 4.389 20 0 EIADMP COc1cccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)c1 ZINC001167981665 1026369345 /nfs/dbraw/zinc/36/93/45/1026369345.db2.gz DKLAIQSBKPXUAW-RKKYOWQMSA-N 2 1 340.511 4.141 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CC(C)(C)Cc4occc43)CC2)[nH+]c1 ZINC000163478680 1026379752 /nfs/dbraw/zinc/37/97/52/1026379752.db2.gz WIYNDKBMBCRFDS-SFHVURJKSA-N 2 1 339.483 4.255 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000550239233 1026390700 /nfs/dbraw/zinc/39/07/00/1026390700.db2.gz TUPAZDOIFKPBPH-WMLDXEAASA-N 2 1 326.406 4.184 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000550239233 1026390713 /nfs/dbraw/zinc/39/07/13/1026390713.db2.gz TUPAZDOIFKPBPH-WMLDXEAASA-N 2 1 326.406 4.184 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000550239233 1026390727 /nfs/dbraw/zinc/39/07/27/1026390727.db2.gz TUPAZDOIFKPBPH-WMLDXEAASA-N 2 1 326.406 4.184 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000550239233 1026390735 /nfs/dbraw/zinc/39/07/35/1026390735.db2.gz TUPAZDOIFKPBPH-WMLDXEAASA-N 2 1 326.406 4.184 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000582328343 1026453619 /nfs/dbraw/zinc/45/36/19/1026453619.db2.gz VBLBLQNFEDQMQK-NVXWUHKLSA-N 2 1 342.449 4.346 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000582328344 1026453974 /nfs/dbraw/zinc/45/39/74/1026453974.db2.gz VBLBLQNFEDQMQK-RDJZCZTQSA-N 2 1 342.449 4.346 20 0 EIADMP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000279499982 1026461726 /nfs/dbraw/zinc/46/17/26/1026461726.db2.gz MNBSVWZKAPDWHM-VKRLORBYSA-N 2 1 330.516 4.005 20 0 EIADMP Cc1ccc(C2(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CCCC2)c(C)c1 ZINC000645503619 1026613443 /nfs/dbraw/zinc/61/34/43/1026613443.db2.gz QQMNIGTYMOXCLE-PMACEKPBSA-N 2 1 326.528 4.332 20 0 EIADMP Cc1cccc2[nH]c(C[NH2+][C@@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)cc21 ZINC000657428867 1026629505 /nfs/dbraw/zinc/62/95/05/1026629505.db2.gz CQLSRBFZCNQMFZ-DLBZAZTESA-N 2 1 325.500 4.219 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000119840043 1026687582 /nfs/dbraw/zinc/68/75/82/1026687582.db2.gz KCBSFTSUWBRKFM-MRXNPFEDSA-N 2 1 335.451 4.349 20 0 EIADMP Fc1ccc(C[N@@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cc1 ZINC000432666731 1026699926 /nfs/dbraw/zinc/69/99/26/1026699926.db2.gz FOYNEZMQYYHLQA-SFHVURJKSA-N 2 1 330.472 4.032 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)CCCS2 ZINC000187964684 1026862470 /nfs/dbraw/zinc/86/24/70/1026862470.db2.gz IIFXFDGMSHGQPO-QFBILLFUSA-N 2 1 348.556 4.332 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3cccnc32)[C@@H]1c1cccs1 ZINC000684956332 1026890315 /nfs/dbraw/zinc/89/03/15/1026890315.db2.gz APVZKIAFQUYGPK-FUHIMQAGSA-N 2 1 341.524 4.193 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3cccnc32)[C@@H]1c1cccs1 ZINC000684956332 1026890318 /nfs/dbraw/zinc/89/03/18/1026890318.db2.gz APVZKIAFQUYGPK-FUHIMQAGSA-N 2 1 341.524 4.193 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000582664318 1026915263 /nfs/dbraw/zinc/91/52/63/1026915263.db2.gz FDQUZWJIMDBVBR-NHCUHLMSSA-N 2 1 344.543 4.224 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000582664318 1026915271 /nfs/dbraw/zinc/91/52/71/1026915271.db2.gz FDQUZWJIMDBVBR-NHCUHLMSSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2noc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000657534226 1026986260 /nfs/dbraw/zinc/98/62/60/1026986260.db2.gz UTBJKTNWFAJNQO-HKUYNNGSSA-N 2 1 349.478 4.013 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2noc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000657534226 1026986267 /nfs/dbraw/zinc/98/62/67/1026986267.db2.gz UTBJKTNWFAJNQO-HKUYNNGSSA-N 2 1 349.478 4.013 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470905 1027095619 /nfs/dbraw/zinc/09/56/19/1027095619.db2.gz KIZUVPRIQVBXOW-RJZRQDKASA-N 2 1 337.920 4.324 20 0 EIADMP Cc1[nH+]c2ccccc2c(N2CC[NH+]([C@@H](C)c3cccnc3)CC2)c1C ZINC000302060725 1027202357 /nfs/dbraw/zinc/20/23/57/1027202357.db2.gz CHGDMZKTOIGLKX-SFHVURJKSA-N 2 1 346.478 4.130 20 0 EIADMP CS[C@@H]1CCCC[NH+](CC[C@H](C)[N@@H+]2CCCC[C@@H](SC)C2)C1 ZINC000441107188 1027274905 /nfs/dbraw/zinc/27/49/05/1027274905.db2.gz WNMUZKYXZQAXDA-RCCFBDPRSA-N 2 1 344.634 4.200 20 0 EIADMP CS[C@@H]1CCCC[NH+](CC[C@H](C)[N@H+]2CCCC[C@@H](SC)C2)C1 ZINC000441107188 1027274945 /nfs/dbraw/zinc/27/49/45/1027274945.db2.gz WNMUZKYXZQAXDA-RCCFBDPRSA-N 2 1 344.634 4.200 20 0 EIADMP Cc1cc(N[C@@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)cc[nH+]1 ZINC000302570442 1027337346 /nfs/dbraw/zinc/33/73/46/1027337346.db2.gz PHNBPSQXZSXLTL-QGZVFWFLSA-N 2 1 335.373 4.095 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000342863099 1027347188 /nfs/dbraw/zinc/34/71/88/1027347188.db2.gz GCTJMVVXDKHLRP-JOCHJYFZSA-N 2 1 331.463 4.381 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000342863099 1027347207 /nfs/dbraw/zinc/34/72/07/1027347207.db2.gz GCTJMVVXDKHLRP-JOCHJYFZSA-N 2 1 331.463 4.381 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CCc3ccccc3C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039974 1027353040 /nfs/dbraw/zinc/35/30/40/1027353040.db2.gz JEZKLHMOMIMYEP-BBIADKPPSA-N 2 1 334.507 4.486 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CCc3ccccc3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039974 1027353059 /nfs/dbraw/zinc/35/30/59/1027353059.db2.gz JEZKLHMOMIMYEP-BBIADKPPSA-N 2 1 334.507 4.486 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CCc3ccccc3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039974 1027353078 /nfs/dbraw/zinc/35/30/78/1027353078.db2.gz JEZKLHMOMIMYEP-BBIADKPPSA-N 2 1 334.507 4.486 20 0 EIADMP C[C@]1(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1(F)F ZINC000657669278 1027486350 /nfs/dbraw/zinc/48/63/50/1027486350.db2.gz CMKFETUZMODAON-MSOLQXFVSA-N 2 1 334.454 4.209 20 0 EIADMP C[C@]1(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1(F)F ZINC000657669278 1027486357 /nfs/dbraw/zinc/48/63/57/1027486357.db2.gz CMKFETUZMODAON-MSOLQXFVSA-N 2 1 334.454 4.209 20 0 EIADMP Cc1cccc(C)c1OCCC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441391665 1027513551 /nfs/dbraw/zinc/51/35/51/1027513551.db2.gz BIJGRLVQHCEYQJ-PZJWPPBQSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441391665 1027513568 /nfs/dbraw/zinc/51/35/68/1027513568.db2.gz BIJGRLVQHCEYQJ-PZJWPPBQSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441391665 1027513575 /nfs/dbraw/zinc/51/35/75/1027513575.db2.gz BIJGRLVQHCEYQJ-PZJWPPBQSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cccc(C)c1OCCC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441391665 1027513581 /nfs/dbraw/zinc/51/35/81/1027513581.db2.gz BIJGRLVQHCEYQJ-PZJWPPBQSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000152449913 1027549918 /nfs/dbraw/zinc/54/99/18/1027549918.db2.gz LGWNCVYBXKCSMZ-QUCCMNQESA-N 2 1 340.536 4.414 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(O)cc32)CC[N@@H+]1Cc1ccccc1 ZINC000657693537 1027579074 /nfs/dbraw/zinc/57/90/74/1027579074.db2.gz MSMLXDZEWSFSFR-WVBUVRCRSA-N 2 1 336.479 4.022 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(O)cc32)CC[N@H+]1Cc1ccccc1 ZINC000657693537 1027579090 /nfs/dbraw/zinc/57/90/90/1027579090.db2.gz MSMLXDZEWSFSFR-WVBUVRCRSA-N 2 1 336.479 4.022 20 0 EIADMP Oc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)C3(CC3)C1)CC2 ZINC000657695095 1027613017 /nfs/dbraw/zinc/61/30/17/1027613017.db2.gz ZIBDHOMYADSHSV-DENIHFKCSA-N 2 1 348.490 4.166 20 0 EIADMP Oc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)C3(CC3)C1)CC2 ZINC000657695095 1027613041 /nfs/dbraw/zinc/61/30/41/1027613041.db2.gz ZIBDHOMYADSHSV-DENIHFKCSA-N 2 1 348.490 4.166 20 0 EIADMP CCOC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000474874643 1027718395 /nfs/dbraw/zinc/71/83/95/1027718395.db2.gz BVESUQMUTGBEAR-YJMBLLCNSA-N 2 1 344.543 4.082 20 0 EIADMP C[NH2+]Cc1cn(C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccc(C)cc12 ZINC001167994804 1027735898 /nfs/dbraw/zinc/73/58/98/1027735898.db2.gz PYMUHNVVHVTVOB-YOFSQIOKSA-N 2 1 337.511 4.247 20 0 EIADMP COc1ccccc1[C@H]1CCC[N@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995603 1027786558 /nfs/dbraw/zinc/78/65/58/1027786558.db2.gz KONNVLVUFMAMAI-KXZRCVDZSA-N 2 1 340.511 4.238 20 0 EIADMP COc1ccccc1[C@H]1CCC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167995603 1027786577 /nfs/dbraw/zinc/78/65/77/1027786577.db2.gz KONNVLVUFMAMAI-KXZRCVDZSA-N 2 1 340.511 4.238 20 0 EIADMP COc1ccccc1[C@H]1CCC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167995603 1027786598 /nfs/dbraw/zinc/78/65/98/1027786598.db2.gz KONNVLVUFMAMAI-KXZRCVDZSA-N 2 1 340.511 4.238 20 0 EIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](CCCc4cccnc4)CC[C@H]32)cc1 ZINC001167646335 1027827582 /nfs/dbraw/zinc/82/75/82/1027827582.db2.gz AUFPPRKHFPYAQU-XZOQPEGZSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](CCCc4cccnc4)CC[C@H]32)cc1 ZINC001167646335 1027827583 /nfs/dbraw/zinc/82/75/83/1027827583.db2.gz AUFPPRKHFPYAQU-XZOQPEGZSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](CCCc4cccnc4)CC[C@H]32)cc1 ZINC001167646335 1027827590 /nfs/dbraw/zinc/82/75/90/1027827590.db2.gz AUFPPRKHFPYAQU-XZOQPEGZSA-N 2 1 349.522 4.001 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]CCC[NH+]2CCCCC2)cc1OC ZINC000444606736 1027888125 /nfs/dbraw/zinc/88/81/25/1027888125.db2.gz GTGSRJNCYOXXRP-KRWDZBQOSA-N 2 1 334.504 4.011 20 0 EIADMP COc1cc([C@H](C)[NH2+]CCC[NH+]2CCCCC2)ccc1OC(C)C ZINC000444607302 1027888651 /nfs/dbraw/zinc/88/86/51/1027888651.db2.gz IJCOOROTYJUIMT-KRWDZBQOSA-N 2 1 334.504 4.009 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2cccc(F)c2)cc1F ZINC000153726152 1027893341 /nfs/dbraw/zinc/89/33/41/1027893341.db2.gz PKMNINBWJGJVTF-CYBMUJFWSA-N 2 1 327.378 4.310 20 0 EIADMP Cc1ccc2cc(C[NH2+][C@@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)ccc2n1 ZINC000189427131 1028133889 /nfs/dbraw/zinc/13/38/89/1028133889.db2.gz CAJGRTOOAQKREW-FXAWDEMLSA-N 2 1 337.511 4.286 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000280809188 1028188581 /nfs/dbraw/zinc/18/85/81/1028188581.db2.gz LUJDGBMYZOMMTP-CSFVBSKPSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000280809188 1028188598 /nfs/dbraw/zinc/18/85/98/1028188598.db2.gz LUJDGBMYZOMMTP-CSFVBSKPSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@]3(C2)CCCCO3)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168048483 1028300494 /nfs/dbraw/zinc/30/04/94/1028300494.db2.gz VXDAOMLZXPHMNN-KNKQGSTJSA-N 2 1 342.527 4.073 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H]1Cc1ccccc1C ZINC000346192040 1028318194 /nfs/dbraw/zinc/31/81/94/1028318194.db2.gz XLFZJBCVFPLEPX-QFIPXVFZSA-N 2 1 346.478 4.091 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+][C@H](c2ccc(F)cc2)c2cccnc2)c1 ZINC000346499836 1028474038 /nfs/dbraw/zinc/47/40/38/1028474038.db2.gz YSZSFTYQUCQOHA-JOCHJYFZSA-N 2 1 349.453 4.162 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)C[C@H]3CCC(F)(F)C3)C2)s1 ZINC000583325121 1028519484 /nfs/dbraw/zinc/51/94/84/1028519484.db2.gz APPVRYBLUIIIQQ-JKSUJKDBSA-N 2 1 342.499 4.246 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)C[C@H]3CCC(F)(F)C3)C2)s1 ZINC000583325121 1028519500 /nfs/dbraw/zinc/51/95/00/1028519500.db2.gz APPVRYBLUIIIQQ-JKSUJKDBSA-N 2 1 342.499 4.246 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)C[C@H]3CCC(F)(F)C3)C2)s1 ZINC000583325121 1028519517 /nfs/dbraw/zinc/51/95/17/1028519517.db2.gz APPVRYBLUIIIQQ-JKSUJKDBSA-N 2 1 342.499 4.246 20 0 EIADMP COCC[C@@H]1CCCC[N@@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168050429 1028875060 /nfs/dbraw/zinc/87/50/60/1028875060.db2.gz ANHHGSXHRHIYOX-MXNKGDRCSA-N 2 1 344.543 4.319 20 0 EIADMP COCC[C@@H]1CCCC[N@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168050429 1028875061 /nfs/dbraw/zinc/87/50/61/1028875061.db2.gz ANHHGSXHRHIYOX-MXNKGDRCSA-N 2 1 344.543 4.319 20 0 EIADMP COCC[C@@H]1CCCC[NH+]1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168050429 1028875064 /nfs/dbraw/zinc/87/50/64/1028875064.db2.gz ANHHGSXHRHIYOX-MXNKGDRCSA-N 2 1 344.543 4.319 20 0 EIADMP COCC[C@@H]1CCCC[NH+]1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168050429 1028875072 /nfs/dbraw/zinc/87/50/72/1028875072.db2.gz ANHHGSXHRHIYOX-MXNKGDRCSA-N 2 1 344.543 4.319 20 0 EIADMP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C/C=C\c1ccc(OCc2ccccc2)cc1 ZINC000583572430 1028883369 /nfs/dbraw/zinc/88/33/69/1028883369.db2.gz IQSCKUZAJHQEPA-BSPJPZBESA-N 2 1 336.479 4.090 20 0 EIADMP C[C@@H]1C[C@H]([NH3+])CC[N@H+]1C/C=C\c1ccc(OCc2ccccc2)cc1 ZINC000583572430 1028883371 /nfs/dbraw/zinc/88/33/71/1028883371.db2.gz IQSCKUZAJHQEPA-BSPJPZBESA-N 2 1 336.479 4.090 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCCCOC(C)(C)C)CC1 ZINC000475056468 1028948986 /nfs/dbraw/zinc/94/89/86/1028948986.db2.gz IYRYAWJTVZSHPZ-UHFFFAOYSA-N 2 1 346.559 4.426 20 0 EIADMP CCCOC1CC[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168051002 1028992332 /nfs/dbraw/zinc/99/23/32/1028992332.db2.gz FEVVBHOUUVETDB-CEQLMSFQSA-N 2 1 344.543 4.319 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@@H](c3ccccn3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168051812 1029065446 /nfs/dbraw/zinc/06/54/46/1029065446.db2.gz ISBVQZHYSFCBEA-SFHLNBCPSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](c3ccccn3)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168051810 1029066239 /nfs/dbraw/zinc/06/62/39/1029066239.db2.gz ISBVQZHYSFCBEA-NPDDRXJXSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@H](c3ccccn3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168051810 1029066251 /nfs/dbraw/zinc/06/62/51/1029066251.db2.gz ISBVQZHYSFCBEA-NPDDRXJXSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3ccccn3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168051810 1029066267 /nfs/dbraw/zinc/06/62/67/1029066267.db2.gz ISBVQZHYSFCBEA-NPDDRXJXSA-N 2 1 349.522 4.313 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(COC)cc2)CC1)CC1CC1 ZINC000536139233 1029245691 /nfs/dbraw/zinc/24/56/91/1029245691.db2.gz CCDZNXXIAMRDGN-UHFFFAOYSA-N 2 1 344.543 4.167 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000475130303 1029277104 /nfs/dbraw/zinc/27/71/04/1029277104.db2.gz VIHIXIPSLBNUMU-UHFFFAOYSA-N 2 1 328.431 4.146 20 0 EIADMP Cc1ccc(-c2nc(C[N@H+]3CCCC34CC[NH+](C)CC4)cs2)cc1 ZINC000475123590 1029278487 /nfs/dbraw/zinc/27/84/87/1029278487.db2.gz YCADETPGZAKOSL-UHFFFAOYSA-N 2 1 341.524 4.179 20 0 EIADMP Cc1ccc(-c2nc(C[N@@H+]3CCCC34CC[NH+](C)CC4)cs2)cc1 ZINC000475123590 1029278501 /nfs/dbraw/zinc/27/85/01/1029278501.db2.gz YCADETPGZAKOSL-UHFFFAOYSA-N 2 1 341.524 4.179 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)CCS2 ZINC000343494394 1029367323 /nfs/dbraw/zinc/36/73/23/1029367323.db2.gz FIHMCEFVRORSJR-LPHOPBHVSA-N 2 1 348.556 4.334 20 0 EIADMP CC(C)CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccoc1 ZINC000428448240 1029457855 /nfs/dbraw/zinc/45/78/55/1029457855.db2.gz OQJSHWHYOLOXAM-ACRUOGEOSA-N 2 1 348.531 4.114 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2csc(C(F)(F)F)c2)CC1 ZINC000628149994 1029483462 /nfs/dbraw/zinc/48/34/62/1029483462.db2.gz WNETZOIGDMIZSN-UHFFFAOYSA-N 2 1 334.451 4.319 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2csc(C(F)(F)F)c2)CC1 ZINC000628149994 1029483470 /nfs/dbraw/zinc/48/34/70/1029483470.db2.gz WNETZOIGDMIZSN-UHFFFAOYSA-N 2 1 334.451 4.319 20 0 EIADMP C[C@H]1C[C@@H](NCc2cc(Cl)ccc2OC2CCCC2)CC[N@H+]1C ZINC000525207853 1029514492 /nfs/dbraw/zinc/51/44/92/1029514492.db2.gz RFDBKVYVIQJXKK-YOEHRIQHSA-N 2 1 336.907 4.234 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2c(OC(F)F)ccc3ccccc32)CC[N@@H+]1C ZINC000525195099 1029518434 /nfs/dbraw/zinc/51/84/34/1029518434.db2.gz PBLMXMVQPXKHGJ-ZFWWWQNUSA-N 2 1 334.410 4.014 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2c(OC(F)F)ccc3ccccc32)CC[N@H+]1C ZINC000525195099 1029518444 /nfs/dbraw/zinc/51/84/44/1029518444.db2.gz PBLMXMVQPXKHGJ-ZFWWWQNUSA-N 2 1 334.410 4.014 20 0 EIADMP C[N@H+](Cc1ccc(-c2c(F)cccc2F)o1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000584080721 1029600257 /nfs/dbraw/zinc/60/02/57/1029600257.db2.gz PKTILBOTTSLBMU-YIONKMFJSA-N 2 1 346.421 4.282 20 0 EIADMP C[N@@H+](Cc1ccc(-c2c(F)cccc2F)o1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000584080721 1029600264 /nfs/dbraw/zinc/60/02/64/1029600264.db2.gz PKTILBOTTSLBMU-YIONKMFJSA-N 2 1 346.421 4.282 20 0 EIADMP C[NH+](Cc1ccc(-c2c(F)cccc2F)o1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000584080721 1029600273 /nfs/dbraw/zinc/60/02/73/1029600273.db2.gz PKTILBOTTSLBMU-YIONKMFJSA-N 2 1 346.421 4.282 20 0 EIADMP C[NH+](Cc1ccc(-c2c(F)cccc2F)o1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000584080721 1029600279 /nfs/dbraw/zinc/60/02/79/1029600279.db2.gz PKTILBOTTSLBMU-YIONKMFJSA-N 2 1 346.421 4.282 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)CCCO2 ZINC000359938934 1029603728 /nfs/dbraw/zinc/60/37/28/1029603728.db2.gz AMPAWYZQWOAJIZ-YLJYHZDGSA-N 2 1 346.515 4.153 20 0 EIADMP CC1(C)CCC[C@@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)O1 ZINC000714342891 1029626895 /nfs/dbraw/zinc/62/68/95/1029626895.db2.gz FOEVQODATGRZDI-VQTJNVASSA-N 2 1 344.543 4.224 20 0 EIADMP CC1(C)CCC[C@@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)O1 ZINC000714342891 1029626900 /nfs/dbraw/zinc/62/69/00/1029626900.db2.gz FOEVQODATGRZDI-VQTJNVASSA-N 2 1 344.543 4.224 20 0 EIADMP CC(C)(C)c1ncc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000192926324 1029647178 /nfs/dbraw/zinc/64/71/78/1029647178.db2.gz BHSXSVYCUCCGHL-QGZVFWFLSA-N 2 1 343.540 4.052 20 0 EIADMP CC(C)(C)c1ncc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000192926324 1029647181 /nfs/dbraw/zinc/64/71/81/1029647181.db2.gz BHSXSVYCUCCGHL-QGZVFWFLSA-N 2 1 343.540 4.052 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CCC(C[NH+]2CCCC2)CC1 ZINC000301381871 1029721783 /nfs/dbraw/zinc/72/17/83/1029721783.db2.gz UUKQHXUYQRJFNX-UHFFFAOYSA-N 2 1 329.875 4.200 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838577 1029722214 /nfs/dbraw/zinc/72/22/14/1029722214.db2.gz DAGRBKJCXZRYSB-RBSFLKMASA-N 2 1 325.447 4.038 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1cccc(C2CC2)c1 ZINC000708502471 1029744012 /nfs/dbraw/zinc/74/40/12/1029744012.db2.gz HNSCXKKPRRKWIP-MBSDFSHPSA-N 2 1 334.507 4.422 20 0 EIADMP Cc1cc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c2cc(F)ccc2[nH+]1 ZINC000301793065 1029809775 /nfs/dbraw/zinc/80/97/75/1029809775.db2.gz RQKBFVPMNMBWAL-YWZLYKJASA-N 2 1 339.458 4.135 20 0 EIADMP C[N@@H+]1CCC[C@@H]2CN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)CC[C@H]21 ZINC000301798191 1029810866 /nfs/dbraw/zinc/81/08/66/1029810866.db2.gz QVVGMCNSYLWLPV-CXAGYDPISA-N 2 1 349.400 4.174 20 0 EIADMP C[N@H+]1CCC[C@@H]2CN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)CC[C@H]21 ZINC000301798191 1029810869 /nfs/dbraw/zinc/81/08/69/1029810869.db2.gz QVVGMCNSYLWLPV-CXAGYDPISA-N 2 1 349.400 4.174 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081635618 1029811403 /nfs/dbraw/zinc/81/14/03/1029811403.db2.gz CHFDMRGSKJGPAF-GOEBONIOSA-N 2 1 338.442 4.013 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081635618 1029811405 /nfs/dbraw/zinc/81/14/05/1029811405.db2.gz CHFDMRGSKJGPAF-GOEBONIOSA-N 2 1 338.442 4.013 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000081635618 1029811409 /nfs/dbraw/zinc/81/14/09/1029811409.db2.gz CHFDMRGSKJGPAF-GOEBONIOSA-N 2 1 338.442 4.013 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081635618 1029811415 /nfs/dbraw/zinc/81/14/15/1029811415.db2.gz CHFDMRGSKJGPAF-GOEBONIOSA-N 2 1 338.442 4.013 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCC[C@H]2CCCC[C@@H]2O)cc1 ZINC000090544572 1029866716 /nfs/dbraw/zinc/86/67/16/1029866716.db2.gz ZJDDILXRFKYGTD-SCWSEQNSSA-N 2 1 341.499 4.163 20 0 EIADMP CCc1ccc([C@@H](CO)[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000090844064 1029870095 /nfs/dbraw/zinc/87/00/95/1029870095.db2.gz VTPNTRGOTUWVND-OPAMFIHVSA-N 2 1 349.478 4.127 20 0 EIADMP FC(F)(F)c1cccc([C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CC2)c1 ZINC000091284505 1029882355 /nfs/dbraw/zinc/88/23/55/1029882355.db2.gz UDAASVJVOSSRAX-SCLBCKFNSA-N 2 1 338.417 4.230 20 0 EIADMP Cc1cc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)ccc1Oc1cccnc1 ZINC000092072961 1029899614 /nfs/dbraw/zinc/89/96/14/1029899614.db2.gz SQRBVBWPQOOVLG-GOSISDBHSA-N 2 1 348.450 4.285 20 0 EIADMP CCN1CCC[C@@H](C[N@@H+](C)CCC2=CCCCC2)[C@@H]1c1cnn(C)c1 ZINC000450795163 1029986259 /nfs/dbraw/zinc/98/62/59/1029986259.db2.gz SWOFJTQGDDUQOY-PZJWPPBQSA-N 2 1 344.547 4.015 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccccc1OC(F)(F)F ZINC000121427867 1030109757 /nfs/dbraw/zinc/10/97/57/1030109757.db2.gz WHQMFAJUNWWGBN-OLZOCXBDSA-N 2 1 341.377 4.077 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657877295 1030155209 /nfs/dbraw/zinc/15/52/09/1030155209.db2.gz PUYOODWCPKWMGA-NEPJUHHUSA-N 2 1 345.712 4.095 20 0 EIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001168165165 1030249593 /nfs/dbraw/zinc/24/95/93/1030249593.db2.gz HRMILEFVHORCJL-HNNXBMFYSA-N 2 1 346.877 4.360 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2c(F)cccc2Cl)[C@H](C)C1 ZINC000447728300 1030291305 /nfs/dbraw/zinc/29/13/05/1030291305.db2.gz LBGSGTHZSMZWOD-KDOFPFPSSA-N 2 1 326.887 4.074 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2c(F)cccc2Cl)[C@H](C)C1 ZINC000447728300 1030291323 /nfs/dbraw/zinc/29/13/23/1030291323.db2.gz LBGSGTHZSMZWOD-KDOFPFPSSA-N 2 1 326.887 4.074 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2c(F)cccc2Cl)[C@H](C)C1 ZINC000447728300 1030291331 /nfs/dbraw/zinc/29/13/31/1030291331.db2.gz LBGSGTHZSMZWOD-KDOFPFPSSA-N 2 1 326.887 4.074 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2c(F)cccc2Cl)[C@@H](C)C1 ZINC000447728302 1030294859 /nfs/dbraw/zinc/29/48/59/1030294859.db2.gz LBGSGTHZSMZWOD-KSSFIOAISA-N 2 1 326.887 4.074 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2c(F)cccc2Cl)[C@@H](C)C1 ZINC000447728302 1030294881 /nfs/dbraw/zinc/29/48/81/1030294881.db2.gz LBGSGTHZSMZWOD-KSSFIOAISA-N 2 1 326.887 4.074 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2c(F)cccc2Cl)[C@@H](C)C1 ZINC000447728302 1030294897 /nfs/dbraw/zinc/29/48/97/1030294897.db2.gz LBGSGTHZSMZWOD-KSSFIOAISA-N 2 1 326.887 4.074 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000392489843 1030301449 /nfs/dbraw/zinc/30/14/49/1030301449.db2.gz SRUINYLMAVODCI-IAGOWNOFSA-N 2 1 326.484 4.492 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000392489843 1030301471 /nfs/dbraw/zinc/30/14/71/1030301471.db2.gz SRUINYLMAVODCI-IAGOWNOFSA-N 2 1 326.484 4.492 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCCc2c(F)cccc2Cl)CC1 ZINC000447798676 1030330264 /nfs/dbraw/zinc/33/02/64/1030330264.db2.gz ZQNCFEWXFNCNNI-UHFFFAOYSA-N 2 1 326.887 4.216 20 0 EIADMP CC[N@H+](Cc1coc(-c2ccccc2)n1)Cc1ccc(C[NH+](C)C)cc1 ZINC000685456743 1030333253 /nfs/dbraw/zinc/33/32/53/1030333253.db2.gz VIECMUQENKUYTG-UHFFFAOYSA-N 2 1 349.478 4.425 20 0 EIADMP CC[N@@H+](Cc1coc(-c2ccccc2)n1)Cc1ccc(C[NH+](C)C)cc1 ZINC000685456743 1030333278 /nfs/dbraw/zinc/33/32/78/1030333278.db2.gz VIECMUQENKUYTG-UHFFFAOYSA-N 2 1 349.478 4.425 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(F)cc3C(F)(F)F)C2)CC1 ZINC000685462796 1030341878 /nfs/dbraw/zinc/34/18/78/1030341878.db2.gz FLHPLUOTMCXRFE-CQSZACIVSA-N 2 1 344.396 4.008 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@@H]2C)o1 ZINC000685470264 1030351411 /nfs/dbraw/zinc/35/14/11/1030351411.db2.gz BYSVLDNMPCHONK-KXBFYZLASA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@@H]2C)o1 ZINC000685470264 1030351430 /nfs/dbraw/zinc/35/14/30/1030351430.db2.gz BYSVLDNMPCHONK-KXBFYZLASA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)o1 ZINC000685470264 1030351448 /nfs/dbraw/zinc/35/14/48/1030351448.db2.gz BYSVLDNMPCHONK-KXBFYZLASA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)o1 ZINC000685470264 1030351463 /nfs/dbraw/zinc/35/14/63/1030351463.db2.gz BYSVLDNMPCHONK-KXBFYZLASA-N 2 1 330.447 4.166 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1cccc2cccnc21 ZINC000708571134 1030390652 /nfs/dbraw/zinc/39/06/52/1030390652.db2.gz QRYGAPPCCUQJCV-AVRDEDQJSA-N 2 1 345.490 4.093 20 0 EIADMP Clc1ccccc1C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000062426676 1030427582 /nfs/dbraw/zinc/42/75/82/1030427582.db2.gz QRZMJEIUHCNCNG-SFHVURJKSA-N 2 1 328.887 4.342 20 0 EIADMP Clc1ccccc1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000062426676 1030427595 /nfs/dbraw/zinc/42/75/95/1030427595.db2.gz QRZMJEIUHCNCNG-SFHVURJKSA-N 2 1 328.887 4.342 20 0 EIADMP CC(C)[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1 ZINC000530460368 1030435533 /nfs/dbraw/zinc/43/55/33/1030435533.db2.gz NYUUNOITHUFQKP-MRXNPFEDSA-N 2 1 326.271 4.256 20 0 EIADMP CC[C@@H]1C[C@H]([NH2+]CC2([NH2+][C@@H](C)c3ccccc3)CCCC2)CCO1 ZINC000648456721 1030503227 /nfs/dbraw/zinc/50/32/27/1030503227.db2.gz HVYJEXAKUAAAON-DFQSSKMNSA-N 2 1 330.516 4.197 20 0 EIADMP CSc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000685621683 1030575941 /nfs/dbraw/zinc/57/59/41/1030575941.db2.gz UHOMEKIUUAFIRS-MRXNPFEDSA-N 2 1 332.538 4.082 20 0 EIADMP Cc1nccn1CCCC[N@@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000191237731 1030610681 /nfs/dbraw/zinc/61/06/81/1030610681.db2.gz HLPIJMHBOUYULI-UHFFFAOYSA-N 2 1 339.405 4.426 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000191237731 1030610690 /nfs/dbraw/zinc/61/06/90/1030610690.db2.gz HLPIJMHBOUYULI-UHFFFAOYSA-N 2 1 339.405 4.426 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000191237731 1030610700 /nfs/dbraw/zinc/61/07/00/1030610700.db2.gz HLPIJMHBOUYULI-UHFFFAOYSA-N 2 1 339.405 4.426 20 0 EIADMP Oc1cccc2c1CCC[C@@H]2[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000191640190 1030635573 /nfs/dbraw/zinc/63/55/73/1030635573.db2.gz JQBTZXYBZSKXDL-NRFANRHFSA-N 2 1 336.479 4.024 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(C(F)F)nc2)C1 ZINC000657932243 1030636637 /nfs/dbraw/zinc/63/66/37/1030636637.db2.gz VAJNSEPGZLPTBD-LSDHHAIUSA-N 2 1 325.447 4.038 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(C(F)F)nc2)C1 ZINC000657932243 1030636648 /nfs/dbraw/zinc/63/66/48/1030636648.db2.gz VAJNSEPGZLPTBD-LSDHHAIUSA-N 2 1 325.447 4.038 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(F)cc1 ZINC000398037985 1030688674 /nfs/dbraw/zinc/68/86/74/1030688674.db2.gz QOMYXALHUONLMM-XGHQBKJUSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(F)cc1 ZINC000398037985 1030688685 /nfs/dbraw/zinc/68/86/85/1030688685.db2.gz QOMYXALHUONLMM-XGHQBKJUSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2ccccc2n1 ZINC000398109849 1030700787 /nfs/dbraw/zinc/70/07/87/1030700787.db2.gz CPLUTDVYPDDFOV-XMSQKQJNSA-N 2 1 345.490 4.235 20 0 EIADMP CC[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000658027979 1030776146 /nfs/dbraw/zinc/77/61/46/1030776146.db2.gz BHTOSNKYBKKERI-OOKSDGMUSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@]1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)CC1(F)F ZINC000658219634 1030885815 /nfs/dbraw/zinc/88/58/15/1030885815.db2.gz CJANBTSUOQPLGU-NCXUSEDFSA-N 2 1 334.454 4.065 20 0 EIADMP Cc1cccc(N([C@H](C)Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)[nH+]1 ZINC001168191883 1030972523 /nfs/dbraw/zinc/97/25/23/1030972523.db2.gz LAHOXCULGSCIQR-MRXNPFEDSA-N 2 1 343.902 4.233 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)[C@@H](C)C1 ZINC000532459607 1031112842 /nfs/dbraw/zinc/11/28/42/1031112842.db2.gz MDFXGJZBQIDVMJ-PGRDOPGGSA-N 2 1 338.495 4.086 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)CCOc2c(Cl)cccc2Cl)C[C@H]1C ZINC000531378175 1031140632 /nfs/dbraw/zinc/14/06/32/1031140632.db2.gz DGFJXBFNTLNZHK-ZIAGYGMSSA-N 2 1 345.314 4.177 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCOc2c(Cl)cccc2Cl)C[C@H]1C ZINC000531378175 1031140649 /nfs/dbraw/zinc/14/06/49/1031140649.db2.gz DGFJXBFNTLNZHK-ZIAGYGMSSA-N 2 1 345.314 4.177 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCOc2c(Cl)cccc2Cl)C[C@H]1C ZINC000531378175 1031140659 /nfs/dbraw/zinc/14/06/59/1031140659.db2.gz DGFJXBFNTLNZHK-ZIAGYGMSSA-N 2 1 345.314 4.177 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCOc2c(Cl)cccc2Cl)C[C@H]1C ZINC000531378175 1031140672 /nfs/dbraw/zinc/14/06/72/1031140672.db2.gz DGFJXBFNTLNZHK-ZIAGYGMSSA-N 2 1 345.314 4.177 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2csc(C3CC3)n2)c1 ZINC000343809249 1031168100 /nfs/dbraw/zinc/16/81/00/1031168100.db2.gz OKSYZZCTEDCYQK-UHFFFAOYSA-N 2 1 329.513 4.151 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2csc(C3CC3)n2)c1 ZINC000343809249 1031168111 /nfs/dbraw/zinc/16/81/11/1031168111.db2.gz OKSYZZCTEDCYQK-UHFFFAOYSA-N 2 1 329.513 4.151 20 0 EIADMP C[N@@H+]1CC[C@H](N[C@@H]2CCCOc3ccccc32)C[C@H]1c1ccccc1 ZINC000340219131 1031193569 /nfs/dbraw/zinc/19/35/69/1031193569.db2.gz IHHBPSSBEMVQKX-TYPHKJRUSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@H+]1CC[C@H](N[C@@H]2CCCOc3ccccc32)C[C@H]1c1ccccc1 ZINC000340219131 1031193591 /nfs/dbraw/zinc/19/35/91/1031193591.db2.gz IHHBPSSBEMVQKX-TYPHKJRUSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCOc3ccccc32)C[C@H]1c1ccccc1 ZINC000340219131 1031193612 /nfs/dbraw/zinc/19/36/12/1031193612.db2.gz IHHBPSSBEMVQKX-TYPHKJRUSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCOc3ccccc32)C[C@H]1c1ccccc1 ZINC000340219131 1031193632 /nfs/dbraw/zinc/19/36/32/1031193632.db2.gz IHHBPSSBEMVQKX-TYPHKJRUSA-N 2 1 336.479 4.325 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000532477058 1031207037 /nfs/dbraw/zinc/20/70/37/1031207037.db2.gz MPKQUSUOBDUGEJ-LLGFUMIMSA-N 2 1 342.552 4.391 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000532524467 1031240439 /nfs/dbraw/zinc/24/04/39/1031240439.db2.gz UKELLMZHAQHNQX-KRWDZBQOSA-N 2 1 326.484 4.163 20 0 EIADMP CCN1CC[C@@H]([N@H+](C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@H]1C ZINC000532589651 1031320419 /nfs/dbraw/zinc/32/04/19/1031320419.db2.gz ROVIOMMRJWFCJD-VQIMIIECSA-N 2 1 330.516 4.119 20 0 EIADMP CCN1CC[C@@H]([N@@H+](C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@H]1C ZINC000532589651 1031320439 /nfs/dbraw/zinc/32/04/39/1031320439.db2.gz ROVIOMMRJWFCJD-VQIMIIECSA-N 2 1 330.516 4.119 20 0 EIADMP CC1CCC([N@@H+]2C[C@@H]3CCC[C@@H]([NH+](C)Cc4ccccn4)[C@@H]3C2)CC1 ZINC001168216970 1031323315 /nfs/dbraw/zinc/32/33/15/1031323315.db2.gz GOVBCIWFZVIOQW-OWYTWOCOSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([N@H+]2C[C@@H]3CCC[C@@H]([NH+](C)Cc4ccccn4)[C@@H]3C2)CC1 ZINC001168216970 1031323330 /nfs/dbraw/zinc/32/33/30/1031323330.db2.gz GOVBCIWFZVIOQW-OWYTWOCOSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([NH+]2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)CC1 ZINC001168216970 1031323345 /nfs/dbraw/zinc/32/33/45/1031323345.db2.gz GOVBCIWFZVIOQW-OWYTWOCOSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([NH+]2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)CC1 ZINC001168216970 1031323362 /nfs/dbraw/zinc/32/33/62/1031323362.db2.gz GOVBCIWFZVIOQW-OWYTWOCOSA-N 2 1 341.543 4.193 20 0 EIADMP COc1cc2ccccc2cc1C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000449038176 1031377288 /nfs/dbraw/zinc/37/72/88/1031377288.db2.gz SDBBRPLKDZDKNG-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc2ccccc2cc1C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000449038176 1031377299 /nfs/dbraw/zinc/37/72/99/1031377299.db2.gz SDBBRPLKDZDKNG-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc2ccccc2cc1C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000449038176 1031377312 /nfs/dbraw/zinc/37/73/12/1031377312.db2.gz SDBBRPLKDZDKNG-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc2ccccc2cc1C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000449038176 1031377320 /nfs/dbraw/zinc/37/73/20/1031377320.db2.gz SDBBRPLKDZDKNG-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cc3cccnc3o2)CC1 ZINC000449020753 1031384209 /nfs/dbraw/zinc/38/42/09/1031384209.db2.gz AINQXQDEUWWVBK-UHFFFAOYSA-N 2 1 349.478 4.172 20 0 EIADMP COc1cccc(Sc2ccccc2C[NH2+]C2CC[NH+](C)CC2)c1 ZINC000449063960 1031392454 /nfs/dbraw/zinc/39/24/54/1031392454.db2.gz SCQAEHNZJOFKPF-UHFFFAOYSA-N 2 1 342.508 4.030 20 0 EIADMP COc1cc2ccccc2cc1C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000449085718 1031416004 /nfs/dbraw/zinc/41/60/04/1031416004.db2.gz AIKHWOKWPODBRM-UHFFFAOYSA-N 2 1 326.484 4.201 20 0 EIADMP COc1cc(C[NH2+]C2CC[NH+](CC(C)C)CC2)cc2ccccc21 ZINC000449070726 1031422111 /nfs/dbraw/zinc/42/21/11/1031422111.db2.gz FABKMMAVUZKVLF-UHFFFAOYSA-N 2 1 326.484 4.058 20 0 EIADMP COc1ccc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cc1O ZINC000449111426 1031449571 /nfs/dbraw/zinc/44/95/71/1031449571.db2.gz LWTWIWDGTWWXHF-UHFFFAOYSA-N 2 1 348.531 4.170 20 0 EIADMP COCC1CCC([NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)CC1 ZINC000449151113 1031485275 /nfs/dbraw/zinc/48/52/75/1031485275.db2.gz VUMKYSNXSJZLHP-PGYGNJIDSA-N 2 1 330.516 4.007 20 0 EIADMP COc1cc(F)cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1 ZINC000449159598 1031488990 /nfs/dbraw/zinc/48/89/90/1031488990.db2.gz HPGBTQXJUOGYQK-HNAYVOBHSA-N 2 1 348.487 4.069 20 0 EIADMP COc1cc(F)cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1 ZINC000449159598 1031489014 /nfs/dbraw/zinc/48/90/14/1031489014.db2.gz HPGBTQXJUOGYQK-HNAYVOBHSA-N 2 1 348.487 4.069 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccc(OC)cc1 ZINC000123932752 1031496135 /nfs/dbraw/zinc/49/61/35/1031496135.db2.gz FBYOOBUWLXNYMH-NRFANRHFSA-N 2 1 326.484 4.388 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000531738280 1031514763 /nfs/dbraw/zinc/51/47/63/1031514763.db2.gz FUHJTXZAAOBUOM-IGCXYCKISA-N 2 1 329.315 4.244 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000531738282 1031516688 /nfs/dbraw/zinc/51/66/88/1031516688.db2.gz FUHJTXZAAOBUOM-PBFPGSCMSA-N 2 1 329.315 4.244 20 0 EIADMP CC[C@@H]([NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1)C1CCOCC1 ZINC000531722651 1031524452 /nfs/dbraw/zinc/52/44/52/1031524452.db2.gz IUQRRDUXWZBYJE-GHTZIAJQSA-N 2 1 344.543 4.445 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCCOC2CCCC2)cc1 ZINC000125282910 1031584126 /nfs/dbraw/zinc/58/41/26/1031584126.db2.gz GRTBAGJQSJRIOC-INIZCTEOSA-N 2 1 327.472 4.181 20 0 EIADMP Cn1cc2c(n1)CCC[C@H]2[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449312736 1031628810 /nfs/dbraw/zinc/62/88/10/1031628810.db2.gz NDCJBWCRXPAFTM-GOSISDBHSA-N 2 1 346.563 4.066 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(-c2ccccc2)nn1C ZINC000453142145 1031648139 /nfs/dbraw/zinc/64/81/39/1031648139.db2.gz FBRHTXHTFICETI-MRXNPFEDSA-N 2 1 340.515 4.001 20 0 EIADMP COCC1CCC([NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000449338109 1031655386 /nfs/dbraw/zinc/65/53/86/1031655386.db2.gz RNKCRZBIFMILQM-ORFBVSJDSA-N 2 1 344.543 4.084 20 0 EIADMP COCCC(C)(C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453198903 1031710065 /nfs/dbraw/zinc/71/00/65/1031710065.db2.gz PESYJQNADREOQK-HBMCJLEFSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CC(C)(C)Cc4occc43)CC2)[nH+]1 ZINC000128127373 1031726516 /nfs/dbraw/zinc/72/65/16/1031726516.db2.gz HELZESWQVKNTGS-SFHVURJKSA-N 2 1 339.483 4.255 20 0 EIADMP CSCC1CCC([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000453268492 1031792210 /nfs/dbraw/zinc/79/22/10/1031792210.db2.gz KJOZAAPVMYVJLJ-PEVDHWGLSA-N 2 1 332.557 4.333 20 0 EIADMP CSCC1CCC([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000453268492 1031792222 /nfs/dbraw/zinc/79/22/22/1031792222.db2.gz KJOZAAPVMYVJLJ-PEVDHWGLSA-N 2 1 332.557 4.333 20 0 EIADMP FC1(F)CC(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)C1 ZINC000453242258 1031796342 /nfs/dbraw/zinc/79/63/42/1031796342.db2.gz PYGGRXLLNVIYBE-QRVBRYPASA-N 2 1 334.454 4.065 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000449561691 1031848033 /nfs/dbraw/zinc/84/80/33/1031848033.db2.gz XHFFIDVNXQQLDE-FENUFBNTSA-N 2 1 338.417 4.324 20 0 EIADMP Cc1nccn1CCCC[N@H+](C)CCCOc1ccc(Cl)cc1 ZINC000119351214 1031878961 /nfs/dbraw/zinc/87/89/61/1031878961.db2.gz WHUCLQPBBBYHMT-UHFFFAOYSA-N 2 1 335.879 4.026 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)CCCOc1ccc(Cl)cc1 ZINC000119351214 1031878964 /nfs/dbraw/zinc/87/89/64/1031878964.db2.gz WHUCLQPBBBYHMT-UHFFFAOYSA-N 2 1 335.879 4.026 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)CCCOc1ccc(Cl)cc1 ZINC000119351214 1031878971 /nfs/dbraw/zinc/87/89/71/1031878971.db2.gz WHUCLQPBBBYHMT-UHFFFAOYSA-N 2 1 335.879 4.026 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453351985 1031880465 /nfs/dbraw/zinc/88/04/65/1031880465.db2.gz NAIGBMBZPCDAOI-MGNMYUMUSA-N 2 1 338.948 4.426 20 0 EIADMP C[C@H](C[NH2+][C@@H]1C[C@H](C)[N@@H+](C)C[C@H]1C)c1c(Cl)cccc1Cl ZINC000531963663 1031883960 /nfs/dbraw/zinc/88/39/60/1031883960.db2.gz LNNLFEFSMYYNES-NFFDBFGFSA-N 2 1 329.315 4.415 20 0 EIADMP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000531970875 1031904405 /nfs/dbraw/zinc/90/44/05/1031904405.db2.gz ZDINZSKSVGJXEE-MJBXVCDLSA-N 2 1 345.314 4.081 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@H](Cc1ccccc1)c1ccccc1 ZINC000531993771 1031960815 /nfs/dbraw/zinc/96/08/15/1031960815.db2.gz LEIBZYUZJOKJCW-VKGYTVAMSA-N 2 1 336.523 4.331 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H]2CC[C@@H](c3cccc(Cl)c3)C2)s1 ZINC000449774342 1031998499 /nfs/dbraw/zinc/99/84/99/1031998499.db2.gz OQLQHPVMYFFLDC-ZBFHGGJFSA-N 2 1 349.931 4.284 20 0 EIADMP C[N@@H+](CCCSc1ccccc1Cl)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512559952 1033378805 /nfs/dbraw/zinc/37/88/05/1033378805.db2.gz BAORETBWXOHZKO-XYPWUTKMSA-N 2 1 338.948 4.379 20 0 EIADMP Cn1cncc1CCC[N@@H+](Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000575427212 1033439863 /nfs/dbraw/zinc/43/98/63/1033439863.db2.gz MOICHHYLTFQDCC-UHFFFAOYSA-N 2 1 338.282 4.324 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+](Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000575427212 1033439870 /nfs/dbraw/zinc/43/98/70/1033439870.db2.gz MOICHHYLTFQDCC-UHFFFAOYSA-N 2 1 338.282 4.324 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+](Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000575427212 1033439887 /nfs/dbraw/zinc/43/98/87/1033439887.db2.gz MOICHHYLTFQDCC-UHFFFAOYSA-N 2 1 338.282 4.324 20 0 EIADMP FC1(F)CCC([NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000512632311 1033556494 /nfs/dbraw/zinc/55/64/94/1033556494.db2.gz YZSBOIQZBGAPKD-DFQSSKMNSA-N 2 1 348.481 4.455 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000512653430 1033621056 /nfs/dbraw/zinc/62/10/56/1033621056.db2.gz FHIFODHMDTVILA-FGTMMUONSA-N 2 1 340.433 4.219 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCCc2cccc(C(F)(F)F)c2)CCN1C ZINC000429846704 1033768912 /nfs/dbraw/zinc/76/89/12/1033768912.db2.gz DLVVMNASUPBZMS-YJBOKZPZSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCCc2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000429846704 1033768929 /nfs/dbraw/zinc/76/89/29/1033768929.db2.gz DLVVMNASUPBZMS-YJBOKZPZSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCCc2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000429846704 1033768948 /nfs/dbraw/zinc/76/89/48/1033768948.db2.gz DLVVMNASUPBZMS-YJBOKZPZSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)CCCCc2cccc(C(F)(F)F)c2)CC[NH+]1C ZINC000429846704 1033768960 /nfs/dbraw/zinc/76/89/60/1033768960.db2.gz DLVVMNASUPBZMS-YJBOKZPZSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCCc2cccc(C(F)(F)F)c2)CC[NH+]1C ZINC000429846704 1033768971 /nfs/dbraw/zinc/76/89/71/1033768971.db2.gz DLVVMNASUPBZMS-YJBOKZPZSA-N 2 1 342.449 4.443 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@@H]3C[C@H]4C[C@H]4C3)[C@H](c3ccccc3)C2)cc1 ZINC001167917493 1033843498 /nfs/dbraw/zinc/84/34/98/1033843498.db2.gz MMHMYQVKLXQSAI-HTUFRPJOSA-N 2 1 346.518 4.433 20 0 EIADMP Cc1nccn1CCC[N@H+](C)[C@@H](C)c1nc2ccccc2n1C(F)F ZINC000411403189 1033883402 /nfs/dbraw/zinc/88/34/02/1033883402.db2.gz VUZKSRKVSHIELL-ZDUSSCGKSA-N 2 1 347.413 4.019 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1nc2ccccc2n1C(F)F ZINC000411403189 1033883410 /nfs/dbraw/zinc/88/34/10/1033883410.db2.gz VUZKSRKVSHIELL-ZDUSSCGKSA-N 2 1 347.413 4.019 20 0 EIADMP C[C@H](NCCC[N@H+]1CCCC[C@H]1C)c1ccccc1OC(F)F ZINC000320373533 1034395681 /nfs/dbraw/zinc/39/56/81/1034395681.db2.gz UJNAFFSIHRJNQY-CABCVRRESA-N 2 1 326.431 4.203 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccccc1OC(F)F ZINC000320373533 1034395693 /nfs/dbraw/zinc/39/56/93/1034395693.db2.gz UJNAFFSIHRJNQY-CABCVRRESA-N 2 1 326.431 4.203 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccccc1OC(F)F ZINC000320373533 1034395705 /nfs/dbraw/zinc/39/57/05/1034395705.db2.gz UJNAFFSIHRJNQY-CABCVRRESA-N 2 1 326.431 4.203 20 0 EIADMP C[C@@H](C[NH2+]Cc1c(OC(F)F)ccc2ccccc21)C[NH+]1CCCC1 ZINC000513068414 1034482159 /nfs/dbraw/zinc/48/21/59/1034482159.db2.gz GRZYDKLXKNZIEI-HNNXBMFYSA-N 2 1 348.437 4.263 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CSc3ccccc32)CC1 ZINC000513208000 1034835548 /nfs/dbraw/zinc/83/55/48/1034835548.db2.gz KNNBKALTEUMZDL-ATZDWAIDSA-N 2 1 330.541 4.466 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(F)c(F)c1 ZINC000469099938 1034900038 /nfs/dbraw/zinc/90/00/38/1034900038.db2.gz ZCIOFOBBMOZGDQ-HRAATJIYSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(F)c(F)c1 ZINC000469099938 1034900060 /nfs/dbraw/zinc/90/00/60/1034900060.db2.gz ZCIOFOBBMOZGDQ-HRAATJIYSA-N 2 1 344.449 4.008 20 0 EIADMP c1ccc2c(c1)C=C(C[N@H+]1CCC[C@H](C[NH+]3CCCCCC3)C1)CO2 ZINC000513420437 1034927709 /nfs/dbraw/zinc/92/77/09/1034927709.db2.gz OCOWMJMYZLPTGO-LJQANCHMSA-N 2 1 340.511 4.050 20 0 EIADMP c1ccc2c(c1)C=C(C[N@@H+]1CCC[C@H](C[NH+]3CCCCCC3)C1)CO2 ZINC000513420437 1034927717 /nfs/dbraw/zinc/92/77/17/1034927717.db2.gz OCOWMJMYZLPTGO-LJQANCHMSA-N 2 1 340.511 4.050 20 0 EIADMP c1cc2c(cccc2C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)[nH]1 ZINC000513437900 1034945014 /nfs/dbraw/zinc/94/50/14/1034945014.db2.gz GROSGYUDHDQGST-GOSISDBHSA-N 2 1 325.500 4.256 20 0 EIADMP CCc1nc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cs1 ZINC000513546755 1035029283 /nfs/dbraw/zinc/02/92/83/1035029283.db2.gz ZPSJVNKCPWTJRS-SJLPKXTDSA-N 2 1 343.540 4.096 20 0 EIADMP C[C@H](c1ccccc1F)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501049480 1035358528 /nfs/dbraw/zinc/35/85/28/1035358528.db2.gz JHLICUHVRMTBQA-MRXNPFEDSA-N 2 1 327.447 4.130 20 0 EIADMP C[N@H+](Cc1ccc(Cl)s1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501048709 1035358565 /nfs/dbraw/zinc/35/85/65/1035358565.db2.gz SCRSNNIXQVNFEW-UHFFFAOYSA-N 2 1 335.904 4.145 20 0 EIADMP C[C@@H](c1c(F)cccc1F)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501060327 1035364067 /nfs/dbraw/zinc/36/40/67/1035364067.db2.gz AGADWKCKRJDQMG-HNNXBMFYSA-N 2 1 345.437 4.269 20 0 EIADMP CCc1ccc(CC[N@@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000501064519 1035366011 /nfs/dbraw/zinc/36/60/11/1035366011.db2.gz XLIXZFKQVJCEOK-UHFFFAOYSA-N 2 1 337.511 4.035 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501378237 1035433365 /nfs/dbraw/zinc/43/33/65/1035433365.db2.gz PACLTWOMMVQFQZ-XAPVIXHLSA-N 2 1 343.559 4.456 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000501419516 1035441769 /nfs/dbraw/zinc/44/17/69/1035441769.db2.gz GZYHKHYRHXXEET-IPJDOKCGSA-N 2 1 326.406 4.040 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000501466377 1035450162 /nfs/dbraw/zinc/45/01/62/1035450162.db2.gz JNXGAHNQKXKFCR-PXXUHZIESA-N 2 1 326.406 4.181 20 0 EIADMP C[N@H+](Cc1ccccc1OCc1ccccc1)CC1CC[NH+](C)CC1 ZINC000513716694 1035456666 /nfs/dbraw/zinc/45/66/66/1035456666.db2.gz GPQRJIDJBLJXOB-UHFFFAOYSA-N 2 1 338.495 4.039 20 0 EIADMP COc1ccccc1-c1ccc([C@@H](C)[N@@H+](C)CC[C@@H]2CC[NH2+]C2)cc1 ZINC000420294551 1035492714 /nfs/dbraw/zinc/49/27/14/1035492714.db2.gz BBEGUNNBGNMCFG-MSOLQXFVSA-N 2 1 338.495 4.355 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2C[C@@H](C[NH3+])C[C@H]2C)oc1-c1ccc(Cl)cc1 ZINC000420306831 1035505102 /nfs/dbraw/zinc/50/51/02/1035505102.db2.gz AWPZJLMPNYYPPQ-KWCYVHTRSA-N 2 1 333.863 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2C[C@@H](C[NH3+])C[C@H]2C)oc1-c1ccc(Cl)cc1 ZINC000420306831 1035505130 /nfs/dbraw/zinc/50/51/30/1035505130.db2.gz AWPZJLMPNYYPPQ-KWCYVHTRSA-N 2 1 333.863 4.034 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000595073427 1035556181 /nfs/dbraw/zinc/55/61/81/1035556181.db2.gz SLDWDSCGUNGRBI-MJGOQNOKSA-N 2 1 332.557 4.020 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CC[C@H](C)[C@H](C[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420420612 1035574977 /nfs/dbraw/zinc/57/49/77/1035574977.db2.gz YAWLOXHRPIZJRC-DUVNUKRYSA-N 2 1 347.890 4.281 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420420612 1035574992 /nfs/dbraw/zinc/57/49/92/1035574992.db2.gz YAWLOXHRPIZJRC-DUVNUKRYSA-N 2 1 347.890 4.281 20 0 EIADMP CCCCCOc1cc(C[N@@H+](C)CC2CC[NH+](C)CC2)ccc1OC ZINC000513723835 1035717439 /nfs/dbraw/zinc/71/74/39/1035717439.db2.gz AZXCCRDUHYJAOB-UHFFFAOYSA-N 2 1 348.531 4.038 20 0 EIADMP CC(C)SCC[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000485497119 1035948621 /nfs/dbraw/zinc/94/86/21/1035948621.db2.gz WUDIQOZJMVXOES-UHFFFAOYSA-N 2 1 332.557 4.116 20 0 EIADMP C[C@H]([NH2+]C1(C[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)CCCC1)c1ccccc1 ZINC000571492436 1036055435 /nfs/dbraw/zinc/05/54/35/1036055435.db2.gz XOSHOUYOPBKZCY-DMUMMCEESA-N 2 1 330.516 4.196 20 0 EIADMP Fc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000485716960 1036203136 /nfs/dbraw/zinc/20/31/36/1036203136.db2.gz MTCYDFPXPVQCSA-KRWDZBQOSA-N 2 1 346.877 4.133 20 0 EIADMP Fc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000485716960 1036203158 /nfs/dbraw/zinc/20/31/58/1036203158.db2.gz MTCYDFPXPVQCSA-KRWDZBQOSA-N 2 1 346.877 4.133 20 0 EIADMP C[C@@H](N[C@@H](C)c1cnn(C2CCCC2)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000502469655 1036245597 /nfs/dbraw/zinc/24/55/97/1036245597.db2.gz CWWZEARNNUJVNN-SQNIBIBYSA-N 2 1 344.547 4.302 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cnn(C2CCCC2)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000502469655 1036245624 /nfs/dbraw/zinc/24/56/24/1036245624.db2.gz CWWZEARNNUJVNN-SQNIBIBYSA-N 2 1 344.547 4.302 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cnn(C2CCCC2)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000502469655 1036245640 /nfs/dbraw/zinc/24/56/40/1036245640.db2.gz CWWZEARNNUJVNN-SQNIBIBYSA-N 2 1 344.547 4.302 20 0 EIADMP COc1ccccc1/C=C\C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000588178437 1036288976 /nfs/dbraw/zinc/28/89/76/1036288976.db2.gz PCQCCHIJZIWOLQ-WQLSENKSSA-N 2 1 338.495 4.338 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC12CCSCC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000421384974 1036343160 /nfs/dbraw/zinc/34/31/60/1036343160.db2.gz QAJVINTXXXXKEL-DFQSSKMNSA-N 2 1 344.568 4.020 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000572243021 1036469667 /nfs/dbraw/zinc/46/96/67/1036469667.db2.gz HHUBFJPLNPPRPW-SJORKVTESA-N 2 1 333.545 4.012 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000502696048 1036512329 /nfs/dbraw/zinc/51/23/29/1036512329.db2.gz BMJSLHZGLUHBPA-NYVOZVTQSA-N 2 1 344.543 4.213 20 0 EIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CC2CC2)CC1 ZINC001168388694 1036721845 /nfs/dbraw/zinc/72/18/45/1036721845.db2.gz GJELUANPBCYUNE-UHFFFAOYSA-N 2 1 340.433 4.402 20 0 EIADMP COC1([C@H](C)[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)CCCC1 ZINC000421828657 1036783975 /nfs/dbraw/zinc/78/39/75/1036783975.db2.gz DSAGICYHLUPHPW-ROUUACIJSA-N 2 1 330.516 4.149 20 0 EIADMP CC(C)C[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043718 1036884211 /nfs/dbraw/zinc/88/42/11/1036884211.db2.gz HDLPTYWMRGXHNR-RDJZCZTQSA-N 2 1 328.422 4.334 20 0 EIADMP CC(C)C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043718 1036884212 /nfs/dbraw/zinc/88/42/12/1036884212.db2.gz HDLPTYWMRGXHNR-RDJZCZTQSA-N 2 1 328.422 4.334 20 0 EIADMP Clc1csc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000486928362 1036894257 /nfs/dbraw/zinc/89/42/57/1036894257.db2.gz UZDWHGQMYZMKPL-ZDUSSCGKSA-N 2 1 340.945 4.465 20 0 EIADMP Clc1csc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000486928362 1036894258 /nfs/dbraw/zinc/89/42/58/1036894258.db2.gz UZDWHGQMYZMKPL-ZDUSSCGKSA-N 2 1 340.945 4.465 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000271742242 1037004328 /nfs/dbraw/zinc/00/43/28/1037004328.db2.gz QLBLMUSTWUUYTN-GHMZBOCLSA-N 2 1 341.286 4.067 20 0 EIADMP Cc1ccccc1C[N@H+]1CCCN(c2cc[nH+]c3ccccc32)CC1 ZINC000599496016 1037031415 /nfs/dbraw/zinc/03/14/15/1037031415.db2.gz RDPCSMXLCGQDIP-UHFFFAOYSA-N 2 1 331.463 4.256 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2csc(Br)c2)CC1 ZINC000590786259 1037168002 /nfs/dbraw/zinc/16/80/02/1037168002.db2.gz LENGRXWYUHZVLD-UHFFFAOYSA-N 2 1 345.350 4.063 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2csc(Br)c2)CC1 ZINC000590786259 1037168009 /nfs/dbraw/zinc/16/80/09/1037168009.db2.gz LENGRXWYUHZVLD-UHFFFAOYSA-N 2 1 345.350 4.063 20 0 EIADMP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(c2nc(C(C)(C)C)cs2)CC1 ZINC000760832428 1037452781 /nfs/dbraw/zinc/45/27/81/1037452781.db2.gz XZQQKTIIUYYYMU-KRWDZBQOSA-N 2 1 349.588 4.494 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(c2nc(C(C)(C)C)cs2)CC1 ZINC000760832428 1037452787 /nfs/dbraw/zinc/45/27/87/1037452787.db2.gz XZQQKTIIUYYYMU-KRWDZBQOSA-N 2 1 349.588 4.494 20 0 EIADMP CSc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000573528411 1037564982 /nfs/dbraw/zinc/56/49/82/1037564982.db2.gz AFVFOLAHOFNOGB-QAPCUYQASA-N 2 1 346.565 4.470 20 0 EIADMP CSc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000573528411 1037564987 /nfs/dbraw/zinc/56/49/87/1037564987.db2.gz AFVFOLAHOFNOGB-QAPCUYQASA-N 2 1 346.565 4.470 20 0 EIADMP CC(C)(C)[C@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC000488423318 1037578367 /nfs/dbraw/zinc/57/83/67/1037578367.db2.gz WMNRYTSGQLCEHA-RBUKOAKNSA-N 2 1 332.557 4.161 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000488436641 1037591962 /nfs/dbraw/zinc/59/19/62/1037591962.db2.gz YAGQONXUJIIPBB-VNPDGQOTSA-N 2 1 344.568 4.302 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)CC1 ZINC000488454052 1037597946 /nfs/dbraw/zinc/59/79/46/1037597946.db2.gz XZZICNOQJLPSPN-PMACEKPBSA-N 2 1 346.584 4.469 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CS[C@H](C(C)(C)C)C2)CC1 ZINC000488454054 1037598857 /nfs/dbraw/zinc/59/88/57/1037598857.db2.gz XZZICNOQJLPSPN-UXHICEINSA-N 2 1 346.584 4.469 20 0 EIADMP c1c2ccccc2oc1CNC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000488514664 1037644197 /nfs/dbraw/zinc/64/41/97/1037644197.db2.gz NSHFXKBSPKWZMM-LJQANCHMSA-N 2 1 334.463 4.087 20 0 EIADMP c1c2ccccc2oc1C[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000488514664 1037644213 /nfs/dbraw/zinc/64/42/13/1037644213.db2.gz NSHFXKBSPKWZMM-LJQANCHMSA-N 2 1 334.463 4.087 20 0 EIADMP c1c2ccccc2oc1C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000488514664 1037644227 /nfs/dbraw/zinc/64/42/27/1037644227.db2.gz NSHFXKBSPKWZMM-LJQANCHMSA-N 2 1 334.463 4.087 20 0 EIADMP C[C@H]([NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000488551025 1037663883 /nfs/dbraw/zinc/66/38/83/1037663883.db2.gz ZOHQJIUJKFPPCB-FRYIKTPZSA-N 2 1 346.584 4.407 20 0 EIADMP Cc1nc2c(s1)[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CCC2 ZINC000157545268 1037673576 /nfs/dbraw/zinc/67/35/76/1037673576.db2.gz SRFHRMDWZNABLP-SFHVURJKSA-N 2 1 333.545 4.216 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCSc2ccccc2)C1 ZINC000605151025 1037693632 /nfs/dbraw/zinc/69/36/32/1037693632.db2.gz ZBNXNYDZWXHKGP-RTBURBONSA-N 2 1 332.557 4.365 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCSc2ccccc2)C1 ZINC000605151025 1037693644 /nfs/dbraw/zinc/69/36/44/1037693644.db2.gz ZBNXNYDZWXHKGP-RTBURBONSA-N 2 1 332.557 4.365 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCSc2ccccc2)C1 ZINC000605151025 1037693652 /nfs/dbraw/zinc/69/36/52/1037693652.db2.gz ZBNXNYDZWXHKGP-RTBURBONSA-N 2 1 332.557 4.365 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCSc2ccccc2)C1 ZINC000605151025 1037693659 /nfs/dbraw/zinc/69/36/59/1037693659.db2.gz ZBNXNYDZWXHKGP-RTBURBONSA-N 2 1 332.557 4.365 20 0 EIADMP c1ccc(C[N@@H+](Cc2cccc(C3CC3)c2)[C@@H]2CCC[NH2+]CC2)nc1 ZINC000422551199 1037763165 /nfs/dbraw/zinc/76/31/65/1037763165.db2.gz DDZMMTMASLSWRP-JOCHJYFZSA-N 2 1 335.495 4.103 20 0 EIADMP c1ccc(C[N@H+](Cc2cccc(C3CC3)c2)[C@@H]2CCC[NH2+]CC2)nc1 ZINC000422551199 1037763179 /nfs/dbraw/zinc/76/31/79/1037763179.db2.gz DDZMMTMASLSWRP-JOCHJYFZSA-N 2 1 335.495 4.103 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCCC34CCCC4)CC2)oc1C ZINC000573976971 1037798926 /nfs/dbraw/zinc/79/89/26/1037798926.db2.gz NMFCBUGNVSGWSJ-IBGZPJMESA-N 2 1 345.531 4.206 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)cc1OCC ZINC000422751101 1037825389 /nfs/dbraw/zinc/82/53/89/1037825389.db2.gz FDKWSUWNPMNXGM-ZOCIIQOWSA-N 2 1 340.467 4.279 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414690880 1037832234 /nfs/dbraw/zinc/83/22/34/1037832234.db2.gz AXIFKXRPEDTUOG-BHYGNILZSA-N 2 1 343.540 4.499 20 0 EIADMP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000422854972 1037846942 /nfs/dbraw/zinc/84/69/42/1037846942.db2.gz BNYLTAPPZRQWLB-YPMHNXCESA-N 2 1 332.517 4.015 20 0 EIADMP Cc1cc(Cl)ccc1C[N@H+](Cc1ccccn1)[C@H]1CCC[NH2+]CC1 ZINC000414711961 1037908698 /nfs/dbraw/zinc/90/86/98/1037908698.db2.gz IJJBDEIKJNDTJQ-FQEVSTJZSA-N 2 1 343.902 4.188 20 0 EIADMP Cc1cc(Cl)ccc1C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH2+]CC1 ZINC000414711961 1037908732 /nfs/dbraw/zinc/90/87/32/1037908732.db2.gz IJJBDEIKJNDTJQ-FQEVSTJZSA-N 2 1 343.902 4.188 20 0 EIADMP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000423048944 1037910559 /nfs/dbraw/zinc/91/05/59/1037910559.db2.gz AMHFKNHDWNZVTR-OUJBWJOFSA-N 2 1 342.327 4.414 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000503864810 1037949297 /nfs/dbraw/zinc/94/92/97/1037949297.db2.gz WHCQLJBKTOXWRK-LPHOPBHVSA-N 2 1 336.470 4.312 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC2([NH3+])CCCCCC2)CC1 ZINC000423198817 1038050621 /nfs/dbraw/zinc/05/06/21/1038050621.db2.gz ICGWLCJEDZLFOF-UHFFFAOYSA-N 3 1 343.559 4.071 20 0 EIADMP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC2(N)CCCCCC2)CC1 ZINC000423198817 1038050640 /nfs/dbraw/zinc/05/06/40/1038050640.db2.gz ICGWLCJEDZLFOF-UHFFFAOYSA-N 2 1 343.559 4.071 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC2(N)CCCCCC2)CC1 ZINC000423198817 1038050657 /nfs/dbraw/zinc/05/06/57/1038050657.db2.gz ICGWLCJEDZLFOF-UHFFFAOYSA-N 2 1 343.559 4.071 20 0 EIADMP CC(C)([NH3+])C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423287826 1038094021 /nfs/dbraw/zinc/09/40/21/1038094021.db2.gz OSYNGJGBNXETQD-ZDUSSCGKSA-N 2 1 335.904 4.168 20 0 EIADMP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000423391351 1038198190 /nfs/dbraw/zinc/19/81/90/1038198190.db2.gz KXJLPRFOIWLNEZ-ZNOIYHFQSA-N 2 1 332.850 4.156 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cccc3c2CCCN3)cc1 ZINC000423421613 1038208186 /nfs/dbraw/zinc/20/81/86/1038208186.db2.gz YDSKUUXWQSBTOE-INIZCTEOSA-N 2 1 346.478 4.390 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423444689 1038225658 /nfs/dbraw/zinc/22/56/58/1038225658.db2.gz LXLOFJCCFZWHPP-GCJKJVERSA-N 2 1 349.522 4.045 20 0 EIADMP CC[C@@H]([NH3+])C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423478945 1038249655 /nfs/dbraw/zinc/24/96/55/1038249655.db2.gz UYKHXSSPDUXXCQ-KGLIPLIRSA-N 2 1 335.904 4.168 20 0 EIADMP CC[N@H+]1CC[C@H](CN[C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000490168566 1038366245 /nfs/dbraw/zinc/36/62/45/1038366245.db2.gz XJWDOVWJSQMGBJ-QRWLVFNGSA-N 2 1 346.877 4.500 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc3cc[nH]c32)[C@H]1c1cccs1 ZINC000608059629 1038437416 /nfs/dbraw/zinc/43/74/16/1038437416.db2.gz MJUUVTRWKDEJFD-PXNSSMCTSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc3cc[nH]c32)[C@H]1c1cccs1 ZINC000608059629 1038437428 /nfs/dbraw/zinc/43/74/28/1038437428.db2.gz MJUUVTRWKDEJFD-PXNSSMCTSA-N 2 1 339.508 4.402 20 0 EIADMP c1ccc2c(c1)sc1c2CCC[C@@H]1[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000480758672 1038800271 /nfs/dbraw/zinc/80/02/71/1038800271.db2.gz NRWBESLRUYPHRP-KSSFIOAISA-N 2 1 326.509 4.353 20 0 EIADMP CO[C@H]1C[C@H]2C[C@@H]([NH2+]C3CC[NH+]([C@H](C)c4ccccc4)CC3)C[C@H]2C1 ZINC000424315665 1038801335 /nfs/dbraw/zinc/80/13/35/1038801335.db2.gz PQXWKFPSWODNRB-QOXYCXOJSA-N 2 1 342.527 4.005 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCOc2ccc(C)cc2)cc1 ZINC000539076307 1038824310 /nfs/dbraw/zinc/82/43/10/1038824310.db2.gz PWLCLRIYZXCNTH-KRWDZBQOSA-N 2 1 335.451 4.219 20 0 EIADMP Cc1cc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c(C)s1 ZINC000608510637 1038842971 /nfs/dbraw/zinc/84/29/71/1038842971.db2.gz YOJSUVALRGUGLD-LJQANCHMSA-N 2 1 328.525 4.319 20 0 EIADMP Cc1cc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c(C)s1 ZINC000608510637 1038842972 /nfs/dbraw/zinc/84/29/72/1038842972.db2.gz YOJSUVALRGUGLD-LJQANCHMSA-N 2 1 328.525 4.319 20 0 EIADMP Cc1cc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C)s1 ZINC000608510637 1038842975 /nfs/dbraw/zinc/84/29/75/1038842975.db2.gz YOJSUVALRGUGLD-LJQANCHMSA-N 2 1 328.525 4.319 20 0 EIADMP Cc1cc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)s1 ZINC000608510637 1038842976 /nfs/dbraw/zinc/84/29/76/1038842976.db2.gz YOJSUVALRGUGLD-LJQANCHMSA-N 2 1 328.525 4.319 20 0 EIADMP CC(C[NH+](C)CCc1cccs1)C[N@@H+](C)CCc1cccs1 ZINC000608576176 1038854776 /nfs/dbraw/zinc/85/47/76/1038854776.db2.gz IUMGNPCZYNACEG-UHFFFAOYSA-N 2 1 336.570 4.095 20 0 EIADMP CC(C)[C@H]([NH3+])C[NH2+]Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000414789140 1038863171 /nfs/dbraw/zinc/86/31/71/1038863171.db2.gz FBZAHPPDCLMTIZ-QGZVFWFLSA-N 2 1 348.922 4.031 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000539162851 1038864709 /nfs/dbraw/zinc/86/47/09/1038864709.db2.gz MLXCARWRSAMKGX-KDOFPFPSSA-N 2 1 340.433 4.476 20 0 EIADMP Fc1ccc(-c2ccc(C[N@@H+]3CC[C@H](C[NH+]4CCCC4)C3)o2)cc1 ZINC000537616008 1038897508 /nfs/dbraw/zinc/89/75/08/1038897508.db2.gz GRGYJQYWJHVEQZ-MRXNPFEDSA-N 2 1 328.431 4.003 20 0 EIADMP Fc1ccc(-c2ccc(C[N@H+]3CC[C@H](C[NH+]4CCCC4)C3)o2)cc1 ZINC000537616008 1038897512 /nfs/dbraw/zinc/89/75/12/1038897512.db2.gz GRGYJQYWJHVEQZ-MRXNPFEDSA-N 2 1 328.431 4.003 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CCSCc1ccc(Cl)cc1Cl ZINC000539296781 1038946114 /nfs/dbraw/zinc/94/61/14/1038946114.db2.gz LCWGAQDDCUDUBA-WBMJQRKESA-N 2 1 347.355 4.156 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc3cc(OC)ccc3c2)C1 ZINC000481023383 1038959046 /nfs/dbraw/zinc/95/90/46/1038959046.db2.gz NDLRMRVNLVIEHW-SJORKVTESA-N 2 1 326.484 4.231 20 0 EIADMP Clc1ccc2c(c1Cl)CC[C@H]2[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000119732288 1038979979 /nfs/dbraw/zinc/97/99/79/1038979979.db2.gz DYFIUKIOCJIKMK-MRXNPFEDSA-N 2 1 325.283 4.197 20 0 EIADMP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000119732452 1038980115 /nfs/dbraw/zinc/98/01/15/1038980115.db2.gz DYFIUKIOCJIKMK-INIZCTEOSA-N 2 1 325.283 4.197 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001168334886 1039057015 /nfs/dbraw/zinc/05/70/15/1039057015.db2.gz ZFNKEDJMTKGVEB-UHFFFAOYSA-N 2 1 327.299 4.224 20 0 EIADMP Cc1ccc(-c2nc(C[NH2+]Cc3ccc([C@H](C)[NH3+])cc3)cs2)cc1 ZINC000414814690 1039086573 /nfs/dbraw/zinc/08/65/73/1039086573.db2.gz VYNVAYJGUQKWHA-HNNXBMFYSA-N 2 1 337.492 4.428 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2c(OC(F)F)ccc3ccccc32)CCN1C ZINC000552071541 1039098314 /nfs/dbraw/zinc/09/83/14/1039098314.db2.gz NCIXWUOSDYUGET-GDBMZVCRSA-N 2 1 348.437 4.356 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2c(OC(F)F)ccc3ccccc32)CCN1C ZINC000552071541 1039098335 /nfs/dbraw/zinc/09/83/35/1039098335.db2.gz NCIXWUOSDYUGET-GDBMZVCRSA-N 2 1 348.437 4.356 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCC[C@H]1Cc1ccccc1 ZINC000481191180 1039099120 /nfs/dbraw/zinc/09/91/20/1039099120.db2.gz MUMCXAFGBHDGHO-LEWJYISDSA-N 2 1 325.500 4.363 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)s1 ZINC000090406546 1039221678 /nfs/dbraw/zinc/22/16/78/1039221678.db2.gz HMAZGXVJIRAFOE-HIFRSBDPSA-N 2 1 335.542 4.076 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c(C)c1OC ZINC000552225099 1039275416 /nfs/dbraw/zinc/27/54/16/1039275416.db2.gz AICKNZZEGWEGDU-FUHWJXTLSA-N 2 1 348.531 4.175 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](Cc2ccccc2)c2sccc2C)C1 ZINC000481314193 1039285457 /nfs/dbraw/zinc/28/54/57/1039285457.db2.gz BNPWDZBOPYSXCH-RTBURBONSA-N 2 1 328.525 4.272 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]3CCCC3)c(C)c2c1 ZINC000481327461 1039301380 /nfs/dbraw/zinc/30/13/80/1039301380.db2.gz IDNRCQZAEDOSRZ-GDBMZVCRSA-N 2 1 330.472 4.132 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000552277139 1039351832 /nfs/dbraw/zinc/35/18/32/1039351832.db2.gz PJUCXQMDZIZKDG-DYXWJJEUSA-N 2 1 337.511 4.341 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(N[C@@H]2CC[NH+](C)[C@@H]3CCC[C@H]32)cc1 ZINC000552276354 1039353244 /nfs/dbraw/zinc/35/32/44/1039353244.db2.gz UNCGNKJUYDYSCW-XYEHWOGUSA-N 2 1 341.543 4.346 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(N[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)cc1 ZINC000552276354 1039353261 /nfs/dbraw/zinc/35/32/61/1039353261.db2.gz UNCGNKJUYDYSCW-XYEHWOGUSA-N 2 1 341.543 4.346 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(N[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)cc1 ZINC000552276354 1039353283 /nfs/dbraw/zinc/35/32/83/1039353283.db2.gz UNCGNKJUYDYSCW-XYEHWOGUSA-N 2 1 341.543 4.346 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000121892480 1039526942 /nfs/dbraw/zinc/52/69/42/1039526942.db2.gz MIZZYFSLPUJHNR-JXFKEZNVSA-N 2 1 328.500 4.098 20 0 EIADMP COc1ccc2oc(C[NH2+]CCCC[N@H+]3CCC[C@@H](C)C3)cc2c1 ZINC000478349066 1039688380 /nfs/dbraw/zinc/68/83/80/1039688380.db2.gz ZJGWGKJZWZZMMZ-MRXNPFEDSA-N 2 1 330.472 4.043 20 0 EIADMP COc1ccc2oc(C[NH2+]CCCC[N@H+]3CCCC[C@@H]3C)cc2c1 ZINC000478346932 1039688583 /nfs/dbraw/zinc/68/85/83/1039688583.db2.gz UXWHIZCWJIJSPV-INIZCTEOSA-N 2 1 330.472 4.186 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCc2ccccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000505465509 1039804360 /nfs/dbraw/zinc/80/43/60/1039804360.db2.gz VRNJWMOSSZGMJE-BWAGFHJFSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537647387 1039805602 /nfs/dbraw/zinc/80/56/02/1039805602.db2.gz MZGWVJYFTVTNNF-FQEVSTJZSA-N 2 1 342.527 4.172 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537647387 1039805613 /nfs/dbraw/zinc/80/56/13/1039805613.db2.gz MZGWVJYFTVTNNF-FQEVSTJZSA-N 2 1 342.527 4.172 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537647387 1039805617 /nfs/dbraw/zinc/80/56/17/1039805617.db2.gz MZGWVJYFTVTNNF-FQEVSTJZSA-N 2 1 342.527 4.172 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537647387 1039805621 /nfs/dbraw/zinc/80/56/21/1039805621.db2.gz MZGWVJYFTVTNNF-FQEVSTJZSA-N 2 1 342.527 4.172 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH+]1CCC(c3[nH+]cc4n3CCCC4)CC1)CC2 ZINC000434688144 1039810878 /nfs/dbraw/zinc/81/08/78/1039810878.db2.gz ISNQZJDCKCAMMC-HXUWFJFHSA-N 2 1 339.458 4.225 20 0 EIADMP COc1cccc([C@@H](C)[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000434684156 1039816222 /nfs/dbraw/zinc/81/62/22/1039816222.db2.gz JVLBNAQZKFVNBQ-MRXNPFEDSA-N 2 1 339.483 4.169 20 0 EIADMP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(F)c1 ZINC000123003890 1039849353 /nfs/dbraw/zinc/84/93/53/1039849353.db2.gz VZXMNCJFVXKCLY-INIZCTEOSA-N 2 1 342.458 4.281 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)C1(c2ccccc2)CCCC1 ZINC000481841441 1039856011 /nfs/dbraw/zinc/85/60/11/1039856011.db2.gz LERJIPPMEQGVAY-GOSISDBHSA-N 2 1 325.500 4.462 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc(F)cc3)CC2)C[C@H]1c1ccccc1 ZINC000551006696 1039868556 /nfs/dbraw/zinc/86/85/56/1039868556.db2.gz IISIIFPBGRWMBW-SFTDATJTSA-N 2 1 338.470 4.282 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC2(c3ccc(F)cc3)CC2)C[C@H]1c1ccccc1 ZINC000551006696 1039868562 /nfs/dbraw/zinc/86/85/62/1039868562.db2.gz IISIIFPBGRWMBW-SFTDATJTSA-N 2 1 338.470 4.282 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H](c2cccnc2)C2CCC2)C1 ZINC000481922284 1039895705 /nfs/dbraw/zinc/89/57/05/1039895705.db2.gz XUYVXBVHIKKIPK-UEXGIBASSA-N 2 1 329.532 4.271 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(OCC2CCCCC2)CC1 ZINC000535050666 1039908386 /nfs/dbraw/zinc/90/83/86/1039908386.db2.gz AQVYJXFMQJOECM-UHFFFAOYSA-N 2 1 333.520 4.033 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)s1 ZINC000551050762 1039917644 /nfs/dbraw/zinc/91/76/44/1039917644.db2.gz BQYDVIOAJONAQS-ZAAXVRCTSA-N 2 1 328.525 4.413 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)s1 ZINC000551050762 1039917671 /nfs/dbraw/zinc/91/76/71/1039917671.db2.gz BQYDVIOAJONAQS-ZAAXVRCTSA-N 2 1 328.525 4.413 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCO[C@@H]2C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000551051604 1039924102 /nfs/dbraw/zinc/92/41/02/1039924102.db2.gz SLWLKRAOPIFNML-BURNTYAHSA-N 2 1 344.543 4.253 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCCO[C@@H]2C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000551051604 1039924128 /nfs/dbraw/zinc/92/41/28/1039924128.db2.gz SLWLKRAOPIFNML-BURNTYAHSA-N 2 1 344.543 4.253 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)Oc1ccc(F)cc1 ZINC000551051664 1039924584 /nfs/dbraw/zinc/92/45/84/1039924584.db2.gz PTKPCQOFSCGTSC-PBEJRMEISA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)Oc1ccc(F)cc1 ZINC000551051664 1039924601 /nfs/dbraw/zinc/92/46/01/1039924601.db2.gz PTKPCQOFSCGTSC-PBEJRMEISA-N 2 1 342.458 4.018 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000481976090 1039925513 /nfs/dbraw/zinc/92/55/13/1039925513.db2.gz XYTFXDCAPHFMIG-GJZGRUSLSA-N 2 1 331.529 4.033 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCOc2ccccc2Cl)C[C@@H]1c1ccccc1 ZINC000551086045 1039966605 /nfs/dbraw/zinc/96/66/05/1039966605.db2.gz MCAMXBXRQNTZNA-PKOBYXMFSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCOc2ccccc2Cl)C[C@@H]1c1ccccc1 ZINC000551086045 1039966633 /nfs/dbraw/zinc/96/66/33/1039966633.db2.gz MCAMXBXRQNTZNA-PKOBYXMFSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cnc(C4CCCCC4)s3)CC[C@H]21 ZINC000537695388 1039970914 /nfs/dbraw/zinc/97/09/14/1039970914.db2.gz NUABRROLCQVIGW-FUHWJXTLSA-N 2 1 333.545 4.107 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](Cc3cnc(C4CCCCC4)s3)CC[C@H]21 ZINC000537695388 1039970929 /nfs/dbraw/zinc/97/09/29/1039970929.db2.gz NUABRROLCQVIGW-FUHWJXTLSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](Cc3cnc(C4CCCCC4)s3)CC[C@H]21 ZINC000537695388 1039970941 /nfs/dbraw/zinc/97/09/41/1039970941.db2.gz NUABRROLCQVIGW-FUHWJXTLSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](Cc3cnc(C4CCCCC4)s3)CC[C@H]21 ZINC000537695388 1039970949 /nfs/dbraw/zinc/97/09/49/1039970949.db2.gz NUABRROLCQVIGW-FUHWJXTLSA-N 2 1 333.545 4.107 20 0 EIADMP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551147670 1040006785 /nfs/dbraw/zinc/00/67/85/1040006785.db2.gz HNIDGWRGKPLORZ-IFMALSPDSA-N 2 1 337.511 4.304 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551222031 1040079664 /nfs/dbraw/zinc/07/96/64/1040079664.db2.gz FBCGWGCIGMMTTP-UHFFFAOYSA-N 2 1 337.920 4.283 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551222031 1040079677 /nfs/dbraw/zinc/07/96/77/1040079677.db2.gz FBCGWGCIGMMTTP-UHFFFAOYSA-N 2 1 337.920 4.283 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(OC(F)F)cc1 ZINC000482328901 1040178101 /nfs/dbraw/zinc/17/81/01/1040178101.db2.gz IVLIDVYIAYJZSV-MAUKXSAKSA-N 2 1 340.458 4.449 20 0 EIADMP C[C@@H](NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441684 1040247992 /nfs/dbraw/zinc/24/79/92/1040247992.db2.gz VPIMHNQDQPTRNK-AEFFLSMTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441684 1040248008 /nfs/dbraw/zinc/24/80/08/1040248008.db2.gz VPIMHNQDQPTRNK-AEFFLSMTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441684 1040248019 /nfs/dbraw/zinc/24/80/19/1040248019.db2.gz VPIMHNQDQPTRNK-AEFFLSMTSA-N 2 1 344.449 4.180 20 0 EIADMP Cc1ccc([C@H]([NH2+]CC2([NH+](C)C)CCOCC2)C2CCCCC2)cc1 ZINC000479297497 1040255783 /nfs/dbraw/zinc/25/57/83/1040255783.db2.gz WCLADDAOERYMAA-OAQYLSRUSA-N 2 1 344.543 4.317 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)s1 ZINC000482462791 1040271386 /nfs/dbraw/zinc/27/13/86/1040271386.db2.gz XMIQLEIDEPGICQ-IEBWSBKVSA-N 2 1 328.525 4.272 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C2CC(OC(C)(C)C)C2)CC1 ZINC000520877990 1040327953 /nfs/dbraw/zinc/32/79/53/1040327953.db2.gz HAYDIOHZJLVFAF-UHFFFAOYSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@H](C[N@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000435447648 1040394429 /nfs/dbraw/zinc/39/44/29/1040394429.db2.gz HVSMZVGYXGXIGI-QZTJIDSGSA-N 2 1 343.540 4.057 20 0 EIADMP Clc1ccc(-c2ccc(C[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)o2)cc1 ZINC000666998216 1040438021 /nfs/dbraw/zinc/43/80/21/1040438021.db2.gz INTRFMCBHBZXAM-INIZCTEOSA-N 2 1 330.859 4.364 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CCc4ccc(Cl)cc43)CC2)[nH+]1 ZINC000479545675 1040451363 /nfs/dbraw/zinc/45/13/63/1040451363.db2.gz WKNFNWQFIAHQPB-IBGZPJMESA-N 2 1 341.886 4.289 20 0 EIADMP CSc1ccc(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000435734669 1040589585 /nfs/dbraw/zinc/58/95/85/1040589585.db2.gz GZVDEXOVJMRONT-UHFFFAOYSA-N 2 1 340.536 4.205 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3ccc4c(c3)CCC4)CC2)[nH+]1 ZINC000483172060 1040754781 /nfs/dbraw/zinc/75/47/81/1040754781.db2.gz FCNHWANAAWLHAT-KRWDZBQOSA-N 2 1 335.495 4.198 20 0 EIADMP COCC(C)(C)CCC[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000554088512 1040797525 /nfs/dbraw/zinc/79/75/25/1040797525.db2.gz LPSQSZLDHCFMFP-UHFFFAOYSA-N 2 1 346.559 4.472 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cc(Cl)cc(Cl)c2OC)C[C@@H]1C ZINC000539816806 1040808884 /nfs/dbraw/zinc/80/88/84/1040808884.db2.gz DIRFXEZYNUPJKL-SWLSCSKDSA-N 2 1 345.314 4.307 20 0 EIADMP CCCCOc1cc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)ccc1OC ZINC000539818056 1040810914 /nfs/dbraw/zinc/81/09/14/1040810914.db2.gz PJGDKLKPIIQSEK-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[N@@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)ccc1OC ZINC000539818056 1040810918 /nfs/dbraw/zinc/81/09/18/1040810918.db2.gz PJGDKLKPIIQSEK-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[NH+](C)[C@@H]2CC[N@H+](CC)[C@H](C)C2)ccc1OC ZINC000539818056 1040810925 /nfs/dbraw/zinc/81/09/25/1040810925.db2.gz PJGDKLKPIIQSEK-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[NH+](C)[C@@H]2CC[N@@H+](CC)[C@H](C)C2)ccc1OC ZINC000539818056 1040810929 /nfs/dbraw/zinc/81/09/29/1040810929.db2.gz PJGDKLKPIIQSEK-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)cc1OC ZINC000539817425 1040811042 /nfs/dbraw/zinc/81/10/42/1040811042.db2.gz YUKAVFOYRFBYRD-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)cc1OC ZINC000539817425 1040811050 /nfs/dbraw/zinc/81/10/50/1040811050.db2.gz YUKAVFOYRFBYRD-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](CC)[C@@H](C)C2)cc1OC ZINC000539817425 1040811052 /nfs/dbraw/zinc/81/10/52/1040811052.db2.gz YUKAVFOYRFBYRD-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](CC)[C@@H](C)C2)cc1OC ZINC000539817425 1040811054 /nfs/dbraw/zinc/81/10/54/1040811054.db2.gz YUKAVFOYRFBYRD-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP COc1ccc2ccccc2c1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000539819511 1040814425 /nfs/dbraw/zinc/81/44/25/1040814425.db2.gz FCOQCJCCNNMUAG-IBGZPJMESA-N 2 1 338.495 4.299 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cccc(OCc3ccccc3)c2)CC[N@@H+]1C ZINC000539838100 1040818888 /nfs/dbraw/zinc/81/88/88/1040818888.db2.gz IRKRVTFGHQCICV-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cccc(OCc3ccccc3)c2)CC[N@H+]1C ZINC000539838100 1040818892 /nfs/dbraw/zinc/81/88/92/1040818892.db2.gz IRKRVTFGHQCICV-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2cccc(OCc3ccccc3)c2)CC[NH+]1C ZINC000539838100 1040818894 /nfs/dbraw/zinc/81/88/94/1040818894.db2.gz IRKRVTFGHQCICV-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cccc(OCc3ccccc3)c2)CC[NH+]1C ZINC000539838100 1040818902 /nfs/dbraw/zinc/81/89/02/1040818902.db2.gz IRKRVTFGHQCICV-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCCc3c(O)cccc32)CC1 ZINC000483431997 1040856594 /nfs/dbraw/zinc/85/65/94/1040856594.db2.gz FWASCXAQGRWKJI-CZAAIQMYSA-N 2 1 342.527 4.402 20 0 EIADMP CC[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000537940133 1040905451 /nfs/dbraw/zinc/90/54/51/1040905451.db2.gz VNUXUOXSFYICHU-DWLFOUALSA-N 2 1 344.543 4.082 20 0 EIADMP COc1ccc(F)cc1C[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000462775299 1040912584 /nfs/dbraw/zinc/91/25/84/1040912584.db2.gz FWXMOULHPCDHBK-KUHUBIRLSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(F)cc1C[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000462775299 1040912599 /nfs/dbraw/zinc/91/25/99/1040912599.db2.gz FWXMOULHPCDHBK-KUHUBIRLSA-N 2 1 348.487 4.069 20 0 EIADMP CC[NH+](CC)CC1CCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000462785354 1040930164 /nfs/dbraw/zinc/93/01/64/1040930164.db2.gz OOQKHAIZOIJJHL-UHFFFAOYSA-N 2 1 331.891 4.446 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H](c3cccnc3)C3CC3)CC2)C1 ZINC000537947834 1040939407 /nfs/dbraw/zinc/93/94/07/1040939407.db2.gz LSGJGKZZOPDRDP-CZAAIQMYSA-N 2 1 327.516 4.165 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000537991006 1040969148 /nfs/dbraw/zinc/96/91/48/1040969148.db2.gz QBXCBWGKXUQIKK-CRAIPNDOSA-N 2 1 348.943 4.444 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000436229420 1040977274 /nfs/dbraw/zinc/97/72/74/1040977274.db2.gz DOLPSIQYVRGGBL-NSHDSACASA-N 2 1 345.796 4.290 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000462818066 1040995806 /nfs/dbraw/zinc/99/58/06/1040995806.db2.gz ITRNJCCWGJAPIA-IKGGRYGDSA-N 2 1 327.516 4.296 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000462818066 1040995824 /nfs/dbraw/zinc/99/58/24/1040995824.db2.gz ITRNJCCWGJAPIA-IKGGRYGDSA-N 2 1 327.516 4.296 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)Cc1cccs1 ZINC000483760325 1041002861 /nfs/dbraw/zinc/00/28/61/1041002861.db2.gz WSHSLUSKWHWXFS-UEXGIBASSA-N 2 1 342.552 4.427 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)Cc1cccs1 ZINC000483760325 1041002875 /nfs/dbraw/zinc/00/28/75/1041002875.db2.gz WSHSLUSKWHWXFS-UEXGIBASSA-N 2 1 342.552 4.427 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCOC1CCCCC1 ZINC000480161056 1041018219 /nfs/dbraw/zinc/01/82/19/1041018219.db2.gz QQCCWXVBJBAORJ-SIKLNZKXSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCOC1CCCCC1 ZINC000480161056 1041018234 /nfs/dbraw/zinc/01/82/34/1041018234.db2.gz QQCCWXVBJBAORJ-SIKLNZKXSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCOC1CCCCC1 ZINC000480161055 1041018834 /nfs/dbraw/zinc/01/88/34/1041018834.db2.gz QQCCWXVBJBAORJ-KNQAVFIVSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCOC1CCCCC1 ZINC000480161055 1041018853 /nfs/dbraw/zinc/01/88/53/1041018853.db2.gz QQCCWXVBJBAORJ-KNQAVFIVSA-N 2 1 344.543 4.226 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C(C)C ZINC000538100538 1041039712 /nfs/dbraw/zinc/03/97/12/1041039712.db2.gz PLJUIPWOLMNEMT-INIZCTEOSA-N 2 1 326.271 4.485 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC000538116498 1041048714 /nfs/dbraw/zinc/04/87/14/1041048714.db2.gz LBVMBCFTTNZXOD-NYVOZVTQSA-N 2 1 337.511 4.421 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC000538116498 1041048731 /nfs/dbraw/zinc/04/87/31/1041048731.db2.gz LBVMBCFTTNZXOD-NYVOZVTQSA-N 2 1 337.511 4.421 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+][C@H](c3ccccc3)C3CC3)C2)cc1 ZINC000538103100 1041059772 /nfs/dbraw/zinc/05/97/72/1041059772.db2.gz UCVDGXKNAXNMFA-NZQKXSOJSA-N 2 1 334.507 4.292 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)CCCC(F)(F)F)CC2)[nH+]c1 ZINC000480204267 1041074237 /nfs/dbraw/zinc/07/42/37/1041074237.db2.gz SESAHMDRWGTUNU-AWEZNQCLSA-N 2 1 329.410 4.070 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@@H](C)C1 ZINC000436317362 1041087312 /nfs/dbraw/zinc/08/73/12/1041087312.db2.gz UZEUBPKAFHZRKB-IKICRFKJSA-N 2 1 340.433 4.271 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3ccc4c(c3)CCC4)CC2)[nH+]c1 ZINC000484132333 1041139867 /nfs/dbraw/zinc/13/98/67/1041139867.db2.gz RJUGLNVJNHZQPI-KRWDZBQOSA-N 2 1 335.495 4.198 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@@H]3C)cc2)cs1 ZINC000480272828 1041152604 /nfs/dbraw/zinc/15/26/04/1041152604.db2.gz DYRDXGVCGBITEV-QCUYGVNKSA-N 2 1 343.540 4.498 20 0 EIADMP Cc1ccc(C)c([C@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)c1 ZINC000484279502 1041181347 /nfs/dbraw/zinc/18/13/47/1041181347.db2.gz WKXTVTNIPGSQCT-KRWDZBQOSA-N 2 1 338.499 4.030 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1sccc1Br ZINC000540167467 1041209203 /nfs/dbraw/zinc/20/92/03/1041209203.db2.gz ZHHBAWZBPUKNSX-GHMZBOCLSA-N 2 1 342.306 4.002 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000540170106 1041212261 /nfs/dbraw/zinc/21/22/61/1041212261.db2.gz YSABVYQJEXRRNP-VXGBXAGGSA-N 2 1 326.271 4.485 20 0 EIADMP CCC[C@@H](Cc1ccccc1)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000540170075 1041212896 /nfs/dbraw/zinc/21/28/96/1041212896.db2.gz YPCJTHBRBQKVHN-NRFANRHFSA-N 2 1 344.543 4.023 20 0 EIADMP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+]2C)cc1 ZINC000538259734 1041219736 /nfs/dbraw/zinc/21/97/36/1041219736.db2.gz NEMQVUHNXZRIPY-XLIONFOSSA-N 2 1 338.495 4.497 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1cccc(O)c1 ZINC000194850331 1041236038 /nfs/dbraw/zinc/23/60/38/1041236038.db2.gz BECWMRSHCLBGMU-ROUUACIJSA-N 2 1 338.495 4.475 20 0 EIADMP C[C@H]([NH2+]C1(C[NH2+][C@H]2CCC23CCOCC3)CCCC1)c1ccccc1 ZINC000554559547 1041245258 /nfs/dbraw/zinc/24/52/58/1041245258.db2.gz DFEYIPKKNDJOLT-ICSRJNTNSA-N 2 1 342.527 4.199 20 0 EIADMP Cc1c(CC[NH3+])c2ccccc2n1C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167960793 1041248795 /nfs/dbraw/zinc/24/87/95/1041248795.db2.gz CYHZPYCWVVCAKB-DFNIBXOVSA-N 2 1 337.511 4.029 20 0 EIADMP C[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000463089037 1041325457 /nfs/dbraw/zinc/32/54/57/1041325457.db2.gz PGEYQDXHYOLBLN-PUHATCMVSA-N 2 1 334.507 4.244 20 0 EIADMP C[NH+](C[C@@H]1C[C@H]1c1ccccc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000463089037 1041325471 /nfs/dbraw/zinc/32/54/71/1041325471.db2.gz PGEYQDXHYOLBLN-PUHATCMVSA-N 2 1 334.507 4.244 20 0 EIADMP C[NH+](C[C@@H]1C[C@H]1c1ccccc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000463089037 1041325480 /nfs/dbraw/zinc/32/54/80/1041325480.db2.gz PGEYQDXHYOLBLN-PUHATCMVSA-N 2 1 334.507 4.244 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cccc(F)c2F)CC[N@@H+]1Cc1ccccc1 ZINC000463130490 1041355446 /nfs/dbraw/zinc/35/54/46/1041355446.db2.gz WUSQRFQFVWUWJF-VQIMIIECSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cccc(F)c2F)CC[N@H+]1Cc1ccccc1 ZINC000463130490 1041355454 /nfs/dbraw/zinc/35/54/54/1041355454.db2.gz WUSQRFQFVWUWJF-VQIMIIECSA-N 2 1 344.449 4.150 20 0 EIADMP Cc1ccc(OCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000463133535 1041367987 /nfs/dbraw/zinc/36/79/87/1041367987.db2.gz TZDPKHMRBFMBMT-CTNGQTDRSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1ccc(OCC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000463133535 1041368003 /nfs/dbraw/zinc/36/80/03/1041368003.db2.gz TZDPKHMRBFMBMT-CTNGQTDRSA-N 2 1 338.495 4.017 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463146461 1041368850 /nfs/dbraw/zinc/36/88/50/1041368850.db2.gz BVMHKLPJZOLJGL-AVRDEDQJSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463146461 1041368862 /nfs/dbraw/zinc/36/88/62/1041368862.db2.gz BVMHKLPJZOLJGL-AVRDEDQJSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000463164551 1041380257 /nfs/dbraw/zinc/38/02/57/1041380257.db2.gz UKGLMQYTQAYZIB-QIJUGHKUSA-N 2 1 334.507 4.359 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000463164551 1041380265 /nfs/dbraw/zinc/38/02/65/1041380265.db2.gz UKGLMQYTQAYZIB-QIJUGHKUSA-N 2 1 334.507 4.359 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000463164555 1041380718 /nfs/dbraw/zinc/38/07/18/1041380718.db2.gz UKGLMQYTQAYZIB-STZQEDGTSA-N 2 1 334.507 4.359 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000463164555 1041380728 /nfs/dbraw/zinc/38/07/28/1041380728.db2.gz UKGLMQYTQAYZIB-STZQEDGTSA-N 2 1 334.507 4.359 20 0 EIADMP C[C@H]1Cc2ccccc2[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463152753 1041385209 /nfs/dbraw/zinc/38/52/09/1041385209.db2.gz SWUVDJHJEMRNKB-MBSDFSHPSA-N 2 1 334.507 4.217 20 0 EIADMP COc1ccc(C2([NH2+]C3CC[NH+]([C@@H]4CCCC[C@H]4C)CC3)CC2)cc1 ZINC000538524304 1041393282 /nfs/dbraw/zinc/39/32/82/1041393282.db2.gz MHWNSXOBKWNNIH-DYESRHJHSA-N 2 1 342.527 4.317 20 0 EIADMP CC(C)[NH+](CCCN[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000463208587 1041419957 /nfs/dbraw/zinc/41/99/57/1041419957.db2.gz XOVOXKNCPMLHOB-IRLDBZIGSA-N 2 1 345.575 4.138 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(OC)c1 ZINC000480608406 1041420249 /nfs/dbraw/zinc/42/02/49/1041420249.db2.gz KUTNPWBQVZABKY-SJORKVTESA-N 2 1 334.504 4.009 20 0 EIADMP CC(C)[NH+](CCCN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000463208588 1041420379 /nfs/dbraw/zinc/42/03/79/1041420379.db2.gz XOVOXKNCPMLHOB-RBBKRZOGSA-N 2 1 345.575 4.138 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C[C@H](C)CC(C)C)CC2)cs1 ZINC000554859342 1041458755 /nfs/dbraw/zinc/45/87/55/1041458755.db2.gz OOOLITSKDYFXIW-MRXNPFEDSA-N 2 1 337.577 4.189 20 0 EIADMP C[C@H]([NH2+]C1(Cc2ccccc2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000480692505 1041476170 /nfs/dbraw/zinc/47/61/70/1041476170.db2.gz ASDBOOZMTQCQNQ-UGKGYDQZSA-N 2 1 334.507 4.262 20 0 EIADMP c1ccc(COC[C@@H]([NH2+]CCC[NH+]2CCCC2)c2ccccc2)cc1 ZINC000540456977 1041477396 /nfs/dbraw/zinc/47/73/96/1041477396.db2.gz SUIRANYQPSDISD-JOCHJYFZSA-N 2 1 338.495 4.020 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Br)cc2C)C[C@H]1C ZINC000538718055 1041487686 /nfs/dbraw/zinc/48/76/86/1041487686.db2.gz RUEVPYXSJWBQJQ-PBHICJAKSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Br)cc2C)C[C@H]1C ZINC000538718055 1041487687 /nfs/dbraw/zinc/48/76/87/1041487687.db2.gz RUEVPYXSJWBQJQ-PBHICJAKSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Br)cc2C)C[C@H]1C ZINC000538718055 1041487690 /nfs/dbraw/zinc/48/76/90/1041487690.db2.gz RUEVPYXSJWBQJQ-PBHICJAKSA-N 2 1 339.321 4.062 20 0 EIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538722006 1041493752 /nfs/dbraw/zinc/49/37/52/1041493752.db2.gz RXCGCOQDNHKQCQ-MRXNPFEDSA-N 2 1 340.458 4.069 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538722006 1041493761 /nfs/dbraw/zinc/49/37/61/1041493761.db2.gz RXCGCOQDNHKQCQ-MRXNPFEDSA-N 2 1 340.458 4.069 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538722006 1041493771 /nfs/dbraw/zinc/49/37/71/1041493771.db2.gz RXCGCOQDNHKQCQ-MRXNPFEDSA-N 2 1 340.458 4.069 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538722006 1041493780 /nfs/dbraw/zinc/49/37/80/1041493780.db2.gz RXCGCOQDNHKQCQ-MRXNPFEDSA-N 2 1 340.458 4.069 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc3c[nH]nc3c2)CC1 ZINC000538725055 1041516077 /nfs/dbraw/zinc/51/60/77/1041516077.db2.gz RMLQDPQPABXLPQ-QGZVFWFLSA-N 2 1 340.515 4.039 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)[C@@H](C)C1 ZINC000437073876 1041624434 /nfs/dbraw/zinc/62/44/34/1041624434.db2.gz HOMIJMQEDIWFMD-YOEHRIQHSA-N 2 1 340.433 4.057 20 0 EIADMP CC[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402486992 1041819558 /nfs/dbraw/zinc/81/95/58/1041819558.db2.gz ASRVHNKRKAKRDR-SOLBZPMBSA-N 2 1 342.449 4.465 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]CC(Cc2ccccc2)Cc2ccccc2)C1 ZINC000517001604 1041838803 /nfs/dbraw/zinc/83/88/03/1041838803.db2.gz LBFGLZJWBZSMSM-QFIPXVFZSA-N 2 1 336.523 4.019 20 0 EIADMP c1ccc(OCCCCC[NH+]2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000437592259 1041847291 /nfs/dbraw/zinc/84/72/91/1041847291.db2.gz QYGLYPWIDAKYEI-UHFFFAOYSA-N 2 1 330.516 4.186 20 0 EIADMP CC[C@@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)CC(F)(F)F ZINC000402556502 1041853395 /nfs/dbraw/zinc/85/33/95/1041853395.db2.gz JIXLBDAKHXLYFB-OAHLLOKOSA-N 2 1 328.422 4.219 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCCOCc3ccccc3)C2)CC1 ZINC000541591195 1042024763 /nfs/dbraw/zinc/02/47/63/1042024763.db2.gz RTBXGWILTLFDDW-QFIPXVFZSA-N 2 1 344.543 4.037 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)Cc2ccccc2F)CC1 ZINC000438091592 1042041783 /nfs/dbraw/zinc/04/17/83/1042041783.db2.gz ZNCJYKFFFQNQJU-GOSISDBHSA-N 2 1 340.486 4.319 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@H]3CCC4(CCCCC4)O3)CC2)cc1 ZINC000301961588 1042042376 /nfs/dbraw/zinc/04/23/76/1042042376.db2.gz MUBNUMHDHVPZBZ-OAQYLSRUSA-N 2 1 342.527 4.123 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)C1 ZINC000438119941 1042062727 /nfs/dbraw/zinc/06/27/27/1042062727.db2.gz LAFTUKSKZIACIF-PVSGBFIBSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000438119941 1042062735 /nfs/dbraw/zinc/06/27/35/1042062735.db2.gz LAFTUKSKZIACIF-PVSGBFIBSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000438119941 1042062742 /nfs/dbraw/zinc/06/27/42/1042062742.db2.gz LAFTUKSKZIACIF-PVSGBFIBSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000438119941 1042062748 /nfs/dbraw/zinc/06/27/48/1042062748.db2.gz LAFTUKSKZIACIF-PVSGBFIBSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000438119941 1042062753 /nfs/dbraw/zinc/06/27/53/1042062753.db2.gz LAFTUKSKZIACIF-PVSGBFIBSA-N 2 1 338.539 4.446 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCCOc2cccc3ccccc32)C1 ZINC000464776224 1042158861 /nfs/dbraw/zinc/15/88/61/1042158861.db2.gz KWPCDNSDTKQVGJ-LJQANCHMSA-N 2 1 340.511 4.272 20 0 EIADMP CCc1ccc(-c2ccc(C[NH2+]C[C@H](C)Cn3cc[nH+]c3C)o2)cc1 ZINC000465006639 1042278842 /nfs/dbraw/zinc/27/88/42/1042278842.db2.gz RTJCCYPGJGKSSD-INIZCTEOSA-N 2 1 337.467 4.440 20 0 EIADMP [NH3+]C[C@H](NC1CCN(c2ccccc2)CC1)c1ccc2ccccc2c1 ZINC000414947266 1042333758 /nfs/dbraw/zinc/33/37/58/1042333758.db2.gz VYWKJXQMYDYNEM-QHCPKHFHSA-N 2 1 345.490 4.098 20 0 EIADMP [NH3+]C[C@@H](NC1CCN(c2ccccc2)CC1)c1ccc2ccccc2c1 ZINC000414947265 1042334099 /nfs/dbraw/zinc/33/40/99/1042334099.db2.gz VYWKJXQMYDYNEM-HSZRJFAPSA-N 2 1 345.490 4.098 20 0 EIADMP COc1ccc2cc(C[NH+]3CCC([NH+]4CCCCC4)CC3)ccc2c1 ZINC000506371467 1042360216 /nfs/dbraw/zinc/36/02/16/1042360216.db2.gz TWRIDHSJGVUYHM-UHFFFAOYSA-N 2 1 338.495 4.299 20 0 EIADMP C[C@@H](C[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C[NH+]1CCCC1 ZINC000518272604 1042445398 /nfs/dbraw/zinc/44/53/98/1042445398.db2.gz LLCZXCSDMSPMSZ-LBPRGKRZSA-N 2 1 334.813 4.180 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCOc2cccc(C(C)(C)C)c2)CC1 ZINC000506464748 1042467477 /nfs/dbraw/zinc/46/74/77/1042467477.db2.gz XXXILHYPLWRNIJ-UHFFFAOYSA-N 2 1 332.532 4.168 20 0 EIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000303686570 1042497380 /nfs/dbraw/zinc/49/73/80/1042497380.db2.gz NTKGQEBTTUGZSK-HNNXBMFYSA-N 2 1 328.422 4.362 20 0 EIADMP c1csc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000518387705 1042501412 /nfs/dbraw/zinc/50/14/12/1042501412.db2.gz YFQRJPISSJCAQR-UHFFFAOYSA-N 2 1 326.509 4.236 20 0 EIADMP CC(C)(C)OCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000669942054 1042538627 /nfs/dbraw/zinc/53/86/27/1042538627.db2.gz SJTQNTKNFDFXIN-LJQANCHMSA-N 2 1 332.532 4.082 20 0 EIADMP CC(C)(C)OCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000669942054 1042538630 /nfs/dbraw/zinc/53/86/30/1042538630.db2.gz SJTQNTKNFDFXIN-LJQANCHMSA-N 2 1 332.532 4.082 20 0 EIADMP Clc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1Cl ZINC001167964386 1042599112 /nfs/dbraw/zinc/59/91/12/1042599112.db2.gz QHHSQXKAAMUXLS-MQVJKMGUSA-N 2 1 339.310 4.488 20 0 EIADMP CCCC1CCC([NH2+]CC2([NH+]3CCC(OC)CC3)CCCC2)CC1 ZINC000518798379 1042702077 /nfs/dbraw/zinc/70/20/77/1042702077.db2.gz ZKTRXROCPWQJPT-UHFFFAOYSA-N 2 1 336.564 4.359 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(Cl)s1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309912990 1042824231 /nfs/dbraw/zinc/82/42/31/1042824231.db2.gz MWGOGHDMVJUKMZ-HOCLYGCPSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@H]([NH2+]CCSc1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310170865 1042829963 /nfs/dbraw/zinc/82/99/63/1042829963.db2.gz UAUPBAFOHWMDDW-AZUAARDMSA-N 2 1 340.536 4.279 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2ncccc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311524985 1042861454 /nfs/dbraw/zinc/86/14/54/1042861454.db2.gz JZUIOWKBHLHJBI-XMSQKQJNSA-N 2 1 345.490 4.235 20 0 EIADMP COc1ccc([C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)c2ccccc2)cc1 ZINC000493277233 1042890968 /nfs/dbraw/zinc/89/09/68/1042890968.db2.gz PQZVAEDXJRBGLU-KCZVDYSFSA-N 2 1 338.495 4.247 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@H]1C ZINC000493282725 1042892727 /nfs/dbraw/zinc/89/27/27/1042892727.db2.gz TZGWWDYVRCVDTC-WBVHZDCISA-N 2 1 338.923 4.432 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@H]1C ZINC000493282725 1042892728 /nfs/dbraw/zinc/89/27/28/1042892728.db2.gz TZGWWDYVRCVDTC-WBVHZDCISA-N 2 1 338.923 4.432 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@H]1C ZINC000493282725 1042892729 /nfs/dbraw/zinc/89/27/29/1042892729.db2.gz TZGWWDYVRCVDTC-WBVHZDCISA-N 2 1 338.923 4.432 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@H]1C ZINC000493282725 1042892732 /nfs/dbraw/zinc/89/27/32/1042892732.db2.gz TZGWWDYVRCVDTC-WBVHZDCISA-N 2 1 338.923 4.432 20 0 EIADMP COc1ccc(C2CCC([NH2+]C[C@@H](C)Cn3cc[nH+]c3C)CC2)cc1 ZINC000542469285 1042926125 /nfs/dbraw/zinc/92/61/25/1042926125.db2.gz WSYNKNPZZIJKLJ-PPDQVPDSSA-N 2 1 341.499 4.152 20 0 EIADMP COC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000493882722 1042971028 /nfs/dbraw/zinc/97/10/28/1042971028.db2.gz JOXROKYMEUDERV-VQIMIIECSA-N 2 1 338.923 4.129 20 0 EIADMP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000493889999 1042973065 /nfs/dbraw/zinc/97/30/65/1042973065.db2.gz ZVJIVCOYSFAYKF-GCJKJVERSA-N 2 1 338.495 4.017 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)[C@@H](OC)c2ccccc2)c1 ZINC000493905181 1042974809 /nfs/dbraw/zinc/97/48/09/1042974809.db2.gz HBVMIRPPKPMYKF-DYESRHJHSA-N 2 1 326.484 4.004 20 0 EIADMP Cc1nc2ccc(C[NH2+][C@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)cc2s1 ZINC000494196802 1043032567 /nfs/dbraw/zinc/03/25/67/1043032567.db2.gz ZQWZDBXORQQKLX-RHSMWYFYSA-N 2 1 343.540 4.347 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1c(Cl)cccc1Cl ZINC000166447783 1043086072 /nfs/dbraw/zinc/08/60/72/1043086072.db2.gz WPZSKDNJVNHWPM-HZSPNIEDSA-N 2 1 327.299 4.313 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310365542 1043131428 /nfs/dbraw/zinc/13/14/28/1043131428.db2.gz LZGXTHWSAHMIFR-MJGOQNOKSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310365542 1043131433 /nfs/dbraw/zinc/13/14/33/1043131433.db2.gz LZGXTHWSAHMIFR-MJGOQNOKSA-N 2 1 326.459 4.389 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCSc2c(Cl)cccc21 ZINC000164697110 1043152518 /nfs/dbraw/zinc/15/25/18/1043152518.db2.gz VJQCADKCNVAUNF-MRXNPFEDSA-N 2 1 335.904 4.452 20 0 EIADMP Cc1cc2c(cc1C)[C@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CCS2 ZINC000427709618 1043171962 /nfs/dbraw/zinc/17/19/62/1043171962.db2.gz AGNJTKNYQZCLEL-LJQANCHMSA-N 2 1 330.541 4.447 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cnc3ccccc3c2)C1 ZINC000727467009 1043226859 /nfs/dbraw/zinc/22/68/59/1043226859.db2.gz LOFLVANVEKGTRC-HDICACEKSA-N 2 1 325.500 4.083 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2cnc3ccccc3c2)cc1F ZINC000727468933 1043229770 /nfs/dbraw/zinc/22/97/70/1043229770.db2.gz PPVFMKGFNTZMHC-UHFFFAOYSA-N 2 1 346.409 4.158 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCCc3nc(C)ncc32)cc1 ZINC000766046659 1043247044 /nfs/dbraw/zinc/24/70/44/1043247044.db2.gz ZKYGAVPZZAUIKX-VLIAUNLRSA-N 2 1 347.466 4.007 20 0 EIADMP CCSc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)ccn1 ZINC000427887059 1043251143 /nfs/dbraw/zinc/25/11/43/1043251143.db2.gz RWZQORHETUEZMO-VQIMIIECSA-N 2 1 347.572 4.326 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000674005779 1043269935 /nfs/dbraw/zinc/26/99/35/1043269935.db2.gz OKTPLRBLDJJRIR-MAUKXSAKSA-N 2 1 342.449 4.443 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000674005779 1043269944 /nfs/dbraw/zinc/26/99/44/1043269944.db2.gz OKTPLRBLDJJRIR-MAUKXSAKSA-N 2 1 342.449 4.443 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000674005779 1043269956 /nfs/dbraw/zinc/26/99/56/1043269956.db2.gz OKTPLRBLDJJRIR-MAUKXSAKSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1cccc2ccccc21 ZINC000674048910 1043349760 /nfs/dbraw/zinc/34/97/60/1043349760.db2.gz FUMCKJDZLJBPNB-PXNSSMCTSA-N 2 1 338.495 4.134 20 0 EIADMP C[C@@H]1CC([NH2+][C@H]2CCCc3cccnc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012549 1043438797 /nfs/dbraw/zinc/43/87/97/1043438797.db2.gz BWXRMZUZGKPNTO-HMFYCAOWSA-N 2 1 349.522 4.490 20 0 EIADMP Cc1cccc2c1OCC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000189373685 1043548263 /nfs/dbraw/zinc/54/82/63/1043548263.db2.gz NBPPXDNBVXMMAU-HXUWFJFHSA-N 2 1 328.500 4.205 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467363819 1043579641 /nfs/dbraw/zinc/57/96/41/1043579641.db2.gz GBQFDCAWLNURDZ-RBUKOAKNSA-N 2 1 340.515 4.035 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccccn1 ZINC000639219171 1043655312 /nfs/dbraw/zinc/65/53/12/1043655312.db2.gz QBVWCDXCMANZTK-PZJWPPBQSA-N 2 1 349.522 4.317 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccccn1 ZINC000639219171 1043655327 /nfs/dbraw/zinc/65/53/27/1043655327.db2.gz QBVWCDXCMANZTK-PZJWPPBQSA-N 2 1 349.522 4.317 20 0 EIADMP Cc1nccn1CCCC[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000442393790 1043670349 /nfs/dbraw/zinc/67/03/49/1043670349.db2.gz IRSVEDDKRDHAJA-UHFFFAOYSA-N 2 1 326.271 4.411 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000442393790 1043670355 /nfs/dbraw/zinc/67/03/55/1043670355.db2.gz IRSVEDDKRDHAJA-UHFFFAOYSA-N 2 1 326.271 4.411 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000442393790 1043670362 /nfs/dbraw/zinc/67/03/62/1043670362.db2.gz IRSVEDDKRDHAJA-UHFFFAOYSA-N 2 1 326.271 4.411 20 0 EIADMP Cn1cc[nH+]c1C[C@H](Nc1cc[nH+]c2ccccc12)c1ccccc1 ZINC000078559018 1043682047 /nfs/dbraw/zinc/68/20/47/1043682047.db2.gz FRBZACWBZYHUCF-FQEVSTJZSA-N 2 1 328.419 4.364 20 0 EIADMP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000543051646 1043683105 /nfs/dbraw/zinc/68/31/05/1043683105.db2.gz JMVASEPCPSWSLN-UYAOXDASSA-N 2 1 343.902 4.093 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000543051646 1043683111 /nfs/dbraw/zinc/68/31/11/1043683111.db2.gz JMVASEPCPSWSLN-UYAOXDASSA-N 2 1 343.902 4.093 20 0 EIADMP CC(C)O[C@H](C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000428251060 1043694113 /nfs/dbraw/zinc/69/41/13/1043694113.db2.gz YALIBPCCQYJKHA-NHCUHLMSSA-N 2 1 330.516 4.103 20 0 EIADMP CC[NH+](CC)CCC[NH2+]CC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000521332866 1043716944 /nfs/dbraw/zinc/71/69/44/1043716944.db2.gz REPXTMPJRUKJHZ-UHFFFAOYSA-N 2 1 343.298 4.091 20 0 EIADMP C[C@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccccn1 ZINC000658065420 1043723544 /nfs/dbraw/zinc/72/35/44/1043723544.db2.gz BIWYQXROUGCDMJ-KMFTYDHNSA-N 2 1 337.511 4.218 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)CCS2 ZINC000191528795 1043824478 /nfs/dbraw/zinc/82/44/78/1043824478.db2.gz MODTVSOIZMSWNT-KRWDZBQOSA-N 2 1 334.529 4.085 20 0 EIADMP CC1(C)CC([NH2+]Cc2ccccc2OCC(F)(F)F)CC(C)(C)[NH2+]1 ZINC000494599647 1043840903 /nfs/dbraw/zinc/84/09/03/1043840903.db2.gz TUBGMZXIUXMAJP-UHFFFAOYSA-N 2 1 344.421 4.027 20 0 EIADMP Cc1cccc2[nH]c(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)cc21 ZINC000657309020 1043883726 /nfs/dbraw/zinc/88/37/26/1043883726.db2.gz GOJOTPBORRMCIN-UHFFFAOYSA-N 2 1 347.506 4.273 20 0 EIADMP FC(F)(F)c1cccc(CCCC[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC000192457885 1043926349 /nfs/dbraw/zinc/92/63/49/1043926349.db2.gz WSSYXNQBHKOQHK-UHFFFAOYSA-N 2 1 340.433 4.245 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000674909368 1043933100 /nfs/dbraw/zinc/93/31/00/1043933100.db2.gz LCFSMUQNRCPNDS-SFTDATJTSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000674909368 1043933111 /nfs/dbraw/zinc/93/31/11/1043933111.db2.gz LCFSMUQNRCPNDS-SFTDATJTSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000674909367 1043936722 /nfs/dbraw/zinc/93/67/22/1043936722.db2.gz LCFSMUQNRCPNDS-RTWAWAEBSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000674909367 1043936737 /nfs/dbraw/zinc/93/67/37/1043936737.db2.gz LCFSMUQNRCPNDS-RTWAWAEBSA-N 2 1 336.479 4.079 20 0 EIADMP C[N@@H+]1CC[C@H]2CC[NH+](CCCCc3cccc(C(F)(F)F)c3)[C@@H]2C1 ZINC000192698887 1043948766 /nfs/dbraw/zinc/94/87/66/1043948766.db2.gz PIDNNBGXKSLDQH-FUHWJXTLSA-N 2 1 340.433 4.054 20 0 EIADMP C[N@H+]1CC[C@H]2CC[NH+](CCCCc3cccc(C(F)(F)F)c3)[C@@H]2C1 ZINC000192698887 1043948782 /nfs/dbraw/zinc/94/87/82/1043948782.db2.gz PIDNNBGXKSLDQH-FUHWJXTLSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@H+](CCCCc3cccc(C(F)(F)F)c3)[C@@H]2C1 ZINC000192698887 1043948792 /nfs/dbraw/zinc/94/87/92/1043948792.db2.gz PIDNNBGXKSLDQH-FUHWJXTLSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@@H+](CCCCc3cccc(C(F)(F)F)c3)[C@@H]2C1 ZINC000192698887 1043948803 /nfs/dbraw/zinc/94/88/03/1043948803.db2.gz PIDNNBGXKSLDQH-FUHWJXTLSA-N 2 1 340.433 4.054 20 0 EIADMP CCCC[N@@H+](C)CC1CCN(Cc2coc(-c3cccs3)n2)CC1 ZINC000079914910 1044034248 /nfs/dbraw/zinc/03/42/48/1044034248.db2.gz GITCWGBKEREVOP-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2coc(-c3cccs3)n2)CC1 ZINC000079914910 1044034267 /nfs/dbraw/zinc/03/42/67/1044034267.db2.gz GITCWGBKEREVOP-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2coc(-c3cccs3)n2)CC1 ZINC000079914910 1044034287 /nfs/dbraw/zinc/03/42/87/1044034287.db2.gz GITCWGBKEREVOP-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP c1ccc(SC2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCCC2)cc1 ZINC000166560167 1044036191 /nfs/dbraw/zinc/03/61/91/1044036191.db2.gz LSAGWGNZEOWXAD-QZTJIDSGSA-N 2 1 330.541 4.308 20 0 EIADMP CC[N@@H+](Cc1ccc(C(=O)Nc2c(C)cc(C)nc2C)cc1)C(C)C ZINC000195253064 1044046871 /nfs/dbraw/zinc/04/68/71/1044046871.db2.gz AUYQPOARVSPSIQ-UHFFFAOYSA-N 2 1 339.483 4.489 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000186518134 1044163423 /nfs/dbraw/zinc/16/34/23/1044163423.db2.gz IGAVCYDGDUFXDE-QLFBSQMISA-N 2 1 336.907 4.349 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)CCc1ccc(C(F)(F)F)cc1 ZINC000193976784 1044225222 /nfs/dbraw/zinc/22/52/22/1044225222.db2.gz CJFVPSPFZYKJRI-CQSZACIVSA-N 2 1 339.405 4.211 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3cccs3)C1)CC2 ZINC000479387547 1044242969 /nfs/dbraw/zinc/24/29/69/1044242969.db2.gz HNOCFDRZQQUZSS-MGPUTAFESA-N 2 1 344.499 4.376 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc3cccs3)C1)CC2 ZINC000479387547 1044242987 /nfs/dbraw/zinc/24/29/87/1044242987.db2.gz HNOCFDRZQQUZSS-MGPUTAFESA-N 2 1 344.499 4.376 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cc(Br)cs1 ZINC000194025896 1044242993 /nfs/dbraw/zinc/24/29/93/1044242993.db2.gz UAXIMWRROPMYSE-MNOVXSKESA-N 2 1 342.306 4.002 20 0 EIADMP COc1ccccc1CC[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000347969804 1044343856 /nfs/dbraw/zinc/34/38/56/1044343856.db2.gz WFRKEJQEQBATDQ-MRXNPFEDSA-N 2 1 335.451 4.083 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1Cc1ccccc1Cl ZINC000348068037 1044374084 /nfs/dbraw/zinc/37/40/84/1044374084.db2.gz FVWSPHABLOOSCC-SFHVURJKSA-N 2 1 331.891 4.332 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1Cc1ccccc1Cl ZINC000348068037 1044374097 /nfs/dbraw/zinc/37/40/97/1044374097.db2.gz FVWSPHABLOOSCC-SFHVURJKSA-N 2 1 331.891 4.332 20 0 EIADMP c1ccc(C[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCCCC2)cc1 ZINC000480239993 1044446422 /nfs/dbraw/zinc/44/64/22/1044446422.db2.gz IYEHPLSBUINRNH-JOCHJYFZSA-N 2 1 326.528 4.394 20 0 EIADMP C[C@H](C[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)Cc1ccccc1 ZINC000542518626 1044451606 /nfs/dbraw/zinc/45/16/06/1044451606.db2.gz YAQCJYSMFXEDPK-NZQKXSOJSA-N 2 1 336.523 4.019 20 0 EIADMP C[C@@H]1C[C@@H](N2CC[C@@H]([NH3+])c3ccccc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168023150 1044561707 /nfs/dbraw/zinc/56/17/07/1044561707.db2.gz VMYSCORWSVEKNN-BAYUQKDNSA-N 2 1 349.522 4.338 20 0 EIADMP Cc1ccccc1[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)C1CCCC1 ZINC000495081002 1044650327 /nfs/dbraw/zinc/65/03/27/1044650327.db2.gz FLTKWKNGFHJEMQ-IRLDBZIGSA-N 2 1 344.543 4.053 20 0 EIADMP C[N@@H+](CCCCc1cccc(C(F)(F)F)c1)C[C@@H]1CCC[NH+](C)C1 ZINC000474152100 1044699600 /nfs/dbraw/zinc/69/96/00/1044699600.db2.gz GSYWQTNZGLYWGS-KRWDZBQOSA-N 2 1 342.449 4.302 20 0 EIADMP C[NH+](CCCCc1cccc(C(F)(F)F)c1)C[C@@H]1CCC[N@H+](C)C1 ZINC000474152100 1044699607 /nfs/dbraw/zinc/69/96/07/1044699607.db2.gz GSYWQTNZGLYWGS-KRWDZBQOSA-N 2 1 342.449 4.302 20 0 EIADMP C[NH+](CCCCc1cccc(C(F)(F)F)c1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000474152100 1044699617 /nfs/dbraw/zinc/69/96/17/1044699617.db2.gz GSYWQTNZGLYWGS-KRWDZBQOSA-N 2 1 342.449 4.302 20 0 EIADMP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2nc3ccc(F)cc3s2)c1 ZINC000428853209 1044720285 /nfs/dbraw/zinc/72/02/85/1044720285.db2.gz ZDRKFMJDBWHQIA-UHFFFAOYSA-N 2 1 343.471 4.177 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2nc3ccc(F)cc3s2)c1 ZINC000428853209 1044720299 /nfs/dbraw/zinc/72/02/99/1044720299.db2.gz ZDRKFMJDBWHQIA-UHFFFAOYSA-N 2 1 343.471 4.177 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(N)c1 ZINC001168026960 1044724741 /nfs/dbraw/zinc/72/47/41/1044724741.db2.gz MPVSXSRFJAWQRC-SUWCGCSTSA-N 2 1 337.511 4.361 20 0 EIADMP CC1(C[NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532367 1044800310 /nfs/dbraw/zinc/80/03/10/1044800310.db2.gz OAUAXHSXRHJXKP-FUHWJXTLSA-N 2 1 334.454 4.380 20 0 EIADMP CC1(C[NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532367 1044800311 /nfs/dbraw/zinc/80/03/11/1044800311.db2.gz OAUAXHSXRHJXKP-FUHWJXTLSA-N 2 1 334.454 4.380 20 0 EIADMP FC(F)(F)c1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000676712967 1044827161 /nfs/dbraw/zinc/82/71/61/1044827161.db2.gz VLCNDTOISKYXAR-QAPCUYQASA-N 2 1 338.417 4.154 20 0 EIADMP FC(F)(F)c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000676712967 1044827163 /nfs/dbraw/zinc/82/71/63/1044827163.db2.gz VLCNDTOISKYXAR-QAPCUYQASA-N 2 1 338.417 4.154 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH2+]C[C@@H]3CC[N@@H+](CC)C3)ccc21 ZINC000327321135 1044833438 /nfs/dbraw/zinc/83/34/38/1044833438.db2.gz ZXNQIDJRHWMTOA-SFHVURJKSA-N 2 1 335.495 4.246 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000673600441 1044854636 /nfs/dbraw/zinc/85/46/36/1044854636.db2.gz XCQRJQGARZZKLI-MBSJSRAVSA-N 2 1 326.406 4.040 20 0 EIADMP CCCn1ccnc1CCC[N@@H+](C)[C@@H]1CCc2c1cccc2Cl ZINC000429259872 1044856941 /nfs/dbraw/zinc/85/69/41/1044856941.db2.gz LHFTYKPDKOOFAF-GOSISDBHSA-N 2 1 331.891 4.498 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H]1CCc2c1cccc2Cl ZINC000429259872 1044856944 /nfs/dbraw/zinc/85/69/44/1044856944.db2.gz LHFTYKPDKOOFAF-GOSISDBHSA-N 2 1 331.891 4.498 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H]1CCc2c1cccc2Cl ZINC000429259872 1044856952 /nfs/dbraw/zinc/85/69/52/1044856952.db2.gz LHFTYKPDKOOFAF-GOSISDBHSA-N 2 1 331.891 4.498 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000673600221 1044861281 /nfs/dbraw/zinc/86/12/81/1044861281.db2.gz WPAXHEQWJOTUKX-NIAZTZROSA-N 2 1 338.417 4.325 20 0 EIADMP Fc1ccccc1C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000191693416 1044908354 /nfs/dbraw/zinc/90/83/54/1044908354.db2.gz QZVQIMHCSYXDAF-VGSWGCGISA-N 2 1 338.470 4.183 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)c1cncc(F)c1 ZINC001168034975 1044976613 /nfs/dbraw/zinc/97/66/13/1044976613.db2.gz RXHJKWWFBDUXDQ-YESZJQIVSA-N 2 1 341.474 4.313 20 0 EIADMP C[C@@H]1C[C@@H](Nc2cccc(CC[NH3+])c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168035140 1044996205 /nfs/dbraw/zinc/99/62/05/1044996205.db2.gz ROVCTACJCIWTPX-OPMZPASUSA-N 2 1 337.511 4.041 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC2(CCC[N@@H+]2CC2CC2)CC1 ZINC001168487690 1045047319 /nfs/dbraw/zinc/04/73/19/1045047319.db2.gz PNHUQVQIFOXLDW-KRWDZBQOSA-N 2 1 330.491 4.097 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1 ZINC001168487690 1045047331 /nfs/dbraw/zinc/04/73/31/1045047331.db2.gz PNHUQVQIFOXLDW-KRWDZBQOSA-N 2 1 330.491 4.097 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCc2cccs2)CC[N@@H+]1Cc1ccccc1 ZINC000738330850 1045053656 /nfs/dbraw/zinc/05/36/56/1045053656.db2.gz JISLDNSHLCWVMT-IEBWSBKVSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCc2cccs2)CC[N@H+]1Cc1ccccc1 ZINC000738330850 1045053669 /nfs/dbraw/zinc/05/36/69/1045053669.db2.gz JISLDNSHLCWVMT-IEBWSBKVSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)CCc2cccs2)CC[NH+]1Cc1ccccc1 ZINC000738330850 1045053678 /nfs/dbraw/zinc/05/36/78/1045053678.db2.gz JISLDNSHLCWVMT-IEBWSBKVSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)CCc2cccs2)CC[NH+]1Cc1ccccc1 ZINC000738330850 1045053685 /nfs/dbraw/zinc/05/36/85/1045053685.db2.gz JISLDNSHLCWVMT-IEBWSBKVSA-N 2 1 328.525 4.276 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)oc1-c1ccc(Cl)cc1 ZINC000923494882 1045135439 /nfs/dbraw/zinc/13/54/39/1045135439.db2.gz PYRMSXMOXSPFOQ-INWMFGNUSA-N 2 1 347.890 4.281 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccc(F)c(F)c1 ZINC000495503688 1045163618 /nfs/dbraw/zinc/16/36/18/1045163618.db2.gz PCVLVUGBUOYOPL-OAHLLOKOSA-N 2 1 330.422 4.064 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccc(F)c(F)c1 ZINC000495503688 1045163628 /nfs/dbraw/zinc/16/36/28/1045163628.db2.gz PCVLVUGBUOYOPL-OAHLLOKOSA-N 2 1 330.422 4.064 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(F)F)cc2)C[C@H]1C ZINC000740883934 1045238406 /nfs/dbraw/zinc/23/84/06/1045238406.db2.gz QRXKLPIGKUFONG-UKRRQHHQSA-N 2 1 328.472 4.306 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(F)F)cc2)C[C@H]1C ZINC000740883934 1045238418 /nfs/dbraw/zinc/23/84/18/1045238418.db2.gz QRXKLPIGKUFONG-UKRRQHHQSA-N 2 1 328.472 4.306 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(SC(F)F)cc2)C[C@H]1C ZINC000740883934 1045238427 /nfs/dbraw/zinc/23/84/27/1045238427.db2.gz QRXKLPIGKUFONG-UKRRQHHQSA-N 2 1 328.472 4.306 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(SC(F)F)cc2)C[C@H]1C ZINC000740883934 1045238436 /nfs/dbraw/zinc/23/84/36/1045238436.db2.gz QRXKLPIGKUFONG-UKRRQHHQSA-N 2 1 328.472 4.306 20 0 EIADMP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000161655534 1045308262 /nfs/dbraw/zinc/30/82/62/1045308262.db2.gz XJMPTKVKZHEKCW-HSMVNMDESA-N 2 1 325.283 4.197 20 0 EIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+]C1CC(c2cccc(Br)c2)C1 ZINC000312516295 1045366630 /nfs/dbraw/zinc/36/66/30/1045366630.db2.gz LCIVTHMDKJNKGL-KTAKPFMOSA-N 2 1 339.321 4.013 20 0 EIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+]C1CC(c2cccc(Br)c2)C1 ZINC000312516295 1045366637 /nfs/dbraw/zinc/36/66/37/1045366637.db2.gz LCIVTHMDKJNKGL-KTAKPFMOSA-N 2 1 339.321 4.013 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000237580589 1045389984 /nfs/dbraw/zinc/38/99/84/1045389984.db2.gz MQGFSUFDCFDWQX-OAHLLOKOSA-N 2 1 325.481 4.346 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc2c(c1)CCCO2 ZINC000768101100 1045713403 /nfs/dbraw/zinc/71/34/03/1045713403.db2.gz HISCZRPDWNOOSY-XLIONFOSSA-N 2 1 330.516 4.173 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([NH2+]Cc3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170156950 1045781243 /nfs/dbraw/zinc/78/12/43/1045781243.db2.gz IRFWZRNFGWTUSD-RDTXWAMCSA-N 2 1 340.433 4.448 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000397993100 1045820778 /nfs/dbraw/zinc/82/07/78/1045820778.db2.gz RANXRNJAFJXBEF-NZSAHSFTSA-N 2 1 336.470 4.312 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1OC ZINC000248404234 1045873022 /nfs/dbraw/zinc/87/30/22/1045873022.db2.gz PTMGXDSAXWRJOK-BQFCYCMXSA-N 2 1 346.515 4.007 20 0 EIADMP CC(C)c1ccc(C2(O)CCC([NH2+]CCC[N@H+](C)C(C)C)CC2)cc1 ZINC000769006307 1045876435 /nfs/dbraw/zinc/87/64/35/1045876435.db2.gz YZUPHPOSJUCUAB-UHFFFAOYSA-N 2 1 346.559 4.260 20 0 EIADMP CSCCCCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000248882156 1045887838 /nfs/dbraw/zinc/88/78/38/1045887838.db2.gz LBHNXXXENYLRCJ-OWZKRDHZSA-N 2 1 332.557 4.305 20 0 EIADMP Cc1c[nH+]c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c2[nH]ccc21 ZINC001170330429 1046002143 /nfs/dbraw/zinc/00/21/43/1046002143.db2.gz NHHUSCCYHYIWFC-LDLYASANSA-N 2 1 346.478 4.479 20 0 EIADMP Cc1c[nH+]c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c2[nH]ccc21 ZINC001170330429 1046002157 /nfs/dbraw/zinc/00/21/57/1046002157.db2.gz NHHUSCCYHYIWFC-LDLYASANSA-N 2 1 346.478 4.479 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000161521108 1046003128 /nfs/dbraw/zinc/00/31/28/1046003128.db2.gz SHLQQJRIXYIUDD-INIZCTEOSA-N 2 1 342.458 4.150 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@@H](c2ccccc2)C(C)C)cn1 ZINC000792921299 1046108028 /nfs/dbraw/zinc/10/80/28/1046108028.db2.gz FNCVDLAPUTVVCL-HXUWFJFHSA-N 2 1 334.467 4.105 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000261754442 1046142694 /nfs/dbraw/zinc/14/26/94/1046142694.db2.gz KKPOEVDPLISGBH-KXBFYZLASA-N 2 1 329.513 4.111 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000261754442 1046142708 /nfs/dbraw/zinc/14/27/08/1046142708.db2.gz KKPOEVDPLISGBH-KXBFYZLASA-N 2 1 329.513 4.111 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@](C)(C[NH3+])C3)s2)cc1 ZINC000261789768 1046151817 /nfs/dbraw/zinc/15/18/17/1046151817.db2.gz UWBBAMZQMVAHKN-LJQANCHMSA-N 2 1 329.513 4.104 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@](C)(C[NH3+])C3)s2)cc1 ZINC000261789768 1046151826 /nfs/dbraw/zinc/15/18/26/1046151826.db2.gz UWBBAMZQMVAHKN-LJQANCHMSA-N 2 1 329.513 4.104 20 0 EIADMP Cc1cc(C)cc([C@@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)c1 ZINC000162223332 1046157359 /nfs/dbraw/zinc/15/73/59/1046157359.db2.gz AYVCEGOMLJORMC-QGZVFWFLSA-N 2 1 338.499 4.030 20 0 EIADMP Cc1ccccc1COc1ccc([C@H](C)[NH2+]CCc2c[nH+]cn2C)cc1 ZINC000530355282 1046168145 /nfs/dbraw/zinc/16/81/45/1046168145.db2.gz YKBQUTUALZHGNX-SFHVURJKSA-N 2 1 349.478 4.201 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(OC)cc2F)c1 ZINC000123901759 1046204222 /nfs/dbraw/zinc/20/42/22/1046204222.db2.gz HZKKXXDFZBQNAB-HNNXBMFYSA-N 2 1 330.447 4.137 20 0 EIADMP C[N@H+](Cc1ccc2ncccc2c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000124678102 1046255445 /nfs/dbraw/zinc/25/54/45/1046255445.db2.gz CSUZSAMLOCKYFV-OAQYLSRUSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2ncccc2c1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000124678102 1046255466 /nfs/dbraw/zinc/25/54/66/1046255466.db2.gz CSUZSAMLOCKYFV-OAQYLSRUSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2ncccc2c1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000124678102 1046255481 /nfs/dbraw/zinc/25/54/81/1046255481.db2.gz CSUZSAMLOCKYFV-OAQYLSRUSA-N 2 1 345.490 4.189 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)Cc1cccs1 ZINC000508692940 1046323210 /nfs/dbraw/zinc/32/32/10/1046323210.db2.gz XMTQOQCIZQMNIP-BJLQDIEVSA-N 2 1 342.552 4.427 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2ncc(C(C)C)o2)CC1)CC1CC1 ZINC000771475853 1046408233 /nfs/dbraw/zinc/40/82/33/1046408233.db2.gz OLCQRZXFONFNGZ-UHFFFAOYSA-N 2 1 333.520 4.132 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ncc(C(C)C)o2)CC1)CC1CC1 ZINC000771475853 1046408252 /nfs/dbraw/zinc/40/82/52/1046408252.db2.gz OLCQRZXFONFNGZ-UHFFFAOYSA-N 2 1 333.520 4.132 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cnc(Cl)s2)CC1)CC1CC1 ZINC000771474644 1046409851 /nfs/dbraw/zinc/40/98/51/1046409851.db2.gz ATLSANCQBCRHKK-UHFFFAOYSA-N 2 1 341.952 4.131 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2cnc(Cl)s2)CC1)CC1CC1 ZINC000771474644 1046409828 /nfs/dbraw/zinc/40/98/28/1046409828.db2.gz ATLSANCQBCRHKK-UHFFFAOYSA-N 2 1 341.952 4.131 20 0 EIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCCO2 ZINC000126484400 1046489036 /nfs/dbraw/zinc/48/90/36/1046489036.db2.gz JDRPVRZJNJPCHV-FQEVSTJZSA-N 2 1 328.500 4.240 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCOc2c(Cl)cc(C)cc21 ZINC000126741116 1046518910 /nfs/dbraw/zinc/51/89/10/1046518910.db2.gz WLRPJKHYBKVJGB-SFHVURJKSA-N 2 1 347.890 4.437 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@H]1C ZINC000536659110 1046613640 /nfs/dbraw/zinc/61/36/40/1046613640.db2.gz FHRSUOVCMROXQR-KDOFPFPSSA-N 2 1 346.906 4.035 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@H]1C ZINC000536659110 1046613653 /nfs/dbraw/zinc/61/36/53/1046613653.db2.gz FHRSUOVCMROXQR-KDOFPFPSSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@H]1C ZINC000536659110 1046613656 /nfs/dbraw/zinc/61/36/56/1046613656.db2.gz FHRSUOVCMROXQR-KDOFPFPSSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@H]1C ZINC000536659110 1046613663 /nfs/dbraw/zinc/61/36/63/1046613663.db2.gz FHRSUOVCMROXQR-KDOFPFPSSA-N 2 1 346.906 4.035 20 0 EIADMP c1cc(-c2ccccc2)sc1C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000536658922 1046624473 /nfs/dbraw/zinc/62/44/73/1046624473.db2.gz UUPHRPZXIRCPNO-QGZVFWFLSA-N 2 1 326.509 4.333 20 0 EIADMP COc1ccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c2ccccc12 ZINC000536662396 1046630458 /nfs/dbraw/zinc/63/04/58/1046630458.db2.gz TUYOTWUFMNFILT-IBGZPJMESA-N 2 1 338.495 4.299 20 0 EIADMP c1csc([C@@H]([NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)C2CCCC2)c1 ZINC000772457389 1046643119 /nfs/dbraw/zinc/64/31/19/1046643119.db2.gz VMPOEVITXLCNDV-QUCCMNQESA-N 2 1 348.556 4.212 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CC[C@@H](c4ccccc4)C3)CC2)[nH+]c1 ZINC000127365860 1046658528 /nfs/dbraw/zinc/65/85/28/1046658528.db2.gz GBJCZTRKKSVJRG-CTNGQTDRSA-N 2 1 335.495 4.285 20 0 EIADMP C[C@@H](CC[NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000459444185 1046675259 /nfs/dbraw/zinc/67/52/59/1046675259.db2.gz REPHXYIOJSVNGY-AWEZNQCLSA-N 2 1 340.433 4.415 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379618872 1046709823 /nfs/dbraw/zinc/70/98/23/1046709823.db2.gz AULDSWBTRGOMNB-UTKZUKDTSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)CC[N@H+]1Cc1ccccc1 ZINC000379618872 1046709840 /nfs/dbraw/zinc/70/98/40/1046709840.db2.gz AULDSWBTRGOMNB-UTKZUKDTSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@H](NCc2ccc(F)cc2F)CC[N@H+]1Cc1ccccc1 ZINC000379622200 1046714007 /nfs/dbraw/zinc/71/40/07/1046714007.db2.gz GEOHMLPKQHEPCZ-DNVCBOLYSA-N 2 1 330.422 4.108 20 0 EIADMP CCN(Cc1ccccc1OC)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536708738 1046718898 /nfs/dbraw/zinc/71/88/98/1046718898.db2.gz QCKXTNJWAOWEHU-FQEVSTJZSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1ccccc1OC)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536708738 1046718930 /nfs/dbraw/zinc/71/89/30/1046718930.db2.gz QCKXTNJWAOWEHU-FQEVSTJZSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1ccccc1OC)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536708738 1046718946 /nfs/dbraw/zinc/71/89/46/1046718946.db2.gz QCKXTNJWAOWEHU-FQEVSTJZSA-N 2 1 338.495 4.039 20 0 EIADMP CCOc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379656072 1046759512 /nfs/dbraw/zinc/75/95/12/1046759512.db2.gz NXSNMKJTWLSNSY-NQIIRXRSSA-N 2 1 338.495 4.228 20 0 EIADMP CCOc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379656072 1046759525 /nfs/dbraw/zinc/75/95/25/1046759525.db2.gz NXSNMKJTWLSNSY-NQIIRXRSSA-N 2 1 338.495 4.228 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)c(Cl)c1 ZINC000536860577 1046828420 /nfs/dbraw/zinc/82/84/20/1046828420.db2.gz YXDMWRCWYDDBLW-QLFBSQMISA-N 2 1 342.886 4.019 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459728936 1046865132 /nfs/dbraw/zinc/86/51/32/1046865132.db2.gz CWEUNKCBHXIVIJ-OWCLPIDISA-N 2 1 331.529 4.110 20 0 EIADMP C[C@@H](C[NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000459725137 1046865467 /nfs/dbraw/zinc/86/54/67/1046865467.db2.gz BATFYJPYBJRHIE-LSDHHAIUSA-N 2 1 328.422 4.130 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000536961942 1046870132 /nfs/dbraw/zinc/87/01/32/1046870132.db2.gz VMVPKWCRSKGGDB-HNAYVOBHSA-N 2 1 345.487 4.085 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000536999915 1046891228 /nfs/dbraw/zinc/89/12/28/1046891228.db2.gz FZTJSTWUJDVXQW-DYVFJYSZSA-N 2 1 326.406 4.088 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000537012675 1046893139 /nfs/dbraw/zinc/89/31/39/1046893139.db2.gz BSTPTBCIEOCUPF-WFXMLNOXSA-N 2 1 337.511 4.348 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000537012675 1046893144 /nfs/dbraw/zinc/89/31/44/1046893144.db2.gz BSTPTBCIEOCUPF-WFXMLNOXSA-N 2 1 337.511 4.348 20 0 EIADMP CCO[C@@H]1C[C@@H]([NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)C12CCC2 ZINC000537293480 1047075785 /nfs/dbraw/zinc/07/57/85/1047075785.db2.gz UPJLKQBWSUXMIV-IOMROCGXSA-N 2 1 342.527 4.149 20 0 EIADMP COc1ccc(C2([NH2+]C3CC[NH+]([C@H]4CCC[C@@H](C)C4)CC3)CC2)cc1 ZINC000537422501 1047213908 /nfs/dbraw/zinc/21/39/08/1047213908.db2.gz MGIZGPHTOLXTFB-XLIONFOSSA-N 2 1 342.527 4.317 20 0 EIADMP Cc1ccc(C[N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC001204033450 1047226101 /nfs/dbraw/zinc/22/61/01/1047226101.db2.gz AHVUPUKTBOPOID-UHFFFAOYSA-N 2 1 328.525 4.401 20 0 EIADMP COc1ccc(C[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c2ccccc12 ZINC000325425005 1047238878 /nfs/dbraw/zinc/23/88/78/1047238878.db2.gz XKJZUNXCWRALHW-KRWDZBQOSA-N 2 1 326.484 4.203 20 0 EIADMP FC(F)(F)[C@H]1CCC[C@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)C1 ZINC000129219511 1047335741 /nfs/dbraw/zinc/33/57/41/1047335741.db2.gz DLMPSPYFIORTEK-ROUUACIJSA-N 2 1 340.433 4.146 20 0 EIADMP FC(F)(F)[C@H]1CCC[C@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)C1 ZINC000129219511 1047335758 /nfs/dbraw/zinc/33/57/58/1047335758.db2.gz DLMPSPYFIORTEK-ROUUACIJSA-N 2 1 340.433 4.146 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(F)c(Cl)c2)C[C@H]1c1ccccc1 ZINC000556075932 1047431108 /nfs/dbraw/zinc/43/11/08/1047431108.db2.gz FPJVBJONXCFATE-LPHOPBHVSA-N 2 1 332.850 4.404 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(F)c(Cl)c2)C[C@H]1c1ccccc1 ZINC000556075932 1047431118 /nfs/dbraw/zinc/43/11/18/1047431118.db2.gz FPJVBJONXCFATE-LPHOPBHVSA-N 2 1 332.850 4.404 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](Cc1ccccc1Cl)C1CC1 ZINC000556077235 1047433103 /nfs/dbraw/zinc/43/31/03/1047433103.db2.gz VDCNXXPBFVAICB-AUUYWEPGSA-N 2 1 331.891 4.092 20 0 EIADMP CCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1F ZINC000556077757 1047433593 /nfs/dbraw/zinc/43/35/93/1047433593.db2.gz ZXROQWKXCYGVHG-ICSRJNTNSA-N 2 1 342.458 4.150 20 0 EIADMP CCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1F ZINC000556077757 1047433603 /nfs/dbraw/zinc/43/36/03/1047433603.db2.gz ZXROQWKXCYGVHG-ICSRJNTNSA-N 2 1 342.458 4.150 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](Cc1ccccc1Cl)C1CC1 ZINC000556093843 1047444905 /nfs/dbraw/zinc/44/49/05/1047444905.db2.gz NNTQBMAVVMLKHM-IBGZPJMESA-N 2 1 331.891 4.236 20 0 EIADMP Cc1ccccc1O[C@H](C)C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556094119 1047445774 /nfs/dbraw/zinc/44/57/74/1047445774.db2.gz QPZWVOVOCSSWIQ-HLAWJBBLSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1ccccc1O[C@H](C)C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556094119 1047445779 /nfs/dbraw/zinc/44/57/79/1047445779.db2.gz QPZWVOVOCSSWIQ-HLAWJBBLSA-N 2 1 338.495 4.187 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]C[C@@H]3CCc4ccccc43)C2)c1 ZINC000790050332 1047511021 /nfs/dbraw/zinc/51/10/21/1047511021.db2.gz ZJWDZGJUZPPMQQ-HKUYNNGSSA-N 2 1 340.536 4.280 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]C[C@@H]3CCc4ccccc43)C2)c1 ZINC000790050332 1047511036 /nfs/dbraw/zinc/51/10/36/1047511036.db2.gz ZJWDZGJUZPPMQQ-HKUYNNGSSA-N 2 1 340.536 4.280 20 0 EIADMP CCC[C@H](CC)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231275 1047596223 /nfs/dbraw/zinc/59/62/23/1047596223.db2.gz UNPJRFAEUQDCEA-SFTDATJTSA-N 2 1 344.543 4.084 20 0 EIADMP CCC[C@@H](CC)[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231268 1047597114 /nfs/dbraw/zinc/59/71/14/1047597114.db2.gz UNPJRFAEUQDCEA-NHCUHLMSSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1ccncc1F ZINC000556235737 1047600667 /nfs/dbraw/zinc/60/06/67/1047600667.db2.gz GTDFTCVXINKQGG-IAGOWNOFSA-N 2 1 341.474 4.446 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(C2CC2)c1 ZINC000550629444 1047782772 /nfs/dbraw/zinc/78/27/72/1047782772.db2.gz QVJGVMBURCECDX-FGTMMUONSA-N 2 1 330.516 4.104 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CC2(Cc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000550701162 1047819513 /nfs/dbraw/zinc/81/95/13/1047819513.db2.gz STEZTFZBQUEVAB-FCHUYYIVSA-N 2 1 334.507 4.434 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC2(Cc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000550701162 1047819514 /nfs/dbraw/zinc/81/95/14/1047819514.db2.gz STEZTFZBQUEVAB-FCHUYYIVSA-N 2 1 334.507 4.434 20 0 EIADMP C[C@H]1C[C@@H](N(C)Cc2cnc(-c3ccc(Cl)cc3)s2)CC[N@H+]1C ZINC000556598240 1047834265 /nfs/dbraw/zinc/83/42/65/1047834265.db2.gz IWCZBWCXMXAXIZ-BBRMVZONSA-N 2 1 349.931 4.378 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2cnc(-c3ccc(Cl)cc3)s2)CCN1C ZINC000556598240 1047834266 /nfs/dbraw/zinc/83/42/66/1047834266.db2.gz IWCZBWCXMXAXIZ-BBRMVZONSA-N 2 1 349.931 4.378 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cnc(-c3ccc(Cl)cc3)s2)CCN1C ZINC000556598240 1047834267 /nfs/dbraw/zinc/83/42/67/1047834267.db2.gz IWCZBWCXMXAXIZ-BBRMVZONSA-N 2 1 349.931 4.378 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556609728 1047840359 /nfs/dbraw/zinc/84/03/59/1047840359.db2.gz ACGYCMVZISSDPG-IIYDPXPESA-N 2 1 349.931 4.282 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556609728 1047840363 /nfs/dbraw/zinc/84/03/63/1047840363.db2.gz ACGYCMVZISSDPG-IIYDPXPESA-N 2 1 349.931 4.282 20 0 EIADMP C[C@@H]1SCC[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000814173589 1047867069 /nfs/dbraw/zinc/86/70/69/1047867069.db2.gz STUMHEPDPLWXSQ-QFMLELGNSA-N 2 1 330.541 4.056 20 0 EIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cn1 ZINC000498938069 1047992647 /nfs/dbraw/zinc/99/26/47/1047992647.db2.gz LIVDVIYWGYJSJO-HXUWFJFHSA-N 2 1 333.495 4.305 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000556857799 1048069160 /nfs/dbraw/zinc/06/91/60/1048069160.db2.gz HMYRKBIAFRQBKG-CXAGYDPISA-N 2 1 342.405 4.110 20 0 EIADMP Cc1cncc(C[NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000556884241 1048100720 /nfs/dbraw/zinc/10/07/20/1048100720.db2.gz HNESLWXSUKDJBL-RJGXRXQPSA-N 2 1 349.522 4.170 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@@H]2CCC[C@H]21 ZINC000556886246 1048107616 /nfs/dbraw/zinc/10/76/16/1048107616.db2.gz KDZMNKMJCSMBSV-JENIJYKNSA-N 2 1 347.572 4.196 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000556890738 1048131063 /nfs/dbraw/zinc/13/10/63/1048131063.db2.gz RQUCCLGEJLYEIC-BNEJOLLZSA-N 2 1 340.433 4.271 20 0 EIADMP Cc1nc(C[N@H+](C)C2CCC([NH3+])CC2)oc1-c1ccc(Cl)cc1 ZINC000844221408 1048225078 /nfs/dbraw/zinc/22/50/78/1048225078.db2.gz YZNLMAMOIKBUGL-UHFFFAOYSA-N 2 1 333.863 4.005 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CCc3cccs3)C2)s1 ZINC000844325993 1048295270 /nfs/dbraw/zinc/29/52/70/1048295270.db2.gz FQWNLGRSSQBMTP-INIZCTEOSA-N 2 1 334.554 4.114 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CCc3cccs3)C2)s1 ZINC000844325993 1048295282 /nfs/dbraw/zinc/29/52/82/1048295282.db2.gz FQWNLGRSSQBMTP-INIZCTEOSA-N 2 1 334.554 4.114 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CCc3cccs3)C2)s1 ZINC000844325993 1048295293 /nfs/dbraw/zinc/29/52/93/1048295293.db2.gz FQWNLGRSSQBMTP-INIZCTEOSA-N 2 1 334.554 4.114 20 0 EIADMP C[NH+]1CCC2(CC[N@@H+](Cc3cc(Cl)cc(C(F)(F)F)c3)C2)CC1 ZINC001143990734 1048350003 /nfs/dbraw/zinc/35/00/03/1048350003.db2.gz IFQCNBUAXWJMIR-UHFFFAOYSA-N 2 1 346.824 4.277 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171133531 1048395385 /nfs/dbraw/zinc/39/53/85/1048395385.db2.gz MMMLHPBAUVPUOV-FQEVSTJZSA-N 2 1 334.935 4.394 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(C(F)(F)F)s2)cc1 ZINC000809738738 1048509542 /nfs/dbraw/zinc/50/95/42/1048509542.db2.gz HCININMZJQHZLJ-UHFFFAOYSA-N 2 1 342.430 4.461 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cnc(-c3ccco3)s2)cc1 ZINC000809738648 1048509576 /nfs/dbraw/zinc/50/95/76/1048509576.db2.gz CYWISNSMOQICCE-UHFFFAOYSA-N 2 1 341.480 4.097 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cnc(-c3ccco3)s2)cc1 ZINC000809738648 1048509587 /nfs/dbraw/zinc/50/95/87/1048509587.db2.gz CYWISNSMOQICCE-UHFFFAOYSA-N 2 1 341.480 4.097 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(F)c3cccnc23)cc1 ZINC000809737780 1048510855 /nfs/dbraw/zinc/51/08/55/1048510855.db2.gz KVIZHABDSCSTIO-UHFFFAOYSA-N 2 1 337.442 4.068 20 0 EIADMP Cc1cc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c2ccccc2n1 ZINC000809737957 1048511209 /nfs/dbraw/zinc/51/12/09/1048511209.db2.gz NHTCSVQWLXUFPW-UHFFFAOYSA-N 2 1 333.479 4.237 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cnc(C3CCCC3)s2)cc1 ZINC000809738977 1048511325 /nfs/dbraw/zinc/51/13/25/1048511325.db2.gz RKJYSOWFTBUFCB-UHFFFAOYSA-N 2 1 343.540 4.494 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cnc(C3CCCC3)s2)cc1 ZINC000809738977 1048511335 /nfs/dbraw/zinc/51/13/35/1048511335.db2.gz RKJYSOWFTBUFCB-UHFFFAOYSA-N 2 1 343.540 4.494 20 0 EIADMP C[C@H](NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccccc1SC(C)(C)C ZINC000815576098 1048515717 /nfs/dbraw/zinc/51/57/17/1048515717.db2.gz JIEIFKOYYBCREI-ULQDDVLXSA-N 2 1 348.556 4.091 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CN2CCC[C@H]2CO1)c1ccccc1SC(C)(C)C ZINC000815576098 1048515734 /nfs/dbraw/zinc/51/57/34/1048515734.db2.gz JIEIFKOYYBCREI-ULQDDVLXSA-N 2 1 348.556 4.091 20 0 EIADMP Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000815575487 1048536637 /nfs/dbraw/zinc/53/66/37/1048536637.db2.gz SRZIXWDAOWFUDA-UYAOXDASSA-N 2 1 340.486 4.349 20 0 EIADMP CCCCCC[C@@H](CC)n1nc(C[N@@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001170592881 1048590120 /nfs/dbraw/zinc/59/01/20/1048590120.db2.gz NGOWBDHKRKLPOR-QGZVFWFLSA-N 2 1 334.552 4.291 20 0 EIADMP Cc1nc(C[N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)sc1C ZINC001144378614 1048616761 /nfs/dbraw/zinc/61/67/61/1048616761.db2.gz UFNMDGSEGWWHAJ-UHFFFAOYSA-N 2 1 343.540 4.104 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1ccc(Br)nc1)C(C)C ZINC000810221502 1048691050 /nfs/dbraw/zinc/69/10/50/1048691050.db2.gz QEWAUEPNNTYSOV-AWEZNQCLSA-N 2 1 342.325 4.004 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@](C)(O)c2ccccc2)cc1 ZINC000846044070 1048804534 /nfs/dbraw/zinc/80/45/34/1048804534.db2.gz NTMNZXRLVRSWAG-HOIFWPIMSA-N 2 1 349.478 4.128 20 0 EIADMP c1cc2cccc(C[NH+]3CCC4(CC[N@H+](Cc5ccoc5)C4)CC3)c2[nH]1 ZINC001144713096 1048815176 /nfs/dbraw/zinc/81/51/76/1048815176.db2.gz KVOIBCYMGMLZOK-UHFFFAOYSA-N 2 1 349.478 4.249 20 0 EIADMP CC(C)CCn1cccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000236634538 1048817900 /nfs/dbraw/zinc/81/79/00/1048817900.db2.gz PKUAQGXXOKTQHR-UHFFFAOYSA-N 2 1 331.548 4.421 20 0 EIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(F)cc1 ZINC000846145974 1048832913 /nfs/dbraw/zinc/83/29/13/1048832913.db2.gz PVQGBJOBZLCCMP-LEWJYISDSA-N 2 1 348.506 4.146 20 0 EIADMP [NH3+]CCc1cc2ccccc2n1-c1cc[nH+]c(C2(C(F)(F)F)CC2)c1 ZINC001171304783 1049149966 /nfs/dbraw/zinc/14/99/66/1049149966.db2.gz YAQOKTGVBYZQDF-UHFFFAOYSA-N 2 1 345.368 4.121 20 0 EIADMP COC1(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCCCC1 ZINC000348176398 1049473002 /nfs/dbraw/zinc/47/30/02/1049473002.db2.gz VOSNOQJFXUZYTG-INIZCTEOSA-N 2 1 327.472 4.181 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3[nH]ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000080338891 1049579005 /nfs/dbraw/zinc/57/90/05/1049579005.db2.gz XORJODDTUXQPOY-XLIONFOSSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3[nH]ccc32)CC[N@H+]1Cc1ccccc1 ZINC000080338891 1049579015 /nfs/dbraw/zinc/57/90/15/1049579015.db2.gz XORJODDTUXQPOY-XLIONFOSSA-N 2 1 333.479 4.311 20 0 EIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCc2c(F)cccc2C1 ZINC001171445373 1049695720 /nfs/dbraw/zinc/69/57/20/1049695720.db2.gz JRUOPZCEFFNEAJ-HXUWFJFHSA-N 2 1 344.518 4.412 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001171570849 1049758954 /nfs/dbraw/zinc/75/89/54/1049758954.db2.gz PAUANLCZQMZWKG-SFTDATJTSA-N 2 1 326.528 4.193 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@H](c2ccncc2Cl)C2CC2)CC1(C)C ZINC001171627159 1049769636 /nfs/dbraw/zinc/76/96/36/1049769636.db2.gz MREVEDSQUVGYIT-KRWDZBQOSA-N 2 1 335.923 4.427 20 0 EIADMP CN(Cc1ccc(Cl)cc1F)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001137661575 1049769676 /nfs/dbraw/zinc/76/96/76/1049769676.db2.gz YZTAOFJKGPMHMO-KRWDZBQOSA-N 2 1 346.877 4.433 20 0 EIADMP Cc1ccc(CC[C@H](C)N(c2[nH+]cccc2C)C2CC[NH2+]CC2)cc1 ZINC001171682879 1049777152 /nfs/dbraw/zinc/77/71/52/1049777152.db2.gz XVDNOTNMHZEOHJ-IBGZPJMESA-N 2 1 337.511 4.278 20 0 EIADMP C[N@@H+](CC[C@H]1CC1(Cl)Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000822654603 1049782290 /nfs/dbraw/zinc/78/22/90/1049782290.db2.gz NTGAGONNOWMHJP-IRXDYDNUSA-N 2 1 341.326 4.024 20 0 EIADMP Cc1cccc2c(CC[NH3+])cn([C@@H]3C[C@@H](C)[N@H+](Cc4ccccc4)C3)c21 ZINC001171726357 1049785765 /nfs/dbraw/zinc/78/57/65/1049785765.db2.gz VERMBNJPXMICEV-WIYYLYMNSA-N 2 1 347.506 4.286 20 0 EIADMP C[N@H+](CC[C@H]1CC1(Cl)Cl)C1CC[NH+](Cc2ccccc2)CC1 ZINC000822746686 1049792552 /nfs/dbraw/zinc/79/25/52/1049792552.db2.gz MPNKHHBQTJYBOO-INIZCTEOSA-N 2 1 341.326 4.167 20 0 EIADMP C[N@@H+](CC[C@H]1CC1(Cl)Cl)C1CC[NH+](Cc2ccccc2)CC1 ZINC000822746686 1049792556 /nfs/dbraw/zinc/79/25/56/1049792556.db2.gz MPNKHHBQTJYBOO-INIZCTEOSA-N 2 1 341.326 4.167 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC[C@H]2CC2(Cl)Cl)cc1 ZINC000822822754 1049801511 /nfs/dbraw/zinc/80/15/11/1049801511.db2.gz UFOWTNLYMCHATC-WFASDCNBSA-N 2 1 338.282 4.415 20 0 EIADMP C[C@H]1C[C@@H](n2c(C[NH3+])cc3cccc(F)c32)C[N@H+]1Cc1ccccc1 ZINC001171741665 1049801804 /nfs/dbraw/zinc/80/18/04/1049801804.db2.gz QSJMHHDTQCOPDE-HNAYVOBHSA-N 2 1 337.442 4.075 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)[C@H]2Cc3cccc(F)c3C2)CC1 ZINC001171785433 1049803980 /nfs/dbraw/zinc/80/39/80/1049803980.db2.gz NIHHWFMPKBQFKI-UFYCRDLUSA-N 2 1 344.518 4.445 20 0 EIADMP COC1(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCC1 ZINC000813790734 1049816184 /nfs/dbraw/zinc/81/61/84/1049816184.db2.gz VVDUZEOJBFVQPL-SEJPIABJSA-N 2 1 342.527 4.121 20 0 EIADMP CC1(C)C[C@H](n2cc3cc(C[NH3+])ccc3n2)CC[N@H+]1Cc1ccccc1 ZINC001171971783 1049834586 /nfs/dbraw/zinc/83/45/86/1049834586.db2.gz JYVYLLZIVCVZDH-HXUWFJFHSA-N 2 1 348.494 4.111 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH+]1CCC([NH+]2CCCC2)CC1 ZINC001171970364 1049835096 /nfs/dbraw/zinc/83/50/96/1049835096.db2.gz NQJRMUCEHAGEFA-HNNXBMFYSA-N 2 1 340.433 4.197 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001171974439 1049836250 /nfs/dbraw/zinc/83/62/50/1049836250.db2.gz UHCUKPZPAMQEDT-OAHLLOKOSA-N 2 1 340.433 4.054 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cncc(F)c1 ZINC001171978454 1049837008 /nfs/dbraw/zinc/83/70/08/1049837008.db2.gz KVYACXZVJSYOOD-OXQOHEQNSA-N 2 1 341.474 4.315 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cncc(F)c1 ZINC001171978454 1049837009 /nfs/dbraw/zinc/83/70/09/1049837009.db2.gz KVYACXZVJSYOOD-OXQOHEQNSA-N 2 1 341.474 4.315 20 0 EIADMP Cc1cccc(C(=[NH2+])N[C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171976178 1049837250 /nfs/dbraw/zinc/83/72/50/1049837250.db2.gz QASTWNSOXHVPTO-HXUWFJFHSA-N 2 1 335.495 4.353 20 0 EIADMP CCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CCOCC1 ZINC001171977806 1049837314 /nfs/dbraw/zinc/83/73/14/1049837314.db2.gz HBOXDXFTJDWBIC-FQEVSTJZSA-N 2 1 344.543 4.226 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2CCc3ncccc32)CC[N@H+]1Cc1ccccc1 ZINC001171977187 1049837401 /nfs/dbraw/zinc/83/74/01/1049837401.db2.gz YCEKTBGYEMBUJN-NQIIRXRSSA-N 2 1 335.495 4.102 20 0 EIADMP CC1(C)C[C@@H]([NH2+]C2(Cc3cccnc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171974952 1049837430 /nfs/dbraw/zinc/83/74/30/1049837430.db2.gz BJNAPFFCRQTLCN-NRFANRHFSA-N 2 1 349.522 4.190 20 0 EIADMP CC1(C)C[C@@H](N2CC[C@](C)(F)[C@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976026 1049837608 /nfs/dbraw/zinc/83/76/08/1049837608.db2.gz HQLDSDPMRPKLFW-NSHGMRRFSA-N 2 1 336.470 4.202 20 0 EIADMP CC1(C)C[C@H](N2CC[C@](C)(F)[C@@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976025 1049837867 /nfs/dbraw/zinc/83/78/67/1049837867.db2.gz HQLDSDPMRPKLFW-HBFSDRIKSA-N 2 1 336.470 4.202 20 0 EIADMP Cc1cc2c(cn1)[C@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)C(C)(C)C1)CC2 ZINC001171980586 1049838598 /nfs/dbraw/zinc/83/85/98/1049838598.db2.gz RTFVZJFWPPLRQZ-IFMALSPDSA-N 2 1 349.522 4.410 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)s1 ZINC001171983191 1049838964 /nfs/dbraw/zinc/83/89/64/1049838964.db2.gz NKOJMFSFTUWPNF-GOSISDBHSA-N 2 1 343.540 4.293 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)s1 ZINC001171983191 1049838966 /nfs/dbraw/zinc/83/89/66/1049838966.db2.gz NKOJMFSFTUWPNF-GOSISDBHSA-N 2 1 343.540 4.293 20 0 EIADMP CC1(C)C[C@H]([NH+]2C[C@H]3[C@H](CC3(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171981016 1049839103 /nfs/dbraw/zinc/83/91/03/1049839103.db2.gz JXSOCQXMPSMXJS-KURKYZTESA-N 2 1 334.454 4.017 20 0 EIADMP CC1(C)C[C@H]([N@H+]2C[C@H]3[C@H](CC3(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171981016 1049839104 /nfs/dbraw/zinc/83/91/04/1049839104.db2.gz JXSOCQXMPSMXJS-KURKYZTESA-N 2 1 334.454 4.017 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171981016 1049839105 /nfs/dbraw/zinc/83/91/05/1049839105.db2.gz JXSOCQXMPSMXJS-KURKYZTESA-N 2 1 334.454 4.017 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2CCCc3cnccc32)CC[N@H+]1Cc1ccccc1 ZINC001171980483 1049839271 /nfs/dbraw/zinc/83/92/71/1049839271.db2.gz VNXRCFCSOBXWHF-IFMALSPDSA-N 2 1 349.522 4.492 20 0 EIADMP Cc1ncccc1C[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171983783 1049839895 /nfs/dbraw/zinc/83/98/95/1049839895.db2.gz AJYFXVKOLYIJBW-NRFANRHFSA-N 2 1 337.511 4.265 20 0 EIADMP Cc1ncccc1C[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171983783 1049839896 /nfs/dbraw/zinc/83/98/96/1049839896.db2.gz AJYFXVKOLYIJBW-NRFANRHFSA-N 2 1 337.511 4.265 20 0 EIADMP Cc1ncccc1C[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171983783 1049839900 /nfs/dbraw/zinc/83/99/00/1049839900.db2.gz AJYFXVKOLYIJBW-NRFANRHFSA-N 2 1 337.511 4.265 20 0 EIADMP Cc1ncccc1C[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171983783 1049839905 /nfs/dbraw/zinc/83/99/05/1049839905.db2.gz AJYFXVKOLYIJBW-NRFANRHFSA-N 2 1 337.511 4.265 20 0 EIADMP COCCC1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171985187 1049840569 /nfs/dbraw/zinc/84/05/69/1049840569.db2.gz SSHXXVHXUKVEKV-OAQYLSRUSA-N 2 1 344.543 4.178 20 0 EIADMP CC1(C)C[C@H]([NH+]2CC[C@@H](c3ccccn3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171983814 1049840639 /nfs/dbraw/zinc/84/06/39/1049840639.db2.gz GWHZCPGRAPDMNJ-NHCUHLMSSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CC[C@@H](c3ccccn3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983814 1049840640 /nfs/dbraw/zinc/84/06/40/1049840640.db2.gz GWHZCPGRAPDMNJ-NHCUHLMSSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CC[C@@H](c3ccccn3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983814 1049840641 /nfs/dbraw/zinc/84/06/41/1049840641.db2.gz GWHZCPGRAPDMNJ-NHCUHLMSSA-N 2 1 349.522 4.314 20 0 EIADMP Cc1ncccc1C[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171983795 1049840739 /nfs/dbraw/zinc/84/07/39/1049840739.db2.gz AJYFXVKOLYIJBW-OAQYLSRUSA-N 2 1 337.511 4.265 20 0 EIADMP Cc1ncccc1C[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171983795 1049840742 /nfs/dbraw/zinc/84/07/42/1049840742.db2.gz AJYFXVKOLYIJBW-OAQYLSRUSA-N 2 1 337.511 4.265 20 0 EIADMP Cc1ncccc1C[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171983795 1049840746 /nfs/dbraw/zinc/84/07/46/1049840746.db2.gz AJYFXVKOLYIJBW-OAQYLSRUSA-N 2 1 337.511 4.265 20 0 EIADMP Cc1ncccc1C[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171983795 1049840749 /nfs/dbraw/zinc/84/07/49/1049840749.db2.gz AJYFXVKOLYIJBW-OAQYLSRUSA-N 2 1 337.511 4.265 20 0 EIADMP C[NH2+]Cc1ccc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001172072166 1049844543 /nfs/dbraw/zinc/84/45/43/1049844543.db2.gz HTMBRPPMARGUSW-WBDAEOGXSA-N 2 1 349.522 4.404 20 0 EIADMP C[N@H+](C1CC(F)(F)C1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076508 1049845341 /nfs/dbraw/zinc/84/53/41/1049845341.db2.gz DTVDUEVZFASIGF-BCDXTJNWSA-N 2 1 334.454 4.302 20 0 EIADMP C[N@@H+](C1CC(F)(F)C1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076508 1049845343 /nfs/dbraw/zinc/84/53/43/1049845343.db2.gz DTVDUEVZFASIGF-BCDXTJNWSA-N 2 1 334.454 4.302 20 0 EIADMP C[NH+](C1CC(F)(F)C1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076508 1049845344 /nfs/dbraw/zinc/84/53/44/1049845344.db2.gz DTVDUEVZFASIGF-BCDXTJNWSA-N 2 1 334.454 4.302 20 0 EIADMP C[NH+](C1CC(F)(F)C1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076508 1049845346 /nfs/dbraw/zinc/84/53/46/1049845346.db2.gz DTVDUEVZFASIGF-BCDXTJNWSA-N 2 1 334.454 4.302 20 0 EIADMP CO[C@H]1CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172076429 1049845524 /nfs/dbraw/zinc/84/55/24/1049845524.db2.gz YMXXYPSAOGUMMB-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP CO[C@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172076429 1049845526 /nfs/dbraw/zinc/84/55/26/1049845526.db2.gz YMXXYPSAOGUMMB-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP CO[C@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172076429 1049845532 /nfs/dbraw/zinc/84/55/32/1049845532.db2.gz YMXXYPSAOGUMMB-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP CO[C@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172079702 1049846169 /nfs/dbraw/zinc/84/61/69/1049846169.db2.gz PNLAWCDBHLJPNS-BDHVOXNPSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1cc(Cl)ccc1Cl)C2 ZINC001172099065 1049849420 /nfs/dbraw/zinc/84/94/20/1049849420.db2.gz ICYCTZXMTFSXMJ-MUJYYYPQSA-N 2 1 327.299 4.141 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](NCc1cc(F)c(Cl)cc1Cl)C2 ZINC001172100427 1049849669 /nfs/dbraw/zinc/84/96/69/1049849669.db2.gz QKPBIVHEUBHRJD-XYYAHUGASA-N 2 1 331.262 4.237 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1Cl)C2 ZINC001172100427 1049849670 /nfs/dbraw/zinc/84/96/70/1049849670.db2.gz QKPBIVHEUBHRJD-XYYAHUGASA-N 2 1 331.262 4.237 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1Cl)C2 ZINC001172100427 1049849672 /nfs/dbraw/zinc/84/96/72/1049849672.db2.gz QKPBIVHEUBHRJD-XYYAHUGASA-N 2 1 331.262 4.237 20 0 EIADMP Cc1ccccc1[C@@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172099939 1049849889 /nfs/dbraw/zinc/84/98/89/1049849889.db2.gz NVKSIITYDMAWCP-IIZPIQPGSA-N 2 1 335.495 4.084 20 0 EIADMP Cc1ccccc1[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172099939 1049849892 /nfs/dbraw/zinc/84/98/92/1049849892.db2.gz NVKSIITYDMAWCP-IIZPIQPGSA-N 2 1 335.495 4.084 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1cc(Cl)ccc1Cl)C2 ZINC001172099067 1049850398 /nfs/dbraw/zinc/85/03/98/1049850398.db2.gz ICYCTZXMTFSXMJ-PHZGNYQRSA-N 2 1 327.299 4.141 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2CCSCC2)C3)cc1 ZINC001172066173 1049852030 /nfs/dbraw/zinc/85/20/30/1049852030.db2.gz UMJWVUCPADZOCV-OWZKRDHZSA-N 2 1 330.541 4.057 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]CC2CCSCC2)C3)cc1 ZINC001172066919 1049852052 /nfs/dbraw/zinc/85/20/52/1049852052.db2.gz DFUWDAPQFONQJH-WKCHPHFGSA-N 2 1 344.568 4.305 20 0 EIADMP C[C@@H]1CCN([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C[C@H]1F ZINC001172067550 1049852068 /nfs/dbraw/zinc/85/20/68/1049852068.db2.gz CVYQMUQQDIDUCZ-QNDFHXLGSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)N3Cc2ccccc2)C[C@H]1F ZINC001172067550 1049852071 /nfs/dbraw/zinc/85/20/71/1049852071.db2.gz CVYQMUQQDIDUCZ-QNDFHXLGSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)N3Cc2ccccc2)C[C@H]1F ZINC001172067550 1049852073 /nfs/dbraw/zinc/85/20/73/1049852073.db2.gz CVYQMUQQDIDUCZ-QNDFHXLGSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C[C@H]1F ZINC001172067550 1049852075 /nfs/dbraw/zinc/85/20/75/1049852075.db2.gz CVYQMUQQDIDUCZ-QNDFHXLGSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C[C@H]1F ZINC001172067550 1049852076 /nfs/dbraw/zinc/85/20/76/1049852076.db2.gz CVYQMUQQDIDUCZ-QNDFHXLGSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C[C@H]1F ZINC001172067550 1049852077 /nfs/dbraw/zinc/85/20/77/1049852077.db2.gz CVYQMUQQDIDUCZ-QNDFHXLGSA-N 2 1 330.491 4.252 20 0 EIADMP C[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C[C@H]1F ZINC001172067550 1049852079 /nfs/dbraw/zinc/85/20/79/1049852079.db2.gz CVYQMUQQDIDUCZ-QNDFHXLGSA-N 2 1 330.491 4.252 20 0 EIADMP Cc1cnccc1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070015 1049852382 /nfs/dbraw/zinc/85/23/82/1049852382.db2.gz ZUMUFTZUQGHSCJ-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP C[C@@]1(CF)CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070259 1049852781 /nfs/dbraw/zinc/85/27/81/1049852781.db2.gz XRPCYOGEKCQSTN-WOZUAGRISA-N 2 1 330.491 4.254 20 0 EIADMP C[C@@]1(CF)CC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070259 1049852786 /nfs/dbraw/zinc/85/27/86/1049852786.db2.gz XRPCYOGEKCQSTN-WOZUAGRISA-N 2 1 330.491 4.254 20 0 EIADMP C[C@@]1(CF)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070259 1049852788 /nfs/dbraw/zinc/85/27/88/1049852788.db2.gz XRPCYOGEKCQSTN-WOZUAGRISA-N 2 1 330.491 4.254 20 0 EIADMP C[C@@]1(CF)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070259 1049852791 /nfs/dbraw/zinc/85/27/91/1049852791.db2.gz XRPCYOGEKCQSTN-WOZUAGRISA-N 2 1 330.491 4.254 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245770345 1049852887 /nfs/dbraw/zinc/85/28/87/1049852887.db2.gz XEBGOLFGCFCYGV-AFYVEPGGSA-N 2 1 340.536 4.464 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Sc3ccccc3)CC1)C2 ZINC001172127433 1049853054 /nfs/dbraw/zinc/85/30/54/1049853054.db2.gz JHGLIQHVIOQLES-PIIMJCKOSA-N 2 1 330.541 4.258 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Sc3ccccc3)CC1)C2 ZINC001172127433 1049853055 /nfs/dbraw/zinc/85/30/55/1049853055.db2.gz JHGLIQHVIOQLES-PIIMJCKOSA-N 2 1 330.541 4.258 20 0 EIADMP COC[C@H]1CCCC[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069321 1049853111 /nfs/dbraw/zinc/85/31/11/1049853111.db2.gz PAQSLIMHGKMSRJ-MBDNFAEBSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@H]1CCCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069321 1049853113 /nfs/dbraw/zinc/85/31/13/1049853113.db2.gz PAQSLIMHGKMSRJ-MBDNFAEBSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@H]1CCCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069321 1049853116 /nfs/dbraw/zinc/85/31/16/1049853116.db2.gz PAQSLIMHGKMSRJ-MBDNFAEBSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@H]1CCCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069321 1049853120 /nfs/dbraw/zinc/85/31/20/1049853120.db2.gz PAQSLIMHGKMSRJ-MBDNFAEBSA-N 2 1 342.527 4.073 20 0 EIADMP CCCCOCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069173 1049853243 /nfs/dbraw/zinc/85/32/43/1049853243.db2.gz HEJHANVYWJWKLN-KOUNCHBCSA-N 2 1 344.543 4.369 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(C(=O)c3ccccc3)cc1)C2 ZINC001172101920 1049855543 /nfs/dbraw/zinc/85/55/43/1049855543.db2.gz IFZYVMNGYGQUCZ-DKUWSORSSA-N 2 1 348.490 4.023 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cccc(OC3CCCC3)c1)C2 ZINC001172117857 1049858000 /nfs/dbraw/zinc/85/80/00/1049858000.db2.gz NOQCVCUBCZNJOV-REPLKXPHSA-N 2 1 328.500 4.113 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(Cc3ccccc3Cl)CC1)C2 ZINC001172110944 1049858653 /nfs/dbraw/zinc/85/86/53/1049858653.db2.gz MDZOVINFCMWIJX-BCDXTJNWSA-N 2 1 332.919 4.268 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1ccccc1)c1ccc(O)cc1)C2 ZINC001172118789 1049858768 /nfs/dbraw/zinc/85/87/68/1049858768.db2.gz SVLXVBSWYRCODC-XWSHUIEDSA-N 2 1 336.479 4.087 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Cc3ccc(F)cc3)CC1)C2 ZINC001172120975 1049859181 /nfs/dbraw/zinc/85/91/81/1049859181.db2.gz AXNLIHUNCYXIEZ-WKCHPHFGSA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Cc3ccc(F)cc3)CC1)C2 ZINC001172120975 1049859187 /nfs/dbraw/zinc/85/91/87/1049859187.db2.gz AXNLIHUNCYXIEZ-WKCHPHFGSA-N 2 1 330.491 4.096 20 0 EIADMP c1ccc2c(c1)C[C@@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)CS2 ZINC001172199853 1049869703 /nfs/dbraw/zinc/86/97/03/1049869703.db2.gz HQHXXYJMTOJJKP-LJQANCHMSA-N 2 1 342.552 4.044 20 0 EIADMP c1ccc2c(c1)C[C@@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)CS2 ZINC001172199853 1049869705 /nfs/dbraw/zinc/86/97/05/1049869705.db2.gz HQHXXYJMTOJJKP-LJQANCHMSA-N 2 1 342.552 4.044 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172356182 1049894498 /nfs/dbraw/zinc/89/44/98/1049894498.db2.gz XYMYHUHRNXEVIR-JAXLGGSGSA-N 2 1 344.543 4.178 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172356182 1049894501 /nfs/dbraw/zinc/89/45/01/1049894501.db2.gz XYMYHUHRNXEVIR-JAXLGGSGSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@H](C)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172437377 1049912321 /nfs/dbraw/zinc/91/23/21/1049912321.db2.gz OSIRDDOPENJREX-VDGAXYAQSA-N 2 1 336.495 4.101 20 0 EIADMP CC(C)OCC[C@@H](C)[N@@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001172451447 1049914766 /nfs/dbraw/zinc/91/47/66/1049914766.db2.gz QASNAHSAYIBWTJ-MNAPGUCWSA-N 2 1 344.543 4.301 20 0 EIADMP CC(C)OCC[C@@H](C)[NH+]1C[C@H]2c3ccccc3[C@H]([N@H+](C)C(C)C)[C@H]2C1 ZINC001172451447 1049914769 /nfs/dbraw/zinc/91/47/69/1049914769.db2.gz QASNAHSAYIBWTJ-MNAPGUCWSA-N 2 1 344.543 4.301 20 0 EIADMP CC(C)OCC[C@@H](C)[NH+]1C[C@H]2c3ccccc3[C@H]([N@@H+](C)C(C)C)[C@H]2C1 ZINC001172451447 1049914772 /nfs/dbraw/zinc/91/47/72/1049914772.db2.gz QASNAHSAYIBWTJ-MNAPGUCWSA-N 2 1 344.543 4.301 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccn2)[C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172555942 1049930988 /nfs/dbraw/zinc/93/09/88/1049930988.db2.gz KNQQUBWPGKXMBJ-PRTQVNTJSA-N 2 1 349.522 4.490 20 0 EIADMP C[C@@H](CCc1c(F)cc(Cl)cc1F)[N@@H+](C)C1CCC([NH3+])CC1 ZINC001172565997 1049935742 /nfs/dbraw/zinc/93/57/42/1049935742.db2.gz ANMAXRWGPYJYLY-XGNXJENSSA-N 2 1 330.850 4.141 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172655267 1049957204 /nfs/dbraw/zinc/95/72/04/1049957204.db2.gz TZUCLZCDMLFRAX-YLJYHZDGSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172655267 1049957206 /nfs/dbraw/zinc/95/72/06/1049957206.db2.gz TZUCLZCDMLFRAX-YLJYHZDGSA-N 2 1 344.543 4.223 20 0 EIADMP CC1(C)CC([N@@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC(C)(C)O1 ZINC001172653733 1049957276 /nfs/dbraw/zinc/95/72/76/1049957276.db2.gz PYLIYNULFSQZHQ-IYARVYRRSA-N 2 1 336.564 4.485 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CC[NH+](C2CC(C)(C)OC(C)(C)C2)CC1 ZINC001172658414 1049957820 /nfs/dbraw/zinc/95/78/20/1049957820.db2.gz QAYYCWQCHNUGBO-UHFFFAOYSA-N 2 1 344.543 4.319 20 0 EIADMP Cc1ccc(-c2nc(CN3CC[C@H]4[C@H](CCC[N@@H+]4C)C3)cs2)cc1 ZINC000139906781 1050004617 /nfs/dbraw/zinc/00/46/17/1050004617.db2.gz NGYHKTWMMOXCAA-MJGOQNOKSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2nc(CN3CC[C@@H]4[C@H](CCC[N@@H+]4C)C3)cs2)cc1 ZINC000139906627 1050004699 /nfs/dbraw/zinc/00/46/99/1050004699.db2.gz NGYHKTWMMOXCAA-IEBWSBKVSA-N 2 1 341.524 4.035 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccc(OC(F)F)cc2)C1 ZINC000246969546 1050007731 /nfs/dbraw/zinc/00/77/31/1050007731.db2.gz IZPAJPSNOYOGFZ-WMLDXEAASA-N 2 1 326.431 4.061 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2sc(-c3ccccc3)nc2C)C1 ZINC000246999652 1050009274 /nfs/dbraw/zinc/00/92/74/1050009274.db2.gz KPILKJDLKVOZQB-GDBMZVCRSA-N 2 1 329.513 4.111 20 0 EIADMP c1cncc(-c2cccc(C[NH+]3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)c2)c1 ZINC000247062614 1050011998 /nfs/dbraw/zinc/01/19/98/1050011998.db2.gz VJURAIARAHDNKP-GMAHTHKFSA-N 2 1 347.506 4.197 20 0 EIADMP c1cncc(-c2cccc(C[NH+]3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c2)c1 ZINC000247062614 1050012004 /nfs/dbraw/zinc/01/20/04/1050012004.db2.gz VJURAIARAHDNKP-GMAHTHKFSA-N 2 1 347.506 4.197 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cnc2ccsc2c1 ZINC000247177756 1050015934 /nfs/dbraw/zinc/01/59/34/1050015934.db2.gz VBHCNGHWZKVUEC-JKSUJKDBSA-N 2 1 331.529 4.459 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)cc1 ZINC000247217207 1050017498 /nfs/dbraw/zinc/01/74/98/1050017498.db2.gz XJIZVPYKWWMANL-OALUTQOASA-N 2 1 338.495 4.067 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)cc1 ZINC000247217207 1050017504 /nfs/dbraw/zinc/01/75/04/1050017504.db2.gz XJIZVPYKWWMANL-OALUTQOASA-N 2 1 338.495 4.067 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@@H](C)C1 ZINC000248044616 1050040270 /nfs/dbraw/zinc/04/02/70/1050040270.db2.gz UPSCYLKKUSDFQV-BBRMVZONSA-N 2 1 349.569 4.042 20 0 EIADMP COc1ccc(OC)c([C@H](C)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000248404241 1050054257 /nfs/dbraw/zinc/05/42/57/1050054257.db2.gz PUEJKYUGASWYOP-ULQDDVLXSA-N 2 1 346.515 4.007 20 0 EIADMP COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000248404241 1050054263 /nfs/dbraw/zinc/05/42/63/1050054263.db2.gz PUEJKYUGASWYOP-ULQDDVLXSA-N 2 1 346.515 4.007 20 0 EIADMP COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000248404241 1050054267 /nfs/dbraw/zinc/05/42/67/1050054267.db2.gz PUEJKYUGASWYOP-ULQDDVLXSA-N 2 1 346.515 4.007 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cnn1C(C)(C)C ZINC000248713477 1050074109 /nfs/dbraw/zinc/07/41/09/1050074109.db2.gz QVAHCMPZCNMFOT-SJORKVTESA-N 2 1 334.552 4.252 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](CC)c2cccc(F)c2)[C@H](C)C1 ZINC000249214415 1050095344 /nfs/dbraw/zinc/09/53/44/1050095344.db2.gz ZJIIEAWNBLZGIC-UXPWSPDFSA-N 2 1 336.495 4.003 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@H](C)C1 ZINC000090046500 1050152431 /nfs/dbraw/zinc/15/24/31/1050152431.db2.gz AADPSAOILARXLX-WBVHZDCISA-N 2 1 335.561 4.053 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828185 1050166980 /nfs/dbraw/zinc/16/69/80/1050166980.db2.gz JGOCMNSVYYYDSQ-YMPZKCBVSA-N 2 1 349.522 4.019 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@@H+](C)C[C@@H]1CC[NH+](Cc3ccccc3)C1)CC2 ZINC001172844395 1050182253 /nfs/dbraw/zinc/18/22/53/1050182253.db2.gz SQCFVCBOKKWGHM-XUZZJYLKSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH+](C)C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172844395 1050182257 /nfs/dbraw/zinc/18/22/57/1050182257.db2.gz SQCFVCBOKKWGHM-XUZZJYLKSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH+](C)C[C@@H]1CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC001172844395 1050182263 /nfs/dbraw/zinc/18/22/63/1050182263.db2.gz SQCFVCBOKKWGHM-XUZZJYLKSA-N 2 1 348.534 4.306 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001177268446 1050183041 /nfs/dbraw/zinc/18/30/41/1050183041.db2.gz ZBYIBISSYQCFGE-CZAYHTPWSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001177268446 1050183043 /nfs/dbraw/zinc/18/30/43/1050183043.db2.gz ZBYIBISSYQCFGE-CZAYHTPWSA-N 2 1 344.543 4.224 20 0 EIADMP COC1(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)CCCCC1 ZINC001177261958 1050183611 /nfs/dbraw/zinc/18/36/11/1050183611.db2.gz MBBRMQYBZHQQFW-IBGZPJMESA-N 2 1 344.543 4.357 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@@H+](C)C[C@H]1CC[NH+](Cc3ccccc3)C1)CC2 ZINC001172844396 1050184152 /nfs/dbraw/zinc/18/41/52/1050184152.db2.gz SQCFVCBOKKWGHM-ZJSXRUAMSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH+](C)C[C@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172844396 1050184164 /nfs/dbraw/zinc/18/41/64/1050184164.db2.gz SQCFVCBOKKWGHM-ZJSXRUAMSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH+](C)C[C@H]1CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC001172844396 1050184169 /nfs/dbraw/zinc/18/41/69/1050184169.db2.gz SQCFVCBOKKWGHM-ZJSXRUAMSA-N 2 1 348.534 4.306 20 0 EIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001172849778 1050188197 /nfs/dbraw/zinc/18/81/97/1050188197.db2.gz PNGUXNBKNGAPCJ-LSDHHAIUSA-N 2 1 326.887 4.251 20 0 EIADMP CC(C)[N@@H+]([C@@H](C)Cc1ccc(F)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172855881 1050192403 /nfs/dbraw/zinc/19/24/03/1050192403.db2.gz APZXMFPLDSWOSX-JQFCIGGWSA-N 2 1 326.887 4.390 20 0 EIADMP CC[NH+]1CCC([N@H+](C)[C@H](C)CSc2ccc(Cl)cc2)CC1 ZINC001172877108 1050217047 /nfs/dbraw/zinc/21/70/47/1050217047.db2.gz DPQFRGLGUWVFDB-CQSZACIVSA-N 2 1 326.937 4.237 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)[C@H](C)CSc2ccc(Cl)cc2)CC1 ZINC001172877108 1050217062 /nfs/dbraw/zinc/21/70/62/1050217062.db2.gz DPQFRGLGUWVFDB-CQSZACIVSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(Br)ccc2Cl)CC1 ZINC001206305092 1050236382 /nfs/dbraw/zinc/23/63/82/1050236382.db2.gz SSTSTDAMJHHQMX-OAHLLOKOSA-N 2 1 345.712 4.053 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](c2ccc(OC)cc2)C2CC2)c1 ZINC000091333117 1050253762 /nfs/dbraw/zinc/25/37/62/1050253762.db2.gz TYCDJABIEABCAS-QFIPXVFZSA-N 2 1 338.495 4.388 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1C1CCC2(CCOCC2)CC1 ZINC001173048798 1050273380 /nfs/dbraw/zinc/27/33/80/1050273380.db2.gz VEALEIWAGUGBCQ-VQTJNVASSA-N 2 1 334.548 4.065 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1C1CCC2(CCOCC2)CC1 ZINC001173048798 1050273397 /nfs/dbraw/zinc/27/33/97/1050273397.db2.gz VEALEIWAGUGBCQ-VQTJNVASSA-N 2 1 334.548 4.065 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1C1CCC2(CCOCC2)CC1 ZINC001173048798 1050273410 /nfs/dbraw/zinc/27/34/10/1050273410.db2.gz VEALEIWAGUGBCQ-VQTJNVASSA-N 2 1 334.548 4.065 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)CC1 ZINC001173114005 1050309978 /nfs/dbraw/zinc/30/99/78/1050309978.db2.gz ROLNCQAFYUCHJQ-VWEINGBSSA-N 2 1 330.516 4.101 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](C)CCCc2cccc(OC)c2)CC1 ZINC001173112418 1050310536 /nfs/dbraw/zinc/31/05/36/1050310536.db2.gz AOVFHVYYALDZMO-UHFFFAOYSA-N 2 1 332.532 4.213 20 0 EIADMP C[N@@H+](C1CCOCC1)C1CC[NH+](C2CCC3(CCCCC3)CC2)CC1 ZINC001173121653 1050316270 /nfs/dbraw/zinc/31/62/70/1050316270.db2.gz TWXUJMNPQRZMHX-UHFFFAOYSA-N 2 1 348.575 4.455 20 0 EIADMP Cc1cc(C[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cnc1Cl ZINC001177963304 1050332999 /nfs/dbraw/zinc/33/29/99/1050332999.db2.gz ZUWIWGJWDCZTJE-MRXNPFEDSA-N 2 1 331.891 4.044 20 0 EIADMP Cc1cc(C[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)cnc1Cl ZINC001177963304 1050333012 /nfs/dbraw/zinc/33/30/12/1050333012.db2.gz ZUWIWGJWDCZTJE-MRXNPFEDSA-N 2 1 331.891 4.044 20 0 EIADMP c1ccc(OC2CCC([NH2+][C@H]3CC[N@@H+](CC4CCCC4)C3)CC2)cc1 ZINC001173199035 1050342340 /nfs/dbraw/zinc/34/23/40/1050342340.db2.gz PPQQTUABVRTYEH-FUHYEJFZSA-N 2 1 342.527 4.231 20 0 EIADMP c1ccc(OC2CCC([NH2+][C@H]3CC[N@H+](CC4CCCC4)C3)CC2)cc1 ZINC001173199035 1050342345 /nfs/dbraw/zinc/34/23/45/1050342345.db2.gz PPQQTUABVRTYEH-FUHYEJFZSA-N 2 1 342.527 4.231 20 0 EIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2cccc(OC)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173271851 1050391031 /nfs/dbraw/zinc/39/10/31/1050391031.db2.gz RMIPXAIPMTYXTP-VBSBHUPXSA-N 2 1 330.516 4.346 20 0 EIADMP CCSC[C@@H](C)[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001173299048 1050400802 /nfs/dbraw/zinc/40/08/02/1050400802.db2.gz AIIGQEFRPFWKIF-AEFFLSMTSA-N 2 1 336.545 4.098 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2cnc(Cl)s2)CC1)CC(C)C ZINC000773732271 1050414253 /nfs/dbraw/zinc/41/42/53/1050414253.db2.gz FJMHPGLPOJHGTL-UHFFFAOYSA-N 2 1 343.968 4.377 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cnc(Cl)s2)CC1)CC(C)C ZINC000773732271 1050414261 /nfs/dbraw/zinc/41/42/61/1050414261.db2.gz FJMHPGLPOJHGTL-UHFFFAOYSA-N 2 1 343.968 4.377 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)CCc2ccc(Cl)c(Cl)c2)CC1 ZINC001173545212 1050477016 /nfs/dbraw/zinc/47/70/16/1050477016.db2.gz XGTRZFUZIBDUMG-CYBMUJFWSA-N 2 1 329.315 4.388 20 0 EIADMP CCO[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]CC1CCCCCC1 ZINC001178972575 1050602102 /nfs/dbraw/zinc/60/21/02/1050602102.db2.gz VVIMEWUVOCCCGD-FGZHOGPDSA-N 2 1 344.543 4.084 20 0 EIADMP CCO[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]CC1CCCCCC1 ZINC001178972575 1050602116 /nfs/dbraw/zinc/60/21/16/1050602116.db2.gz VVIMEWUVOCCCGD-FGZHOGPDSA-N 2 1 344.543 4.084 20 0 EIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1C ZINC001179110021 1050634553 /nfs/dbraw/zinc/63/45/53/1050634553.db2.gz FAQOCOTYYBSIBT-NZQKXSOJSA-N 2 1 336.523 4.489 20 0 EIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1C ZINC001179110021 1050634564 /nfs/dbraw/zinc/63/45/64/1050634564.db2.gz FAQOCOTYYBSIBT-NZQKXSOJSA-N 2 1 336.523 4.489 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001179259164 1050662700 /nfs/dbraw/zinc/66/27/00/1050662700.db2.gz SHPMGYWNNOZPQS-INIZCTEOSA-N 2 1 340.433 4.225 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1N(C)C ZINC000093941054 1050724268 /nfs/dbraw/zinc/72/42/68/1050724268.db2.gz FBBOLVFTSNERRC-SFHVURJKSA-N 2 1 337.511 4.068 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]CCC3(c4ccccc4)CC3)CC2)cc1 ZINC001179621501 1050743275 /nfs/dbraw/zinc/74/32/75/1050743275.db2.gz OPUPBIYJBDWOQB-UHFFFAOYSA-N 2 1 348.534 4.405 20 0 EIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877915 1050814541 /nfs/dbraw/zinc/81/45/41/1050814541.db2.gz KHSXWLHZIFGZMC-NJRZHNRPSA-N 2 1 326.528 4.433 20 0 EIADMP Cc1cc(C)c(/C=C\C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877915 1050814544 /nfs/dbraw/zinc/81/45/44/1050814544.db2.gz KHSXWLHZIFGZMC-NJRZHNRPSA-N 2 1 326.528 4.433 20 0 EIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](CC4CCSCC4)CC[C@@H]32)cc1 ZINC001179918367 1050834285 /nfs/dbraw/zinc/83/42/85/1050834285.db2.gz BOCCNQXXYRCCIC-SFTDATJTSA-N 2 1 344.568 4.116 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](CC4CCSCC4)CC[C@@H]32)cc1 ZINC001179918367 1050834286 /nfs/dbraw/zinc/83/42/86/1050834286.db2.gz BOCCNQXXYRCCIC-SFTDATJTSA-N 2 1 344.568 4.116 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](CC4CCSCC4)CC[C@@H]32)cc1 ZINC001179918367 1050834288 /nfs/dbraw/zinc/83/42/88/1050834288.db2.gz BOCCNQXXYRCCIC-SFTDATJTSA-N 2 1 344.568 4.116 20 0 EIADMP C[C@@H]1Cc2cc(C[N@@H+]3CCC[C@H](C[NH+]4CCCC[C@@H]4C)C3)ccc2O1 ZINC001180030182 1050859209 /nfs/dbraw/zinc/85/92/09/1050859209.db2.gz JPMBHSUROZMPTK-NSHGMRRFSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[N@H+]3CCC[C@H](C[NH+]4CCCC[C@@H]4C)C3)ccc2O1 ZINC001180030182 1050859214 /nfs/dbraw/zinc/85/92/14/1050859214.db2.gz JPMBHSUROZMPTK-NSHGMRRFSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[NH+]3CCC[C@H](C[N@@H+]4CCCC[C@@H]4C)C3)ccc2O1 ZINC001180030182 1050859218 /nfs/dbraw/zinc/85/92/18/1050859218.db2.gz JPMBHSUROZMPTK-NSHGMRRFSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[NH+]3CCC[C@H](C[N@H+]4CCCC[C@@H]4C)C3)ccc2O1 ZINC001180030182 1050859221 /nfs/dbraw/zinc/85/92/21/1050859221.db2.gz JPMBHSUROZMPTK-NSHGMRRFSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@@H]2CCc3ccccc32)C1 ZINC001180030503 1050860182 /nfs/dbraw/zinc/86/01/82/1050860182.db2.gz NRWHHXKGZPBBNS-DYXWJJEUSA-N 2 1 326.528 4.303 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@@H]2CCc3ccccc32)C1 ZINC001180030503 1050860186 /nfs/dbraw/zinc/86/01/86/1050860186.db2.gz NRWHHXKGZPBBNS-DYXWJJEUSA-N 2 1 326.528 4.303 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@@H]2CCc3ccccc32)C1 ZINC001180030503 1050860191 /nfs/dbraw/zinc/86/01/91/1050860191.db2.gz NRWHHXKGZPBBNS-DYXWJJEUSA-N 2 1 326.528 4.303 20 0 EIADMP COc1cc2ccccc2cc1CN(C)CC[C@H]1CCCC[N@H+]1C ZINC001180099202 1050886400 /nfs/dbraw/zinc/88/64/00/1050886400.db2.gz WRFHEBVRDRMRPB-HXUWFJFHSA-N 2 1 326.484 4.155 20 0 EIADMP Cc1cc(C)cc(CC[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001180350249 1050966133 /nfs/dbraw/zinc/96/61/33/1050966133.db2.gz WYNODVIKEGDCLT-NFBKMPQASA-N 2 1 336.523 4.346 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000763604577 1050977578 /nfs/dbraw/zinc/97/75/78/1050977578.db2.gz HOBWEORFGXOLRF-AWEZNQCLSA-N 2 1 332.435 4.215 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000763604577 1050977596 /nfs/dbraw/zinc/97/75/96/1050977596.db2.gz HOBWEORFGXOLRF-AWEZNQCLSA-N 2 1 332.435 4.215 20 0 EIADMP CC(C)(C)CC[C@H](CO)[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001181222399 1051188709 /nfs/dbraw/zinc/18/87/09/1051188709.db2.gz GZUYDSHNDGPZKT-QKNQBKEWSA-N 2 1 344.543 4.131 20 0 EIADMP CC(C)(C)CC[C@H](CO)[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001181222399 1051188718 /nfs/dbraw/zinc/18/87/18/1051188718.db2.gz GZUYDSHNDGPZKT-QKNQBKEWSA-N 2 1 344.543 4.131 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1)c1cc(F)cc(F)c1 ZINC001181276062 1051196119 /nfs/dbraw/zinc/19/61/19/1051196119.db2.gz IKTYXRWDARYOQY-YWZLYKJASA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]([NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1)C1CCOCC1 ZINC000153859632 1051238547 /nfs/dbraw/zinc/23/85/47/1051238547.db2.gz UUVXUARTHPRJJI-MSOLQXFVSA-N 2 1 330.516 4.055 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCSCc3ccccc3)C2)CC1 ZINC001190651730 1051244454 /nfs/dbraw/zinc/24/44/54/1051244454.db2.gz QAIQXZSSBHNJNF-NRFANRHFSA-N 2 1 346.584 4.364 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2scnc2Cl)CC1 ZINC001190790748 1051279052 /nfs/dbraw/zinc/27/90/52/1051279052.db2.gz DQMYXYNIFHWDMZ-UHFFFAOYSA-N 2 1 349.931 4.141 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2scnc2Cl)CC1 ZINC001190790748 1051279057 /nfs/dbraw/zinc/27/90/57/1051279057.db2.gz DQMYXYNIFHWDMZ-UHFFFAOYSA-N 2 1 349.931 4.141 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCc2ccccc2F)CC1 ZINC001191550863 1051486171 /nfs/dbraw/zinc/48/61/71/1051486171.db2.gz NOWXUIUICXLKJG-GOSISDBHSA-N 2 1 332.507 4.345 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCOC3(CCCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000271503939 1051542681 /nfs/dbraw/zinc/54/26/81/1051542681.db2.gz MJUSKISVOGQVPT-HMXCVIKNSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCOC3(CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000271503939 1051542693 /nfs/dbraw/zinc/54/26/93/1051542693.db2.gz MJUSKISVOGQVPT-HMXCVIKNSA-N 2 1 342.527 4.121 20 0 EIADMP CC(F)(F)CCC[N@@H+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001175381761 1051562873 /nfs/dbraw/zinc/56/28/73/1051562873.db2.gz JRSSWBMLNQBFGO-KDURUIRLSA-N 2 1 336.470 4.266 20 0 EIADMP CC(F)(F)CCC[N@H+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001175381761 1051562881 /nfs/dbraw/zinc/56/28/81/1051562881.db2.gz JRSSWBMLNQBFGO-KDURUIRLSA-N 2 1 336.470 4.266 20 0 EIADMP CC(F)(F)CCC[NH+]1C[C@]2(C)C[N@H+](Cc3ccccc3)C[C@]2(C)C1 ZINC001175381761 1051562894 /nfs/dbraw/zinc/56/28/94/1051562894.db2.gz JRSSWBMLNQBFGO-KDURUIRLSA-N 2 1 336.470 4.266 20 0 EIADMP CC(F)(F)CCC[NH+]1C[C@]2(C)C[N@@H+](Cc3ccccc3)C[C@]2(C)C1 ZINC001175381761 1051562903 /nfs/dbraw/zinc/56/29/03/1051562903.db2.gz JRSSWBMLNQBFGO-KDURUIRLSA-N 2 1 336.470 4.266 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000774389747 1051587419 /nfs/dbraw/zinc/58/74/19/1051587419.db2.gz DYHOJMJCEGFJKI-LLVKDONJSA-N 2 1 342.314 4.101 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)c(C(F)(F)F)c1 ZINC000157679352 1051663868 /nfs/dbraw/zinc/66/38/68/1051663868.db2.gz DXFIXBGARPDTJK-DZGCQCFKSA-N 2 1 344.421 4.065 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(C(F)(F)F)c1 ZINC000157679352 1051663879 /nfs/dbraw/zinc/66/38/79/1051663879.db2.gz DXFIXBGARPDTJK-DZGCQCFKSA-N 2 1 344.421 4.065 20 0 EIADMP CC(C)COc1cccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192323737 1051692268 /nfs/dbraw/zinc/69/22/68/1051692268.db2.gz FCNKMXJVYXYQAC-DENIHFKCSA-N 2 1 342.527 4.170 20 0 EIADMP CC(C)COc1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001192323737 1051692274 /nfs/dbraw/zinc/69/22/74/1051692274.db2.gz FCNKMXJVYXYQAC-DENIHFKCSA-N 2 1 342.527 4.170 20 0 EIADMP CC(C)COc1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001192323737 1051692283 /nfs/dbraw/zinc/69/22/83/1051692283.db2.gz FCNKMXJVYXYQAC-DENIHFKCSA-N 2 1 342.527 4.170 20 0 EIADMP Cc1nc2c(s1)[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)CCC2 ZINC000158591528 1051762120 /nfs/dbraw/zinc/76/21/20/1051762120.db2.gz XVXAWIHLAXMMKM-UXLLHSPISA-N 2 1 335.561 4.177 20 0 EIADMP COCC1([NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)CCCCC1 ZINC001183059819 1051781316 /nfs/dbraw/zinc/78/13/16/1051781316.db2.gz PEYNQZWOBYNXRV-TZIWHRDSSA-N 2 1 342.527 4.293 20 0 EIADMP COCC1([NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)CCCCC1 ZINC001183059819 1051781325 /nfs/dbraw/zinc/78/13/25/1051781325.db2.gz PEYNQZWOBYNXRV-TZIWHRDSSA-N 2 1 342.527 4.293 20 0 EIADMP C[C@H]([NH2+]CC1CCC2(CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001183122652 1051784361 /nfs/dbraw/zinc/78/43/61/1051784361.db2.gz MAUSWJWGQOHIHZ-GHTZIAJQSA-N 2 1 326.528 4.457 20 0 EIADMP CCc1noc(C)c1C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000158978973 1051803535 /nfs/dbraw/zinc/80/35/35/1051803535.db2.gz JONILGCIXCHSLZ-INIZCTEOSA-N 2 1 333.520 4.022 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC001183371730 1051838177 /nfs/dbraw/zinc/83/81/77/1051838177.db2.gz SDGHTPYUEYNMAU-YTPNCZQQSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@@H](CC[N@@H+]2C)C1 ZINC001183371730 1051838181 /nfs/dbraw/zinc/83/81/81/1051838181.db2.gz SDGHTPYUEYNMAU-YTPNCZQQSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[N@@H+]1CC[C@@H]2[C@@H](CC[NH+]2C)C1 ZINC001183371730 1051838189 /nfs/dbraw/zinc/83/81/89/1051838189.db2.gz SDGHTPYUEYNMAU-YTPNCZQQSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[N@H+]1CC[C@@H]2[C@@H](CC[NH+]2C)C1 ZINC001183371730 1051838195 /nfs/dbraw/zinc/83/81/95/1051838195.db2.gz SDGHTPYUEYNMAU-YTPNCZQQSA-N 2 1 338.417 4.135 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)CC[N@@H+]1C ZINC000621765811 1051941489 /nfs/dbraw/zinc/94/14/89/1051941489.db2.gz FNJAWHFVKXRYNS-CZUORRHYSA-N 2 1 326.406 4.157 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)CC[N@H+]1C ZINC000621765811 1051941500 /nfs/dbraw/zinc/94/15/00/1051941500.db2.gz FNJAWHFVKXRYNS-CZUORRHYSA-N 2 1 326.406 4.157 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)ccc1OC1CCCC1 ZINC000159265176 1051967229 /nfs/dbraw/zinc/96/72/29/1051967229.db2.gz MEDWPNXLJCHCMB-XYJFISCASA-N 2 1 346.515 4.150 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1OC1CCCC1 ZINC000159265176 1051967239 /nfs/dbraw/zinc/96/72/39/1051967239.db2.gz MEDWPNXLJCHCMB-XYJFISCASA-N 2 1 346.515 4.150 20 0 EIADMP CCOc1ccccc1[C@@H](C)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000163526792 1051992605 /nfs/dbraw/zinc/99/26/05/1051992605.db2.gz PAEREVOONFGSMC-QGZVFWFLSA-N 2 1 339.483 4.108 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C[C@H]3C[C@H]3c3ccccc3)CC2)cc1 ZINC000163504625 1051993183 /nfs/dbraw/zinc/99/31/83/1051993183.db2.gz XEYKCBIZUFHGDN-GGAORHGYSA-N 2 1 334.507 4.087 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C[C@H]3C[C@@H]3c3ccccc3)CC2)cc1 ZINC000163504464 1051993231 /nfs/dbraw/zinc/99/32/31/1051993231.db2.gz XEYKCBIZUFHGDN-FYYLOGMGSA-N 2 1 334.507 4.087 20 0 EIADMP C[C@H]1CC[N@H+](Cc2ccc(Br)c3ccccc23)C[C@@H]1C[NH3+] ZINC001205303515 1052053648 /nfs/dbraw/zinc/05/36/48/1052053648.db2.gz GTROHKBGYHPAIO-ZFWWWQNUSA-N 2 1 347.300 4.019 20 0 EIADMP C[C@H]1CC[N@@H+](Cc2ccc(Br)c3ccccc23)C[C@@H]1C[NH3+] ZINC001205303515 1052053660 /nfs/dbraw/zinc/05/36/60/1052053660.db2.gz GTROHKBGYHPAIO-ZFWWWQNUSA-N 2 1 347.300 4.019 20 0 EIADMP C[C@H]1CCC[C@H](C[N@@H+]2CCC[NH+](Cc3ccccc3)CCOCC2)C1 ZINC001176496109 1052075208 /nfs/dbraw/zinc/07/52/08/1052075208.db2.gz NXKQABOALMPCLF-UNMCSNQZSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@H]1CCC[C@H](C[N@H+]2CCC[NH+](Cc3ccccc3)CCOCC2)C1 ZINC001176496109 1052075218 /nfs/dbraw/zinc/07/52/18/1052075218.db2.gz NXKQABOALMPCLF-UNMCSNQZSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@H]1CCC[C@H](C[NH+]2CCC[N@H+](Cc3ccccc3)CCOCC2)C1 ZINC001176496109 1052075229 /nfs/dbraw/zinc/07/52/29/1052075229.db2.gz NXKQABOALMPCLF-UNMCSNQZSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@H]1CCC[C@H](C[NH+]2CCC[N@@H+](Cc3ccccc3)CCOCC2)C1 ZINC001176496109 1052075242 /nfs/dbraw/zinc/07/52/42/1052075242.db2.gz NXKQABOALMPCLF-UNMCSNQZSA-N 2 1 344.543 4.037 20 0 EIADMP C[C@H]1CCC[C@H](C[NH2+]c2ccc(N3CCC([NH+](C)C)CC3)cc2)C1 ZINC000774824217 1052172797 /nfs/dbraw/zinc/17/27/97/1052172797.db2.gz MAWSXPGDOUGQQL-ROUUACIJSA-N 2 1 329.532 4.455 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cc(C)cc(Br)c2)C[C@H]1C ZINC000774903343 1052269999 /nfs/dbraw/zinc/26/99/99/1052269999.db2.gz MKSNUMMUCOJKBU-RHSMWYFYSA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)cc(Br)c2)C[C@H]1C ZINC000774903343 1052270008 /nfs/dbraw/zinc/27/00/08/1052270008.db2.gz MKSNUMMUCOJKBU-RHSMWYFYSA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C)cc(Br)c2)C[C@H]1C ZINC000774903343 1052270017 /nfs/dbraw/zinc/27/00/17/1052270017.db2.gz MKSNUMMUCOJKBU-RHSMWYFYSA-N 2 1 339.321 4.062 20 0 EIADMP C[C@H]([NH2+]CCC[NH+](Cc1ccccc1)Cc1ccccc1)c1cn[nH]c1 ZINC000340544293 1052569140 /nfs/dbraw/zinc/56/91/40/1052569140.db2.gz UKHCDJKGTVHCIE-IBGZPJMESA-N 2 1 348.494 4.153 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CN[C@@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357839 1052632563 /nfs/dbraw/zinc/63/25/63/1052632563.db2.gz CAZRBZRLHWWQQM-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CN[C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357839 1052632567 /nfs/dbraw/zinc/63/25/67/1052632567.db2.gz CAZRBZRLHWWQQM-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1CN[C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623357839 1052632570 /nfs/dbraw/zinc/63/25/70/1052632570.db2.gz CAZRBZRLHWWQQM-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357839 1052632574 /nfs/dbraw/zinc/63/25/74/1052632574.db2.gz CAZRBZRLHWWQQM-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357839 1052632581 /nfs/dbraw/zinc/63/25/81/1052632581.db2.gz CAZRBZRLHWWQQM-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357839 1052632586 /nfs/dbraw/zinc/63/25/86/1052632586.db2.gz CAZRBZRLHWWQQM-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623357839 1052632605 /nfs/dbraw/zinc/63/26/05/1052632605.db2.gz CAZRBZRLHWWQQM-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2nc(C3CCCCC3)cs2)CC1(C)C ZINC000623425448 1052653326 /nfs/dbraw/zinc/65/33/26/1052653326.db2.gz BDIXYSHAUXEWJF-MRXNPFEDSA-N 2 1 335.561 4.196 20 0 EIADMP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623487710 1052664366 /nfs/dbraw/zinc/66/43/66/1052664366.db2.gz NVIMUUGRBODESG-UKRRQHHQSA-N 2 1 328.422 4.099 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C2(c3cccc(OC(F)(F)F)c3)CC2)CC1(C)C ZINC000623561657 1052680303 /nfs/dbraw/zinc/68/03/03/1052680303.db2.gz URURHRAKEOKXIA-AWEZNQCLSA-N 2 1 342.405 4.037 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C2(c3cccc(OC(F)(F)F)c3)CC2)CC1(C)C ZINC000623561657 1052680310 /nfs/dbraw/zinc/68/03/10/1052680310.db2.gz URURHRAKEOKXIA-AWEZNQCLSA-N 2 1 342.405 4.037 20 0 EIADMP CC(C)OCCCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000180463487 1052800984 /nfs/dbraw/zinc/80/09/84/1052800984.db2.gz UREQFCINUUQEPT-BHIFYINESA-N 2 1 344.543 4.082 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]C[C@@H]3CCCC[N@H+](C)C3)c(C)c2c1 ZINC000624121117 1052867433 /nfs/dbraw/zinc/86/74/33/1052867433.db2.gz ONPHRCZXDGMQSN-CVEARBPZSA-N 2 1 330.472 4.132 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]C[C@@H]3CCCC[N@@H+](C)C3)c(C)c2c1 ZINC000624121117 1052867434 /nfs/dbraw/zinc/86/74/34/1052867434.db2.gz ONPHRCZXDGMQSN-CVEARBPZSA-N 2 1 330.472 4.132 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1OC(F)F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185667333 1053019351 /nfs/dbraw/zinc/01/93/51/1053019351.db2.gz TXDPUTOSPAVHRN-ZBFHGGJFSA-N 2 1 338.442 4.031 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1OC(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185667333 1053019357 /nfs/dbraw/zinc/01/93/57/1053019357.db2.gz TXDPUTOSPAVHRN-ZBFHGGJFSA-N 2 1 338.442 4.031 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c1 ZINC000850095880 1053071609 /nfs/dbraw/zinc/07/16/09/1053071609.db2.gz GNPBHDZQGWWJRF-UHFFFAOYSA-N 2 1 336.545 4.029 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cnn(-c2ccccc2)c1 ZINC000764960056 1053398899 /nfs/dbraw/zinc/39/88/99/1053398899.db2.gz CBYBRKQUXZKJQA-RBUKOAKNSA-N 2 1 340.515 4.035 20 0 EIADMP CC(C)(C)c1csc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)n1 ZINC000865405279 1053491925 /nfs/dbraw/zinc/49/19/25/1053491925.db2.gz FGXZGYWPMBPXFT-UHFFFAOYSA-N 2 1 343.540 4.326 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cnc3c(F)cccc3c2)c1 ZINC000865451539 1053511611 /nfs/dbraw/zinc/51/16/11/1053511611.db2.gz RIQFXWDAZVHAHZ-UHFFFAOYSA-N 2 1 337.442 4.115 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc2c(c1)CCCO2 ZINC000853248801 1053659810 /nfs/dbraw/zinc/65/98/10/1053659810.db2.gz JYYNSFQWTKNIIT-NDXORKPFSA-N 2 1 336.479 4.156 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@H]2CCCO2)[C@H]1c1cccs1 ZINC000866271590 1053671081 /nfs/dbraw/zinc/67/10/81/1053671081.db2.gz ANQJYFWZSCWSIL-LFGUQSLTSA-N 2 1 348.556 4.068 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@H]2CCCO2)[C@H]1c1cccs1 ZINC000866271590 1053671088 /nfs/dbraw/zinc/67/10/88/1053671088.db2.gz ANQJYFWZSCWSIL-LFGUQSLTSA-N 2 1 348.556 4.068 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](CCc1ccccc1)c1ccccn1 ZINC000866272955 1053673155 /nfs/dbraw/zinc/67/31/55/1053673155.db2.gz ZIJXGDBILVASPT-QFIPXVFZSA-N 2 1 348.494 4.330 20 0 EIADMP COc1cccc(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000386321891 1053679081 /nfs/dbraw/zinc/67/90/81/1053679081.db2.gz IPTNWEZEEYDFEY-OAQYLSRUSA-N 2 1 338.495 4.087 20 0 EIADMP C[C@H]([NH2+]Cc1cc(F)c(F)c(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386394583 1053704705 /nfs/dbraw/zinc/70/47/05/1053704705.db2.gz VVTKSJJVECQCDM-WMLDXEAASA-N 2 1 348.412 4.104 20 0 EIADMP C[C@H]([NH2+]Cc1cc(F)c(F)c(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386394583 1053704720 /nfs/dbraw/zinc/70/47/20/1053704720.db2.gz VVTKSJJVECQCDM-WMLDXEAASA-N 2 1 348.412 4.104 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386432696 1053722745 /nfs/dbraw/zinc/72/27/45/1053722745.db2.gz OOEJLXSFWDMRGI-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386432696 1053722771 /nfs/dbraw/zinc/72/27/71/1053722771.db2.gz OOEJLXSFWDMRGI-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2ccccc2C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386546133 1053773398 /nfs/dbraw/zinc/77/33/98/1053773398.db2.gz SFZXELNJKSBGRT-NMNUPHIUSA-N 2 1 334.507 4.044 20 0 EIADMP c1[nH]c2ccccc2c1CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000121716761 1053840223 /nfs/dbraw/zinc/84/02/23/1053840223.db2.gz VHCIXBDXOZRZDJ-UHFFFAOYSA-N 2 1 347.506 4.007 20 0 EIADMP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000765704672 1053850952 /nfs/dbraw/zinc/85/09/52/1053850952.db2.gz ZEQKDTGUVDKPLU-NZQKXSOJSA-N 2 1 334.507 4.137 20 0 EIADMP C[N@H+](Cc1sccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000338563850 1054032009 /nfs/dbraw/zinc/03/20/09/1054032009.db2.gz NXVRWEFAIHXHBJ-UHFFFAOYSA-N 2 1 335.904 4.145 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccn(C)n1 ZINC000542670293 1054187900 /nfs/dbraw/zinc/18/79/00/1054187900.db2.gz JBWULFXDOAPWJE-XLIONFOSSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1ccn(C)n1 ZINC000542670293 1054187906 /nfs/dbraw/zinc/18/79/06/1054187906.db2.gz JBWULFXDOAPWJE-XLIONFOSSA-N 2 1 340.515 4.035 20 0 EIADMP c1cc(C[NH+]2CCCCC2)cc(C[N@H+]2CCCC[C@@]23CCCOC3)c1 ZINC001198830687 1054269302 /nfs/dbraw/zinc/26/93/02/1054269302.db2.gz WMUPCVPQPHHTBK-QFIPXVFZSA-N 2 1 342.527 4.208 20 0 EIADMP Cc1cc(C)c([C@@H](C)[N@H+]2C[C@@]34C[NH+](C)C[C@]3(C2)CCCC4)c(C)c1 ZINC001198821550 1054273745 /nfs/dbraw/zinc/27/37/45/1054273745.db2.gz SSALMYGBKKHHAS-FCEUIQTBSA-N 2 1 326.528 4.481 20 0 EIADMP Cc1cc(C)c([C@@H](C)[NH+]2C[C@@]34C[N@H+](C)C[C@]3(C2)CCCC4)c(C)c1 ZINC001198821550 1054273772 /nfs/dbraw/zinc/27/37/72/1054273772.db2.gz SSALMYGBKKHHAS-FCEUIQTBSA-N 2 1 326.528 4.481 20 0 EIADMP Cc1cc(C)c([C@@H](C)[NH+]2C[C@@]34C[N@@H+](C)C[C@]3(C2)CCCC4)c(C)c1 ZINC001198821550 1054273791 /nfs/dbraw/zinc/27/37/91/1054273791.db2.gz SSALMYGBKKHHAS-FCEUIQTBSA-N 2 1 326.528 4.481 20 0 EIADMP CC(C)COc1cccc(CN2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)c1 ZINC001198819671 1054275391 /nfs/dbraw/zinc/27/53/91/1054275391.db2.gz GJRDFEVYFPHNSH-SZPZYZBQSA-N 2 1 342.527 4.029 20 0 EIADMP CC(C)COc1cccc(C[N@@H+]2C[C@@]34C[NH+](C)C[C@]3(C2)CCCC4)c1 ZINC001198819671 1054275414 /nfs/dbraw/zinc/27/54/14/1054275414.db2.gz GJRDFEVYFPHNSH-SZPZYZBQSA-N 2 1 342.527 4.029 20 0 EIADMP CC(C)COc1cccc(C[NH+]2C[C@@]34C[N@@H+](C)C[C@]3(C2)CCCC4)c1 ZINC001198819671 1054275474 /nfs/dbraw/zinc/27/54/74/1054275474.db2.gz GJRDFEVYFPHNSH-SZPZYZBQSA-N 2 1 342.527 4.029 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCOC3(CCCC3)C2)CC1 ZINC000872036361 1054353957 /nfs/dbraw/zinc/35/39/57/1054353957.db2.gz UJUJHQLUUILIJO-WIYYLYMNSA-N 2 1 342.527 4.293 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2cccc(OC(C)(C)C)c2)C1 ZINC001199329752 1054394749 /nfs/dbraw/zinc/39/47/49/1054394749.db2.gz ZBZLUGVVBUVPRU-HDICACEKSA-N 2 1 332.532 4.322 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2cccc(OC(C)(C)C)c2)C1 ZINC001199329752 1054394756 /nfs/dbraw/zinc/39/47/56/1054394756.db2.gz ZBZLUGVVBUVPRU-HDICACEKSA-N 2 1 332.532 4.322 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1cccc(OC(F)(F)F)c1 ZINC000858149783 1054425422 /nfs/dbraw/zinc/42/54/22/1054425422.db2.gz UVDUKTQWYMWGNL-TZMCWYRMSA-N 2 1 330.394 4.109 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1cccc(OC(F)(F)F)c1 ZINC000858149783 1054425431 /nfs/dbraw/zinc/42/54/31/1054425431.db2.gz UVDUKTQWYMWGNL-TZMCWYRMSA-N 2 1 330.394 4.109 20 0 EIADMP CC(C)[NH+](CCC[NH2+]Cc1cccc(OCC(F)(F)F)c1)C(C)C ZINC001200923643 1054577790 /nfs/dbraw/zinc/57/77/90/1054577790.db2.gz UNGWOFQELRLGBT-UHFFFAOYSA-N 2 1 346.437 4.226 20 0 EIADMP COc1ccc(C[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1OCC(C)C ZINC000061029155 1054738274 /nfs/dbraw/zinc/73/82/74/1054738274.db2.gz JEPIBFIRUMADOT-SFHVURJKSA-N 2 1 348.531 4.084 20 0 EIADMP COc1ccc(C[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cc1OCC(C)C ZINC000061029155 1054738291 /nfs/dbraw/zinc/73/82/91/1054738291.db2.gz JEPIBFIRUMADOT-SFHVURJKSA-N 2 1 348.531 4.084 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000776166995 1054800844 /nfs/dbraw/zinc/80/08/44/1054800844.db2.gz ILFIWIHCYNKINZ-KRWDZBQOSA-N 2 1 338.467 4.230 20 0 EIADMP CCC(CC)C[N@@H+]1CCc2c(C[NH+](C)Cc3ccco3)cncc2C1 ZINC001201528680 1054845415 /nfs/dbraw/zinc/84/54/15/1054845415.db2.gz WSRHGYZWBDSERP-UHFFFAOYSA-N 2 1 341.499 4.101 20 0 EIADMP CCC(CC)C[N@H+]1CCc2c(C[NH+](C)Cc3ccco3)cncc2C1 ZINC001201528680 1054845421 /nfs/dbraw/zinc/84/54/21/1054845421.db2.gz WSRHGYZWBDSERP-UHFFFAOYSA-N 2 1 341.499 4.101 20 0 EIADMP CCC(CC)C[NH+]1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001201528680 1054845423 /nfs/dbraw/zinc/84/54/23/1054845423.db2.gz WSRHGYZWBDSERP-UHFFFAOYSA-N 2 1 341.499 4.101 20 0 EIADMP CCC(CC)C[NH+]1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001201528680 1054845427 /nfs/dbraw/zinc/84/54/27/1054845427.db2.gz WSRHGYZWBDSERP-UHFFFAOYSA-N 2 1 341.499 4.101 20 0 EIADMP CCC(CC)C[NH+]1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001201528150 1054845440 /nfs/dbraw/zinc/84/54/40/1054845440.db2.gz KZKZMJVDFADHSO-UHFFFAOYSA-N 2 1 344.543 4.098 20 0 EIADMP C[N@@H+](CCCc1ccccc1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001201673819 1054873120 /nfs/dbraw/zinc/87/31/20/1054873120.db2.gz QFIQUHKFQVOSKI-UHFFFAOYSA-N 2 1 336.523 4.463 20 0 EIADMP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000877070923 1055012495 /nfs/dbraw/zinc/01/24/95/1055012495.db2.gz YVAQTJYWMDZCNL-CUDHKJQZSA-N 2 1 330.541 4.228 20 0 EIADMP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000877070923 1055012507 /nfs/dbraw/zinc/01/25/07/1055012507.db2.gz YVAQTJYWMDZCNL-CUDHKJQZSA-N 2 1 330.541 4.228 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[NH+](CCC(C)(C)C)C[C@H]21 ZINC001202079161 1055019959 /nfs/dbraw/zinc/01/99/59/1055019959.db2.gz XUYMFHPOHPYNLZ-MISYRCLQSA-N 2 1 329.532 4.050 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[NH+](CCC(C)(C)C)C[C@H]21 ZINC001202079161 1055019976 /nfs/dbraw/zinc/01/99/76/1055019976.db2.gz XUYMFHPOHPYNLZ-MISYRCLQSA-N 2 1 329.532 4.050 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[N@H+](CCC(C)(C)C)C[C@H]21 ZINC001202079161 1055019992 /nfs/dbraw/zinc/01/99/92/1055019992.db2.gz XUYMFHPOHPYNLZ-MISYRCLQSA-N 2 1 329.532 4.050 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[N@@H+](CCC(C)(C)C)C[C@H]21 ZINC001202079161 1055020007 /nfs/dbraw/zinc/02/00/07/1055020007.db2.gz XUYMFHPOHPYNLZ-MISYRCLQSA-N 2 1 329.532 4.050 20 0 EIADMP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1nccc2ccccc21 ZINC001202074558 1055035882 /nfs/dbraw/zinc/03/58/82/1055035882.db2.gz PFUNKBDTVIWRAM-UHFFFAOYSA-N 2 1 325.500 4.369 20 0 EIADMP C[C@]1(C[NH2+]C/C=C/c2ccc(F)cc2)CC[N@@H+](Cc2ccccc2)C1 ZINC001202221006 1055093600 /nfs/dbraw/zinc/09/36/00/1055093600.db2.gz XUTUWIFFHNUYMW-QNBZTBGESA-N 2 1 338.470 4.341 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1cccnc1 ZINC000112528578 1055236325 /nfs/dbraw/zinc/23/63/25/1055236325.db2.gz XLAUUHRRRAYEAO-OTWHNJEPSA-N 2 1 337.511 4.410 20 0 EIADMP C[C@H](NCc1cc(C(F)(F)F)co1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000878411522 1055293980 /nfs/dbraw/zinc/29/39/80/1055293980.db2.gz LHUJNKKRVBAIKM-STQMWFEESA-N 2 1 330.394 4.041 20 0 EIADMP C[C@H](Cc1ccccn1)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000655833882 1055700432 /nfs/dbraw/zinc/70/04/32/1055700432.db2.gz HPYIVCXQYGLKPT-HOHBBMLPSA-N 2 1 337.511 4.045 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+]C3CC[NH+](C(C)C)CC3)cc2)cc1 ZINC000542906146 1056730698 /nfs/dbraw/zinc/73/06/98/1056730698.db2.gz RMLZISGJUCILJQ-UHFFFAOYSA-N 2 1 338.495 4.325 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1OC ZINC000742374724 1058597980 /nfs/dbraw/zinc/59/79/80/1058597980.db2.gz DSSBRCAAPVIIEM-HKUYNNGSSA-N 2 1 348.531 4.227 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000742374724 1058597993 /nfs/dbraw/zinc/59/79/93/1058597993.db2.gz DSSBRCAAPVIIEM-HKUYNNGSSA-N 2 1 348.531 4.227 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccccc1N1CCCCC1 ZINC000743763385 1059114590 /nfs/dbraw/zinc/11/45/90/1059114590.db2.gz GWJREWCNMHSDIA-LJQANCHMSA-N 2 1 329.532 4.031 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccccc1N1CCCCC1 ZINC000743763385 1059114621 /nfs/dbraw/zinc/11/46/21/1059114621.db2.gz GWJREWCNMHSDIA-LJQANCHMSA-N 2 1 329.532 4.031 20 0 EIADMP C[C@H](CC[NH2+]Cc1ccc2cnccc2c1)[N@@H+](C)Cc1ccccc1 ZINC000379641187 1060143110 /nfs/dbraw/zinc/14/31/10/1060143110.db2.gz CVVAESXBXDFIRZ-GOSISDBHSA-N 2 1 333.479 4.235 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCc2c(F)cccc2Cl)cc1 ZINC001168839081 1060451573 /nfs/dbraw/zinc/45/15/73/1060451573.db2.gz SDGORHDWQHBYEB-UHFFFAOYSA-N 2 1 334.866 4.215 20 0 EIADMP Cc1ccc([C@@H](C)Nc2ccc3c(c2)[nH+]cn3[C@H]2CCC[NH2+]CC2)nc1 ZINC001168855021 1060460306 /nfs/dbraw/zinc/46/03/06/1060460306.db2.gz SKPZZGROGCVNNY-AEFFLSMTSA-N 2 1 349.482 4.227 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CCCc3cc(Br)ccc31)C2 ZINC001169101516 1060636532 /nfs/dbraw/zinc/63/65/32/1060636532.db2.gz TZEYQEIFWNTAQB-DFGXFYAUSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CC(C)(c1ccccc1)c1ccccc1)C2 ZINC001169089554 1060643806 /nfs/dbraw/zinc/64/38/06/1060643806.db2.gz CPVBCJOHMCNHSX-DKUWSORSSA-N 2 1 334.507 4.207 20 0 EIADMP C[N@H+]1CCCC[C@@H]1c1ccc(N[C@@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)nc1 ZINC001169141794 1060663754 /nfs/dbraw/zinc/66/37/54/1060663754.db2.gz KWSLKQMCLDDPLD-DBXWQHBBSA-N 2 1 344.547 4.194 20 0 EIADMP 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 1060665350 /nfs/dbraw/zinc/66/53/50/1060665350.db2.gz VSUPYEFXNMBVGX-OWLYRPNTSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CC[C@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147657 1060665361 /nfs/dbraw/zinc/66/53/61/1060665361.db2.gz VSUPYEFXNMBVGX-OWLYRPNTSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CC[C@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147657 1060665372 /nfs/dbraw/zinc/66/53/72/1060665372.db2.gz VSUPYEFXNMBVGX-OWLYRPNTSA-N 2 1 338.417 4.120 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Br)cc1 ZINC000036991668 522811901 /nfs/dbraw/zinc/81/19/01/522811901.db2.gz LVSRREZYZJLHHH-NPYXIHBLSA-N 2 1 337.305 4.115 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2cccc(F)c2)CC[N@@H+]1C ZINC000532226297 1032105504 /nfs/dbraw/zinc/10/55/04/1032105504.db2.gz WFIQHIDZCUJWOM-QAPCUYQASA-N 2 1 328.431 4.190 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2cccc(F)c2)CC[N@H+]1C ZINC000532226297 1032105513 /nfs/dbraw/zinc/10/55/13/1032105513.db2.gz WFIQHIDZCUJWOM-QAPCUYQASA-N 2 1 328.431 4.190 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)C1 ZINC000532226718 1032105713 /nfs/dbraw/zinc/10/57/13/1032105713.db2.gz PIFNCDIYBBQZQN-WFASDCNBSA-N 2 1 343.298 4.139 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)C1 ZINC000532226718 1032105720 /nfs/dbraw/zinc/10/57/20/1032105720.db2.gz PIFNCDIYBBQZQN-WFASDCNBSA-N 2 1 343.298 4.139 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@@H]3C)s2)cc1 ZINC000532249379 1032110157 /nfs/dbraw/zinc/11/01/57/1032110157.db2.gz WYXNNSZKMKCTEY-QMTMVMCOSA-N 2 1 344.524 4.242 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]CC2Cc3ccccc3C2)[C@H]1c1cccs1 ZINC000514697957 1032419761 /nfs/dbraw/zinc/41/97/61/1032419761.db2.gz VIKVHLRRXBLMLW-FPOVZHCZSA-N 2 1 340.536 4.136 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]CC2Cc3ccccc3C2)[C@H]1c1cccs1 ZINC000514697957 1032419766 /nfs/dbraw/zinc/41/97/66/1032419766.db2.gz VIKVHLRRXBLMLW-FPOVZHCZSA-N 2 1 340.536 4.136 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1CC(F)(F)C1 ZINC000529549930 1032438466 /nfs/dbraw/zinc/43/84/66/1032438466.db2.gz OJAXJPYMDXNLIB-OAHLLOKOSA-N 2 1 348.437 4.435 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556104 1032452345 /nfs/dbraw/zinc/45/23/45/1032452345.db2.gz JTQAXXBMAOOBNC-YJBOKZPZSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556104 1032452350 /nfs/dbraw/zinc/45/23/50/1032452350.db2.gz JTQAXXBMAOOBNC-YJBOKZPZSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1CCCCC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000760156861 1032464354 /nfs/dbraw/zinc/46/43/54/1032464354.db2.gz AJQRKSVLTSBYLV-LBPRGKRZSA-N 2 1 330.303 4.102 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)C1 ZINC000760161688 1032484594 /nfs/dbraw/zinc/48/45/94/1032484594.db2.gz ZDVFOMBJNWWUQH-CHWSQXEVSA-N 2 1 344.330 4.347 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000683108321 1018836042 /nfs/dbraw/zinc/83/60/42/1018836042.db2.gz BPQXJIZNJGCTKU-AQNXPRMDSA-N 2 1 332.557 4.018 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCCO2 ZINC000643545990 1018897541 /nfs/dbraw/zinc/89/75/41/1018897541.db2.gz GTQXRXWZMPNLSA-WMLDXEAASA-N 2 1 334.891 4.126 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)oc21 ZINC000643547885 1018929300 /nfs/dbraw/zinc/92/93/00/1018929300.db2.gz KGTZSWXJQMKMJK-HOCLYGCPSA-N 2 1 328.456 4.157 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CC2 ZINC000643548721 1018934885 /nfs/dbraw/zinc/93/48/85/1018934885.db2.gz UGEKDKYELZGSIK-UKRRQHHQSA-N 2 1 325.283 4.245 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)o1 ZINC000432790113 1032804446 /nfs/dbraw/zinc/80/44/46/1032804446.db2.gz VOKBCCADUUVOQI-INIZCTEOSA-N 2 1 330.447 4.310 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)o1 ZINC000432790113 1032804448 /nfs/dbraw/zinc/80/44/48/1032804448.db2.gz VOKBCCADUUVOQI-INIZCTEOSA-N 2 1 330.447 4.310 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1)C[NH+](C)C ZINC000312443913 1019090771 /nfs/dbraw/zinc/09/07/71/1019090771.db2.gz CKIDJDLFEHGRHS-NEPJUHHUSA-N 2 1 339.277 4.044 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)cn1 ZINC000274794981 1019566894 /nfs/dbraw/zinc/56/68/94/1019566894.db2.gz SSUVZQWOUATOLP-BQFCYCMXSA-N 2 1 343.902 4.296 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)cn1 ZINC000274794981 1019566909 /nfs/dbraw/zinc/56/69/09/1019566909.db2.gz SSUVZQWOUATOLP-BQFCYCMXSA-N 2 1 343.902 4.296 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccc(Cl)cn1 ZINC000274928807 1019867899 /nfs/dbraw/zinc/86/78/99/1019867899.db2.gz QKRPMVDXCBDSCF-OAHLLOKOSA-N 2 1 331.891 4.426 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@](C)(c2ccccc2)CC1 ZINC000510139031 1019875706 /nfs/dbraw/zinc/87/57/06/1019875706.db2.gz HDZKAJRRQIHUTK-NRFANRHFSA-N 2 1 325.500 4.416 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@](C)(c2ccccc2)CC1 ZINC000510139031 1019875707 /nfs/dbraw/zinc/87/57/07/1019875707.db2.gz HDZKAJRRQIHUTK-NRFANRHFSA-N 2 1 325.500 4.416 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(OC)cc2)C1 ZINC000180206631 1020078690 /nfs/dbraw/zinc/07/86/90/1020078690.db2.gz LNQZOYFYNILALM-AVRDEDQJSA-N 2 1 338.495 4.106 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(OC)cc2)C1 ZINC000180206631 1020078698 /nfs/dbraw/zinc/07/86/98/1020078698.db2.gz LNQZOYFYNILALM-AVRDEDQJSA-N 2 1 338.495 4.106 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cccc3c[nH]nc32)CC1)CC(C)C ZINC000579887179 1020327854 /nfs/dbraw/zinc/32/78/54/1020327854.db2.gz QWGSXOFLEDZORE-UHFFFAOYSA-N 2 1 342.531 4.143 20 0 EIADMP CN(c1ccccc1)c1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000683357891 1020380234 /nfs/dbraw/zinc/38/02/34/1020380234.db2.gz PIPBENXUWPYRGY-HXUWFJFHSA-N 2 1 337.511 4.371 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2nc3ccccc3s2)CC1 ZINC000510223424 1020501434 /nfs/dbraw/zinc/50/14/34/1020501434.db2.gz PWVXUQVPZCSPGF-UHFFFAOYSA-N 2 1 331.529 4.240 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]Cc3cccc4cccnc43)CC2)cc1 ZINC000236736782 1020649939 /nfs/dbraw/zinc/64/99/39/1020649939.db2.gz OFVLHDDMJSAKGI-UHFFFAOYSA-N 2 1 345.490 4.032 20 0 EIADMP C[NH+]1CCC(Oc2ccc(Nc3ccc4c[nH+]ccc4c3)cc2)CC1 ZINC001210047971 1020783799 /nfs/dbraw/zinc/78/37/99/1020783799.db2.gz BXEZUBLARYPNDD-UHFFFAOYSA-N 2 1 333.435 4.451 20 0 EIADMP C[C@@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000655710805 1020909134 /nfs/dbraw/zinc/90/91/34/1020909134.db2.gz FSTUBCMALRSBBL-XAOHYQHJSA-N 2 1 330.541 4.056 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]CCCC[N@H+](C)C3CC3)s2)cc1C ZINC000655792599 1020965318 /nfs/dbraw/zinc/96/53/18/1020965318.db2.gz MIOQNPSUGBCKRD-UHFFFAOYSA-N 2 1 343.540 4.391 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000538116110 1021006103 /nfs/dbraw/zinc/00/61/03/1021006103.db2.gz DZHWNKNFWBEJFP-IEBWSBKVSA-N 2 1 328.525 4.099 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)[C@@H]1CCCCO1 ZINC000655847157 1021012474 /nfs/dbraw/zinc/01/24/74/1021012474.db2.gz RLQTXFOCKCXWMK-HKBOAZHASA-N 2 1 342.527 4.121 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)[C@@H]1CCCCO1 ZINC000655847157 1021012476 /nfs/dbraw/zinc/01/24/76/1021012476.db2.gz RLQTXFOCKCXWMK-HKBOAZHASA-N 2 1 342.527 4.121 20 0 EIADMP C(C[NH+]1CCCCC1)C[N@@H+]1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000161645674 1021614747 /nfs/dbraw/zinc/61/47/47/1021614747.db2.gz OSSNUBVSBSKOHX-KRWDZBQOSA-N 2 1 347.572 4.077 20 0 EIADMP C(C[NH+]1CCCCC1)C[N@H+]1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000161645674 1021614761 /nfs/dbraw/zinc/61/47/61/1021614761.db2.gz OSSNUBVSBSKOHX-KRWDZBQOSA-N 2 1 347.572 4.077 20 0 EIADMP C[C@H](c1cccnc1)[NH+](C)CCCCC[N@H+](C)[C@H](C)c1cccnc1 ZINC000245537621 1033008394 /nfs/dbraw/zinc/00/83/94/1033008394.db2.gz MICZDEPOUZNDIT-RTBURBONSA-N 2 1 340.515 4.333 20 0 EIADMP CC[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccccc1OC(F)F ZINC000414172929 1022028859 /nfs/dbraw/zinc/02/88/59/1022028859.db2.gz FUCDELJDGFKITB-GDBMZVCRSA-N 2 1 326.431 4.061 20 0 EIADMP Cc1ccc(OCCC[NH+]2CCC([NH+]3CCCCC3)CC2)cc1C ZINC000613455480 1022055546 /nfs/dbraw/zinc/05/55/46/1022055546.db2.gz VXSAUGLJQAOVQE-UHFFFAOYSA-N 2 1 330.516 4.023 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000414202822 1022123563 /nfs/dbraw/zinc/12/35/63/1022123563.db2.gz ZGTPHSNWUGHIHE-CABCVRRESA-N 2 1 344.421 4.010 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)cnc1F ZINC000892574871 1022263408 /nfs/dbraw/zinc/26/34/08/1022263408.db2.gz OTAJSXGKRIWZPV-MRXNPFEDSA-N 2 1 341.474 4.051 20 0 EIADMP COc1cc(Cl)c(CN2CCC(c3[nH]cc[nH+]3)CC2)cc1Cl ZINC000271216071 1022302160 /nfs/dbraw/zinc/30/21/60/1022302160.db2.gz XOLPBOOPRBSBLT-UHFFFAOYSA-N 2 1 340.254 4.105 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CCCC23CCOCC3)C1 ZINC001167424093 1022314956 /nfs/dbraw/zinc/31/49/56/1022314956.db2.gz AXNRWPIMZJTFCO-NJYVYQBISA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@@H]2CCCC23CCOCC3)C1 ZINC001167424093 1022314970 /nfs/dbraw/zinc/31/49/70/1022314970.db2.gz AXNRWPIMZJTFCO-NJYVYQBISA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@@H]2CCCC23CCOCC3)C1 ZINC001167424093 1022314987 /nfs/dbraw/zinc/31/49/87/1022314987.db2.gz AXNRWPIMZJTFCO-NJYVYQBISA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424514 1022318035 /nfs/dbraw/zinc/31/80/35/1022318035.db2.gz KUTWADINFHPBPO-QRVBRYPASA-N 2 1 336.564 4.167 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424514 1022318054 /nfs/dbraw/zinc/31/80/54/1022318054.db2.gz KUTWADINFHPBPO-QRVBRYPASA-N 2 1 336.564 4.167 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424514 1022318072 /nfs/dbraw/zinc/31/80/72/1022318072.db2.gz KUTWADINFHPBPO-QRVBRYPASA-N 2 1 336.564 4.167 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CC[C@H]2CC2(Cl)Cl)C1 ZINC001167426422 1022325063 /nfs/dbraw/zinc/32/50/63/1022325063.db2.gz WTHVXJBNNBZTRA-OAGGEKHMSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CC[C@H]2CC2(Cl)Cl)C1 ZINC001167426422 1022325079 /nfs/dbraw/zinc/32/50/79/1022325079.db2.gz WTHVXJBNNBZTRA-OAGGEKHMSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CC[C@H]2CC2(Cl)Cl)C1 ZINC001167426422 1022325092 /nfs/dbraw/zinc/32/50/92/1022325092.db2.gz WTHVXJBNNBZTRA-OAGGEKHMSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CC[C@H]2CC2(Cl)Cl)C1 ZINC001167426422 1022325109 /nfs/dbraw/zinc/32/51/09/1022325109.db2.gz WTHVXJBNNBZTRA-OAGGEKHMSA-N 2 1 333.347 4.157 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+][C@H](c2ccc(F)cc2)c2cccnc2)cc1 ZINC000106471289 1022443419 /nfs/dbraw/zinc/44/34/19/1022443419.db2.gz GMGPZPXXWMAGSU-JOCHJYFZSA-N 2 1 349.453 4.162 20 0 EIADMP COc1ccc([C@H]([NH2+]C[C@@H](C)Cn2cc[nH+]c2C)c2ccccc2)cc1 ZINC000180442174 1022491374 /nfs/dbraw/zinc/49/13/74/1022491374.db2.gz PCHXJTOOBZSSSB-VGOFRKELSA-N 2 1 349.478 4.215 20 0 EIADMP CC(C)(C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccnc1 ZINC000414324209 1022543053 /nfs/dbraw/zinc/54/30/53/1022543053.db2.gz BCNMWZZGNNLELM-KOUNCHBCSA-N 2 1 349.522 4.144 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000414341004 1022638895 /nfs/dbraw/zinc/63/88/95/1022638895.db2.gz UVOJFHIYIOSJRB-GHTZIAJQSA-N 2 1 337.511 4.002 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000414341004 1022638926 /nfs/dbraw/zinc/63/89/26/1022638926.db2.gz UVOJFHIYIOSJRB-GHTZIAJQSA-N 2 1 337.511 4.002 20 0 EIADMP C[C@@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC2(C[C@H]2C[N@@H+](C)C2CC2)CC1 ZINC000378354968 1022739898 /nfs/dbraw/zinc/73/98/98/1022739898.db2.gz MCWWHHIHHORZPY-HOTGVXAUSA-N 2 1 345.531 4.229 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@H+](C)[C@@H]1c1cccs1)c1cccnc1 ZINC000363863287 1022866486 /nfs/dbraw/zinc/86/64/86/1022866486.db2.gz KJAFPAAPZLAYFW-AOIWGVFYSA-N 2 1 329.513 4.267 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@@H]1c1cccs1)c1cccnc1 ZINC000363863287 1022866487 /nfs/dbraw/zinc/86/64/87/1022866487.db2.gz KJAFPAAPZLAYFW-AOIWGVFYSA-N 2 1 329.513 4.267 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cccnc2Cl)cc1 ZINC000163563863 1022894016 /nfs/dbraw/zinc/89/40/16/1022894016.db2.gz AUBCNHJDXRDUEU-HNNXBMFYSA-N 2 1 331.891 4.428 20 0 EIADMP COc1cc(Cl)c(C[N@H+](C)CCCn2cc[nH+]c2C)cc1Cl ZINC000349416786 1023206693 /nfs/dbraw/zinc/20/66/93/1023206693.db2.gz LUHRWXHVIRAALE-UHFFFAOYSA-N 2 1 342.270 4.029 20 0 EIADMP COc1cc(Cl)c(C[N@@H+](C)CCCn2cc[nH+]c2C)cc1Cl ZINC000349416786 1023206707 /nfs/dbraw/zinc/20/67/07/1023206707.db2.gz LUHRWXHVIRAALE-UHFFFAOYSA-N 2 1 342.270 4.029 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000584819128 1023346006 /nfs/dbraw/zinc/34/60/06/1023346006.db2.gz DWIHZDUNRLXAJE-WIYYLYMNSA-N 2 1 326.459 4.041 20 0 EIADMP COc1cccc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1Cl ZINC000660256992 1023393197 /nfs/dbraw/zinc/39/31/97/1023393197.db2.gz PJCOXNNWJCHXKI-HOCLYGCPSA-N 2 1 336.907 4.091 20 0 EIADMP COc1cccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1Cl ZINC000660256992 1023393208 /nfs/dbraw/zinc/39/32/08/1023393208.db2.gz PJCOXNNWJCHXKI-HOCLYGCPSA-N 2 1 336.907 4.091 20 0 EIADMP C[C@H](NCc1nsc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000660258049 1023394461 /nfs/dbraw/zinc/39/44/61/1023394461.db2.gz YVVYQIVNLLVQSE-LSDHHAIUSA-N 2 1 329.513 4.039 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(Br)cc2C)CC1 ZINC000510435170 1023398175 /nfs/dbraw/zinc/39/81/75/1023398175.db2.gz JCDMRFKTOACPKU-UHFFFAOYSA-N 2 1 339.321 4.064 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)s2)cc1 ZINC000415038596 1023404272 /nfs/dbraw/zinc/40/42/72/1023404272.db2.gz IABAIWHEXITKRM-IEBWSBKVSA-N 2 1 341.524 4.083 20 0 EIADMP CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001167473935 1023426232 /nfs/dbraw/zinc/42/62/32/1023426232.db2.gz NOZIBWOICQMNIT-LEWJYISDSA-N 2 1 344.543 4.308 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415083344 1023432478 /nfs/dbraw/zinc/43/24/78/1023432478.db2.gz NCWXBOMBWCRSTK-RYGJVYDSSA-N 2 1 326.871 4.410 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccncc2Cl)CC1 ZINC000473038017 1023443936 /nfs/dbraw/zinc/44/39/36/1023443936.db2.gz XCTQOAPJHKDIRS-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccncc2Cl)CC1 ZINC000473038017 1023443943 /nfs/dbraw/zinc/44/39/43/1023443943.db2.gz XCTQOAPJHKDIRS-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Br)c(C)c2)C[C@@H]1C ZINC000500088699 1023494159 /nfs/dbraw/zinc/49/41/59/1023494159.db2.gz FQDAPNMFPWXYDZ-GOEBONIOSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Br)c(C)c2)C[C@@H]1C ZINC000500088699 1023494165 /nfs/dbraw/zinc/49/41/65/1023494165.db2.gz FQDAPNMFPWXYDZ-GOEBONIOSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Br)c(C)c2)C[C@@H]1C ZINC000500088699 1023494168 /nfs/dbraw/zinc/49/41/68/1023494168.db2.gz FQDAPNMFPWXYDZ-GOEBONIOSA-N 2 1 339.321 4.062 20 0 EIADMP Cc1oc(-c2cccs2)nc1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000377401413 1023511100 /nfs/dbraw/zinc/51/11/00/1023511100.db2.gz OKJBGTMRTVQPOI-UHFFFAOYSA-N 2 1 345.512 4.019 20 0 EIADMP c1nc(C2CCCC2)sc1C[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656782686 1023517859 /nfs/dbraw/zinc/51/78/59/1023517859.db2.gz ILSXHWJFFWQFLA-KRWDZBQOSA-N 2 1 333.545 4.012 20 0 EIADMP c1csc(-c2nc(C[N@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cs2)c1 ZINC000656783983 1023529398 /nfs/dbraw/zinc/52/93/98/1023529398.db2.gz BYPICGGRUOXIQK-HNNXBMFYSA-N 2 1 347.553 4.083 20 0 EIADMP FC1(F)CC[C@@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000564958703 1023531256 /nfs/dbraw/zinc/53/12/56/1023531256.db2.gz JJCVEJLPBFZFRX-QZTJIDSGSA-N 2 1 334.454 4.209 20 0 EIADMP FC1(F)CC[C@@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000564958703 1023531267 /nfs/dbraw/zinc/53/12/67/1023531267.db2.gz JJCVEJLPBFZFRX-QZTJIDSGSA-N 2 1 334.454 4.209 20 0 EIADMP FC1(F)CC[C@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000564958704 1023531724 /nfs/dbraw/zinc/53/17/24/1023531724.db2.gz JJCVEJLPBFZFRX-ROUUACIJSA-N 2 1 334.454 4.209 20 0 EIADMP FC1(F)CC[C@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000564958704 1023531729 /nfs/dbraw/zinc/53/17/29/1023531729.db2.gz JJCVEJLPBFZFRX-ROUUACIJSA-N 2 1 334.454 4.209 20 0 EIADMP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)C1 ZINC000684369841 1023540161 /nfs/dbraw/zinc/54/01/61/1023540161.db2.gz BYKOLPKQRJCXQU-JRGCBEDISA-N 2 1 330.516 4.108 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000394556586 1023606873 /nfs/dbraw/zinc/60/68/73/1023606873.db2.gz IXSPKLHYOKXVBD-QXAKKESOSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCNc1ccc(F)c(C[NH+]2CCCC2)c1 ZINC001167753035 1023629282 /nfs/dbraw/zinc/62/92/82/1023629282.db2.gz AWGDZHPKNVOKFZ-KRWDZBQOSA-N 2 1 333.495 4.098 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC000398017872 1023643368 /nfs/dbraw/zinc/64/33/68/1023643368.db2.gz IIXQUYISKOXQAP-JPYJTQIMSA-N 2 1 334.507 4.176 20 0 EIADMP COc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000390543211 1023660601 /nfs/dbraw/zinc/66/06/01/1023660601.db2.gz HTSYRMKGUREAPE-OAQYLSRUSA-N 2 1 338.495 4.086 20 0 EIADMP COc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000390543211 1023660604 /nfs/dbraw/zinc/66/06/04/1023660604.db2.gz HTSYRMKGUREAPE-OAQYLSRUSA-N 2 1 338.495 4.086 20 0 EIADMP COc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)cc1 ZINC000390546860 1023664929 /nfs/dbraw/zinc/66/49/29/1023664929.db2.gz IUKDYHSZWUJEPA-OAQYLSRUSA-N 2 1 338.495 4.086 20 0 EIADMP COc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)cc1 ZINC000390546860 1023664934 /nfs/dbraw/zinc/66/49/34/1023664934.db2.gz IUKDYHSZWUJEPA-OAQYLSRUSA-N 2 1 338.495 4.086 20 0 EIADMP CC(C)=CCC[C@@H](C)CC[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000377705707 1023699250 /nfs/dbraw/zinc/69/92/50/1023699250.db2.gz XUIFIVFLNYDGDL-IZCSPVGOSA-N 2 1 347.591 4.002 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000390625717 1023735630 /nfs/dbraw/zinc/73/56/30/1023735630.db2.gz HXFSLUXDESUTEZ-FKBYEOEOSA-N 2 1 349.522 4.022 20 0 EIADMP COc1ccc(F)c(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1 ZINC000549760774 1033158114 /nfs/dbraw/zinc/15/81/14/1033158114.db2.gz BROPSHVLSSPLIX-LIRRHRJNSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(F)c(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000549760774 1033158121 /nfs/dbraw/zinc/15/81/21/1033158121.db2.gz BROPSHVLSSPLIX-LIRRHRJNSA-N 2 1 348.487 4.069 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@H](CCCc1ccccc1)c1ccccc1 ZINC000471763864 1023818657 /nfs/dbraw/zinc/81/86/57/1023818657.db2.gz XTXFGUUBAVCISG-JOCHJYFZSA-N 2 1 333.479 4.316 20 0 EIADMP COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]CCc1c[nH+]cn1C ZINC000471765847 1023820207 /nfs/dbraw/zinc/82/02/07/1023820207.db2.gz DAFVKQYYPYCZPD-KRWDZBQOSA-N 2 1 335.879 4.002 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000500426892 1023822135 /nfs/dbraw/zinc/82/21/35/1023822135.db2.gz HEAJOVMDEXPFDW-SVFBPWRDSA-N 2 1 329.532 4.065 20 0 EIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@H](c2cccc(C)c2)c2cccc(F)c2)C1 ZINC000510648504 1024167346 /nfs/dbraw/zinc/16/73/46/1024167346.db2.gz FRPFRSDQCJQREI-DYESRHJHSA-N 2 1 326.459 4.155 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2cccc(C)c2)c2cccc(F)c2)C1 ZINC000510648504 1024167362 /nfs/dbraw/zinc/16/73/62/1024167362.db2.gz FRPFRSDQCJQREI-DYESRHJHSA-N 2 1 326.459 4.155 20 0 EIADMP Cc1cccc([C@H]([NH2+][C@@H]2CCN(C)[C@@H](C)C2)c2cccc(F)c2)c1 ZINC000510736761 1024380016 /nfs/dbraw/zinc/38/00/16/1024380016.db2.gz RFGWTPIKFYZAIN-DQLDELGASA-N 2 1 326.459 4.296 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)c1cncs1 ZINC000164500884 1024464594 /nfs/dbraw/zinc/46/45/94/1024464594.db2.gz CPDDZYTXPJIGSV-OAHLLOKOSA-N 2 1 341.480 4.219 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccccc1Br ZINC000164612290 1024706542 /nfs/dbraw/zinc/70/65/42/1024706542.db2.gz TYRXJVSZWVAGRX-CYBMUJFWSA-N 2 1 336.277 4.085 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000348835693 1024722848 /nfs/dbraw/zinc/72/28/48/1024722848.db2.gz AVRCSSOZFISROU-IIBYNOLFSA-N 2 1 332.451 4.159 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCSc2ccc(Cl)cc21 ZINC000164635705 1024739575 /nfs/dbraw/zinc/73/95/75/1024739575.db2.gz FMDKUABYVNPJCB-INIZCTEOSA-N 2 1 335.904 4.452 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000092165695 1024747640 /nfs/dbraw/zinc/74/76/40/1024747640.db2.gz LJXVWYCJGPQBOV-UHFFFAOYSA-N 2 1 346.906 4.036 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000092165695 1024747669 /nfs/dbraw/zinc/74/76/69/1024747669.db2.gz LJXVWYCJGPQBOV-UHFFFAOYSA-N 2 1 346.906 4.036 20 0 EIADMP C[N@@H+](CCCCC(F)(F)F)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092821308 1024813016 /nfs/dbraw/zinc/81/30/16/1024813016.db2.gz IBSOIHHCVMADAT-UHFFFAOYSA-N 2 1 343.437 4.353 20 0 EIADMP COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]CCn1cc[nH+]c1C ZINC000341844764 1024818230 /nfs/dbraw/zinc/81/82/30/1024818230.db2.gz DOAVXNDGSLXAQE-KRWDZBQOSA-N 2 1 335.879 4.231 20 0 EIADMP COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]CCn1cc[nH+]c1C ZINC000341844765 1024818650 /nfs/dbraw/zinc/81/86/50/1024818650.db2.gz DOAVXNDGSLXAQE-QGZVFWFLSA-N 2 1 335.879 4.231 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000548482335 1024826441 /nfs/dbraw/zinc/82/64/41/1024826441.db2.gz GDXCIRCCZXLUCZ-CUWPLCDZSA-N 2 1 340.511 4.409 20 0 EIADMP Cc1[nH+]c(N)ccc1CNc1ccc2c(c1)C[N@@H+](Cc1ccccc1)C2 ZINC001167786945 1024848201 /nfs/dbraw/zinc/84/82/01/1024848201.db2.gz LJHMCHIGQYEMLK-UHFFFAOYSA-N 2 1 344.462 4.100 20 0 EIADMP Cc1[nH+]c(N)ccc1CNc1ccc2c(c1)C[N@H+](Cc1ccccc1)C2 ZINC001167786945 1024848202 /nfs/dbraw/zinc/84/82/02/1024848202.db2.gz LJHMCHIGQYEMLK-UHFFFAOYSA-N 2 1 344.462 4.100 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC3c4ccccc4C2c2ccccc23)CC[N@H+]1C ZINC000246937136 1024864309 /nfs/dbraw/zinc/86/43/09/1024864309.db2.gz HKSRUBZRQXHUFG-JRHJTHGVSA-N 2 1 346.518 4.356 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccnc4ccccc34)C2)CC1 ZINC000535826696 1025074861 /nfs/dbraw/zinc/07/48/61/1025074861.db2.gz SCZQCVQVWPAHFG-IBGZPJMESA-N 2 1 337.511 4.179 20 0 EIADMP c1cncc([C@H]([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)C2CCCCC2)c1 ZINC000663467014 1025402070 /nfs/dbraw/zinc/40/20/70/1025402070.db2.gz YZWZURYEBFPYEW-DENIHFKCSA-N 2 1 341.543 4.415 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cnc2ccsc2c1 ZINC000663470613 1025418815 /nfs/dbraw/zinc/41/88/15/1025418815.db2.gz VMOQNMWCNJMMKX-GDBMZVCRSA-N 2 1 329.513 4.069 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000663478479 1025467013 /nfs/dbraw/zinc/46/70/13/1025467013.db2.gz RENAFAOTWRLTKD-DOTOQJQBSA-N 2 1 342.449 4.465 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2cc(O)cc(F)c2)cc1 ZINC000472040312 1025474236 /nfs/dbraw/zinc/47/42/36/1025474236.db2.gz BUNXJUUZQJURKL-INIZCTEOSA-N 2 1 342.458 4.196 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(Cl)c(Cl)c1 ZINC000925781073 1025530942 /nfs/dbraw/zinc/53/09/42/1025530942.db2.gz WLUMVVCSIFQRPF-BXUZGUMPSA-N 2 1 337.241 4.279 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1c1ccc(OC)c(OC)c1 ZINC001167825467 1025605344 /nfs/dbraw/zinc/60/53/44/1025605344.db2.gz JHQOVICCIUBRFH-PKOBYXMFSA-N 2 1 348.531 4.351 20 0 EIADMP CCc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cn1 ZINC000512047151 1025843861 /nfs/dbraw/zinc/84/38/61/1025843861.db2.gz XRMRDKQSQYBOHP-UYAOXDASSA-N 2 1 337.511 4.034 20 0 EIADMP CC[C@H](C)Oc1cc(C[N@@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)ccc1OC ZINC000130479214 1025872738 /nfs/dbraw/zinc/87/27/38/1025872738.db2.gz UAWIULJMYFJLLA-JENIJYKNSA-N 2 1 348.531 4.035 20 0 EIADMP CC[C@H](C)Oc1cc(C[NH+](C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)ccc1OC ZINC000130479214 1025872753 /nfs/dbraw/zinc/87/27/53/1025872753.db2.gz UAWIULJMYFJLLA-JENIJYKNSA-N 2 1 348.531 4.035 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1cncs1 ZINC000157630049 1025889984 /nfs/dbraw/zinc/88/99/84/1025889984.db2.gz IUSUXLSPIFRHLC-HOTGVXAUSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1cncs1 ZINC000157630049 1025889987 /nfs/dbraw/zinc/88/99/87/1025889987.db2.gz IUSUXLSPIFRHLC-HOTGVXAUSA-N 2 1 329.513 4.226 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCOC[C@H]1c1ccccc1Cl ZINC001167842032 1025892829 /nfs/dbraw/zinc/89/28/29/1025892829.db2.gz WAVKUBISTMJBRW-LPHOPBHVSA-N 2 1 338.923 4.224 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCOC[C@H]1c1ccccc1Cl ZINC001167842032 1025892835 /nfs/dbraw/zinc/89/28/35/1025892835.db2.gz WAVKUBISTMJBRW-LPHOPBHVSA-N 2 1 338.923 4.224 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1cnn(C)c1 ZINC000157653428 1025906787 /nfs/dbraw/zinc/90/67/87/1025906787.db2.gz WXIFTLYPYRJPKO-UWJYYQICSA-N 2 1 340.515 4.035 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000431333172 1025923780 /nfs/dbraw/zinc/92/37/80/1025923780.db2.gz MWJLVVBLPPQEQJ-DYESRHJHSA-N 2 1 342.527 4.099 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167968912 1025936594 /nfs/dbraw/zinc/93/65/94/1025936594.db2.gz WSJOZLHANZAXER-VHRCFOOQSA-N 2 1 339.527 4.000 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(F)c(F)c2F)c1 ZINC000657315499 1026013446 /nfs/dbraw/zinc/01/34/46/1026013446.db2.gz VEPGZSCVTNYJJQ-UHFFFAOYSA-N 2 1 336.401 4.236 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ccc(F)cc32)c1 ZINC000344181386 1026099586 /nfs/dbraw/zinc/09/95/86/1026099586.db2.gz ZJFRTRFIFWEDLM-NRFANRHFSA-N 2 1 326.459 4.445 20 0 EIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)cc(C)c1O ZINC000582089683 1026116432 /nfs/dbraw/zinc/11/64/32/1026116432.db2.gz QUHZQEVTWLRUNR-MJGOQNOKSA-N 2 1 344.524 4.243 20 0 EIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cc(C)c1O ZINC000582089683 1026116441 /nfs/dbraw/zinc/11/64/41/1026116441.db2.gz QUHZQEVTWLRUNR-MJGOQNOKSA-N 2 1 344.524 4.243 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000657334366 1026152361 /nfs/dbraw/zinc/15/23/61/1026152361.db2.gz XGBGJUOBRMKBCN-UHFFFAOYSA-N 2 1 341.524 4.225 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000511075249 1026188767 /nfs/dbraw/zinc/18/87/67/1026188767.db2.gz RGDCFJQBNDXMSG-FXAWDEMLSA-N 2 1 336.470 4.423 20 0 EIADMP Cc1nc(-c2cc([C@@H](C)[NH2+]CC3=CC[N@@H+](C)CC3)cs2)cs1 ZINC000344291993 1026219848 /nfs/dbraw/zinc/21/98/48/1026219848.db2.gz NLUHAWMUNJNWLH-GFCCVEGCSA-N 2 1 333.526 4.093 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(C3CCC3)cc2)[C@@H](C)C1 ZINC000550138374 1026223266 /nfs/dbraw/zinc/22/32/66/1026223266.db2.gz DKRAVRWHUSBTAN-PGRDOPGGSA-N 2 1 344.543 4.181 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000344307601 1026230794 /nfs/dbraw/zinc/23/07/94/1026230794.db2.gz XEZLEJIGMYBFIN-HNNXBMFYSA-N 2 1 341.282 4.059 20 0 EIADMP CCC[C@@H](C)[C@@H](CC)[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000162759385 1026299407 /nfs/dbraw/zinc/29/94/07/1026299407.db2.gz LERHUGIPMOODAB-DNVCBOLYSA-N 2 1 335.536 4.308 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCSc2cc(C)c(C)cc21 ZINC000187160649 1026343509 /nfs/dbraw/zinc/34/35/09/1026343509.db2.gz BTLAWAKNEWQIJU-ACJLOTCBSA-N 2 1 329.513 4.271 20 0 EIADMP Clc1ncccc1[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CC1 ZINC001167978629 1026346724 /nfs/dbraw/zinc/34/67/24/1026346724.db2.gz PZIWEHXXOKDVMF-PHSGOXPASA-N 2 1 345.918 4.181 20 0 EIADMP Clc1ncccc1[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C1CC1 ZINC001167978629 1026346735 /nfs/dbraw/zinc/34/67/35/1026346735.db2.gz PZIWEHXXOKDVMF-PHSGOXPASA-N 2 1 345.918 4.181 20 0 EIADMP COc1ccc(C)cc1[C@@H](C)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000163485755 1026380958 /nfs/dbraw/zinc/38/09/58/1026380958.db2.gz KQYVGYLGOYLMDW-QGZVFWFLSA-N 2 1 339.483 4.027 20 0 EIADMP C[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CS1 ZINC000709726461 1026427046 /nfs/dbraw/zinc/42/70/46/1026427046.db2.gz MGPVRDJLBULYDN-BHIYHBOVSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CS1 ZINC000709726461 1026427054 /nfs/dbraw/zinc/42/70/54/1026427054.db2.gz MGPVRDJLBULYDN-BHIYHBOVSA-N 2 1 332.557 4.161 20 0 EIADMP CCC(CC)[N@@H+](CC(C)C)C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC001167562662 1026435389 /nfs/dbraw/zinc/43/53/89/1026435389.db2.gz OJUXEPQJLHZRJY-QFIPXVFZSA-N 2 1 346.559 4.424 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cccc3[nH]ccc32)C1 ZINC000512210345 1026470947 /nfs/dbraw/zinc/47/09/47/1026470947.db2.gz CRSIVWJQOHJUJC-ZWKOTPCHSA-N 2 1 325.500 4.254 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cccc3[nH]ccc32)C1 ZINC000512210345 1026470957 /nfs/dbraw/zinc/47/09/57/1026470957.db2.gz CRSIVWJQOHJUJC-ZWKOTPCHSA-N 2 1 325.500 4.254 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000512210345 1026470963 /nfs/dbraw/zinc/47/09/63/1026470963.db2.gz CRSIVWJQOHJUJC-ZWKOTPCHSA-N 2 1 325.500 4.254 20 0 EIADMP C[N@@H+](Cc1ccccc1NCc1cnc2n1CCC2)C1CCCCC1 ZINC000657404450 1026517153 /nfs/dbraw/zinc/51/71/53/1026517153.db2.gz HZMADVCKAMCTQG-UHFFFAOYSA-N 2 1 338.499 4.206 20 0 EIADMP C[N@H+](Cc1ccccc1NCc1c[nH+]c2n1CCC2)C1CCCCC1 ZINC000657404450 1026517162 /nfs/dbraw/zinc/51/71/62/1026517162.db2.gz HZMADVCKAMCTQG-UHFFFAOYSA-N 2 1 338.499 4.206 20 0 EIADMP C[N@@H+](Cc1ccccc1NCc1c[nH+]c2n1CCC2)C1CCCCC1 ZINC000657404450 1026517172 /nfs/dbraw/zinc/51/71/72/1026517172.db2.gz HZMADVCKAMCTQG-UHFFFAOYSA-N 2 1 338.499 4.206 20 0 EIADMP CO[C@H](CC(C)C)C[N@@H+](C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC001167571827 1026584917 /nfs/dbraw/zinc/58/49/17/1026584917.db2.gz BAVWZTYANQEMTE-HLAWJBBLSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001167571827 1026584925 /nfs/dbraw/zinc/58/49/25/1026584925.db2.gz BAVWZTYANQEMTE-HLAWJBBLSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001167571827 1026584936 /nfs/dbraw/zinc/58/49/36/1026584936.db2.gz BAVWZTYANQEMTE-HLAWJBBLSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001167571827 1026584945 /nfs/dbraw/zinc/58/49/45/1026584945.db2.gz BAVWZTYANQEMTE-HLAWJBBLSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001167571827 1026584953 /nfs/dbraw/zinc/58/49/53/1026584953.db2.gz BAVWZTYANQEMTE-HLAWJBBLSA-N 2 1 332.532 4.032 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2cc(F)cc(F)c2)CCN1Cc1ccccc1 ZINC001167573601 1026620567 /nfs/dbraw/zinc/62/05/67/1026620567.db2.gz WFFQYOZDPOICQI-IIBYNOLFSA-N 2 1 344.449 4.450 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cc(F)cc(F)c2)CCN1Cc1ccccc1 ZINC001167573601 1026620572 /nfs/dbraw/zinc/62/05/72/1026620572.db2.gz WFFQYOZDPOICQI-IIBYNOLFSA-N 2 1 344.449 4.450 20 0 EIADMP Cc1cccc2[nH]c(C[NH2+][C@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)cc21 ZINC000657428874 1026629458 /nfs/dbraw/zinc/62/94/58/1026629458.db2.gz CQLSRBFZCNQMFZ-SJORKVTESA-N 2 1 325.500 4.219 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657430656 1026645210 /nfs/dbraw/zinc/64/52/10/1026645210.db2.gz ULRYCYSNZXYOSA-DOTOQJQBSA-N 2 1 346.490 4.110 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000657430656 1026645217 /nfs/dbraw/zinc/64/52/17/1026645217.db2.gz ULRYCYSNZXYOSA-DOTOQJQBSA-N 2 1 346.490 4.110 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC(C)(c2nc3ccccc3s2)CC1 ZINC000511128567 1026658450 /nfs/dbraw/zinc/65/84/50/1026658450.db2.gz XLDQWOPHMLTJSY-INIZCTEOSA-N 2 1 343.540 4.134 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512330904 1026710581 /nfs/dbraw/zinc/71/05/81/1026710581.db2.gz VVLQVQPPLDAPRY-BZSNNMDCSA-N 2 1 330.516 4.389 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512330904 1026710592 /nfs/dbraw/zinc/71/05/92/1026710592.db2.gz VVLQVQPPLDAPRY-BZSNNMDCSA-N 2 1 330.516 4.389 20 0 EIADMP FC1CCC(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000647252644 1026720032 /nfs/dbraw/zinc/72/00/32/1026720032.db2.gz NFAUXAXBJYMVIZ-UUKMXZOPSA-N 2 1 330.491 4.302 20 0 EIADMP FC1CCC(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000647252644 1026720042 /nfs/dbraw/zinc/72/00/42/1026720042.db2.gz NFAUXAXBJYMVIZ-UUKMXZOPSA-N 2 1 330.491 4.302 20 0 EIADMP C[C@H](NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512333832 1026724308 /nfs/dbraw/zinc/72/43/08/1026724308.db2.gz XOSKDQZJOVRKRN-OALUTQOASA-N 2 1 347.591 4.026 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512333832 1026724318 /nfs/dbraw/zinc/72/43/18/1026724318.db2.gz XOSKDQZJOVRKRN-OALUTQOASA-N 3 1 347.591 4.026 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512333832 1026724332 /nfs/dbraw/zinc/72/43/32/1026724332.db2.gz XOSKDQZJOVRKRN-OALUTQOASA-N 3 1 347.591 4.026 20 0 EIADMP C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512333831 1026724797 /nfs/dbraw/zinc/72/47/97/1026724797.db2.gz XOSKDQZJOVRKRN-MOPGFXCFSA-N 2 1 347.591 4.026 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512333831 1026724810 /nfs/dbraw/zinc/72/48/10/1026724810.db2.gz XOSKDQZJOVRKRN-MOPGFXCFSA-N 3 1 347.591 4.026 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512333831 1026724821 /nfs/dbraw/zinc/72/48/21/1026724821.db2.gz XOSKDQZJOVRKRN-MOPGFXCFSA-N 3 1 347.591 4.026 20 0 EIADMP C[NH+](C)C[C@@]12C[C@@H]1C[N@@H+](CC(C)(C)Sc1ccc(Cl)cc1)C2 ZINC001207299782 1026731745 /nfs/dbraw/zinc/73/17/45/1026731745.db2.gz QASRDPQQXKGKHO-RDTXWAMCSA-N 2 1 338.948 4.094 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)CCOc2cc(Cl)cc(Cl)c2)CC1 ZINC001167585685 1026825079 /nfs/dbraw/zinc/82/50/79/1026825079.db2.gz ADWMZACGGXLGOS-UHFFFAOYSA-N 2 1 345.314 4.178 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)c(C)s1 ZINC000152819553 1026853078 /nfs/dbraw/zinc/85/30/78/1026853078.db2.gz LPDVUIBYWYMGTL-MRXNPFEDSA-N 2 1 343.540 4.118 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@@H]3CCCc4cccnc43)C2)c1 ZINC000684956484 1026890501 /nfs/dbraw/zinc/89/05/01/1026890501.db2.gz ZWYUICVBXZSXPD-QFBILLFUSA-N 2 1 341.524 4.022 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3CCCc4cccnc43)C2)c1 ZINC000684956484 1026890506 /nfs/dbraw/zinc/89/05/06/1026890506.db2.gz ZWYUICVBXZSXPD-QFBILLFUSA-N 2 1 341.524 4.022 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCCc3cccnc32)C[N@H+]1Cc1ccccc1 ZINC000684960973 1026899882 /nfs/dbraw/zinc/89/98/82/1026899882.db2.gz VVQREQUABORPIE-KAGYGMCKSA-N 2 1 349.522 4.349 20 0 EIADMP Cc1nccn1CCCCS[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000582666648 1026920441 /nfs/dbraw/zinc/92/04/41/1026920441.db2.gz XMZHRKWKBNMEPR-HXUWFJFHSA-N 2 1 343.540 4.370 20 0 EIADMP Cc1[nH+]ccn1CCCCS[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000582666648 1026920447 /nfs/dbraw/zinc/92/04/47/1026920447.db2.gz XMZHRKWKBNMEPR-HXUWFJFHSA-N 2 1 343.540 4.370 20 0 EIADMP Cc1[nH+]ccn1CCCCS[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000582666648 1026920454 /nfs/dbraw/zinc/92/04/54/1026920454.db2.gz XMZHRKWKBNMEPR-HXUWFJFHSA-N 2 1 343.540 4.370 20 0 EIADMP CN(CC1CCN(c2cc[nH+]cc2)CC1)c1cc[nH+]c2ccsc21 ZINC000301861820 1027117800 /nfs/dbraw/zinc/11/78/00/1027117800.db2.gz AKSSQKZJTCPDHE-UHFFFAOYSA-N 2 1 338.480 4.044 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)C1CCOCC1 ZINC000474483446 1027120715 /nfs/dbraw/zinc/12/07/15/1027120715.db2.gz AAALBMQDAJBZBG-CEXWTWQISA-N 2 1 344.543 4.069 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000164707815 1027162091 /nfs/dbraw/zinc/16/20/91/1027162091.db2.gz AOQZLLYWLKNWNG-CYBMUJFWSA-N 2 1 341.377 4.221 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCOC(C)(C)C)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168037719 1027271805 /nfs/dbraw/zinc/27/18/05/1027271805.db2.gz ZUQOWVGLFCCXOS-OPVJXMOQSA-N 2 1 332.532 4.223 20 0 EIADMP CS[C@@H]1CCCC[NH+](CC(C)C[N@@H+]2CCCC[C@@H](SC)C2)C1 ZINC000441136043 1027299171 /nfs/dbraw/zinc/29/91/71/1027299171.db2.gz UXTYYTNSAHFJQD-QZTJIDSGSA-N 2 1 344.634 4.058 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1ccccc1Br ZINC000342859627 1027327695 /nfs/dbraw/zinc/32/76/95/1027327695.db2.gz JXTKFOBPLPYJJA-CYBMUJFWSA-N 2 1 336.277 4.037 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1ccccc1Br ZINC000342859627 1027327717 /nfs/dbraw/zinc/32/77/17/1027327717.db2.gz JXTKFOBPLPYJJA-CYBMUJFWSA-N 2 1 336.277 4.037 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@@H](C(C)C)C3)CC2)oc1C ZINC000474717339 1027436914 /nfs/dbraw/zinc/43/69/14/1027436914.db2.gz AZYVLLBXUWWEFR-WOJBJXKFSA-N 2 1 347.547 4.308 20 0 EIADMP c1ccc2cc(CC[N@H+]3CC[C@H]4[C@H](CCCN4C4CC4)C3)ccc2c1 ZINC000441398268 1027519697 /nfs/dbraw/zinc/51/96/97/1027519697.db2.gz HDSPGEKHWRJJKG-GGAORHGYSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441398268 1027519712 /nfs/dbraw/zinc/51/97/12/1027519712.db2.gz HDSPGEKHWRJJKG-GGAORHGYSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441398268 1027519719 /nfs/dbraw/zinc/51/97/19/1027519719.db2.gz HDSPGEKHWRJJKG-GGAORHGYSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)ccc2c1 ZINC000441398268 1027519734 /nfs/dbraw/zinc/51/97/34/1027519734.db2.gz HDSPGEKHWRJJKG-GGAORHGYSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)ccc2c1 ZINC000441398268 1027519746 /nfs/dbraw/zinc/51/97/46/1027519746.db2.gz HDSPGEKHWRJJKG-GGAORHGYSA-N 2 1 334.507 4.331 20 0 EIADMP Cc1cc(C)cc(OCCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441400065 1027524226 /nfs/dbraw/zinc/52/42/26/1027524226.db2.gz ZAPWJDIBLAJDMK-UGKGYDQZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441400065 1027524244 /nfs/dbraw/zinc/52/42/44/1027524244.db2.gz ZAPWJDIBLAJDMK-UGKGYDQZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441400065 1027524260 /nfs/dbraw/zinc/52/42/60/1027524260.db2.gz ZAPWJDIBLAJDMK-UGKGYDQZSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000441400065 1027524278 /nfs/dbraw/zinc/52/42/78/1027524278.db2.gz ZAPWJDIBLAJDMK-UGKGYDQZSA-N 2 1 342.527 4.021 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000474818034 1027541274 /nfs/dbraw/zinc/54/12/74/1027541274.db2.gz RJOIYUWTFAWKDB-PBHICJAKSA-N 2 1 328.422 4.100 20 0 EIADMP Clc1cccc(OCCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441403227 1027541873 /nfs/dbraw/zinc/54/18/73/1027541873.db2.gz CERSPABZYFZHIX-OXQOHEQNSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441403227 1027541883 /nfs/dbraw/zinc/54/18/83/1027541883.db2.gz CERSPABZYFZHIX-OXQOHEQNSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441403227 1027541902 /nfs/dbraw/zinc/54/19/02/1027541902.db2.gz CERSPABZYFZHIX-OXQOHEQNSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000441403227 1027541915 /nfs/dbraw/zinc/54/19/15/1027541915.db2.gz CERSPABZYFZHIX-OXQOHEQNSA-N 2 1 348.918 4.058 20 0 EIADMP Oc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)C3(CC3)C1)CC2 ZINC000657695096 1027612137 /nfs/dbraw/zinc/61/21/37/1027612137.db2.gz ZIBDHOMYADSHSV-KNQAVFIVSA-N 2 1 348.490 4.166 20 0 EIADMP Oc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)C3(CC3)C1)CC2 ZINC000657695096 1027612160 /nfs/dbraw/zinc/61/21/60/1027612160.db2.gz ZIBDHOMYADSHSV-KNQAVFIVSA-N 2 1 348.490 4.166 20 0 EIADMP Fc1ccccc1[C@H]1CCC[N@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995701 1027799576 /nfs/dbraw/zinc/79/95/76/1027799576.db2.gz OKIOBKOBZDXGBS-PGGWPXBNSA-N 2 1 328.475 4.368 20 0 EIADMP CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cs1 ZINC000162277933 1027846920 /nfs/dbraw/zinc/84/69/20/1027846920.db2.gz BTLFIKJAQQSQFF-CABCVRRESA-N 2 1 347.528 4.058 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)s1 ZINC000162316955 1027860898 /nfs/dbraw/zinc/86/08/98/1027860898.db2.gz AHNVGYXFWBYVJF-CQSZACIVSA-N 2 1 344.528 4.037 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCc3cc(F)ccc32)cc1F ZINC000153686308 1027868451 /nfs/dbraw/zinc/86/84/51/1027868451.db2.gz QCKGUSGXVDPTRJ-IBGZPJMESA-N 2 1 339.389 4.236 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CCN(c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000125653733 1027881570 /nfs/dbraw/zinc/88/15/70/1027881570.db2.gz MADRLPMPTDQWFC-ZDUSSCGKSA-N 2 1 337.389 4.032 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2C[C@H]3[C@H](CC3(F)F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168044898 1027885253 /nfs/dbraw/zinc/88/52/53/1027885253.db2.gz HLNMXZKLZJFLDL-CGHHPOIWSA-N 2 1 334.454 4.015 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2C[C@H]3[C@H](CC3(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168044898 1027885260 /nfs/dbraw/zinc/88/52/60/1027885260.db2.gz HLNMXZKLZJFLDL-CGHHPOIWSA-N 2 1 334.454 4.015 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168044898 1027885265 /nfs/dbraw/zinc/88/52/65/1027885265.db2.gz HLNMXZKLZJFLDL-CGHHPOIWSA-N 2 1 334.454 4.015 20 0 EIADMP FC(F)(F)c1cccc([C@H]2CC[N@@H+](CCC[NH+]3CCCCC3)C2)c1 ZINC000444608392 1027887338 /nfs/dbraw/zinc/88/73/38/1027887338.db2.gz KZMSAEGABOJFSG-KRWDZBQOSA-N 2 1 340.433 4.371 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2cccc(F)c2)cc1F ZINC000153726054 1027894574 /nfs/dbraw/zinc/89/45/74/1027894574.db2.gz PKMNINBWJGJVTF-ZDUSSCGKSA-N 2 1 327.378 4.310 20 0 EIADMP c1cc(-c2ccc(C[N@@H+]3CC[C@H](C[NH+]4CCCC4)C3)cc2)cs1 ZINC000444650117 1027920406 /nfs/dbraw/zinc/92/04/06/1027920406.db2.gz CHXCNLDLOGDBCP-GOSISDBHSA-N 2 1 326.509 4.333 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CC[N@H+](C(C)C)C1 ZINC000548786338 1027932645 /nfs/dbraw/zinc/93/26/45/1027932645.db2.gz KJQZTKGRJGTALY-DDITZMBXSA-N 2 1 340.433 4.429 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000384022453 1027983822 /nfs/dbraw/zinc/98/38/22/1027983822.db2.gz KFFYVQVPZPUDFJ-HKUYNNGSSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188657866 1028015593 /nfs/dbraw/zinc/01/55/93/1028015593.db2.gz FWUYJXWUEOMHOY-KEYYUXOJSA-N 2 1 340.433 4.055 20 0 EIADMP c1ccc2cc(OCC[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000441455811 1028034782 /nfs/dbraw/zinc/03/47/82/1028034782.db2.gz ZTDNUHQHGAAUBR-LJQANCHMSA-N 2 1 338.495 4.026 20 0 EIADMP c1ccc2cc(OCC[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000441455811 1028034800 /nfs/dbraw/zinc/03/48/00/1028034800.db2.gz ZTDNUHQHGAAUBR-LJQANCHMSA-N 2 1 338.495 4.026 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](CCO)C2CCCCC2)cc1 ZINC000343093752 1028186728 /nfs/dbraw/zinc/18/67/28/1028186728.db2.gz BUCJIVBXPVYPJY-KKSFZXQISA-N 2 1 341.499 4.163 20 0 EIADMP CC[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@@H](C)c1ccc(F)cc1 ZINC000346142142 1028280152 /nfs/dbraw/zinc/28/01/52/1028280152.db2.gz ACBMKYVCDDNBAO-INIZCTEOSA-N 2 1 338.430 4.298 20 0 EIADMP FC1(F)CC[C@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000281080523 1028378448 /nfs/dbraw/zinc/37/84/48/1028378448.db2.gz JGEPWXACDHOWRX-OKYOBFRVSA-N 2 1 334.454 4.207 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)C[C@@H]3CCC(F)(F)C3)C2)s1 ZINC000583325120 1028517439 /nfs/dbraw/zinc/51/74/39/1028517439.db2.gz APPVRYBLUIIIQQ-HZPDHXFCSA-N 2 1 342.499 4.246 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)C[C@@H]3CCC(F)(F)C3)C2)s1 ZINC000583325120 1028517453 /nfs/dbraw/zinc/51/74/53/1028517453.db2.gz APPVRYBLUIIIQQ-HZPDHXFCSA-N 2 1 342.499 4.246 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)C[C@@H]3CCC(F)(F)C3)C2)s1 ZINC000583325120 1028517473 /nfs/dbraw/zinc/51/74/73/1028517473.db2.gz APPVRYBLUIIIQQ-HZPDHXFCSA-N 2 1 342.499 4.246 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC[N@H+]1C ZINC000443983777 1028692189 /nfs/dbraw/zinc/69/21/89/1028692189.db2.gz FXZFFQDJODLJKW-QAPCUYQASA-N 2 1 328.431 4.190 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)cc3cccnc32)CC1 ZINC000524156082 1028720625 /nfs/dbraw/zinc/72/06/25/1028720625.db2.gz HURAOPRYPBCFON-UHFFFAOYSA-N 2 1 345.918 4.440 20 0 EIADMP CC(=O)c1c(C)cc(C)c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1C ZINC000524156136 1028723574 /nfs/dbraw/zinc/72/35/74/1028723574.db2.gz MMOOAIKVDZFNPL-UHFFFAOYSA-N 2 1 344.543 4.367 20 0 EIADMP C[C@H](c1cccnc1)[N@@H+](C)CCCCC[NH+](C)[C@@H](C)c1cccnc1 ZINC000093234348 1028728803 /nfs/dbraw/zinc/72/88/03/1028728803.db2.gz MICZDEPOUZNDIT-KDURUIRLSA-N 2 1 340.515 4.333 20 0 EIADMP C[C@H](c1cccnc1)[NH+](C)CCCCC[N@H+](C)[C@@H](C)c1cccnc1 ZINC000093234348 1028728814 /nfs/dbraw/zinc/72/88/14/1028728814.db2.gz MICZDEPOUZNDIT-KDURUIRLSA-N 2 1 340.515 4.333 20 0 EIADMP C[C@H](c1cccnc1)[NH+](C)CCCCC[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000093234348 1028728833 /nfs/dbraw/zinc/72/88/33/1028728833.db2.gz MICZDEPOUZNDIT-KDURUIRLSA-N 2 1 340.515 4.333 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000324421128 1029010420 /nfs/dbraw/zinc/01/04/20/1029010420.db2.gz YMPDRXYVVBKHQT-KRWDZBQOSA-N 2 1 326.484 4.060 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444200766 1029072574 /nfs/dbraw/zinc/07/25/74/1029072574.db2.gz UESXPABGYIFMDL-CVEARBPZSA-N 2 1 338.442 4.157 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444200766 1029072588 /nfs/dbraw/zinc/07/25/88/1029072588.db2.gz UESXPABGYIFMDL-CVEARBPZSA-N 2 1 338.442 4.157 20 0 EIADMP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c32)c(F)c1 ZINC000650754275 1029180321 /nfs/dbraw/zinc/18/03/21/1029180321.db2.gz FIBOQBPOZPDKAM-MRXNPFEDSA-N 2 1 339.241 4.368 20 0 EIADMP CC[N@H+](Cc1cccnc1)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168055651 1029214011 /nfs/dbraw/zinc/21/40/11/1029214011.db2.gz XCSAUPZYCMKESZ-OALUTQOASA-N 2 1 337.511 4.345 20 0 EIADMP CC[N@@H+](Cc1cccnc1)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168055651 1029214031 /nfs/dbraw/zinc/21/40/31/1029214031.db2.gz XCSAUPZYCMKESZ-OALUTQOASA-N 2 1 337.511 4.345 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCSCc2cccc3ccccc32)CC[N@H+]1C ZINC000151159484 1029218003 /nfs/dbraw/zinc/21/80/03/1029218003.db2.gz QMXJVMOVDKUQIQ-LPHOPBHVSA-N 2 1 328.525 4.145 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC[N@@H+]1C ZINC000157766147 1029222292 /nfs/dbraw/zinc/22/22/92/1029222292.db2.gz GLUXMVAHZSAEBA-YWPYICTPSA-N 2 1 343.298 4.279 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC[N@H+]1C ZINC000157766147 1029222307 /nfs/dbraw/zinc/22/23/07/1029222307.db2.gz GLUXMVAHZSAEBA-YWPYICTPSA-N 2 1 343.298 4.279 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)CCS2 ZINC000343470732 1029317434 /nfs/dbraw/zinc/31/74/34/1029317434.db2.gz XRXOUYKVQUUTCJ-YJBOKZPZSA-N 2 1 334.529 4.086 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@]3(CC3(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168058827 1029376787 /nfs/dbraw/zinc/37/67/87/1029376787.db2.gz CPEDYAHEHKEJCY-MDZRGWNJSA-N 2 1 334.454 4.159 20 0 EIADMP CC(C)CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccoc1 ZINC000428448241 1029459959 /nfs/dbraw/zinc/45/99/59/1029459959.db2.gz OQJSHWHYOLOXAM-HBMCJLEFSA-N 2 1 348.531 4.114 20 0 EIADMP C[C@H](CCc1ccc(F)cc1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475270421 1029487739 /nfs/dbraw/zinc/48/77/39/1029487739.db2.gz SEXAYVRXHQITJI-NQIIRXRSSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)CC(F)F ZINC000647319348 1029520347 /nfs/dbraw/zinc/52/03/47/1029520347.db2.gz WVDMGSMTBDSFAC-JCHJZTRSSA-N 2 1 336.470 4.168 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](C(F)(F)F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168061383 1029540796 /nfs/dbraw/zinc/54/07/96/1029540796.db2.gz IFESMEYCIUAQKE-CYGHRXIMSA-N 2 1 340.433 4.312 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@H](C(F)(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168061383 1029540799 /nfs/dbraw/zinc/54/07/99/1029540799.db2.gz IFESMEYCIUAQKE-CYGHRXIMSA-N 2 1 340.433 4.312 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@@H](C(F)(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168061383 1029540803 /nfs/dbraw/zinc/54/08/03/1029540803.db2.gz IFESMEYCIUAQKE-CYGHRXIMSA-N 2 1 340.433 4.312 20 0 EIADMP CCC[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccn1 ZINC000158894199 1029610570 /nfs/dbraw/zinc/61/05/70/1029610570.db2.gz JCPZEZCTUFCBCQ-IEBWSBKVSA-N 2 1 343.540 4.486 20 0 EIADMP CCC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccn1 ZINC000158894199 1029610573 /nfs/dbraw/zinc/61/05/73/1029610573.db2.gz JCPZEZCTUFCBCQ-IEBWSBKVSA-N 2 1 343.540 4.486 20 0 EIADMP CC[N@H+](Cc1ccccn1)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168065459 1029649298 /nfs/dbraw/zinc/64/92/98/1029649298.db2.gz WLTSIEWQFYPUNP-RTBURBONSA-N 2 1 337.511 4.345 20 0 EIADMP CC[N@@H+](Cc1ccccn1)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168065459 1029649307 /nfs/dbraw/zinc/64/93/07/1029649307.db2.gz WLTSIEWQFYPUNP-RTBURBONSA-N 2 1 337.511 4.345 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838575 1029720762 /nfs/dbraw/zinc/72/07/62/1029720762.db2.gz DAGRBKJCXZRYSB-KFWWJZLASA-N 2 1 325.447 4.038 20 0 EIADMP FC(F)(F)c1cccc([C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CC2)c1 ZINC000091284507 1029882764 /nfs/dbraw/zinc/88/27/64/1029882764.db2.gz UDAASVJVOSSRAX-FZKQIMNGSA-N 2 1 338.417 4.230 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000091335688 1029884048 /nfs/dbraw/zinc/88/40/48/1029884048.db2.gz FZTJSTWUJDVXQW-SUMWQHHRSA-N 2 1 326.406 4.088 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)CC1 ZINC000181762498 1029916717 /nfs/dbraw/zinc/91/67/17/1029916717.db2.gz DYFJUGFOXTUDQY-RCOXNQKVSA-N 2 1 342.527 4.005 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccc(F)cn1 ZINC000092739318 1029929790 /nfs/dbraw/zinc/92/97/90/1029929790.db2.gz WDCJHOQGXMQXRM-IRXDYDNUSA-N 2 1 341.474 4.446 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1ccc(F)cn1 ZINC000092739318 1029929807 /nfs/dbraw/zinc/92/98/07/1029929807.db2.gz WDCJHOQGXMQXRM-IRXDYDNUSA-N 2 1 341.474 4.446 20 0 EIADMP Fc1ccc(C[C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000447536258 1030141788 /nfs/dbraw/zinc/14/17/88/1030141788.db2.gz LZPUEEIWBHOTNO-PGRDOPGGSA-N 2 1 338.470 4.183 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2c(Cl)cccc2Cl)CCC1 ZINC000447571375 1030157160 /nfs/dbraw/zinc/15/71/60/1030157160.db2.gz XXIAANBZCJNINZ-CJNGLKHVSA-N 2 1 341.326 4.345 20 0 EIADMP C[C@@H](CC(F)(F)F)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447601975 1030220816 /nfs/dbraw/zinc/22/08/16/1030220816.db2.gz RBPKUHFFCRJILV-LLLHUVSDSA-N 2 1 326.406 4.113 20 0 EIADMP Cc1ccc(F)cc1C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000526082777 1030264211 /nfs/dbraw/zinc/26/42/11/1030264211.db2.gz LJKNRBFHKCTSRV-UHFFFAOYSA-N 2 1 341.474 4.268 20 0 EIADMP C[C@@H](CC[NH2+][C@@H](C)c1cc2cnccc2o1)[N@H+](C)Cc1ccccc1 ZINC000657898544 1030405136 /nfs/dbraw/zinc/40/51/36/1030405136.db2.gz DBMULIXHZUMEJH-IRXDYDNUSA-N 2 1 337.467 4.389 20 0 EIADMP C[C@@H](CC[NH2+][C@@H](C)c1cc2cnccc2o1)[N@@H+](C)Cc1ccccc1 ZINC000657898544 1030405139 /nfs/dbraw/zinc/40/51/39/1030405139.db2.gz DBMULIXHZUMEJH-IRXDYDNUSA-N 2 1 337.467 4.389 20 0 EIADMP CC[NH+](CC)CCC[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000530471244 1030441472 /nfs/dbraw/zinc/44/14/72/1030441472.db2.gz TUXKNLXNQRLZRU-UHFFFAOYSA-N 2 1 331.529 4.208 20 0 EIADMP Cc1ccc2cc(C[NH2+]C3CCN(c4cccc(C)[nH+]4)CC3)ccc2n1 ZINC000189347275 1030463543 /nfs/dbraw/zinc/46/35/43/1030463543.db2.gz RTNFWWKNQKPOLD-UHFFFAOYSA-N 2 1 346.478 4.005 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)c1ccccc1OC(F)F)C[NH+]1CCCCC1 ZINC000321694072 1030516962 /nfs/dbraw/zinc/51/69/62/1030516962.db2.gz YUZDMJCHFQLNFL-CABCVRRESA-N 2 1 326.431 4.061 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cscc2C(F)(F)F)C1 ZINC000685612952 1030572309 /nfs/dbraw/zinc/57/23/09/1030572309.db2.gz KPKXMVMKUWTVPN-CYBMUJFWSA-N 2 1 334.451 4.369 20 0 EIADMP CCOC1CCC([NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000657933746 1030629876 /nfs/dbraw/zinc/62/98/76/1030629876.db2.gz VFCDYNUWTHIUGV-GRTSPXDGSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H](CC1CCOCC1)[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000685665256 1030665257 /nfs/dbraw/zinc/66/52/57/1030665257.db2.gz ZWTBYODIVNWVFH-UGKGYDQZSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000398179856 1030730789 /nfs/dbraw/zinc/73/07/89/1030730789.db2.gz WUURNDQBGOEJMI-LAUBAEHRSA-N 2 1 333.479 4.168 20 0 EIADMP CC(C)[N@H+]1CCCC[C@@H]1CN1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000451896107 1030769928 /nfs/dbraw/zinc/76/99/28/1030769928.db2.gz BCSXOPDUHYCTQG-LJQANCHMSA-N 2 1 337.596 4.082 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(C(F)F)nc1 ZINC000657999288 1030770606 /nfs/dbraw/zinc/77/06/06/1030770606.db2.gz TXCYQKJMBFALSV-DOTOQJQBSA-N 2 1 345.437 4.192 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCCSCC1 ZINC000658004255 1030770929 /nfs/dbraw/zinc/77/09/29/1030770929.db2.gz PBXLDHLCXHURNF-MOPGFXCFSA-N 2 1 332.557 4.162 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCCSCC1 ZINC000658004255 1030770938 /nfs/dbraw/zinc/77/09/38/1030770938.db2.gz PBXLDHLCXHURNF-MOPGFXCFSA-N 2 1 332.557 4.162 20 0 EIADMP CCOC1CCC([NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000658018536 1030780874 /nfs/dbraw/zinc/78/08/74/1030780874.db2.gz ITZABOUJHDBJML-HWELCPFYSA-N 2 1 344.543 4.226 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@@H]1c1cccs1 ZINC000527669035 1030807215 /nfs/dbraw/zinc/80/72/15/1030807215.db2.gz WSPZSNIJISZGCE-YLJYHZDGSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@@H]1c1cccs1 ZINC000527669035 1030807220 /nfs/dbraw/zinc/80/72/20/1030807220.db2.gz WSPZSNIJISZGCE-YLJYHZDGSA-N 2 1 339.508 4.402 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)cc1 ZINC000658235993 1030895039 /nfs/dbraw/zinc/89/50/39/1030895039.db2.gz GYZFYURWVOIVQQ-SPLOXXLWSA-N 2 1 333.435 4.224 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccccc2Oc2cccnc2)C[C@H]1C ZINC000531140007 1030909340 /nfs/dbraw/zinc/90/93/40/1030909340.db2.gz SFKMHDRSDYQSHV-IEBWSBKVSA-N 2 1 339.483 4.179 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2Oc2cccnc2)C[C@H]1C ZINC000531140007 1030909371 /nfs/dbraw/zinc/90/93/71/1030909371.db2.gz SFKMHDRSDYQSHV-IEBWSBKVSA-N 2 1 339.483 4.179 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2Oc2cccnc2)C[C@H]1C ZINC000531140007 1030909396 /nfs/dbraw/zinc/90/93/96/1030909396.db2.gz SFKMHDRSDYQSHV-IEBWSBKVSA-N 2 1 339.483 4.179 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2Oc2cccnc2)C[C@H]1C ZINC000531140007 1030909423 /nfs/dbraw/zinc/90/94/23/1030909423.db2.gz SFKMHDRSDYQSHV-IEBWSBKVSA-N 2 1 339.483 4.179 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCOc2cccc3ccccc32)C[C@@H]1C ZINC000531140877 1030913526 /nfs/dbraw/zinc/91/35/26/1030913526.db2.gz MCHAGDIHZULHQR-PKOBYXMFSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCOc2cccc3ccccc32)C[C@@H]1C ZINC000531140877 1030913554 /nfs/dbraw/zinc/91/35/54/1030913554.db2.gz MCHAGDIHZULHQR-PKOBYXMFSA-N 2 1 326.484 4.023 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCOc2cccc3ccccc32)C[C@@H]1C ZINC000531140877 1030913588 /nfs/dbraw/zinc/91/35/88/1030913588.db2.gz MCHAGDIHZULHQR-PKOBYXMFSA-N 2 1 326.484 4.023 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2C(C)(C)C2(F)F)CC1 ZINC000658281056 1030938832 /nfs/dbraw/zinc/93/88/32/1030938832.db2.gz NJQMTKPCXKYHON-ABHNRTSZSA-N 2 1 336.470 4.311 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1OCCC ZINC000392722148 1030946450 /nfs/dbraw/zinc/94/64/50/1030946450.db2.gz PTWYZTCJCPXEGI-ROUUACIJSA-N 2 1 348.531 4.257 20 0 EIADMP Cc1ccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000658293424 1030960275 /nfs/dbraw/zinc/96/02/75/1030960275.db2.gz HBENFHXERQMNHM-FCHUYYIVSA-N 2 1 342.527 4.069 20 0 EIADMP Cc1ccc([C@@H]([NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000658293430 1030960435 /nfs/dbraw/zinc/96/04/35/1030960435.db2.gz HBENFHXERQMNHM-YADHBBJMSA-N 2 1 342.527 4.069 20 0 EIADMP C[C@H](Cc1ccoc1)[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658317410 1030979899 /nfs/dbraw/zinc/97/98/99/1030979899.db2.gz KBPMAQSBOBACFD-WIYYLYMNSA-N 2 1 338.495 4.103 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(CO)c2)cc1 ZINC000305672203 1031215545 /nfs/dbraw/zinc/21/55/45/1031215545.db2.gz XPOIYOKZABIRBF-CVEARBPZSA-N 2 1 335.451 4.085 20 0 EIADMP Cc1noc(C)c1C[N@@H+]1CCCC12CC[NH+](C1CCC(C)CC1)CC2 ZINC001168211703 1031275784 /nfs/dbraw/zinc/27/57/84/1031275784.db2.gz HQUAVCCMXZEFBR-UHFFFAOYSA-N 2 1 345.531 4.301 20 0 EIADMP C[C@H](CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044069 1031396822 /nfs/dbraw/zinc/39/68/22/1031396822.db2.gz BJUZQIUZIQVOAR-QEEYODRMSA-N 2 1 334.454 4.017 20 0 EIADMP C[C@H](C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044069 1031396824 /nfs/dbraw/zinc/39/68/24/1031396824.db2.gz BJUZQIUZIQVOAR-QEEYODRMSA-N 2 1 334.454 4.017 20 0 EIADMP C[C@H](C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044069 1031396827 /nfs/dbraw/zinc/39/68/27/1031396827.db2.gz BJUZQIUZIQVOAR-QEEYODRMSA-N 2 1 334.454 4.017 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000449084226 1031413200 /nfs/dbraw/zinc/41/32/00/1031413200.db2.gz XABGBPIYMUBUKX-NQIIRXRSSA-N 2 1 342.527 4.252 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000449088880 1031449541 /nfs/dbraw/zinc/44/95/41/1031449541.db2.gz IYDUHIBHPLQBDZ-UHFFFAOYSA-N 2 1 347.503 4.302 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2cnc(-c3ccccc3F)s2)C1 ZINC000449131039 1031466459 /nfs/dbraw/zinc/46/64/59/1031466459.db2.gz JSJPXMNQRGWPEV-OAHLLOKOSA-N 2 1 347.503 4.159 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2cnc(-c3ccccc3F)s2)C1 ZINC000449131039 1031466467 /nfs/dbraw/zinc/46/64/67/1031466467.db2.gz JSJPXMNQRGWPEV-OAHLLOKOSA-N 2 1 347.503 4.159 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccccc23)CC[N@@H+]1Cc1ccccc1 ZINC000531677775 1031471002 /nfs/dbraw/zinc/47/10/02/1031471002.db2.gz ZTALYEMLJCXDEL-NQIIRXRSSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccccc23)CC[N@H+]1Cc1ccccc1 ZINC000531677775 1031471013 /nfs/dbraw/zinc/47/10/13/1031471013.db2.gz ZTALYEMLJCXDEL-NQIIRXRSSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2c[nH]c3ccccc23)CC[N@@H+]1Cc1ccccc1 ZINC000531677777 1031471499 /nfs/dbraw/zinc/47/14/99/1031471499.db2.gz ZTALYEMLJCXDEL-WIYYLYMNSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2c[nH]c3ccccc23)CC[N@H+]1Cc1ccccc1 ZINC000531677777 1031471512 /nfs/dbraw/zinc/47/15/12/1031471512.db2.gz ZTALYEMLJCXDEL-WIYYLYMNSA-N 2 1 347.506 4.353 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccccc1OC ZINC000123986657 1031496554 /nfs/dbraw/zinc/49/65/54/1031496554.db2.gz KFXJFLMNMKGIPM-FQEVSTJZSA-N 2 1 326.484 4.388 20 0 EIADMP Cc1cccc(CC[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000449159991 1031501585 /nfs/dbraw/zinc/50/15/85/1031501585.db2.gz KEGCUCZBTCJQNU-QUCCMNQESA-N 2 1 328.525 4.272 20 0 EIADMP Cc1cccc(CC[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1 ZINC000449159991 1031501596 /nfs/dbraw/zinc/50/15/96/1031501596.db2.gz KEGCUCZBTCJQNU-QUCCMNQESA-N 2 1 328.525 4.272 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)Cc3coc4ccccc34)CC2)[nH+]c1 ZINC000449163452 1031503768 /nfs/dbraw/zinc/50/37/68/1031503768.db2.gz MGVLPUTUHIUIOR-KRWDZBQOSA-N 2 1 349.478 4.326 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)c1ccc(F)cc1Cl ZINC000531718364 1031517835 /nfs/dbraw/zinc/51/78/35/1031517835.db2.gz WNYOXBZCPLLBQG-IGCXYCKISA-N 2 1 326.887 4.075 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccnn2C2CCCC2)cc1 ZINC000449185015 1031522176 /nfs/dbraw/zinc/52/21/76/1031522176.db2.gz HAVWEEPDAYJKHC-MRXNPFEDSA-N 2 1 349.482 4.343 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)o1 ZINC000124649726 1031545486 /nfs/dbraw/zinc/54/54/86/1031545486.db2.gz KWLNYRNDEJJFQJ-FGTMMUONSA-N 2 1 342.483 4.048 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)cc(F)c1 ZINC000449232836 1031563627 /nfs/dbraw/zinc/56/36/27/1031563627.db2.gz JGOXTYFLVQFORB-OWCLPIDISA-N 2 1 336.470 4.311 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cs1 ZINC000453090355 1031581672 /nfs/dbraw/zinc/58/16/72/1031581672.db2.gz RAQNVFUJSNQCCL-KRWDZBQOSA-N 2 1 328.525 4.414 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H](C3CC3)C3CCC3)CC2)cs1 ZINC000453104037 1031596135 /nfs/dbraw/zinc/59/61/35/1031596135.db2.gz CBCCDRBIDAAMSF-FQEVSTJZSA-N 2 1 347.572 4.086 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000449263806 1031600936 /nfs/dbraw/zinc/60/09/36/1031600936.db2.gz JYIJMXWJTOBJSZ-UHFFFAOYSA-N 2 1 345.487 4.009 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)c2ccccc2O1 ZINC000449422829 1031734747 /nfs/dbraw/zinc/73/47/47/1031734747.db2.gz FXRQLVJANFKMOO-OXQOHEQNSA-N 2 1 328.500 4.285 20 0 EIADMP CC(C)[C@@H]1C[C@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000449493651 1031789476 /nfs/dbraw/zinc/78/94/76/1031789476.db2.gz LXIPYKOQZGAACF-NMIHRBCNSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000449493651 1031789487 /nfs/dbraw/zinc/78/94/87/1031789487.db2.gz LXIPYKOQZGAACF-NMIHRBCNSA-N 2 1 344.543 4.080 20 0 EIADMP CSCC1CCC([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000453268494 1031793394 /nfs/dbraw/zinc/79/33/94/1031793394.db2.gz KJOZAAPVMYVJLJ-QUDVFMAMSA-N 2 1 332.557 4.333 20 0 EIADMP CSCC1CCC([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000453268494 1031793407 /nfs/dbraw/zinc/79/34/07/1031793407.db2.gz KJOZAAPVMYVJLJ-QUDVFMAMSA-N 2 1 332.557 4.333 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000131210917 1031863412 /nfs/dbraw/zinc/86/34/12/1031863412.db2.gz JBDRVZYZRJUUFO-IBGZPJMESA-N 2 1 328.500 4.143 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)CCCOc1cccc(Cl)c1 ZINC000119356373 1031881204 /nfs/dbraw/zinc/88/12/04/1031881204.db2.gz HJDNKWYEOGNZNV-UHFFFAOYSA-N 2 1 335.879 4.026 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)CCCOc1cccc(Cl)c1 ZINC000119356373 1031881206 /nfs/dbraw/zinc/88/12/06/1031881206.db2.gz HJDNKWYEOGNZNV-UHFFFAOYSA-N 2 1 335.879 4.026 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C1CCOCC1 ZINC000531967641 1031889788 /nfs/dbraw/zinc/88/97/88/1031889788.db2.gz RCTVHNLTXPTACP-DYESRHJHSA-N 2 1 330.516 4.007 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Br)s1 ZINC000453404704 1031938758 /nfs/dbraw/zinc/93/87/58/1031938758.db2.gz BPBUQMMDGBWDMP-LLVKDONJSA-N 2 1 331.323 4.036 20 0 EIADMP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453406477 1031941424 /nfs/dbraw/zinc/94/14/24/1031941424.db2.gz RBDFDHLBHDIIKK-CQSZACIVSA-N 2 1 328.422 4.100 20 0 EIADMP Cc1cnc(CC[N@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)s1 ZINC000411407164 1033883809 /nfs/dbraw/zinc/88/38/09/1033883809.db2.gz KTEYHLKGWSPWDJ-UHFFFAOYSA-N 2 1 343.540 4.112 20 0 EIADMP c1cc(NCc2ccc(OCC[NH+]3CCCC3)cc2)[nH+]c(C2CC2)c1 ZINC000645185913 1033994661 /nfs/dbraw/zinc/99/46/61/1033994661.db2.gz OVGNFIZBGGZHSS-UHFFFAOYSA-N 2 1 337.467 4.046 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2cccc(Cl)c2)CC1 ZINC000512810049 1034010059 /nfs/dbraw/zinc/01/00/59/1034010059.db2.gz PGIMKPVWJQPJGX-UHFFFAOYSA-N 2 1 328.887 4.403 20 0 EIADMP C[C@H](NCCC[N@H+]1CCCC[C@@H]1C)c1ccccc1OC(F)F ZINC000320373535 1034397000 /nfs/dbraw/zinc/39/70/00/1034397000.db2.gz UJNAFFSIHRJNQY-GJZGRUSLSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccccc1OC(F)F ZINC000320373535 1034397010 /nfs/dbraw/zinc/39/70/10/1034397010.db2.gz UJNAFFSIHRJNQY-GJZGRUSLSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccccc1OC(F)F ZINC000320373535 1034397019 /nfs/dbraw/zinc/39/70/19/1034397019.db2.gz UJNAFFSIHRJNQY-GJZGRUSLSA-N 2 1 326.431 4.203 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(-c3cccs3)on2)CC1 ZINC000052208913 1034410371 /nfs/dbraw/zinc/41/03/71/1034410371.db2.gz ATEQTUJJRQQSIF-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(-c3cccs3)on2)CC1 ZINC000052208913 1034410387 /nfs/dbraw/zinc/41/03/87/1034410387.db2.gz ATEQTUJJRQQSIF-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP FC(F)(F)c1ccc(CCC[N@H+]2CCCC3(CC[NH2+]CC3)C2)cc1 ZINC001204727665 1034716101 /nfs/dbraw/zinc/71/61/01/1034716101.db2.gz IWIBAHHXEBBFJU-UHFFFAOYSA-N 2 1 340.433 4.104 20 0 EIADMP CCc1ncc(C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)s1 ZINC000513500612 1034997489 /nfs/dbraw/zinc/99/74/89/1034997489.db2.gz NMKKXRFBVBDCFV-FUHWJXTLSA-N 2 1 343.540 4.096 20 0 EIADMP COc1cccc(C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000513510915 1035006249 /nfs/dbraw/zinc/00/62/49/1035006249.db2.gz GNHOOBOTGVCYPJ-RXVVDRJESA-N 2 1 338.495 4.086 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1cc(Cl)ccc1OC1CCCC1 ZINC000509939806 1035010512 /nfs/dbraw/zinc/01/05/12/1035010512.db2.gz CKZVAMJYLXPXEP-UHFFFAOYSA-N 2 1 347.890 4.346 20 0 EIADMP C[N@H+](Cc1ccccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501069902 1035367541 /nfs/dbraw/zinc/36/75/41/1035367541.db2.gz QQDSFMYBMPMDIR-UHFFFAOYSA-N 2 1 329.875 4.083 20 0 EIADMP CCC[N@@H+](CCCN1CC[NH+](C(C)C)CC1)[C@H](CC)c1ccccc1 ZINC000501103160 1035378600 /nfs/dbraw/zinc/37/86/00/1035378600.db2.gz FXSMZVADRBDRNR-JOCHJYFZSA-N 2 1 345.575 4.266 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)[C@H]2CCC[C@H]21 ZINC000513712194 1035425889 /nfs/dbraw/zinc/42/58/89/1035425889.db2.gz AJPCAEFOAIROLQ-FGTMMUONSA-N 2 1 340.433 4.100 20 0 EIADMP C[N@@H+](CCC[NH2+][C@H]1CCC[C@H](c2cccnc2)C1)C1CCCCC1 ZINC000501379492 1035436037 /nfs/dbraw/zinc/43/60/37/1035436037.db2.gz BBZVFUPJFKATMS-ICSRJNTNSA-N 2 1 329.532 4.352 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000501425135 1035443975 /nfs/dbraw/zinc/44/39/75/1035443975.db2.gz OAWPEBGNPJYANS-UQPQFNMUSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000501425135 1035443985 /nfs/dbraw/zinc/44/39/85/1035443985.db2.gz OAWPEBGNPJYANS-UQPQFNMUSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000501466378 1035449275 /nfs/dbraw/zinc/44/92/75/1035449275.db2.gz JNXGAHNQKXKFCR-RNTKJRCOSA-N 2 1 326.406 4.181 20 0 EIADMP C[N@H+](Cc1cc2ccccc2o1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501541701 1035462680 /nfs/dbraw/zinc/46/26/80/1035462680.db2.gz SFCLPEXREDBMHL-UHFFFAOYSA-N 2 1 335.451 4.176 20 0 EIADMP Cc1nc([C@@H](C)[N@H+]2CCC[C@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420319113 1035513089 /nfs/dbraw/zinc/51/30/89/1035513089.db2.gz XDBOUXCEDPHRDM-HUUCEWRRSA-N 2 1 347.890 4.425 20 0 EIADMP Brc1ccc([C@@H]2CCC[N@H+]2CC[C@H]2CCC[NH2+]C2)s1 ZINC000420372162 1035556607 /nfs/dbraw/zinc/55/66/07/1035556607.db2.gz LGSBFONKUOMVFO-OLZOCXBDSA-N 2 1 343.334 4.037 20 0 EIADMP Brc1ccc([C@@H]2CCC[N@H+]2CC[C@@H]2CCC[NH2+]C2)s1 ZINC000420372164 1035557626 /nfs/dbraw/zinc/55/76/26/1035557626.db2.gz LGSBFONKUOMVFO-STQMWFEESA-N 2 1 343.334 4.037 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420420616 1035575611 /nfs/dbraw/zinc/57/56/11/1035575611.db2.gz YAWLOXHRPIZJRC-IVMMDQJWSA-N 2 1 347.890 4.281 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420420616 1035575639 /nfs/dbraw/zinc/57/56/39/1035575639.db2.gz YAWLOXHRPIZJRC-IVMMDQJWSA-N 2 1 347.890 4.281 20 0 EIADMP Cc1ccc(-c2nc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cs2)o1 ZINC000501778687 1035582622 /nfs/dbraw/zinc/58/26/22/1035582622.db2.gz VLFZWBVEILYNTL-UHFFFAOYSA-N 2 1 347.528 4.265 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000568768696 1035694113 /nfs/dbraw/zinc/69/41/13/1035694113.db2.gz DRFFOXOECVKAOF-SJORKVTESA-N 2 1 344.474 4.130 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000568768696 1035694131 /nfs/dbraw/zinc/69/41/31/1035694131.db2.gz DRFFOXOECVKAOF-SJORKVTESA-N 2 1 344.474 4.130 20 0 EIADMP C[C@H]([NH2+]CCC[NH+](C)C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000195679014 1035880496 /nfs/dbraw/zinc/88/04/96/1035880496.db2.gz QRRGMRRGIBNJLP-JTQLQIEISA-N 2 1 342.327 4.327 20 0 EIADMP Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000571380349 1036035116 /nfs/dbraw/zinc/03/51/16/1036035116.db2.gz IPAXKICDKUKXEN-AKIFATBCSA-N 2 1 349.522 4.170 20 0 EIADMP Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000571380347 1036036164 /nfs/dbraw/zinc/03/61/64/1036036164.db2.gz IPAXKICDKUKXEN-ACIOBRDBSA-N 2 1 349.522 4.170 20 0 EIADMP C[N@H+](Cc1c(OC(F)F)ccc2ccccc21)CC1CC[NH+](C)CC1 ZINC000513742629 1036061384 /nfs/dbraw/zinc/06/13/84/1036061384.db2.gz ZRUKMCTYXGTSIO-UHFFFAOYSA-N 2 1 348.437 4.215 20 0 EIADMP Cc1cc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cc(C)n1 ZINC000421390117 1036353251 /nfs/dbraw/zinc/35/32/51/1036353251.db2.gz ZQEVLEVXZXELRJ-UHFFFAOYSA-N 2 1 331.548 4.467 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CCc2ccccc2F)CC1)CC(C)C ZINC001168412669 1036465033 /nfs/dbraw/zinc/46/50/33/1036465033.db2.gz BCYGZWGPZFEPAW-UHFFFAOYSA-N 2 1 334.523 4.448 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cnn(C2CCCC2)c1 ZINC000502727535 1036585095 /nfs/dbraw/zinc/58/50/95/1036585095.db2.gz NRVMEIMBNUTJDW-QZTJIDSGSA-N 2 1 332.536 4.303 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+][C@@H]3CCC[C@@H]3C(C)(C)C)sc2C1 ZINC000414541475 1036639796 /nfs/dbraw/zinc/63/97/96/1036639796.db2.gz WBWNMHVZSHEJSH-LSDHHAIUSA-N 2 1 335.561 4.214 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+][C@@H]3CCC[C@@H]3C(C)(C)C)sc2C1 ZINC000414541475 1036639808 /nfs/dbraw/zinc/63/98/08/1036639808.db2.gz WBWNMHVZSHEJSH-LSDHHAIUSA-N 2 1 335.561 4.214 20 0 EIADMP C[C@H]([NH2+]C/C=C/c1ccc(F)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486473101 1036718182 /nfs/dbraw/zinc/71/81/82/1036718182.db2.gz DPKARZYRVMHYLF-QSSYGXSSSA-N 2 1 338.470 4.339 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000486727354 1036831490 /nfs/dbraw/zinc/83/14/90/1036831490.db2.gz DZJVIHDJIAEUSZ-UHFFFAOYSA-N 2 1 339.458 4.437 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000589836077 1036879754 /nfs/dbraw/zinc/87/97/54/1036879754.db2.gz FYWPEHLTHRBYIA-OAHLLOKOSA-N 2 1 344.421 4.187 20 0 EIADMP C[N@H+]1CCC[C@H]1CCN1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000503071937 1036889035 /nfs/dbraw/zinc/88/90/35/1036889035.db2.gz JJSBXVVCUGNNPO-INIZCTEOSA-N 2 1 338.417 4.279 20 0 EIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000503071937 1036889039 /nfs/dbraw/zinc/88/90/39/1036889039.db2.gz JJSBXVVCUGNNPO-INIZCTEOSA-N 2 1 338.417 4.279 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000503071937 1036889042 /nfs/dbraw/zinc/88/90/42/1036889042.db2.gz JJSBXVVCUGNNPO-INIZCTEOSA-N 2 1 338.417 4.279 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000503071937 1036889043 /nfs/dbraw/zinc/88/90/43/1036889043.db2.gz JJSBXVVCUGNNPO-INIZCTEOSA-N 2 1 338.417 4.279 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000503071937 1036889044 /nfs/dbraw/zinc/88/90/44/1036889044.db2.gz JJSBXVVCUGNNPO-INIZCTEOSA-N 2 1 338.417 4.279 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2CCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000503078751 1036894827 /nfs/dbraw/zinc/89/48/27/1036894827.db2.gz SINVKFPAGNXCFU-VQIMIIECSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2CCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000503078751 1036894828 /nfs/dbraw/zinc/89/48/28/1036894828.db2.gz SINVKFPAGNXCFU-VQIMIIECSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]C/C=C/c3ccncc3)cc2)C1 ZINC000486943621 1036897380 /nfs/dbraw/zinc/89/73/80/1036897380.db2.gz OBKWRIRGHWCTDJ-XUYKHGSPSA-N 2 1 335.495 4.117 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311088389 1037080112 /nfs/dbraw/zinc/08/01/12/1037080112.db2.gz NJNYOPFCJYHFPH-LQWHRVPQSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311088391 1037082278 /nfs/dbraw/zinc/08/22/78/1037082278.db2.gz NJNYOPFCJYHFPH-OPYAIIAOSA-N 2 1 340.486 4.257 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000272298758 1037152806 /nfs/dbraw/zinc/15/28/06/1037152806.db2.gz GNLATBODLQRPQL-WSTZPKSXSA-N 2 1 340.515 4.025 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2C(F)(F)F)CC1 ZINC000590786708 1037165420 /nfs/dbraw/zinc/16/54/20/1037165420.db2.gz NEZUFDIQTHRPBP-UHFFFAOYSA-N 2 1 328.422 4.258 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C[C@H](C)C[NH+]3CCCCC3)s2)cc1 ZINC000604415132 1037381537 /nfs/dbraw/zinc/38/15/37/1037381537.db2.gz UZYJBCOFLXSHKO-KRWDZBQOSA-N 2 1 343.540 4.330 20 0 EIADMP Clc1ccc(C2=CC[N@@H+](C3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC001168374354 1037409163 /nfs/dbraw/zinc/40/91/63/1037409163.db2.gz ZREUTUYMIHZJHP-UHFFFAOYSA-N 2 1 330.903 4.304 20 0 EIADMP Clc1ccc(C2=CC[N@H+](C3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC001168374354 1037409182 /nfs/dbraw/zinc/40/91/82/1037409182.db2.gz ZREUTUYMIHZJHP-UHFFFAOYSA-N 2 1 330.903 4.304 20 0 EIADMP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2nc(C(C)(C)C)cs2)CC1 ZINC000760832429 1037450929 /nfs/dbraw/zinc/45/09/29/1037450929.db2.gz XZQQKTIIUYYYMU-QGZVFWFLSA-N 2 1 349.588 4.494 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2nc(C(C)(C)C)cs2)CC1 ZINC000760832429 1037450948 /nfs/dbraw/zinc/45/09/48/1037450948.db2.gz XZQQKTIIUYYYMU-QGZVFWFLSA-N 2 1 349.588 4.494 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000591711911 1037558383 /nfs/dbraw/zinc/55/83/83/1037558383.db2.gz CDLUMEJZJKLGKA-MRXNPFEDSA-N 2 1 330.447 4.296 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000591711911 1037558409 /nfs/dbraw/zinc/55/84/09/1037558409.db2.gz CDLUMEJZJKLGKA-MRXNPFEDSA-N 2 1 330.447 4.296 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)CS1 ZINC000488437682 1037596289 /nfs/dbraw/zinc/59/62/89/1037596289.db2.gz WJUOJGJWOCYGFG-VDGAXYAQSA-N 2 1 332.557 4.332 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000513787595 1037713219 /nfs/dbraw/zinc/71/32/19/1037713219.db2.gz BLMGIIJUIBCZBP-HBFSDRIKSA-N 2 1 340.511 4.430 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000513787595 1037713239 /nfs/dbraw/zinc/71/32/39/1037713239.db2.gz BLMGIIJUIBCZBP-HBFSDRIKSA-N 2 1 340.511 4.430 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000513787595 1037713261 /nfs/dbraw/zinc/71/32/61/1037713261.db2.gz BLMGIIJUIBCZBP-HBFSDRIKSA-N 2 1 340.511 4.430 20 0 EIADMP C[C@H](NC(C)(C)C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422733028 1037808234 /nfs/dbraw/zinc/80/82/34/1037808234.db2.gz QLWLXHJNNKYTJB-FYZZASKESA-N 2 1 343.559 4.016 20 0 EIADMP CC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3C[C@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000422800324 1037836571 /nfs/dbraw/zinc/83/65/71/1037836571.db2.gz BGIKWOZIMUEWGY-XZOQPEGZSA-N 3 1 349.522 4.153 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)cc1OC ZINC000422891847 1037852011 /nfs/dbraw/zinc/85/20/11/1037852011.db2.gz LROLOKBQLDMQMX-KYNGSXCRSA-N 2 1 340.467 4.279 20 0 EIADMP Clc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000422937839 1037875804 /nfs/dbraw/zinc/87/58/04/1037875804.db2.gz CUYJBJOIXGCIRF-HOJAQTOUSA-N 2 1 326.871 4.410 20 0 EIADMP Clc1cccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc2)c1 ZINC000422937755 1037875965 /nfs/dbraw/zinc/87/59/65/1037875965.db2.gz OOSZGBRDJOWGHD-XNMUZJSGSA-N 2 1 326.871 4.302 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)o2)cs1 ZINC000422950914 1037887332 /nfs/dbraw/zinc/88/73/32/1037887332.db2.gz XAVXEMHNQHAYOL-BRWVUGGUSA-N 2 1 345.512 4.112 20 0 EIADMP C[C@@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574039358 1037924948 /nfs/dbraw/zinc/92/49/48/1037924948.db2.gz MTSHWUNKXFECLR-GOEBONIOSA-N 2 1 326.406 4.114 20 0 EIADMP C[C@@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574039358 1037924966 /nfs/dbraw/zinc/92/49/66/1037924966.db2.gz MTSHWUNKXFECLR-GOEBONIOSA-N 2 1 326.406 4.114 20 0 EIADMP CC(C)Oc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000574226556 1037955063 /nfs/dbraw/zinc/95/50/63/1037955063.db2.gz LXEUECOKWKUMSH-CEXWTWQISA-N 2 1 348.531 4.014 20 0 EIADMP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423092386 1037955473 /nfs/dbraw/zinc/95/54/73/1037955473.db2.gz BSJSMMMOWHZOFQ-SJFSSXKUSA-N 2 1 328.887 4.134 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000503940533 1038027260 /nfs/dbraw/zinc/02/72/60/1038027260.db2.gz ABVQAJAAEWPXAK-QINSGFPZSA-N 2 1 340.433 4.382 20 0 EIADMP CC[C@H](C[NH2+][C@H](c1ccc(OC)cc1)[C@H]1CCC[NH2+]1)CC(F)(F)F ZINC000423174913 1038031275 /nfs/dbraw/zinc/03/12/75/1038031275.db2.gz DAPCRHYZNUFUFU-IAOVAPTHSA-N 2 1 344.421 4.057 20 0 EIADMP Cc1cc(C)c(C[N@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)cc1C ZINC000414720776 1038031837 /nfs/dbraw/zinc/03/18/37/1038031837.db2.gz ZUKRIUSHLRXLCO-JOCHJYFZSA-N 2 1 337.511 4.151 20 0 EIADMP Cc1cc(C)c(C[N@@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)cc1C ZINC000414720776 1038031861 /nfs/dbraw/zinc/03/18/61/1038031861.db2.gz ZUKRIUSHLRXLCO-JOCHJYFZSA-N 2 1 337.511 4.151 20 0 EIADMP CCC([NH3+])(CC)C[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423287648 1038090488 /nfs/dbraw/zinc/09/04/88/1038090488.db2.gz NSZAPNLFZQACRC-GOSISDBHSA-N 2 1 331.891 4.126 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000606469328 1038092471 /nfs/dbraw/zinc/09/24/71/1038092471.db2.gz RAJHQOIYLPYSFV-KRWDZBQOSA-N 2 1 330.516 4.144 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(C(F)(F)F)s2)CC1 ZINC000570506078 1038092565 /nfs/dbraw/zinc/09/25/65/1038092565.db2.gz KBQKVJVKRZUPBN-UHFFFAOYSA-N 2 1 334.451 4.319 20 0 EIADMP CCCC[C@H](C[NH3+])[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423300565 1038127448 /nfs/dbraw/zinc/12/74/48/1038127448.db2.gz RVYXQEZZFNBWTG-RTBURBONSA-N 2 1 331.891 4.126 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000594974497 1038484541 /nfs/dbraw/zinc/48/45/41/1038484541.db2.gz KNWYVBGSOSIJBZ-IBGZPJMESA-N 2 1 344.568 4.307 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000594974497 1038484552 /nfs/dbraw/zinc/48/45/52/1038484552.db2.gz KNWYVBGSOSIJBZ-IBGZPJMESA-N 2 1 344.568 4.307 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(F)cc2C)CC1)CC1CC1 ZINC001168423748 1038498647 /nfs/dbraw/zinc/49/86/47/1038498647.db2.gz QDKIBHCCJBWSPY-UHFFFAOYSA-N 2 1 332.507 4.468 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CCN(c3ccc(C(C)(C)C)cc3)CC2)CC[N@@H+]1C ZINC000151078193 1038635104 /nfs/dbraw/zinc/63/51/04/1038635104.db2.gz CLVGUPCZOWJHMD-YLJYHZDGSA-N 2 1 343.559 4.025 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CCN(c3ccc(C(C)(C)C)cc3)CC2)CC[N@H+]1C ZINC000151078193 1038635108 /nfs/dbraw/zinc/63/51/08/1038635108.db2.gz CLVGUPCZOWJHMD-YLJYHZDGSA-N 2 1 343.559 4.025 20 0 EIADMP CC(C)CCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480775859 1038811798 /nfs/dbraw/zinc/81/17/98/1038811798.db2.gz QPKPYDLFMQXTRH-ZWKOTPCHSA-N 2 1 330.516 4.246 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000539083150 1038815332 /nfs/dbraw/zinc/81/53/32/1038815332.db2.gz WVHSAIUKVCPXFN-ZIAGYGMSSA-N 2 1 339.405 4.067 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]C[C@H](Cc2ccccc2)C(F)(F)F)CC1 ZINC000555003425 1038825117 /nfs/dbraw/zinc/82/51/17/1038825117.db2.gz YQFMKMOAVFJCKM-INIZCTEOSA-N 2 1 342.449 4.260 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@@H]1Cc1ccccc1 ZINC000539088419 1038830712 /nfs/dbraw/zinc/83/07/12/1038830712.db2.gz SHKGEYDSSOOHOU-PVSGBFIBSA-N 2 1 334.507 4.118 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@@H]1Cc1ccccc1 ZINC000539088419 1038830713 /nfs/dbraw/zinc/83/07/13/1038830713.db2.gz SHKGEYDSSOOHOU-PVSGBFIBSA-N 2 1 334.507 4.118 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539160620 1038862964 /nfs/dbraw/zinc/86/29/64/1038862964.db2.gz QKFXDEDQGIWJGV-GUYCJALGSA-N 2 1 326.406 4.088 20 0 EIADMP Brc1ccc(C2([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CCC2)cc1 ZINC000252734721 1038862938 /nfs/dbraw/zinc/86/29/38/1038862938.db2.gz ZEUIZNQQZUQMGP-IRXDYDNUSA-N 2 1 349.316 4.045 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539201327 1038879027 /nfs/dbraw/zinc/87/90/27/1038879027.db2.gz WTWIIUSWZHCSHY-KDOFPFPSSA-N 2 1 340.433 4.478 20 0 EIADMP COc1ccc([C@@H]([NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)C2CC2)cc1 ZINC000539215682 1038886545 /nfs/dbraw/zinc/88/65/45/1038886545.db2.gz BZBQSDINQUHZDR-UWJYYQICSA-N 2 1 330.516 4.104 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001168327562 1038898320 /nfs/dbraw/zinc/89/83/20/1038898320.db2.gz OQZBDRJLLGDFBC-DAWZGUTISA-N 2 1 338.948 4.303 20 0 EIADMP CC[C@@H](Cc1ccccc1)[NH2+]CC1([NH+]2CCC(OC)CC2)CCCC1 ZINC000462107495 1038907267 /nfs/dbraw/zinc/90/72/67/1038907267.db2.gz AJMLEJLWLJLCSO-FQEVSTJZSA-N 2 1 344.543 4.021 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](Cc1ccccc1)c1ccccc1F ZINC000539361289 1039021967 /nfs/dbraw/zinc/02/19/67/1039021967.db2.gz QIEWTHHCXHLMJO-NRFANRHFSA-N 2 1 337.442 4.294 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@@H]1C ZINC000552070780 1039097026 /nfs/dbraw/zinc/09/70/26/1039097026.db2.gz DJZFMJRANKPBFA-YJBOKZPZSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@@H]1C ZINC000552070780 1039097048 /nfs/dbraw/zinc/09/70/48/1039097048.db2.gz DJZFMJRANKPBFA-YJBOKZPZSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@@H]1C ZINC000552070780 1039097073 /nfs/dbraw/zinc/09/70/73/1039097073.db2.gz DJZFMJRANKPBFA-YJBOKZPZSA-N 2 1 330.447 4.390 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(OC(F)(F)F)cc1 ZINC001168360317 1039179275 /nfs/dbraw/zinc/17/92/75/1039179275.db2.gz NSVBJAKBLVBHOS-CYBMUJFWSA-N 2 1 342.405 4.110 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]CC(C)(C)C[NH+]3CCCC3)oc21 ZINC000477917072 1039228454 /nfs/dbraw/zinc/22/84/54/1039228454.db2.gz SAKSRFDWNUFMOQ-OAHLLOKOSA-N 2 1 330.472 4.214 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000552277141 1039349678 /nfs/dbraw/zinc/34/96/78/1039349678.db2.gz PJUCXQMDZIZKDG-SVFBPWRDSA-N 2 1 337.511 4.341 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1OCCC ZINC000157225152 1039385565 /nfs/dbraw/zinc/38/55/65/1039385565.db2.gz PIDLMNWVBWRNJE-AOIWGVFYSA-N 2 1 348.531 4.398 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1OCCC ZINC000157225152 1039385575 /nfs/dbraw/zinc/38/55/75/1039385575.db2.gz PIDLMNWVBWRNJE-AOIWGVFYSA-N 2 1 348.531 4.398 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]C3CC[NH+](C4CCC4)CC3)c(C)c2c1 ZINC000481436784 1039412137 /nfs/dbraw/zinc/41/21/37/1039412137.db2.gz OXYHFNQTODJPMH-HNNXBMFYSA-N 2 1 342.483 4.417 20 0 EIADMP C[N@H+]1CC[C@]2(CC[NH+](C3CCC(c4ccc(Cl)cc4)CC3)C2)C1 ZINC001168348484 1039552487 /nfs/dbraw/zinc/55/24/87/1039552487.db2.gz YYMGVMMQXNYNHE-UUKMXZOPSA-N 2 1 332.919 4.394 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@@H+](C3CCC(c4ccc(Cl)cc4)CC3)C2)C1 ZINC001168348484 1039552514 /nfs/dbraw/zinc/55/25/14/1039552514.db2.gz YYMGVMMQXNYNHE-UUKMXZOPSA-N 2 1 332.919 4.394 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@H+](C3CCC(c4ccc(Cl)cc4)CC3)C2)C1 ZINC001168348484 1039552536 /nfs/dbraw/zinc/55/25/36/1039552536.db2.gz YYMGVMMQXNYNHE-UUKMXZOPSA-N 2 1 332.919 4.394 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)[C@@H]1CCC[NH2+]C1 ZINC000414846923 1039576674 /nfs/dbraw/zinc/57/66/74/1039576674.db2.gz FLQNREGUAAHYGH-ZIAGYGMSSA-N 2 1 341.480 4.034 20 0 EIADMP C[C@H](c1nc(C(C)(C)C)no1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000122155480 1039602908 /nfs/dbraw/zinc/60/29/08/1039602908.db2.gz KLMSIVDFVFBYDW-MRXNPFEDSA-N 2 1 348.535 4.016 20 0 EIADMP C[N@H+]1CC[C@@]2(CC[NH+](CCCCc3cccc(C(F)(F)F)c3)C2)C1 ZINC000430121181 1039845227 /nfs/dbraw/zinc/84/52/27/1039845227.db2.gz GIVINGOSNIDYIB-GOSISDBHSA-N 2 1 340.433 4.056 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@H+](CCCCc3cccc(C(F)(F)F)c3)C2)C1 ZINC000430121181 1039845229 /nfs/dbraw/zinc/84/52/29/1039845229.db2.gz GIVINGOSNIDYIB-GOSISDBHSA-N 2 1 340.433 4.056 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@@H+](CCCCc3cccc(C(F)(F)F)c3)C2)C1 ZINC000430121181 1039845230 /nfs/dbraw/zinc/84/52/30/1039845230.db2.gz GIVINGOSNIDYIB-GOSISDBHSA-N 2 1 340.433 4.056 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)C1(c2ccccc2)CCCC1 ZINC000481841442 1039856405 /nfs/dbraw/zinc/85/64/05/1039856405.db2.gz LERJIPPMEQGVAY-SFHVURJKSA-N 2 1 325.500 4.462 20 0 EIADMP Cc1cccc(OC[C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551004980 1039867391 /nfs/dbraw/zinc/86/73/91/1039867391.db2.gz CEBLAGYSNCSKAI-DWLFOUALSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1cccc(OC[C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551004980 1039867392 /nfs/dbraw/zinc/86/73/92/1039867392.db2.gz CEBLAGYSNCSKAI-DWLFOUALSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1cccc(C)c1OCC[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000551013212 1039877206 /nfs/dbraw/zinc/87/72/06/1039877206.db2.gz GVXIAUWJKFJCRC-NHCUHLMSSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1cccc(C)c1OCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000551013212 1039877213 /nfs/dbraw/zinc/87/72/13/1039877213.db2.gz GVXIAUWJKFJCRC-NHCUHLMSSA-N 2 1 338.495 4.107 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc(-c3ccccn3)c2)CC1 ZINC000535082789 1039918190 /nfs/dbraw/zinc/91/81/90/1039918190.db2.gz BECLYDWIKDAHMP-UHFFFAOYSA-N 2 1 337.511 4.301 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC[N@@H+]1C ZINC000482010796 1039949576 /nfs/dbraw/zinc/94/95/76/1039949576.db2.gz CLUZNNAZIVUWJU-PVAVHDDUSA-N 2 1 341.524 4.260 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC[N@H+]1C ZINC000482010796 1039949604 /nfs/dbraw/zinc/94/96/04/1039949604.db2.gz CLUZNNAZIVUWJU-PVAVHDDUSA-N 2 1 341.524 4.260 20 0 EIADMP CCC(CC)[C@H](CC[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)OC ZINC000551087466 1039972777 /nfs/dbraw/zinc/97/27/77/1039972777.db2.gz RPWICWWETKKLHR-HKBOAZHASA-N 2 1 332.532 4.253 20 0 EIADMP CCC(CC)[C@H](CC[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)OC ZINC000551087466 1039972799 /nfs/dbraw/zinc/97/27/99/1039972799.db2.gz RPWICWWETKKLHR-HKBOAZHASA-N 2 1 332.532 4.253 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc2ccccc2c1OC(F)F ZINC000482109388 1040021300 /nfs/dbraw/zinc/02/13/00/1040021300.db2.gz KHXPPKMSKZDRCA-CYBMUJFWSA-N 2 1 345.393 4.297 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(-c2ccccc2F)s1 ZINC000482111321 1040022046 /nfs/dbraw/zinc/02/20/46/1040022046.db2.gz AXTJLTQKYUCRGQ-ZDUSSCGKSA-N 2 1 329.444 4.410 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132480 1040026046 /nfs/dbraw/zinc/02/60/46/1040026046.db2.gz YHANFRQDDNUZKB-HRAATJIYSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132480 1040026064 /nfs/dbraw/zinc/02/60/64/1040026064.db2.gz YHANFRQDDNUZKB-HRAATJIYSA-N 2 1 344.449 4.008 20 0 EIADMP CC(C)CC[C@@](C)(O)C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000551266771 1040129034 /nfs/dbraw/zinc/12/90/34/1040129034.db2.gz DUCTULVQMKIMSR-LZBANZJXSA-N 2 1 346.559 4.206 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(F)c(F)c2)CC1 ZINC000551271131 1040134528 /nfs/dbraw/zinc/13/45/28/1040134528.db2.gz UZYMZBDZLNTLNK-UHFFFAOYSA-N 2 1 344.449 4.498 20 0 EIADMP CSC1(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000514697410 1040149784 /nfs/dbraw/zinc/14/97/84/1040149784.db2.gz OOOXJCLXFBHTAQ-MJGOQNOKSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000514697410 1040149825 /nfs/dbraw/zinc/14/98/25/1040149825.db2.gz OOOXJCLXFBHTAQ-MJGOQNOKSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000514697410 1040149855 /nfs/dbraw/zinc/14/98/55/1040149855.db2.gz OOOXJCLXFBHTAQ-MJGOQNOKSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000514697410 1040149888 /nfs/dbraw/zinc/14/98/88/1040149888.db2.gz OOOXJCLXFBHTAQ-MJGOQNOKSA-N 2 1 332.557 4.257 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)Cc3ccc(C)nc3C)C2)s1 ZINC000514734038 1040197550 /nfs/dbraw/zinc/19/75/50/1040197550.db2.gz XZHHUNJNBAZMDY-SFHVURJKSA-N 2 1 343.540 4.022 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)Cc3ccc(C)nc3C)C2)s1 ZINC000514734038 1040197569 /nfs/dbraw/zinc/19/75/69/1040197569.db2.gz XZHHUNJNBAZMDY-SFHVURJKSA-N 2 1 343.540 4.022 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)Cc3ccc(C)nc3C)C2)s1 ZINC000514734038 1040197586 /nfs/dbraw/zinc/19/75/86/1040197586.db2.gz XZHHUNJNBAZMDY-SFHVURJKSA-N 2 1 343.540 4.022 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)Cc3ccc(C)nc3C)C2)s1 ZINC000514734038 1040197594 /nfs/dbraw/zinc/19/75/94/1040197594.db2.gz XZHHUNJNBAZMDY-SFHVURJKSA-N 2 1 343.540 4.022 20 0 EIADMP Cc1ccc2c(c1)C[N@H+](Cc1ccccc1N(C)C1CC[NH+](C)CC1)C2 ZINC000482443286 1040252437 /nfs/dbraw/zinc/25/24/37/1040252437.db2.gz YKZFIQHHGSFHQE-UHFFFAOYSA-N 2 1 349.522 4.041 20 0 EIADMP Cc1ccc2c(c1)C[N@@H+](Cc1ccccc1N(C)C1CC[NH+](C)CC1)C2 ZINC000482443286 1040252457 /nfs/dbraw/zinc/25/24/57/1040252457.db2.gz YKZFIQHHGSFHQE-UHFFFAOYSA-N 2 1 349.522 4.041 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCc3c2cccc3O)CC1 ZINC000482544409 1040343677 /nfs/dbraw/zinc/34/36/77/1040343677.db2.gz SFNKYRYMTNQBSO-UIAACRFSSA-N 2 1 328.500 4.012 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000479447864 1040376292 /nfs/dbraw/zinc/37/62/92/1040376292.db2.gz DRMJOMMKMZWRPQ-NTYOPAKOSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000479466322 1040390942 /nfs/dbraw/zinc/39/09/42/1040390942.db2.gz RNJJXZYXLKYOIR-TVTNDZMWSA-N 2 1 338.470 4.171 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000551533794 1040393759 /nfs/dbraw/zinc/39/37/59/1040393759.db2.gz QOCIATXHKCPLEQ-BNEJOLLZSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000551533794 1040393769 /nfs/dbraw/zinc/39/37/69/1040393769.db2.gz QOCIATXHKCPLEQ-BNEJOLLZSA-N 2 1 340.433 4.414 20 0 EIADMP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479524122 1040421890 /nfs/dbraw/zinc/42/18/90/1040421890.db2.gz HCFROGRAHJCMMZ-PMTKGXAQSA-N 2 1 328.500 4.024 20 0 EIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](CCCc4ccncc4)CC[C@H]32)cc1 ZINC000462314225 1040474344 /nfs/dbraw/zinc/47/43/44/1040474344.db2.gz JBUAKLCMTLYAFJ-DHIUTWEWSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](CCCc4ccncc4)CC[C@H]32)cc1 ZINC000462314225 1040474349 /nfs/dbraw/zinc/47/43/49/1040474349.db2.gz JBUAKLCMTLYAFJ-DHIUTWEWSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](CCCc4ccncc4)CC[C@H]32)cc1 ZINC000462314225 1040474355 /nfs/dbraw/zinc/47/43/55/1040474355.db2.gz JBUAKLCMTLYAFJ-DHIUTWEWSA-N 2 1 349.522 4.001 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]C3CC[NH+](C4CCC4)CC3)oc21 ZINC000539498393 1040489468 /nfs/dbraw/zinc/48/94/68/1040489468.db2.gz NTYYXUXUVGFFSD-OAHLLOKOSA-N 2 1 342.483 4.499 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000539610337 1040608084 /nfs/dbraw/zinc/60/80/84/1040608084.db2.gz WLINRYDIPYYXMG-PILAGYSTSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000539610337 1040608091 /nfs/dbraw/zinc/60/80/91/1040608091.db2.gz WLINRYDIPYYXMG-PILAGYSTSA-N 2 1 340.433 4.414 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccc(OC)c1 ZINC000479850628 1040728236 /nfs/dbraw/zinc/72/82/36/1040728236.db2.gz KXRFDYSRGVYBTF-QFIPXVFZSA-N 2 1 338.495 4.401 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3ccc4c(c3)CCC4)CC2)[nH+]1 ZINC000483172062 1040754632 /nfs/dbraw/zinc/75/46/32/1040754632.db2.gz FCNHWANAAWLHAT-QGZVFWFLSA-N 2 1 335.495 4.198 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CC(C)(C)c4ccccc43)CC2)[nH+]1 ZINC000483191733 1040765331 /nfs/dbraw/zinc/76/53/31/1040765331.db2.gz GCYJSEDPGPRZGK-HXUWFJFHSA-N 2 1 335.495 4.371 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2sccc2OC)CC1)CC1CC1 ZINC000537755605 1040808244 /nfs/dbraw/zinc/80/82/44/1040808244.db2.gz MSNCYCLXTNNTON-UHFFFAOYSA-N 2 1 336.545 4.091 20 0 EIADMP CCCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)cc1OC ZINC000539817427 1040812766 /nfs/dbraw/zinc/81/27/66/1040812766.db2.gz YUKAVFOYRFBYRD-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)cc1OC ZINC000539817427 1040812768 /nfs/dbraw/zinc/81/27/68/1040812768.db2.gz YUKAVFOYRFBYRD-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](CC)[C@H](C)C2)cc1OC ZINC000539817427 1040812773 /nfs/dbraw/zinc/81/27/73/1040812773.db2.gz YUKAVFOYRFBYRD-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](CC)[C@H](C)C2)cc1OC ZINC000539817427 1040812784 /nfs/dbraw/zinc/81/27/84/1040812784.db2.gz YUKAVFOYRFBYRD-MJGOQNOKSA-N 2 1 348.531 4.179 20 0 EIADMP COc1ccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1Cl ZINC000462671957 1040816425 /nfs/dbraw/zinc/81/64/25/1040816425.db2.gz DEUYEWFVOZVPKV-IYBDPMFKSA-N 2 1 338.923 4.196 20 0 EIADMP C[N@@H+](Cc1ccnn1-c1cc[nH+]cc1)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000668235278 1040818468 /nfs/dbraw/zinc/81/84/68/1040818468.db2.gz HRDSXDUIDXKPBP-NHCUHLMSSA-N 2 1 332.451 4.035 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2cccc(OCc3ccccc3)c2)CC[N@@H+]1C ZINC000539838097 1040819537 /nfs/dbraw/zinc/81/95/37/1040819537.db2.gz IRKRVTFGHQCICV-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2cccc(OCc3ccccc3)c2)CC[N@H+]1C ZINC000539838097 1040819543 /nfs/dbraw/zinc/81/95/43/1040819543.db2.gz IRKRVTFGHQCICV-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2cccc(OCc3ccccc3)c2)CC[NH+]1C ZINC000539838097 1040819546 /nfs/dbraw/zinc/81/95/46/1040819546.db2.gz IRKRVTFGHQCICV-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cccc(OCc3ccccc3)c2)CC[NH+]1C ZINC000539838097 1040819547 /nfs/dbraw/zinc/81/95/47/1040819547.db2.gz IRKRVTFGHQCICV-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(F)cc2C(F)(F)F)[C@@H](C)C1 ZINC000539834792 1040829836 /nfs/dbraw/zinc/82/98/36/1040829836.db2.gz FZURXILMAVCPNV-BLLLJJGKSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(F)cc2C(F)(F)F)[C@@H](C)C1 ZINC000539834792 1040829847 /nfs/dbraw/zinc/82/98/47/1040829847.db2.gz FZURXILMAVCPNV-BLLLJJGKSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(F)cc2C(F)(F)F)[C@@H](C)C1 ZINC000539834792 1040829850 /nfs/dbraw/zinc/82/98/50/1040829850.db2.gz FZURXILMAVCPNV-BLLLJJGKSA-N 2 1 332.385 4.007 20 0 EIADMP Cc1cc(C[NH2+]CCC[NH+]2CCC(C)CC2)c(OC(F)F)cc1C ZINC000462675918 1040833205 /nfs/dbraw/zinc/83/32/05/1040833205.db2.gz JSXKVYMZYCAHJP-UHFFFAOYSA-N 2 1 340.458 4.116 20 0 EIADMP Cc1cc(C[NH2+]CCC[N@H+]2CCCC[C@H]2C)c(OC(F)F)cc1C ZINC000462674382 1040833608 /nfs/dbraw/zinc/83/36/08/1040833608.db2.gz HOICPWAZDOKGRQ-MRXNPFEDSA-N 2 1 340.458 4.259 20 0 EIADMP Cc1cc(C[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c(OC(F)F)cc1C ZINC000462674382 1040833620 /nfs/dbraw/zinc/83/36/20/1040833620.db2.gz HOICPWAZDOKGRQ-MRXNPFEDSA-N 2 1 340.458 4.259 20 0 EIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccccc2OC2CCCC2)C1 ZINC000539849127 1040838428 /nfs/dbraw/zinc/83/84/28/1040838428.db2.gz MKFLTZBIDNKMLE-LJQANCHMSA-N 2 1 342.527 4.172 20 0 EIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccccc2OC2CCCC2)C1 ZINC000539849127 1040838434 /nfs/dbraw/zinc/83/84/34/1040838434.db2.gz MKFLTZBIDNKMLE-LJQANCHMSA-N 2 1 342.527 4.172 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccccc2OC2CCCC2)C1 ZINC000539849127 1040838440 /nfs/dbraw/zinc/83/84/40/1040838440.db2.gz MKFLTZBIDNKMLE-LJQANCHMSA-N 2 1 342.527 4.172 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccccc2OC2CCCC2)C1 ZINC000539849127 1040838446 /nfs/dbraw/zinc/83/84/46/1040838446.db2.gz MKFLTZBIDNKMLE-LJQANCHMSA-N 2 1 342.527 4.172 20 0 EIADMP C[C@H](c1ccsc1)[NH+]1CCN(c2cc[nH+]c3cc(F)ccc32)CC1 ZINC000462693313 1040845198 /nfs/dbraw/zinc/84/51/98/1040845198.db2.gz UVTJORDZQVHVQP-CQSZACIVSA-N 2 1 341.455 4.319 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(COc2ccccc2)cc1 ZINC000537988283 1040964540 /nfs/dbraw/zinc/96/45/40/1040964540.db2.gz WHISYYCMHTXXKA-JBYIUTFZSA-N 2 1 338.495 4.084 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CC[N@@H+](C)C[C@@H]1C)c1cccc(C(F)(F)F)c1 ZINC000483700465 1040967883 /nfs/dbraw/zinc/96/78/83/1040967883.db2.gz KTWOGAWJMHEAIV-JKIFEVAISA-N 2 1 328.422 4.129 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCc2c1cc(Cl)cc2Cl ZINC000537967793 1040968834 /nfs/dbraw/zinc/96/88/34/1040968834.db2.gz AMFACMYNTRLZEY-PIGZYNQJSA-N 2 1 338.282 4.412 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)c1ccccn1 ZINC000898523030 1040977307 /nfs/dbraw/zinc/97/73/07/1040977307.db2.gz XLSSUQWYBOFJTM-AYWYSENESA-N 2 1 335.495 4.033 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)c2cccc(Br)c21 ZINC000483734457 1040988589 /nfs/dbraw/zinc/98/85/89/1040988589.db2.gz XDQFQMGZLSZLQF-JXFSHQFZSA-N 2 1 337.305 4.070 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)c2cccc(Br)c21 ZINC000483734457 1040988609 /nfs/dbraw/zinc/98/86/09/1040988609.db2.gz XDQFQMGZLSZLQF-JXFSHQFZSA-N 2 1 337.305 4.070 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000483737429 1040991658 /nfs/dbraw/zinc/99/16/58/1040991658.db2.gz VDDUFOJCKWMKQL-RHSMWYFYSA-N 2 1 340.433 4.057 20 0 EIADMP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000554374164 1041058276 /nfs/dbraw/zinc/05/82/76/1041058276.db2.gz PKOFMVVZQXZXPM-QGLKVJOYSA-N 2 1 330.491 4.157 20 0 EIADMP FC1(CC[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CCC1 ZINC000554374978 1041061661 /nfs/dbraw/zinc/06/16/61/1041061661.db2.gz DFGODXVOKUAYDI-SLFFLAALSA-N 2 1 330.491 4.159 20 0 EIADMP C([NH2+]C1CCC2(CCOCC2)CC1)[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436296300 1041062670 /nfs/dbraw/zinc/06/26/70/1041062670.db2.gz RDYPIIUIANJKJW-FQEVSTJZSA-N 2 1 334.548 4.113 20 0 EIADMP CC[C@H]([NH2+]CC1([NH2+][C@H](C)c2ccccc2)CCCC1)[C@@H]1CCOC1 ZINC000484141041 1041134551 /nfs/dbraw/zinc/13/45/51/1041134551.db2.gz VISRCJNNNABISC-RLLQIKCJSA-N 2 1 330.516 4.055 20 0 EIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000480253197 1041134913 /nfs/dbraw/zinc/13/49/13/1041134913.db2.gz WOSGGUXKBRVXJV-WMZOPIPTSA-N 2 1 342.449 4.262 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000540148278 1041196266 /nfs/dbraw/zinc/19/62/66/1041196266.db2.gz YKEWNEZPRJDYCY-OXQOHEQNSA-N 2 1 326.509 4.268 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@H](c2ccccc2)C(C)C)[C@H](C)C1 ZINC000480331508 1041217749 /nfs/dbraw/zinc/21/77/49/1041217749.db2.gz HBIHUOZWCJGSGI-HJNYFJLDSA-N 2 1 346.559 4.153 20 0 EIADMP COC1(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CCCCC1 ZINC000480342639 1041230992 /nfs/dbraw/zinc/23/09/92/1041230992.db2.gz HYWCDTXUWUOHPM-WMZOPIPTSA-N 2 1 336.545 4.070 20 0 EIADMP COC1(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CCCCC1 ZINC000480342639 1041231004 /nfs/dbraw/zinc/23/10/04/1041231004.db2.gz HYWCDTXUWUOHPM-WMZOPIPTSA-N 2 1 336.545 4.070 20 0 EIADMP COc1cccc(C[C@H](C)[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000540181508 1041245868 /nfs/dbraw/zinc/24/58/68/1041245868.db2.gz LBEIFLGKQXWEFK-DLBZAZTESA-N 2 1 349.478 4.471 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C2CC(c3cc(F)cc(F)c3)C2)c1 ZINC000515918819 1041263039 /nfs/dbraw/zinc/26/30/39/1041263039.db2.gz WZVBYHQRZOHYMO-UHFFFAOYSA-N 2 1 344.449 4.452 20 0 EIADMP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc[nH+]c2ccsc21 ZINC000463063409 1041295762 /nfs/dbraw/zinc/29/57/62/1041295762.db2.gz UHHKOQJBODMATK-KRWDZBQOSA-N 2 1 337.492 4.255 20 0 EIADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc[nH+]c2ccsc21 ZINC000463063409 1041295776 /nfs/dbraw/zinc/29/57/76/1041295776.db2.gz UHHKOQJBODMATK-KRWDZBQOSA-N 2 1 337.492 4.255 20 0 EIADMP Cc1ccccc1OCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463063901 1041298596 /nfs/dbraw/zinc/29/85/96/1041298596.db2.gz FTFGNRQFWPGFJU-TZIWHRDSSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1ccccc1OCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463063901 1041298618 /nfs/dbraw/zinc/29/86/18/1041298618.db2.gz FTFGNRQFWPGFJU-TZIWHRDSSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)o1 ZINC000484496304 1041303899 /nfs/dbraw/zinc/30/38/99/1041303899.db2.gz HGGIDRGDQFUQRD-NUJGCVRESA-N 2 1 326.484 4.395 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]CC2CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000538419235 1041319681 /nfs/dbraw/zinc/31/96/81/1041319681.db2.gz GSAPYNXEZCALMP-NVXWUHKLSA-N 2 1 326.406 4.088 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]CC2CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000538419235 1041319696 /nfs/dbraw/zinc/31/96/96/1041319696.db2.gz GSAPYNXEZCALMP-NVXWUHKLSA-N 2 1 326.406 4.088 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)C1 ZINC000540258969 1041326326 /nfs/dbraw/zinc/32/63/26/1041326326.db2.gz KLUZKOPAYWHPDU-WMLDXEAASA-N 2 1 328.422 4.334 20 0 EIADMP CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000538408849 1041328035 /nfs/dbraw/zinc/32/80/35/1041328035.db2.gz UKAKJSONDKBXFK-INIZCTEOSA-N 2 1 327.299 4.166 20 0 EIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cncc(C(F)(F)F)c1 ZINC000463126810 1041349961 /nfs/dbraw/zinc/34/99/61/1041349961.db2.gz LOSWHICVPHTANZ-RDJZCZTQSA-N 2 1 343.437 4.091 20 0 EIADMP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1cncc(C(F)(F)F)c1 ZINC000463126811 1041350882 /nfs/dbraw/zinc/35/08/82/1041350882.db2.gz LOSWHICVPHTANZ-WBVHZDCISA-N 2 1 343.437 4.091 20 0 EIADMP C[C@@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314502 1041360679 /nfs/dbraw/zinc/36/06/79/1041360679.db2.gz QCMNEYBSHUVOFM-GGPKGHCWSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@H]1CCN(C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314502 1041360693 /nfs/dbraw/zinc/36/06/93/1041360693.db2.gz QCMNEYBSHUVOFM-GGPKGHCWSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314502 1041360707 /nfs/dbraw/zinc/36/07/07/1041360707.db2.gz QCMNEYBSHUVOFM-GGPKGHCWSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314502 1041360719 /nfs/dbraw/zinc/36/07/19/1041360719.db2.gz QCMNEYBSHUVOFM-GGPKGHCWSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463138084 1041372610 /nfs/dbraw/zinc/37/26/10/1041372610.db2.gz UNOZMODIRBJRIK-LAUBAEHRSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463138084 1041372618 /nfs/dbraw/zinc/37/26/18/1041372618.db2.gz UNOZMODIRBJRIK-LAUBAEHRSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)c1ccccc1 ZINC000463149317 1041382266 /nfs/dbraw/zinc/38/22/66/1041382266.db2.gz YQRVMFIUIADSLK-SFHVURJKSA-N 2 1 340.486 4.226 20 0 EIADMP Clc1ccccc1[C@@H]1CCC[C@@H]1[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000414888141 1041386053 /nfs/dbraw/zinc/38/60/53/1041386053.db2.gz XRNHORPVUASYMM-ICSRJNTNSA-N 2 1 343.902 4.141 20 0 EIADMP CCS[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000463189494 1041406589 /nfs/dbraw/zinc/40/65/89/1041406589.db2.gz AKVUGFSKCALAPQ-NHCUHLMSSA-N 2 1 346.584 4.347 20 0 EIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+]([C@H]4C[C@H]4c4ccccc4)C3)C2)cc1 ZINC000463195389 1041409814 /nfs/dbraw/zinc/40/98/14/1041409814.db2.gz WXQLQIMQIKDFFF-VABKMULXSA-N 2 1 332.491 4.141 20 0 EIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+]([C@H]4C[C@H]4c4ccccc4)C3)C2)cc1 ZINC000463195389 1041409819 /nfs/dbraw/zinc/40/98/19/1041409819.db2.gz WXQLQIMQIKDFFF-VABKMULXSA-N 2 1 332.491 4.141 20 0 EIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+]([C@H]4C[C@H]4c4ccccc4)C3)C2)cc1 ZINC000463195389 1041409826 /nfs/dbraw/zinc/40/98/26/1041409826.db2.gz WXQLQIMQIKDFFF-VABKMULXSA-N 2 1 332.491 4.141 20 0 EIADMP CCS[C@H]1CCCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463187575 1041416768 /nfs/dbraw/zinc/41/67/68/1041416768.db2.gz BPNXQKLDODRYRW-SFTDATJTSA-N 2 1 346.584 4.347 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2cccc(OC3CCCC3)c2)CC1 ZINC000506393179 1041422550 /nfs/dbraw/zinc/42/25/50/1041422550.db2.gz BQNCKWWIVYUTSD-UHFFFAOYSA-N 2 1 330.516 4.313 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2cccc(OC3CCCC3)c2)CC1 ZINC000506393179 1041422554 /nfs/dbraw/zinc/42/25/54/1041422554.db2.gz BQNCKWWIVYUTSD-UHFFFAOYSA-N 2 1 330.516 4.313 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[N@H+]2C)cc1OC ZINC000540377593 1041427714 /nfs/dbraw/zinc/42/77/14/1041427714.db2.gz QHYHLNPFPKZLNH-FUHWJXTLSA-N 2 1 334.504 4.009 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000480629484 1041433202 /nfs/dbraw/zinc/43/32/02/1041433202.db2.gz DVGRKGHDZNNMQG-HOTGVXAUSA-N 2 1 340.458 4.451 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCSCc2ccc(Cl)cc2Cl)CC[N@H+]1C ZINC000540396775 1041440712 /nfs/dbraw/zinc/44/07/12/1041440712.db2.gz DLILSPOWAWAWBZ-WFASDCNBSA-N 2 1 347.355 4.299 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(OCC3CC3)cc2)C1 ZINC000480658365 1041458269 /nfs/dbraw/zinc/45/82/69/1041458269.db2.gz CLAIATDHOARKIM-GOSISDBHSA-N 2 1 330.516 4.077 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[N@@H+]1C ZINC000538717702 1041488269 /nfs/dbraw/zinc/48/82/69/1041488269.db2.gz SDEGMBKCMYNOGV-ZBFHGGJFSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[N@H+]1C ZINC000538717702 1041488273 /nfs/dbraw/zinc/48/82/73/1041488273.db2.gz SDEGMBKCMYNOGV-ZBFHGGJFSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[NH+]1C ZINC000538717702 1041488279 /nfs/dbraw/zinc/48/82/79/1041488279.db2.gz SDEGMBKCMYNOGV-ZBFHGGJFSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[NH+]1C ZINC000538717702 1041488286 /nfs/dbraw/zinc/48/82/86/1041488286.db2.gz SDEGMBKCMYNOGV-ZBFHGGJFSA-N 2 1 332.488 4.469 20 0 EIADMP COCCC[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000480723742 1041491102 /nfs/dbraw/zinc/49/11/02/1041491102.db2.gz FCPDDIBIHIVNBU-OTWHNJEPSA-N 2 1 332.532 4.069 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccccc4F)o3)CC[C@@H]21 ZINC000538799164 1041539113 /nfs/dbraw/zinc/53/91/13/1041539113.db2.gz RRENVKHCEKAYTI-BEFAXECRSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(-c4ccccc4F)o3)CC[C@@H]21 ZINC000538799164 1041539124 /nfs/dbraw/zinc/53/91/24/1041539124.db2.gz RRENVKHCEKAYTI-BEFAXECRSA-N 2 1 328.431 4.002 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3cccc(OCC)c3o2)C1 ZINC000540596475 1041552527 /nfs/dbraw/zinc/55/25/27/1041552527.db2.gz BBVPPGDGWVAGES-HOTGVXAUSA-N 2 1 330.472 4.214 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3cccc(OCC)c3o2)C1 ZINC000540596475 1041552535 /nfs/dbraw/zinc/55/25/35/1041552535.db2.gz BBVPPGDGWVAGES-HOTGVXAUSA-N 2 1 330.472 4.214 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000540915734 1041736782 /nfs/dbraw/zinc/73/67/82/1041736782.db2.gz LHCSUNFIYOXKKS-JXFKEZNVSA-N 2 1 328.887 4.361 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000540915734 1041736791 /nfs/dbraw/zinc/73/67/91/1041736791.db2.gz LHCSUNFIYOXKKS-JXFKEZNVSA-N 2 1 328.887 4.361 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000516881759 1041794426 /nfs/dbraw/zinc/79/44/26/1041794426.db2.gz GCGUBAXTWFKXPF-INIZCTEOSA-N 2 1 338.499 4.409 20 0 EIADMP CC(C)(C)[C@H]1CCC[N@H+]1CC1(C[NH+]2CCC[C@H]2C(C)(C)C)COC1 ZINC000541071927 1041798347 /nfs/dbraw/zinc/79/83/47/1041798347.db2.gz RDLDVISRDQIQPI-HDICACEKSA-N 2 1 336.564 4.024 20 0 EIADMP CC(C)(C)[C@H]1CCC[NH+]1CC1(C[N@@H+]2CCC[C@H]2C(C)(C)C)COC1 ZINC000541071927 1041798354 /nfs/dbraw/zinc/79/83/54/1041798354.db2.gz RDLDVISRDQIQPI-HDICACEKSA-N 2 1 336.564 4.024 20 0 EIADMP CC(C)(C)[C@H]1CCC[NH+]1CC1(C[N@H+]2CCC[C@H]2C(C)(C)C)COC1 ZINC000541071927 1041798361 /nfs/dbraw/zinc/79/83/61/1041798361.db2.gz RDLDVISRDQIQPI-HDICACEKSA-N 2 1 336.564 4.024 20 0 EIADMP FC1(F)CC(C[NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000425940690 1042017703 /nfs/dbraw/zinc/01/77/03/1042017703.db2.gz XNIPNMOUVJKIMA-HSALFYBXSA-N 2 1 348.481 4.312 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCn1c2ccccc2c2ccccc21 ZINC000541571129 1042019599 /nfs/dbraw/zinc/01/95/99/1042019599.db2.gz OSXMEAVDWABZPZ-FUHIMQAGSA-N 2 1 335.495 4.113 20 0 EIADMP c1ccc(OCCCCC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000438100028 1042048366 /nfs/dbraw/zinc/04/83/66/1042048366.db2.gz YEJNBWKHWKYFNO-FQEVSTJZSA-N 2 1 330.516 4.186 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]CC[C@H]3CCCC[N@@H+]3C)c(C)c2c1 ZINC000541653727 1042057894 /nfs/dbraw/zinc/05/78/94/1042057894.db2.gz PFBJTIKVSWWYTE-JKSUJKDBSA-N 2 1 330.472 4.275 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]CC[C@H]3CCCC[N@H+]3C)c(C)c2c1 ZINC000541653727 1042057897 /nfs/dbraw/zinc/05/78/97/1042057897.db2.gz PFBJTIKVSWWYTE-JKSUJKDBSA-N 2 1 330.472 4.275 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000517537497 1042070285 /nfs/dbraw/zinc/07/02/85/1042070285.db2.gz VZJUCCNFFKJOCC-KDURUIRLSA-N 2 1 332.532 4.322 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000438201638 1042079150 /nfs/dbraw/zinc/07/91/50/1042079150.db2.gz QIIFDCGFVRMQPE-SYNHAJSKSA-N 2 1 346.515 4.491 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000438201638 1042079159 /nfs/dbraw/zinc/07/91/59/1042079159.db2.gz QIIFDCGFVRMQPE-SYNHAJSKSA-N 2 1 346.515 4.491 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CC[C@@H](Cc4ccccc4)C3)CC2)[nH+]c1 ZINC000438187459 1042081462 /nfs/dbraw/zinc/08/14/62/1042081462.db2.gz JAPIAAHJECBWBK-RBBKRZOGSA-N 2 1 349.522 4.360 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000464782621 1042161685 /nfs/dbraw/zinc/16/16/85/1042161685.db2.gz YTFUOVJONGUGBC-LSDHHAIUSA-N 2 1 328.422 4.430 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000464782621 1042161692 /nfs/dbraw/zinc/16/16/92/1042161692.db2.gz YTFUOVJONGUGBC-LSDHHAIUSA-N 2 1 328.422 4.430 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](CSC)c2ccc(C(F)(F)F)cc2)C1 ZINC000541916180 1042178764 /nfs/dbraw/zinc/17/87/64/1042178764.db2.gz DTIGOMLQKZAYKM-CZUORRHYSA-N 2 1 346.462 4.041 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC000426063596 1042238680 /nfs/dbraw/zinc/23/86/80/1042238680.db2.gz PPOGMKDSJBBIFP-IIDMSEBBSA-N 2 1 336.470 4.095 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC000426063598 1042240185 /nfs/dbraw/zinc/24/01/85/1042240185.db2.gz PPOGMKDSJBBIFP-RVKKMQEKSA-N 2 1 336.470 4.095 20 0 EIADMP OC[C@@H]1CCC[N@H+]1CCCC[NH2+][C@H](c1ccccc1)C1CCCCC1 ZINC000542084054 1042270111 /nfs/dbraw/zinc/27/01/11/1042270111.db2.gz AJFCAXCQVRZOPK-FCHUYYIVSA-N 2 1 344.543 4.135 20 0 EIADMP COc1ccc2cc(C[N@@H+](C)C3CC[NH+](C(C)C)CC3)ccc2c1 ZINC000506386035 1042367306 /nfs/dbraw/zinc/36/73/06/1042367306.db2.gz NMEUMFSNNRBNBA-UHFFFAOYSA-N 2 1 326.484 4.153 20 0 EIADMP COc1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c2ccccc12 ZINC000506386014 1042367502 /nfs/dbraw/zinc/36/75/02/1042367502.db2.gz NGJFDEIBYCGLFD-UHFFFAOYSA-N 2 1 326.484 4.153 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258746 1042436929 /nfs/dbraw/zinc/43/69/29/1042436929.db2.gz TYDROYGRANIVFW-GCJKJVERSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258746 1042436932 /nfs/dbraw/zinc/43/69/32/1042436932.db2.gz TYDROYGRANIVFW-GCJKJVERSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258746 1042436934 /nfs/dbraw/zinc/43/69/34/1042436934.db2.gz TYDROYGRANIVFW-GCJKJVERSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258746 1042436939 /nfs/dbraw/zinc/43/69/39/1042436939.db2.gz TYDROYGRANIVFW-GCJKJVERSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCN3)CC[N@H+]1Cc1ccccc1 ZINC000414974628 1042461829 /nfs/dbraw/zinc/46/18/29/1042461829.db2.gz DUDJKIOKKVBLDZ-PGRDOPGGSA-N 2 1 349.522 4.187 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Br)s2)C2CC2)CC[N@@H+]1C ZINC000439145995 1042519934 /nfs/dbraw/zinc/51/99/34/1042519934.db2.gz KQMAMDAXGJDFIX-HCKVZZMMSA-N 2 1 343.334 4.034 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Br)s2)C2CC2)CC[N@H+]1C ZINC000439145995 1042519938 /nfs/dbraw/zinc/51/99/38/1042519938.db2.gz KQMAMDAXGJDFIX-HCKVZZMMSA-N 2 1 343.334 4.034 20 0 EIADMP CSc1ccc([C@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)cc1 ZINC000173423682 1042572111 /nfs/dbraw/zinc/57/21/11/1042572111.db2.gz AKCRUMMKKAHEQQ-INIZCTEOSA-N 2 1 341.524 4.432 20 0 EIADMP C[C@@H]([NH2+]CCOC1CCCCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492398269 1042634643 /nfs/dbraw/zinc/63/46/43/1042634643.db2.gz GVDWKSMOSKSGOY-CTNGQTDRSA-N 2 1 344.543 4.226 20 0 EIADMP Cc1nc2ccc(C[N@@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2s1 ZINC000426416020 1042680437 /nfs/dbraw/zinc/68/04/37/1042680437.db2.gz GENOXXYBPPVXIJ-QFBILLFUSA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[N@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2s1 ZINC000426416020 1042680439 /nfs/dbraw/zinc/68/04/39/1042680439.db2.gz GENOXXYBPPVXIJ-QFBILLFUSA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[NH+]3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)cc2s1 ZINC000426416020 1042680443 /nfs/dbraw/zinc/68/04/43/1042680443.db2.gz GENOXXYBPPVXIJ-QFBILLFUSA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[NH+]3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)cc2s1 ZINC000426416020 1042680449 /nfs/dbraw/zinc/68/04/49/1042680449.db2.gz GENOXXYBPPVXIJ-QFBILLFUSA-N 2 1 341.524 4.053 20 0 EIADMP C[C@H](c1ccccn1)[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000493106050 1042819581 /nfs/dbraw/zinc/81/95/81/1042819581.db2.gz OCODLTKKIXXSNL-DENIHFKCSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccccn1)[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000493106050 1042819585 /nfs/dbraw/zinc/81/95/85/1042819585.db2.gz OCODLTKKIXXSNL-DENIHFKCSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccccn1)[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000493106050 1042819587 /nfs/dbraw/zinc/81/95/87/1042819587.db2.gz OCODLTKKIXXSNL-DENIHFKCSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@H](c1ccccn1)[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000493106050 1042819590 /nfs/dbraw/zinc/81/95/90/1042819590.db2.gz OCODLTKKIXXSNL-DENIHFKCSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309752623 1042820304 /nfs/dbraw/zinc/82/03/04/1042820304.db2.gz ALUPFKUHCUTAGG-APWZRJJASA-N 2 1 328.887 4.340 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309752623 1042820308 /nfs/dbraw/zinc/82/03/08/1042820308.db2.gz ALUPFKUHCUTAGG-APWZRJJASA-N 2 1 328.887 4.340 20 0 EIADMP Fc1c(Cl)cccc1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309773624 1042821085 /nfs/dbraw/zinc/82/10/85/1042821085.db2.gz BOYXPOOWTWEKPF-MRXNPFEDSA-N 2 1 332.850 4.091 20 0 EIADMP Fc1c(Cl)cccc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309773624 1042821088 /nfs/dbraw/zinc/82/10/88/1042821088.db2.gz BOYXPOOWTWEKPF-MRXNPFEDSA-N 2 1 332.850 4.091 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(Cl)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309875648 1042823145 /nfs/dbraw/zinc/82/31/45/1042823145.db2.gz SYKBHBQASWVKIU-VQIMIIECSA-N 2 1 328.887 4.340 20 0 EIADMP C[C@H]([NH2+]CCSc1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310170866 1042830184 /nfs/dbraw/zinc/83/01/84/1042830184.db2.gz UAUPBAFOHWMDDW-ICSRJNTNSA-N 2 1 340.536 4.279 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310236023 1042832233 /nfs/dbraw/zinc/83/22/33/1042832233.db2.gz KSFFZNFLYDVSOF-QXAKKESOSA-N 2 1 336.470 4.312 20 0 EIADMP CC(C)Oc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310991159 1042849951 /nfs/dbraw/zinc/84/99/51/1042849951.db2.gz HTDJSTJXTMEJGQ-NRFANRHFSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2ncccc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311524979 1042861271 /nfs/dbraw/zinc/86/12/71/1042861271.db2.gz JZUIOWKBHLHJBI-AVRDEDQJSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1OC(F)(F)F ZINC000178254087 1042862240 /nfs/dbraw/zinc/86/22/40/1042862240.db2.gz GSRNHJLJUFPQSH-ZDUSSCGKSA-N 2 1 342.405 4.110 20 0 EIADMP CC[C@H](NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)c1ccc(F)cn1 ZINC000493278730 1042891856 /nfs/dbraw/zinc/89/18/56/1042891856.db2.gz VKLLLNWGLQMDIF-SIXWZSSISA-N 2 1 347.503 4.406 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCCN(C)[C@H]1c1cccs1)c1ccc(F)cn1 ZINC000493278730 1042891858 /nfs/dbraw/zinc/89/18/58/1042891858.db2.gz VKLLLNWGLQMDIF-SIXWZSSISA-N 2 1 347.503 4.406 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+](CC)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000507784520 1042928066 /nfs/dbraw/zinc/92/80/66/1042928066.db2.gz RNPZIUSHFZEVPR-BHIFYINESA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2cc(OC)ccc2c1 ZINC000152418117 1043006379 /nfs/dbraw/zinc/00/63/79/1043006379.db2.gz ANTQRRABYMDJEE-KSFYIVLOSA-N 2 1 338.495 4.373 20 0 EIADMP C[C@H]1CC([NH2+]Cc2ccc(F)c(F)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168006988 1043011186 /nfs/dbraw/zinc/01/11/86/1043011186.db2.gz QDEAVUFQAJBQTG-HOTGVXAUSA-N 2 1 344.449 4.496 20 0 EIADMP C[C@H]1CC([NH2+]Cc2cc(F)cc(F)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168007754 1043023649 /nfs/dbraw/zinc/02/36/49/1043023649.db2.gz UJTWBFCUJKDXST-HOTGVXAUSA-N 2 1 344.449 4.496 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(Oc3ccccc3)o2)C[C@H]1C ZINC000507809880 1043042038 /nfs/dbraw/zinc/04/20/38/1043042038.db2.gz AMADFQBSMHULST-IAGOWNOFSA-N 2 1 328.456 4.377 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168008876 1043085655 /nfs/dbraw/zinc/08/56/55/1043085655.db2.gz YFHVVSLUQIPRRO-UPHUGPLXSA-N 2 1 326.459 4.357 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000310336181 1043125552 /nfs/dbraw/zinc/12/55/52/1043125552.db2.gz BJYGGLMQZQMTDZ-IEBWSBKVSA-N 2 1 326.459 4.389 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](Cc3ccccc3)C(C)C)CC2)[nH+]1 ZINC000427706531 1043170202 /nfs/dbraw/zinc/17/02/02/1043170202.db2.gz UQVHUONWHKKXKG-NRFANRHFSA-N 2 1 337.511 4.216 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657965812 1043222098 /nfs/dbraw/zinc/22/20/98/1043222098.db2.gz BOBQZHSXLJZENT-LNLFQRSKSA-N 2 1 349.478 4.389 20 0 EIADMP FC(F)(F)c1ccc(CCC[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000674005742 1043270545 /nfs/dbraw/zinc/27/05/45/1043270545.db2.gz NJLABTQLIJHLML-KRWDZBQOSA-N 2 1 340.433 4.056 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000508135283 1043287943 /nfs/dbraw/zinc/28/79/43/1043287943.db2.gz DICRAPBCINJDPH-IBGZPJMESA-N 2 1 338.495 4.184 20 0 EIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000166755835 1043311619 /nfs/dbraw/zinc/31/16/19/1043311619.db2.gz PCSDHKPESNIUQL-GGPKGHCWSA-N 2 1 330.516 4.389 20 0 EIADMP CCCc1csc(C[NH2+]Cc2ccc(C[NH+](CC)CC)cc2)n1 ZINC000494365330 1043436586 /nfs/dbraw/zinc/43/65/86/1043436586.db2.gz GAYHBXSOCWYUGZ-UHFFFAOYSA-N 2 1 331.529 4.227 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000520974170 1043458565 /nfs/dbraw/zinc/45/85/65/1043458565.db2.gz RSXKKVMIKSUDEI-CQSZACIVSA-N 2 1 334.916 4.500 20 0 EIADMP c1ccc(C[NH+]2CCCCCC2)c(C[NH2+]Cc2ccc3c(n2)CCC3)c1 ZINC000520989287 1043475974 /nfs/dbraw/zinc/47/59/74/1043475974.db2.gz JUCLYHMMSFRDLG-UHFFFAOYSA-N 2 1 349.522 4.236 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CC[N@@H+]1C ZINC000467439869 1043579420 /nfs/dbraw/zinc/57/94/20/1043579420.db2.gz YBRMTJZSGKCQEM-MXAVVETBSA-N 2 1 327.299 4.312 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CC[N@H+]1C ZINC000467439869 1043579431 /nfs/dbraw/zinc/57/94/31/1043579431.db2.gz YBRMTJZSGKCQEM-MXAVVETBSA-N 2 1 327.299 4.312 20 0 EIADMP C[N@H+](CCCc1ccsc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000543032814 1043589332 /nfs/dbraw/zinc/58/93/32/1043589332.db2.gz WUZLOEZTUVLHQY-UHFFFAOYSA-N 2 1 328.525 4.277 20 0 EIADMP C[N@@H+](CCCc1ccsc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000543032814 1043589358 /nfs/dbraw/zinc/58/93/58/1043589358.db2.gz WUZLOEZTUVLHQY-UHFFFAOYSA-N 2 1 328.525 4.277 20 0 EIADMP Clc1ccc(-c2cc(CN3CCC[C@@H](n4ccnc4)C3)on2)cc1 ZINC000674322010 1043596291 /nfs/dbraw/zinc/59/62/91/1043596291.db2.gz GNFUCFLDGDSRSM-MRXNPFEDSA-N 2 1 342.830 4.029 20 0 EIADMP C[C@@H](N[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(F)cn1 ZINC001168013736 1043647905 /nfs/dbraw/zinc/64/79/05/1043647905.db2.gz IYTDXOCYFHABTD-AXVVYFOYSA-N 2 1 341.474 4.313 20 0 EIADMP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000474033790 1043691366 /nfs/dbraw/zinc/69/13/66/1043691366.db2.gz LUTFVOUQTQHRJI-OXJNMPFZSA-N 2 1 330.516 4.128 20 0 EIADMP CC(C)O[C@@H](C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000428251062 1043695491 /nfs/dbraw/zinc/69/54/91/1043695491.db2.gz YALIBPCCQYJKHA-SFTDATJTSA-N 2 1 330.516 4.103 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1csc(-c2ccc(C)cc2)n1 ZINC000172118888 1043718649 /nfs/dbraw/zinc/71/86/49/1043718649.db2.gz JZMWPJULXUMJBK-OAHLLOKOSA-N 2 1 340.496 4.049 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCC[N@H+](C)Cc2ccccc2)cnn1C(C)(C)C ZINC000191132856 1043784887 /nfs/dbraw/zinc/78/48/87/1043784887.db2.gz JTYGKHUBFRQZHJ-QGZVFWFLSA-N 2 1 342.531 4.119 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)cnn1C(C)(C)C ZINC000191132856 1043784908 /nfs/dbraw/zinc/78/49/08/1043784908.db2.gz JTYGKHUBFRQZHJ-QGZVFWFLSA-N 2 1 342.531 4.119 20 0 EIADMP C[NH+]1CCC([NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442645538 1043794829 /nfs/dbraw/zinc/79/48/29/1043794829.db2.gz IXBUTCUSLCDQMT-WMLDXEAASA-N 2 1 326.406 4.025 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1 ZINC000442714652 1043816586 /nfs/dbraw/zinc/81/65/86/1043816586.db2.gz KNZXCKPJXQAWKJ-IBGZPJMESA-N 2 1 347.506 4.265 20 0 EIADMP C[C@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(O)c1 ZINC000442779929 1043831769 /nfs/dbraw/zinc/83/17/69/1043831769.db2.gz MEMAFWKKJBGKGW-RQXXJAGISA-N 2 1 338.495 4.199 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CCC(C(F)F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000442783431 1043835604 /nfs/dbraw/zinc/83/56/04/1043835604.db2.gz NCNOBHKSVNXMAD-JYPHPWERSA-N 2 1 336.470 4.453 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2CCC(C(F)F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000442783431 1043835606 /nfs/dbraw/zinc/83/56/06/1043835606.db2.gz NCNOBHKSVNXMAD-JYPHPWERSA-N 2 1 336.470 4.453 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442829247 1043859845 /nfs/dbraw/zinc/85/98/45/1043859845.db2.gz UJKWAAVFNUKVRJ-WMZOPIPTSA-N 2 1 338.417 4.193 20 0 EIADMP CC1(C)CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1cnc(Cl)s1 ZINC000282522566 1043861142 /nfs/dbraw/zinc/86/11/42/1043861142.db2.gz PRAWIGGERCUOQT-MRXNPFEDSA-N 2 1 349.931 4.187 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000442872450 1043871168 /nfs/dbraw/zinc/87/11/68/1043871168.db2.gz JNRWJFQWJJIIHR-BJLQDIEVSA-N 2 1 338.495 4.344 20 0 EIADMP CC(C)(C)C[N@@H+]([C@H]1Cc2cccc(Cl)c2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168707188 1043895659 /nfs/dbraw/zinc/89/56/59/1043895659.db2.gz KIVDCCYJOAYXGJ-ULQDDVLXSA-N 2 1 334.935 4.425 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035646 1044173811 /nfs/dbraw/zinc/17/38/11/1044173811.db2.gz CMUWDRBBSFHYDV-KSSFIOAISA-N 2 1 332.875 4.372 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035646 1044173818 /nfs/dbraw/zinc/17/38/18/1044173818.db2.gz CMUWDRBBSFHYDV-KSSFIOAISA-N 2 1 332.875 4.372 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035646 1044173824 /nfs/dbraw/zinc/17/38/24/1044173824.db2.gz CMUWDRBBSFHYDV-KSSFIOAISA-N 2 1 332.875 4.372 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035646 1044173828 /nfs/dbraw/zinc/17/38/28/1044173828.db2.gz CMUWDRBBSFHYDV-KSSFIOAISA-N 2 1 332.875 4.372 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cc(Br)cs1 ZINC000194025883 1044244495 /nfs/dbraw/zinc/24/44/95/1044244495.db2.gz UAXIMWRROPMYSE-QWRGUYRKSA-N 2 1 342.306 4.002 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc3cccs3)C1)CC2 ZINC000479387546 1044244678 /nfs/dbraw/zinc/24/46/78/1044244678.db2.gz HNOCFDRZQQUZSS-FOIQADDNSA-N 2 1 344.499 4.376 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc3cccs3)C1)CC2 ZINC000479387546 1044244695 /nfs/dbraw/zinc/24/46/95/1044244695.db2.gz HNOCFDRZQQUZSS-FOIQADDNSA-N 2 1 344.499 4.376 20 0 EIADMP Cc1[nH]c2ccccc2c1CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000174337440 1044261794 /nfs/dbraw/zinc/26/17/94/1044261794.db2.gz QSWSKQMTYXPILE-UHFFFAOYSA-N 2 1 347.506 4.273 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000675489080 1044360231 /nfs/dbraw/zinc/36/02/31/1044360231.db2.gz FTWITTOWMBUAKI-RTBURBONSA-N 2 1 325.500 4.222 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000675489080 1044360236 /nfs/dbraw/zinc/36/02/36/1044360236.db2.gz FTWITTOWMBUAKI-RTBURBONSA-N 2 1 325.500 4.222 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000675489080 1044360249 /nfs/dbraw/zinc/36/02/49/1044360249.db2.gz FTWITTOWMBUAKI-RTBURBONSA-N 2 1 325.500 4.222 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH2+][C@H]3CC[N@@H+](C)[C@H](C)C3)ccc21 ZINC000327016909 1044405758 /nfs/dbraw/zinc/40/57/58/1044405758.db2.gz HMJOJOWVVUOPHZ-AEFFLSMTSA-N 2 1 335.495 4.387 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+][C@H](C)CCCC(F)(F)F)sc2C1 ZINC000494837429 1044425766 /nfs/dbraw/zinc/42/57/66/1044425766.db2.gz LMENTBSKCOOYCD-GFCCVEGCSA-N 2 1 349.466 4.120 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+][C@H](C)CCCC(F)(F)F)sc2C1 ZINC000494837429 1044425775 /nfs/dbraw/zinc/42/57/75/1044425775.db2.gz LMENTBSKCOOYCD-GFCCVEGCSA-N 2 1 349.466 4.120 20 0 EIADMP Cc1cccc2c1OCC[C@H]2[NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1 ZINC000474090869 1044452835 /nfs/dbraw/zinc/45/28/35/1044452835.db2.gz UVLFWPAXNINBND-NBHGPNQESA-N 2 1 342.527 4.451 20 0 EIADMP C[NH+]1CCC([NH2+][C@H](Cc2ccccc2Cl)c2ccccc2)CC1 ZINC000675733726 1044453023 /nfs/dbraw/zinc/45/30/23/1044453023.db2.gz KEVAMFRZQHJEFF-HXUWFJFHSA-N 2 1 328.887 4.308 20 0 EIADMP CC(C)c1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000675881464 1044552433 /nfs/dbraw/zinc/55/24/33/1044552433.db2.gz LRNOFJIJGBTORW-UWJYYQICSA-N 2 1 330.516 4.104 20 0 EIADMP CC(C)Cc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000675882952 1044556216 /nfs/dbraw/zinc/55/62/16/1044556216.db2.gz VUICZTCSZLWQLP-AVRDEDQJSA-N 2 1 344.543 4.179 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542529916 1044567032 /nfs/dbraw/zinc/56/70/32/1044567032.db2.gz XPSMZAWWEFGTRQ-PKOBYXMFSA-N 2 1 330.516 4.216 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000542529916 1044567039 /nfs/dbraw/zinc/56/70/39/1044567039.db2.gz XPSMZAWWEFGTRQ-PKOBYXMFSA-N 2 1 330.516 4.216 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](C/C=C\c2ccncc2)CC1 ZINC000494984911 1044570487 /nfs/dbraw/zinc/57/04/87/1044570487.db2.gz HQEDPDXVFVUXNP-UTSMFGRCSA-N 2 1 327.516 4.071 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@@H]1C ZINC000443650244 1044620006 /nfs/dbraw/zinc/62/00/06/1044620006.db2.gz CNRDIWCSZUYYLO-YOEHRIQHSA-N 2 1 328.422 4.318 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@@H]1C ZINC000443650244 1044620014 /nfs/dbraw/zinc/62/00/14/1044620014.db2.gz CNRDIWCSZUYYLO-YOEHRIQHSA-N 2 1 328.422 4.318 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@@H]1C ZINC000443650244 1044620024 /nfs/dbraw/zinc/62/00/24/1044620024.db2.gz CNRDIWCSZUYYLO-YOEHRIQHSA-N 2 1 328.422 4.318 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000359943104 1044651878 /nfs/dbraw/zinc/65/18/78/1044651878.db2.gz PSPRUQWKDFYUCS-QAPCUYQASA-N 2 1 336.520 4.464 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C[C@H]3CCC4(CCC4)O3)CC[N@@H+]2C2CC2)cc1 ZINC000895677918 1044845027 /nfs/dbraw/zinc/84/50/27/1044845027.db2.gz TXMRSVJHRKMXOT-TYPHKJRUSA-N 2 1 340.511 4.046 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C[C@H]3CCC4(CCC4)O3)CC[N@H+]2C2CC2)cc1 ZINC000895677918 1044845031 /nfs/dbraw/zinc/84/50/31/1044845031.db2.gz TXMRSVJHRKMXOT-TYPHKJRUSA-N 2 1 340.511 4.046 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000673599493 1044858944 /nfs/dbraw/zinc/85/89/44/1044858944.db2.gz XWQAXESQCHBZEQ-KAMYIIQDSA-N 2 1 338.417 4.325 20 0 EIADMP CCC(C)(C)c1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)cc1 ZINC000509022462 1044943779 /nfs/dbraw/zinc/94/37/79/1044943779.db2.gz PUPVVBJVJQUNND-PWRODBHTSA-N 2 1 344.543 4.058 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cscc1Br ZINC000512148702 1044968319 /nfs/dbraw/zinc/96/83/19/1044968319.db2.gz XVWISMMKMHIPOS-ZDUSSCGKSA-N 2 1 345.350 4.255 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)ccc1SC(F)F ZINC000766165395 1045003831 /nfs/dbraw/zinc/00/38/31/1045003831.db2.gz HMMUKYUBGFFJEA-OBJOEFQTSA-N 2 1 344.471 4.143 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1SC(F)F ZINC000766165395 1045003847 /nfs/dbraw/zinc/00/38/47/1045003847.db2.gz HMMUKYUBGFFJEA-OBJOEFQTSA-N 2 1 344.471 4.143 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCC[C@@H]1c1ccc(Br)cc1C ZINC000626010348 1045125731 /nfs/dbraw/zinc/12/57/31/1045125731.db2.gz OTKMYWPYIHLTBB-QGZVFWFLSA-N 2 1 348.288 4.100 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCC[C@@H]1c1ccc(Br)cc1C ZINC000626010348 1045125738 /nfs/dbraw/zinc/12/57/38/1045125738.db2.gz OTKMYWPYIHLTBB-QGZVFWFLSA-N 2 1 348.288 4.100 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@H](C)CCc3ccccc3)CCCC2)CC1 ZINC000495445481 1045129947 /nfs/dbraw/zinc/12/99/47/1045129947.db2.gz WIEDGYDPPABASQ-LJQANCHMSA-N 2 1 344.543 4.021 20 0 EIADMP Cc1nc([C@@H](C)[N@H+]2CC[C@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000923480068 1045132281 /nfs/dbraw/zinc/13/22/81/1045132281.db2.gz DULRNROEFBNKEI-KGLIPLIRSA-N 2 1 333.863 4.035 20 0 EIADMP c1cc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]CC4)CC3)cs2)co1 ZINC000923505797 1045139223 /nfs/dbraw/zinc/13/92/23/1045139223.db2.gz CIWPDTMPMPQTJP-HNNXBMFYSA-N 2 1 345.512 4.005 20 0 EIADMP CC[N@H+](Cc1cc(-c2ccco2)on1)Cc1ccc(C[NH+](C)C)cc1 ZINC000626061777 1045165151 /nfs/dbraw/zinc/16/51/51/1045165151.db2.gz VALZCDVFJOCJIY-UHFFFAOYSA-N 2 1 339.439 4.018 20 0 EIADMP CC[N@@H+](Cc1cc(-c2ccco2)on1)Cc1ccc(C[NH+](C)C)cc1 ZINC000626061777 1045165158 /nfs/dbraw/zinc/16/51/58/1045165158.db2.gz VALZCDVFJOCJIY-UHFFFAOYSA-N 2 1 339.439 4.018 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)[C@@H](C)c1nc2ccccc2o1 ZINC000626062809 1045165830 /nfs/dbraw/zinc/16/58/30/1045165830.db2.gz HJBRBAVZNYWQMN-INIZCTEOSA-N 2 1 337.467 4.473 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2scnc2C2CC2)[C@@H]1c1cccs1 ZINC000487272993 1045223901 /nfs/dbraw/zinc/22/39/01/1045223901.db2.gz SCFNNOWRBPJRBO-RDTXWAMCSA-N 2 1 347.553 4.255 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2scnc2C2CC2)[C@@H]1c1cccs1 ZINC000487272993 1045223911 /nfs/dbraw/zinc/22/39/11/1045223911.db2.gz SCFNNOWRBPJRBO-RDTXWAMCSA-N 2 1 347.553 4.255 20 0 EIADMP c1ccc(C[NH+](CCC[NH2+]Cc2ccncc2)Cc2ccccc2)cc1 ZINC000236717467 1045365202 /nfs/dbraw/zinc/36/52/02/1045365202.db2.gz DMOITVKDLORNJS-UHFFFAOYSA-N 2 1 345.490 4.264 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3ccc(C)cc3)cc2)C1 ZINC000236826142 1045367200 /nfs/dbraw/zinc/36/72/00/1045367200.db2.gz SISYZVMZWKMAIR-OAQYLSRUSA-N 2 1 338.495 4.005 20 0 EIADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000236933533 1045370588 /nfs/dbraw/zinc/37/05/88/1045370588.db2.gz VGOVUDYSBILZFS-MRXNPFEDSA-N 2 1 330.447 4.216 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000236933533 1045370590 /nfs/dbraw/zinc/37/05/90/1045370590.db2.gz VGOVUDYSBILZFS-MRXNPFEDSA-N 2 1 330.447 4.216 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH2+]C[C@@H]3CCC[N@@H+](C)C3)ccc21 ZINC000237006617 1045372898 /nfs/dbraw/zinc/37/28/98/1045372898.db2.gz FLTCUGOJJNBEKR-SFHVURJKSA-N 2 1 335.495 4.246 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001168501373 1045498184 /nfs/dbraw/zinc/49/81/84/1045498184.db2.gz NWQGYCWPOPCJOZ-QGZVFWFLSA-N 2 1 332.507 4.486 20 0 EIADMP c1ccc(Sc2ccc(C[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)cc2)cc1 ZINC000533607789 1045648541 /nfs/dbraw/zinc/64/85/41/1045648541.db2.gz CIRJATGWKMDJSE-GOSISDBHSA-N 2 1 338.520 4.412 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccccc2Br)cc1 ZINC000768162745 1045728786 /nfs/dbraw/zinc/72/87/86/1045728786.db2.gz HJLURRLSCQYHFT-UHFFFAOYSA-N 2 1 347.300 4.143 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccccc2Br)cc1 ZINC000768162745 1045728770 /nfs/dbraw/zinc/72/87/70/1045728770.db2.gz HJLURRLSCQYHFT-UHFFFAOYSA-N 2 1 347.300 4.143 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cncc3ccccc32)CC1 ZINC000768303477 1045784513 /nfs/dbraw/zinc/78/45/13/1045784513.db2.gz OVCAISYRAHHXGL-UHFFFAOYSA-N 2 1 325.500 4.179 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1)c1ccccc1 ZINC000246919724 1045835828 /nfs/dbraw/zinc/83/58/28/1045835828.db2.gz GQXFIXXRVNQOTE-AVRDEDQJSA-N 2 1 338.495 4.148 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1)c1ccccc1 ZINC000246919724 1045835829 /nfs/dbraw/zinc/83/58/29/1045835829.db2.gz GQXFIXXRVNQOTE-AVRDEDQJSA-N 2 1 338.495 4.148 20 0 EIADMP CC[C@@H]1C[C@H]([N@@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170188949 1045920668 /nfs/dbraw/zinc/92/06/68/1045920668.db2.gz ABUPYMWCKAGVFT-XRXFAXGQSA-N 2 1 330.516 4.025 20 0 EIADMP C[N@H+](Cc1ccc(SC(F)(F)F)cc1)CC1CC[NH+](C)CC1 ZINC000769331757 1045925200 /nfs/dbraw/zinc/92/52/00/1045925200.db2.gz XISRSQSFNAHNHM-UHFFFAOYSA-N 2 1 332.435 4.072 20 0 EIADMP Cc1cc(C)cc(C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC001170206171 1045926111 /nfs/dbraw/zinc/92/61/11/1045926111.db2.gz RJNURJMPOHTNCS-HSZRJFAPSA-N 2 1 334.507 4.401 20 0 EIADMP Cc1cc(C)cc(C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC001170206171 1045926118 /nfs/dbraw/zinc/92/61/18/1045926118.db2.gz RJNURJMPOHTNCS-HSZRJFAPSA-N 2 1 334.507 4.401 20 0 EIADMP Cc1cc(C)cc(C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1 ZINC001170206171 1045926126 /nfs/dbraw/zinc/92/61/26/1045926126.db2.gz RJNURJMPOHTNCS-HSZRJFAPSA-N 2 1 334.507 4.401 20 0 EIADMP C[C@@H](CCC1CC1)Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000769419448 1045955458 /nfs/dbraw/zinc/95/54/58/1045955458.db2.gz USRCMSBOYAELRP-KRWDZBQOSA-N 2 1 329.532 4.455 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCCCCOc2ccc(Cl)cc2)CC[N@H+]1C ZINC000769418083 1045956740 /nfs/dbraw/zinc/95/67/40/1045956740.db2.gz TXKYLQFKIWMIBN-SJLPKXTDSA-N 2 1 338.923 4.352 20 0 EIADMP c1cc2cc[nH+]c(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2[nH]1 ZINC001170333895 1046005179 /nfs/dbraw/zinc/00/51/79/1046005179.db2.gz YFLKNIJYJFVFBC-LDLYASANSA-N 2 1 332.451 4.170 20 0 EIADMP c1cc2cc[nH+]c(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)c2[nH]1 ZINC001170333895 1046005192 /nfs/dbraw/zinc/00/51/92/1046005192.db2.gz YFLKNIJYJFVFBC-LDLYASANSA-N 2 1 332.451 4.170 20 0 EIADMP [NH3+][C@@H]1CCc2c1cccc2N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001170336812 1046005769 /nfs/dbraw/zinc/00/57/69/1046005769.db2.gz FUZMTIXHVKRNCN-NXWNEQKCSA-N 2 1 347.506 4.240 20 0 EIADMP Cc1cccc(C)c1OCCC[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000496934823 1046107684 /nfs/dbraw/zinc/10/76/84/1046107684.db2.gz UNTQZSLRUUNMBL-UHFFFAOYSA-N 2 1 330.516 4.023 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@H](c2ccccc2)C(C)C)cn1 ZINC000792921297 1046108135 /nfs/dbraw/zinc/10/81/35/1046108135.db2.gz FNCVDLAPUTVVCL-FQEVSTJZSA-N 2 1 334.467 4.105 20 0 EIADMP COc1ccccc1-c1ccc([C@@H](C)[N@@H+](C)C[C@H]2CCC[NH2+]C2)cc1 ZINC000261745936 1046144209 /nfs/dbraw/zinc/14/42/09/1046144209.db2.gz BWMYVDZTRPWFBR-MSOLQXFVSA-N 2 1 338.495 4.355 20 0 EIADMP CCOc1ccc([C@H]2CCC[N@@H+]2CCCCn2cc[nH+]c2C)cc1 ZINC000125430353 1046307608 /nfs/dbraw/zinc/30/76/08/1046307608.db2.gz IJVGSZJERBOTJE-HXUWFJFHSA-N 2 1 327.472 4.208 20 0 EIADMP CCOc1ccc([C@H]2CCC[N@H+]2CCCCn2cc[nH+]c2C)cc1 ZINC000125430353 1046307620 /nfs/dbraw/zinc/30/76/20/1046307620.db2.gz IJVGSZJERBOTJE-HXUWFJFHSA-N 2 1 327.472 4.208 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000125519912 1046313380 /nfs/dbraw/zinc/31/33/80/1046313380.db2.gz JPPPRNNWJFTIDO-GOSISDBHSA-N 2 1 349.931 4.415 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000125519912 1046313398 /nfs/dbraw/zinc/31/33/98/1046313398.db2.gz JPPPRNNWJFTIDO-GOSISDBHSA-N 2 1 349.931 4.415 20 0 EIADMP C[C@H]([NH2+]CC1(c2ccccc2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710702 1046369345 /nfs/dbraw/zinc/36/93/45/1046369345.db2.gz NRFRVNSJNRLIAS-FPOVZHCZSA-N 2 1 334.507 4.218 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c(C)n1 ZINC000771384109 1046383533 /nfs/dbraw/zinc/38/35/33/1046383533.db2.gz OAZMSYJPTRDXBB-GOSISDBHSA-N 2 1 329.532 4.394 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1OCC ZINC000125985795 1046407788 /nfs/dbraw/zinc/40/77/88/1046407788.db2.gz VVTYGTIODRYDLR-ZWKOTPCHSA-N 2 1 348.531 4.255 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CCC[C@@H](C(F)(F)F)C3)CC2)[nH+]1 ZINC000127052074 1046600795 /nfs/dbraw/zinc/60/07/95/1046600795.db2.gz HBAFSUPOFUUDQL-ZBFHGGJFSA-N 2 1 341.421 4.070 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)[C@@H](C)C1 ZINC000536659054 1046608956 /nfs/dbraw/zinc/60/89/56/1046608956.db2.gz AQNSURGEIHJDTB-HNAYVOBHSA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)[C@@H](C)C1 ZINC000536659054 1046608966 /nfs/dbraw/zinc/60/89/66/1046608966.db2.gz AQNSURGEIHJDTB-HNAYVOBHSA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3F)o2)[C@@H](C)C1 ZINC000536659054 1046608969 /nfs/dbraw/zinc/60/89/69/1046608969.db2.gz AQNSURGEIHJDTB-HNAYVOBHSA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)[C@@H](C)C1 ZINC000536659054 1046608979 /nfs/dbraw/zinc/60/89/79/1046608979.db2.gz AQNSURGEIHJDTB-HNAYVOBHSA-N 2 1 330.447 4.248 20 0 EIADMP C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000459397837 1046614910 /nfs/dbraw/zinc/61/49/10/1046614910.db2.gz KIRRKBHOXJBHNB-LBPRGKRZSA-N 2 1 327.299 4.141 20 0 EIADMP CCOc1cc(C[N@H+](C)[C@H]2CCN(C)[C@@H](C)C2)ccc1OCC(C)C ZINC000536658655 1046621562 /nfs/dbraw/zinc/62/15/62/1046621562.db2.gz PMXMAAFICKTECU-HKUYNNGSSA-N 2 1 348.531 4.035 20 0 EIADMP CCOc1cc(C[N@@H+](C)[C@H]2CCN(C)[C@@H](C)C2)ccc1OCC(C)C ZINC000536658655 1046621575 /nfs/dbraw/zinc/62/15/75/1046621575.db2.gz PMXMAAFICKTECU-HKUYNNGSSA-N 2 1 348.531 4.035 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cnc(-c3ccsc3)s2)[C@@H](C)C1 ZINC000536661022 1046629209 /nfs/dbraw/zinc/62/92/09/1046629209.db2.gz VBTAQFGTOSWVRH-XJKSGUPXSA-N 2 1 335.542 4.034 20 0 EIADMP c1ccc(-c2cccc3c2OCC[C@H]3[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000459411909 1046630177 /nfs/dbraw/zinc/63/01/77/1046630177.db2.gz KGPYPFJEIPNYPE-JOCHJYFZSA-N 2 1 348.490 4.394 20 0 EIADMP C[C@H](c1ccc2c(c1)CCC2)[N@@H+]1CC[C@H](C[NH+](C)Cc2cccnc2)C1 ZINC000459449015 1046677341 /nfs/dbraw/zinc/67/73/41/1046677341.db2.gz WXBOZTZIWBFDGI-UYAOXDASSA-N 2 1 349.522 4.085 20 0 EIADMP C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@H](C[NH+](C)Cc2cccnc2)C1 ZINC000459449015 1046677349 /nfs/dbraw/zinc/67/73/49/1046677349.db2.gz WXBOZTZIWBFDGI-UYAOXDASSA-N 2 1 349.522 4.085 20 0 EIADMP C[C@H](c1ccc2c(c1)CCC2)[NH+]1CC[C@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000459449015 1046677354 /nfs/dbraw/zinc/67/73/54/1046677354.db2.gz WXBOZTZIWBFDGI-UYAOXDASSA-N 2 1 349.522 4.085 20 0 EIADMP C[C@H](c1ccc2c(c1)CCC2)[NH+]1CC[C@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000459449015 1046677363 /nfs/dbraw/zinc/67/73/63/1046677363.db2.gz WXBOZTZIWBFDGI-UYAOXDASSA-N 2 1 349.522 4.085 20 0 EIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536694854 1046689682 /nfs/dbraw/zinc/68/96/82/1046689682.db2.gz AWNYUKBOZJDSLP-KRWDZBQOSA-N 2 1 342.458 4.249 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536694854 1046689705 /nfs/dbraw/zinc/68/97/05/1046689705.db2.gz AWNYUKBOZJDSLP-KRWDZBQOSA-N 2 1 342.458 4.249 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536694854 1046689712 /nfs/dbraw/zinc/68/97/12/1046689712.db2.gz AWNYUKBOZJDSLP-KRWDZBQOSA-N 2 1 342.458 4.249 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536694854 1046689738 /nfs/dbraw/zinc/68/97/38/1046689738.db2.gz AWNYUKBOZJDSLP-KRWDZBQOSA-N 2 1 342.458 4.249 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(OC)c3ccccc23)C1 ZINC000536695778 1046692673 /nfs/dbraw/zinc/69/26/73/1046692673.db2.gz FOHCGYIKXYMJDF-KRWDZBQOSA-N 2 1 326.484 4.012 20 0 EIADMP Cc1cc2cc(C[NH+]3CC[C@@H](C[N@H+](C)CC4CC4)C3)oc2cc1C ZINC000536698652 1046694204 /nfs/dbraw/zinc/69/42/04/1046694204.db2.gz VXCRUHBDYPNZQQ-SFHVURJKSA-N 2 1 326.484 4.213 20 0 EIADMP Cc1cc2cc(C[NH+]3CC[C@@H](C[N@@H+](C)CC4CC4)C3)oc2cc1C ZINC000536698652 1046694227 /nfs/dbraw/zinc/69/42/27/1046694227.db2.gz VXCRUHBDYPNZQQ-SFHVURJKSA-N 2 1 326.484 4.213 20 0 EIADMP Cc1cc2cc(C[N@H+]3CC[C@@H](C[NH+](C)CC4CC4)C3)oc2cc1C ZINC000536698652 1046694242 /nfs/dbraw/zinc/69/42/42/1046694242.db2.gz VXCRUHBDYPNZQQ-SFHVURJKSA-N 2 1 326.484 4.213 20 0 EIADMP Cc1cc2cc(C[N@@H+]3CC[C@@H](C[NH+](C)CC4CC4)C3)oc2cc1C ZINC000536698652 1046694256 /nfs/dbraw/zinc/69/42/56/1046694256.db2.gz VXCRUHBDYPNZQQ-SFHVURJKSA-N 2 1 326.484 4.213 20 0 EIADMP C[C@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)[C@H]1CC1(C)C ZINC000785497559 1046698659 /nfs/dbraw/zinc/69/86/59/1046698659.db2.gz SHSFEMITMMVZQS-OXJNMPFZSA-N 2 1 329.532 4.311 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H](COc2ccccc2Cl)C1 ZINC000127612562 1046705308 /nfs/dbraw/zinc/70/53/08/1046705308.db2.gz QVHCJBFDKYHHOO-KRWDZBQOSA-N 2 1 347.890 4.026 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H](COc2ccccc2Cl)C1 ZINC000127612562 1046705324 /nfs/dbraw/zinc/70/53/24/1046705324.db2.gz QVHCJBFDKYHHOO-KRWDZBQOSA-N 2 1 347.890 4.026 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(F)cc1F ZINC000536714355 1046707186 /nfs/dbraw/zinc/70/71/86/1046707186.db2.gz XRUCMJPDOMPLQZ-UHFFFAOYSA-N 2 1 345.437 4.098 20 0 EIADMP CN(Cc1ccccn1)[C@H]1CCC[N@@H+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501873 1046727638 /nfs/dbraw/zinc/72/76/38/1046727638.db2.gz FGQYJHDKVOHITG-QHCPKHFHSA-N 2 1 349.522 4.446 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@H]1CCC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501873 1046727658 /nfs/dbraw/zinc/72/76/58/1046727658.db2.gz FGQYJHDKVOHITG-QHCPKHFHSA-N 2 1 349.522 4.446 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501873 1046727670 /nfs/dbraw/zinc/72/76/70/1046727670.db2.gz FGQYJHDKVOHITG-QHCPKHFHSA-N 2 1 349.522 4.446 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@H+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501873 1046727685 /nfs/dbraw/zinc/72/76/85/1046727685.db2.gz FGQYJHDKVOHITG-QHCPKHFHSA-N 2 1 349.522 4.446 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@@H+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501873 1046727704 /nfs/dbraw/zinc/72/77/04/1046727704.db2.gz FGQYJHDKVOHITG-QHCPKHFHSA-N 2 1 349.522 4.446 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3cc(F)ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000379644803 1046737621 /nfs/dbraw/zinc/73/76/21/1046737621.db2.gz CPYLNOWWZTYXQS-CNDZOEFASA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3cc(F)ccc32)CC[N@H+]1Cc1ccccc1 ZINC000379644803 1046737635 /nfs/dbraw/zinc/73/76/35/1046737635.db2.gz CPYLNOWWZTYXQS-CNDZOEFASA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCCC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000379651223 1046744179 /nfs/dbraw/zinc/74/41/79/1046744179.db2.gz UJEQNTIMWVEJHV-NEWSRXKRSA-N 2 1 336.470 4.455 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CCC1 ZINC000536845148 1046817465 /nfs/dbraw/zinc/81/74/65/1046817465.db2.gz KRPJOJPOCREQLT-CTNGQTDRSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC(C)(C)c1c(Cl)cccc1Cl ZINC000536865824 1046830625 /nfs/dbraw/zinc/83/06/25/1046830625.db2.gz XXYXFRFIGLYFAS-IUODEOHRSA-N 2 1 329.315 4.201 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000459723562 1046864722 /nfs/dbraw/zinc/86/47/22/1046864722.db2.gz ADDZODQHPOSTON-ZQDZILKHSA-N 2 1 326.937 4.215 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000536961941 1046869681 /nfs/dbraw/zinc/86/96/81/1046869681.db2.gz VMVPKWCRSKGGDB-DNVCBOLYSA-N 2 1 345.487 4.085 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536998059 1046889741 /nfs/dbraw/zinc/88/97/41/1046889741.db2.gz CYABIDFZTKQNEC-RHSMWYFYSA-N 2 1 328.422 4.334 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccc(OCC2CC2)c(F)c1 ZINC000537123102 1046954834 /nfs/dbraw/zinc/95/48/34/1046954834.db2.gz CMRWDMLZFHNVEX-QAPCUYQASA-N 2 1 334.479 4.140 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(OCC2CC2)c(F)c1 ZINC000537123102 1046954864 /nfs/dbraw/zinc/95/48/64/1046954864.db2.gz CMRWDMLZFHNVEX-QAPCUYQASA-N 2 1 334.479 4.140 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000537303717 1047086249 /nfs/dbraw/zinc/08/62/49/1047086249.db2.gz IVOYGQAYMOPURI-OLZOCXBDSA-N 2 1 343.298 4.001 20 0 EIADMP Clc1ccc2c(n1)[C@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CC2 ZINC000788507878 1047210186 /nfs/dbraw/zinc/21/01/86/1047210186.db2.gz SMEXIFKBKHDTSS-GOSISDBHSA-N 2 1 341.886 4.108 20 0 EIADMP FC(F)(F)[C@H]1CCC[C@@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)C1 ZINC000129219292 1047335288 /nfs/dbraw/zinc/33/52/88/1047335288.db2.gz DLMPSPYFIORTEK-ZWKOTPCHSA-N 2 1 340.433 4.146 20 0 EIADMP FC(F)(F)[C@H]1CCC[C@@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)C1 ZINC000129219292 1047335304 /nfs/dbraw/zinc/33/53/04/1047335304.db2.gz DLMPSPYFIORTEK-ZWKOTPCHSA-N 2 1 340.433 4.146 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3cncc4ccccc43)CC2)n2c1CCCC2 ZINC000789352967 1047401309 /nfs/dbraw/zinc/40/13/09/1047401309.db2.gz OGPCSADSWVJTOG-UHFFFAOYSA-N 2 1 346.478 4.147 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c(C)o1 ZINC000556064119 1047429124 /nfs/dbraw/zinc/42/91/24/1047429124.db2.gz UCCNHDDYVMBLGJ-XLIONFOSSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c(C)o1 ZINC000556064119 1047429129 /nfs/dbraw/zinc/42/91/29/1047429129.db2.gz UCCNHDDYVMBLGJ-XLIONFOSSA-N 2 1 326.484 4.112 20 0 EIADMP CC(C)c1nc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cs1 ZINC000556075642 1047434507 /nfs/dbraw/zinc/43/45/07/1047434507.db2.gz DGGBLIQOHPWMPT-MJGOQNOKSA-N 2 1 343.540 4.234 20 0 EIADMP CC(C)c1nc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cs1 ZINC000556075642 1047434511 /nfs/dbraw/zinc/43/45/11/1047434511.db2.gz DGGBLIQOHPWMPT-MJGOQNOKSA-N 2 1 343.540 4.234 20 0 EIADMP C[C@H]1CC[C@H]([NH+]2CCC([NH3+])(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170120355 1047476659 /nfs/dbraw/zinc/47/66/59/1047476659.db2.gz GBMJJHJTIQBRRH-BBRMVZONSA-N 2 1 326.406 4.144 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793514 1047483019 /nfs/dbraw/zinc/48/30/19/1047483019.db2.gz NYKKORCOSLZHGD-MOPGFXCFSA-N 2 1 344.568 4.447 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793514 1047483025 /nfs/dbraw/zinc/48/30/25/1047483025.db2.gz NYKKORCOSLZHGD-MOPGFXCFSA-N 2 1 344.568 4.447 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000897796005 1047484539 /nfs/dbraw/zinc/48/45/39/1047484539.db2.gz VUSHWYNCVIPERR-YTQUADARSA-N 2 1 332.557 4.161 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)[C@H]1CCOC1 ZINC000129870867 1047520765 /nfs/dbraw/zinc/52/07/65/1047520765.db2.gz JVLZYAAJTGNTJR-UNMCSNQZSA-N 2 1 344.543 4.356 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2cccc3[nH]ccc32)C[C@H]1c1ccccc1 ZINC000556179746 1047540050 /nfs/dbraw/zinc/54/00/50/1047540050.db2.gz WELFNQHLHCGYMI-UGKGYDQZSA-N 2 1 333.479 4.136 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2cccc3[nH]ccc32)C[C@H]1c1ccccc1 ZINC000556179746 1047540065 /nfs/dbraw/zinc/54/00/65/1047540065.db2.gz WELFNQHLHCGYMI-UGKGYDQZSA-N 2 1 333.479 4.136 20 0 EIADMP COc1cccc(C[N@H+]2CCC3(C2)CC[NH+]([C@@H]2CC[C@@H](C)C2)CC3)c1 ZINC001170136348 1047590735 /nfs/dbraw/zinc/59/07/35/1047590735.db2.gz JUMFUVWXXICUSI-UYAOXDASSA-N 2 1 342.527 4.172 20 0 EIADMP COc1cccc(C[N@H+]2CCC3(C2)CC[NH+]([C@H]2CC[C@H](C)C2)CC3)c1 ZINC001170136346 1047591737 /nfs/dbraw/zinc/59/17/37/1047591737.db2.gz JUMFUVWXXICUSI-ICSRJNTNSA-N 2 1 342.527 4.172 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)[C@]1(C)CCCO1 ZINC000556235957 1047601489 /nfs/dbraw/zinc/60/14/89/1047601489.db2.gz KQPARIKCOFEPCD-LQWHRVPQSA-N 2 1 330.516 4.108 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@@H](c3ccncc3)C3CC3)CC23CC3)cc1 ZINC000898319172 1047621952 /nfs/dbraw/zinc/62/19/52/1047621952.db2.gz AGVIOLJACPGLIP-FCHUYYIVSA-N 2 1 347.506 4.320 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@@H](c3ccncc3)C3CC3)CC23CC3)cc1 ZINC000898319172 1047621954 /nfs/dbraw/zinc/62/19/54/1047621954.db2.gz AGVIOLJACPGLIP-FCHUYYIVSA-N 2 1 347.506 4.320 20 0 EIADMP C[N@@H+](CCCN[C@H]1CC[NH+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608679 1047758650 /nfs/dbraw/zinc/75/86/50/1047758650.db2.gz LGJMVKAZCANWIW-RBBKRZOGSA-N 2 1 343.559 4.066 20 0 EIADMP C[NH+](CCCN[C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608679 1047758656 /nfs/dbraw/zinc/75/86/56/1047758656.db2.gz LGJMVKAZCANWIW-RBBKRZOGSA-N 2 1 343.559 4.066 20 0 EIADMP C[NH+](CCCN[C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608679 1047758663 /nfs/dbraw/zinc/75/86/63/1047758663.db2.gz LGJMVKAZCANWIW-RBBKRZOGSA-N 2 1 343.559 4.066 20 0 EIADMP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC000556590219 1047830661 /nfs/dbraw/zinc/83/06/61/1047830661.db2.gz TWXKLECJMUBYKM-XHIHJMKYSA-N 2 1 344.543 4.289 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCO[C@@H]3CCCC[C@H]3C)C2)CC1 ZINC000498881060 1047896923 /nfs/dbraw/zinc/89/69/23/1047896923.db2.gz QYBNAQFZDAAKKN-NJDAHSKKSA-N 2 1 336.564 4.026 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCO[C@@H]3CCCC[C@H]3C)C2)CC1 ZINC000498881060 1047896927 /nfs/dbraw/zinc/89/69/27/1047896927.db2.gz QYBNAQFZDAAKKN-NJDAHSKKSA-N 2 1 336.564 4.026 20 0 EIADMP 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 1047915945 /nfs/dbraw/zinc/91/59/45/1047915945.db2.gz AODVUVOTIVNVBX-RYBYCUDRSA-N 2 1 342.527 4.202 20 0 EIADMP C[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000824775076 1047930635 /nfs/dbraw/zinc/93/06/35/1047930635.db2.gz YFVHBNRDGSHPJV-BHYGNILZSA-N 2 1 341.326 4.071 20 0 EIADMP CC1(C)[C@@H]2C[C@H]([N@@H+](Cc3ccccc3F)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170741017 1047962995 /nfs/dbraw/zinc/96/29/95/1047962995.db2.gz XCQZCKOUSVONKL-YCEIQTCASA-N 2 1 330.491 4.332 20 0 EIADMP Cc1ccc2c(C[N@@H+](C)C[C@@H]3CC[NH+](Cc4ccccc4)C3)c[nH]c2c1 ZINC001136974635 1048006549 /nfs/dbraw/zinc/00/65/49/1048006549.db2.gz GYPYLKYHJZLMED-FQEVSTJZSA-N 2 1 347.506 4.430 20 0 EIADMP Cc1ccc2c(C[NH+](C)C[C@@H]3CC[N@H+](Cc4ccccc4)C3)c[nH]c2c1 ZINC001136974635 1048006563 /nfs/dbraw/zinc/00/65/63/1048006563.db2.gz GYPYLKYHJZLMED-FQEVSTJZSA-N 2 1 347.506 4.430 20 0 EIADMP Cc1ccc2c(C[NH+](C)C[C@@H]3CC[N@@H+](Cc4ccccc4)C3)c[nH]c2c1 ZINC001136974635 1048006576 /nfs/dbraw/zinc/00/65/76/1048006576.db2.gz GYPYLKYHJZLMED-FQEVSTJZSA-N 2 1 347.506 4.430 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccccc1)[C@H](O)c1ccccc1 ZINC000808787737 1048109662 /nfs/dbraw/zinc/10/96/62/1048109662.db2.gz YTTGECOGUVXYEO-FCHUYYIVSA-N 2 1 349.478 4.036 20 0 EIADMP CCCC(C[NH3+])(CCC)[NH2+][C@@H](C)Cc1ccc(Br)cc1 ZINC001246495516 1048175522 /nfs/dbraw/zinc/17/55/22/1048175522.db2.gz LDPYQJXVSMWSPT-AWEZNQCLSA-N 2 1 341.337 4.267 20 0 EIADMP CCOc1c(F)cc(C[N@@H+](C(C)C)C2CCN(C)CC2)cc1Cl ZINC001143746719 1048181355 /nfs/dbraw/zinc/18/13/55/1048181355.db2.gz UDWVFDGLXWBJQO-UHFFFAOYSA-N 2 1 342.886 4.182 20 0 EIADMP Cc1c[nH+]ccc1N1CC[NH+](Cc2cccc(C(F)(F)F)c2C)CC1 ZINC001143929659 1048297840 /nfs/dbraw/zinc/29/78/40/1048297840.db2.gz VEBXSXAMPIVSDU-UHFFFAOYSA-N 2 1 349.400 4.039 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499166236 1048361621 /nfs/dbraw/zinc/36/16/21/1048361621.db2.gz DRHTZUUWQKVBLA-ACDBMABISA-N 2 1 340.536 4.384 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H]2CCc4ccccc4C2)C3)cc1 ZINC000499164510 1048372294 /nfs/dbraw/zinc/37/22/94/1048372294.db2.gz OFZVSRHICCXJAA-YCAMKHIRSA-N 2 1 346.518 4.329 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cnc(Cl)c(C)c1 ZINC000809739338 1048511294 /nfs/dbraw/zinc/51/12/94/1048511294.db2.gz HNLVLTKEQWUIJF-UHFFFAOYSA-N 2 1 331.891 4.127 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)C/C=C/c2ccc(F)c(F)c2)cc1 ZINC000809738810 1048513657 /nfs/dbraw/zinc/51/36/57/1048513657.db2.gz KTNCHWGXUACSFM-SNAWJCMRSA-N 2 1 330.422 4.172 20 0 EIADMP C[NH+](C)[C@H](CNc1cccc(C[NH3+])c1)c1ccc(Cl)cc1Cl ZINC001170587412 1048543510 /nfs/dbraw/zinc/54/35/10/1048543510.db2.gz DPCHVEXNJQRZGC-QGZVFWFLSA-N 2 1 338.282 4.167 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc1O ZINC000810214481 1048682707 /nfs/dbraw/zinc/68/27/07/1048682707.db2.gz YQFFQMOEWUUBDO-MRXNPFEDSA-N 2 1 346.515 4.096 20 0 EIADMP C[N@H+](Cc1ccccc1)C1CC[NH+](Cc2cccc3cc[nH]c32)CC1 ZINC001144716831 1048816549 /nfs/dbraw/zinc/81/65/49/1048816549.db2.gz KZCHLBOJZUMMEH-UHFFFAOYSA-N 2 1 333.479 4.264 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CC[NH+](Cc2cccc3cc[nH]c32)CC1 ZINC001144716831 1048816552 /nfs/dbraw/zinc/81/65/52/1048816552.db2.gz KZCHLBOJZUMMEH-UHFFFAOYSA-N 2 1 333.479 4.264 20 0 EIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(SC(F)F)cc2)C1 ZINC000174949642 1049024576 /nfs/dbraw/zinc/02/45/76/1049024576.db2.gz GLLFGBQHLBVIGW-HNNXBMFYSA-N 2 1 328.472 4.165 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(SC(F)F)cc2)C1 ZINC000174949642 1049024587 /nfs/dbraw/zinc/02/45/87/1049024587.db2.gz GLLFGBQHLBVIGW-HNNXBMFYSA-N 2 1 328.472 4.165 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(SC(F)F)cc2)C1 ZINC000174949642 1049024597 /nfs/dbraw/zinc/02/45/97/1049024597.db2.gz GLLFGBQHLBVIGW-HNNXBMFYSA-N 2 1 328.472 4.165 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(SC(F)F)cc2)C1 ZINC000174949642 1049024607 /nfs/dbraw/zinc/02/46/07/1049024607.db2.gz GLLFGBQHLBVIGW-HNNXBMFYSA-N 2 1 328.472 4.165 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Cl)sc1Cl ZINC000817947673 1049063975 /nfs/dbraw/zinc/06/39/75/1049063975.db2.gz FLCWIDRZALDPPL-SNVBAGLBSA-N 2 1 329.296 4.407 20 0 EIADMP CC(C)C1=[NH+]CCc2ccc(-n3c(CC[NH3+])cc4ccccc43)cc21 ZINC001171304785 1049151346 /nfs/dbraw/zinc/15/13/46/1049151346.db2.gz YDNIMRQZTNQQEJ-UHFFFAOYSA-N 2 1 331.463 4.133 20 0 EIADMP CC[C@H]([NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C1CCOCC1 ZINC000348095366 1049416171 /nfs/dbraw/zinc/41/61/71/1049416171.db2.gz KZGFXGBEFLANCZ-YWZLYKJASA-N 2 1 327.472 4.037 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170679990 1049510766 /nfs/dbraw/zinc/51/07/66/1049510766.db2.gz FLRMGJBJUPAUKA-BHIYHBOVSA-N 2 1 348.481 4.337 20 0 EIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1CCCO1 ZINC000820829451 1049564311 /nfs/dbraw/zinc/56/43/11/1049564311.db2.gz JLOLZGTZHBMGKF-GLHNNUHNSA-N 2 1 342.527 4.119 20 0 EIADMP c1cc(C2CCCC2)ccc1C[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000812756423 1049567877 /nfs/dbraw/zinc/56/78/77/1049567877.db2.gz JQKZGRGXVZYMJE-QFIPXVFZSA-N 2 1 342.527 4.077 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171382823 1049580883 /nfs/dbraw/zinc/58/08/83/1049580883.db2.gz NCBIFYMSGSSTNA-SFHVURJKSA-N 2 1 336.470 4.018 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)[C@@H]2CCc3cccc(F)c3C2)CC1 ZINC001170968047 1049659650 /nfs/dbraw/zinc/65/96/50/1049659650.db2.gz BDNSHDTWTGEAAV-VAMGGRTRSA-N 2 1 344.518 4.445 20 0 EIADMP FC1(F)CCC([NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)CC1 ZINC000716716090 1049703343 /nfs/dbraw/zinc/70/33/43/1049703343.db2.gz ZNVYCAGQONXAJS-WDSOQIARSA-N 2 1 334.454 4.207 20 0 EIADMP CC(F)(F)C(C)(C)C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716715763 1049704207 /nfs/dbraw/zinc/70/42/07/1049704207.db2.gz DNQATEGATDXOIW-KSZLIROESA-N 2 1 336.470 4.311 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171496519 1049723533 /nfs/dbraw/zinc/72/35/33/1049723533.db2.gz CWNPFIVRHUUGST-GOSISDBHSA-N 2 1 336.470 4.018 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171471823 1049727879 /nfs/dbraw/zinc/72/78/79/1049727879.db2.gz KPPKIBYUZYRJCC-BZSNNMDCSA-N 2 1 336.470 4.050 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001171549485 1049751927 /nfs/dbraw/zinc/75/19/27/1049751927.db2.gz BIQMJWUUJMPWAQ-AJSBUHFISA-N 2 1 348.534 4.495 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001171549485 1049751935 /nfs/dbraw/zinc/75/19/35/1049751935.db2.gz BIQMJWUUJMPWAQ-AJSBUHFISA-N 2 1 348.534 4.495 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171558896 1049755511 /nfs/dbraw/zinc/75/55/11/1049755511.db2.gz PYKAJMZQSLHPFR-CEMLEFRQSA-N 2 1 349.522 4.019 20 0 EIADMP c1csc(CC[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000813371259 1049760740 /nfs/dbraw/zinc/76/07/40/1049760740.db2.gz SWAPRLHCRHJQJV-UHFFFAOYSA-N 2 1 340.536 4.279 20 0 EIADMP Cc1ccc(CC[C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001171658626 1049771930 /nfs/dbraw/zinc/77/19/30/1049771930.db2.gz TXNNNIOJXHZJKC-OFNKIYASSA-N 2 1 336.523 4.428 20 0 EIADMP COc1cccc(CCC[N@@H+](C)C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171641420 1049779267 /nfs/dbraw/zinc/77/92/67/1049779267.db2.gz GVVDOJYMPNRXCG-UHFFFAOYSA-N 2 1 332.532 4.211 20 0 EIADMP COc1ccc(C2=CC[N@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)CC2)cc1 ZINC001171641630 1049779525 /nfs/dbraw/zinc/77/95/25/1049779525.db2.gz RGOKBETWMDNECK-UHFFFAOYSA-N 2 1 342.527 4.436 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171731436 1049786803 /nfs/dbraw/zinc/78/68/03/1049786803.db2.gz BCAYVCOJERKCFZ-CZTZKLFOSA-N 2 1 349.522 4.258 20 0 EIADMP C[C@@H]1C[C@H](n2c3ccccc3c3c2CC[NH2+]C3)C[N@H+]1Cc1ccccc1 ZINC001171758561 1049790026 /nfs/dbraw/zinc/79/00/26/1049790026.db2.gz YFEPCTJRVFZIBL-MJGOQNOKSA-N 2 1 345.490 4.123 20 0 EIADMP C[NH2+]CCc1cn([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171760336 1049792052 /nfs/dbraw/zinc/79/20/52/1049792052.db2.gz UDOQZCXTVGNIOX-WIYYLYMNSA-N 2 1 347.506 4.239 20 0 EIADMP C[C@@H]1C[C@@H](NC(=[NH2+])c2cccc3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC001171733927 1049799335 /nfs/dbraw/zinc/79/93/35/1049799335.db2.gz KEAHRFUYTXSYHN-YLJYHZDGSA-N 2 1 343.474 4.418 20 0 EIADMP C[C@@H]1C[C@@H](NC(=[NH2+])c2cccc3ccccc32)C[N@H+]1Cc1ccccc1 ZINC001171733927 1049799348 /nfs/dbraw/zinc/79/93/48/1049799348.db2.gz KEAHRFUYTXSYHN-YLJYHZDGSA-N 2 1 343.474 4.418 20 0 EIADMP CCO[C@@H](CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)C ZINC000245652582 1049812637 /nfs/dbraw/zinc/81/26/37/1049812637.db2.gz CWXFAGRQCRRPFQ-KJJMTIBFSA-N 2 1 344.543 4.223 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2cccc(F)c2C1 ZINC001171005855 1049819938 /nfs/dbraw/zinc/81/99/38/1049819938.db2.gz RMTJOBAMWPCHOP-IPMKNSEASA-N 2 1 330.491 4.022 20 0 EIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC001171961720 1049825308 /nfs/dbraw/zinc/82/53/08/1049825308.db2.gz BGGPRKUOGFDREG-IIDMSEBBSA-N 2 1 342.449 4.345 20 0 EIADMP CC1(C)C[C@@H](N2CC[C@](C)(F)[C@@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976021 1049837538 /nfs/dbraw/zinc/83/75/38/1049837538.db2.gz HQLDSDPMRPKLFW-BJLQDIEVSA-N 2 1 336.470 4.202 20 0 EIADMP CCN(Cc1ccncc1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977618 1049837693 /nfs/dbraw/zinc/83/76/93/1049837693.db2.gz SHISKEFPNWJLNH-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@H+](Cc1ccncc1)[C@H]1CCN(Cc2ccccc2)C(C)(C)C1 ZINC001171977618 1049837696 /nfs/dbraw/zinc/83/76/96/1049837696.db2.gz SHISKEFPNWJLNH-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@@H+](Cc1ccncc1)[C@H]1CCN(Cc2ccccc2)C(C)(C)C1 ZINC001171977618 1049837697 /nfs/dbraw/zinc/83/76/97/1049837697.db2.gz SHISKEFPNWJLNH-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@H+](Cc1ccncc1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171977618 1049837699 /nfs/dbraw/zinc/83/76/99/1049837699.db2.gz SHISKEFPNWJLNH-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@@H+](Cc1ccncc1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171977618 1049837702 /nfs/dbraw/zinc/83/77/02/1049837702.db2.gz SHISKEFPNWJLNH-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[NH+](Cc1ccncc1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977618 1049837703 /nfs/dbraw/zinc/83/77/03/1049837703.db2.gz SHISKEFPNWJLNH-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[NH+](Cc1ccncc1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977618 1049837704 /nfs/dbraw/zinc/83/77/04/1049837704.db2.gz SHISKEFPNWJLNH-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@H+](Cc1cccnc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074669 1049844651 /nfs/dbraw/zinc/84/46/51/1049844651.db2.gz JXAUWNISXCPPCH-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP CC[N@@H+](Cc1cccnc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074669 1049844654 /nfs/dbraw/zinc/84/46/54/1049844654.db2.gz JXAUWNISXCPPCH-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP CC[NH+](Cc1cccnc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172074669 1049844658 /nfs/dbraw/zinc/84/46/58/1049844658.db2.gz JXAUWNISXCPPCH-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP CC[NH+](Cc1cccnc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172074669 1049844661 /nfs/dbraw/zinc/84/46/61/1049844661.db2.gz JXAUWNISXCPPCH-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP CCOC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172073846 1049845124 /nfs/dbraw/zinc/84/51/24/1049845124.db2.gz DACGTFIMTHEKFR-AERCQKQUSA-N 2 1 342.527 4.073 20 0 EIADMP FCC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172075688 1049845278 /nfs/dbraw/zinc/84/52/78/1049845278.db2.gz SCYLYTZUTRNJBI-AERCQKQUSA-N 2 1 330.491 4.254 20 0 EIADMP C[N@@H+](C[C@H]1CCCCO1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076440 1049845307 /nfs/dbraw/zinc/84/53/07/1049845307.db2.gz YOKNTWVFPLFCQJ-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP C[NH+](C[C@H]1CCCCO1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076440 1049845308 /nfs/dbraw/zinc/84/53/08/1049845308.db2.gz YOKNTWVFPLFCQJ-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP C[NH+](C[C@H]1CCCCO1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076440 1049845310 /nfs/dbraw/zinc/84/53/10/1049845310.db2.gz YOKNTWVFPLFCQJ-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@H]1CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172075204 1049845470 /nfs/dbraw/zinc/84/54/70/1049845470.db2.gz OROAGRMQZDFVLN-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172075204 1049845474 /nfs/dbraw/zinc/84/54/74/1049845474.db2.gz OROAGRMQZDFVLN-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172075204 1049845476 /nfs/dbraw/zinc/84/54/76/1049845476.db2.gz OROAGRMQZDFVLN-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@H]1CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172075210 1049845588 /nfs/dbraw/zinc/84/55/88/1049845588.db2.gz OROAGRMQZDFVLN-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172075210 1049845589 /nfs/dbraw/zinc/84/55/89/1049845589.db2.gz OROAGRMQZDFVLN-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP CCO[C@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172075210 1049845592 /nfs/dbraw/zinc/84/55/92/1049845592.db2.gz OROAGRMQZDFVLN-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP COC1(C)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172080417 1049846197 /nfs/dbraw/zinc/84/61/97/1049846197.db2.gz VRSPCTSQFLTMJW-AERCQKQUSA-N 2 1 342.527 4.073 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2(c4cccnc4)CC2)C3)cc1 ZINC001172078373 1049846319 /nfs/dbraw/zinc/84/63/19/1049846319.db2.gz YYRUBDRJZODUGJ-DKUWSORSSA-N 2 1 347.506 4.246 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2(c4cccnc4)CC2)C3)cc1 ZINC001172078373 1049846320 /nfs/dbraw/zinc/84/63/20/1049846320.db2.gz YYRUBDRJZODUGJ-DKUWSORSSA-N 2 1 347.506 4.246 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2(c4cccnc4)CC2)C3)cc1 ZINC001172078374 1049846383 /nfs/dbraw/zinc/84/63/83/1049846383.db2.gz YYRUBDRJZODUGJ-KOUNCHBCSA-N 2 1 347.506 4.246 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2(c4cccnc4)CC2)C3)cc1 ZINC001172078374 1049846384 /nfs/dbraw/zinc/84/63/84/1049846384.db2.gz YYRUBDRJZODUGJ-KOUNCHBCSA-N 2 1 347.506 4.246 20 0 EIADMP CO[C@@H]1CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H](C)C1 ZINC001172089924 1049848362 /nfs/dbraw/zinc/84/83/62/1049848362.db2.gz SSJAVIZOBKQIMN-XBJCXQGOSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H](C)C1 ZINC001172089924 1049848365 /nfs/dbraw/zinc/84/83/65/1049848365.db2.gz SSJAVIZOBKQIMN-XBJCXQGOSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@@H](C)C1 ZINC001172089924 1049848368 /nfs/dbraw/zinc/84/83/68/1049848368.db2.gz SSJAVIZOBKQIMN-XBJCXQGOSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@@H](C)C1 ZINC001172089924 1049848370 /nfs/dbraw/zinc/84/83/70/1049848370.db2.gz SSJAVIZOBKQIMN-XBJCXQGOSA-N 2 1 342.527 4.071 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CCCc2ccncc2)C3)cc1 ZINC001172061429 1049849504 /nfs/dbraw/zinc/84/95/04/1049849504.db2.gz HDALGIZFDAQJLB-WBDAEOGXSA-N 2 1 349.522 4.190 20 0 EIADMP Cc1ncccc1CN[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172062004 1049849792 /nfs/dbraw/zinc/84/97/92/1049849792.db2.gz KQSLYPZDXVNEIY-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ncccc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172062004 1049849801 /nfs/dbraw/zinc/84/98/01/1049849801.db2.gz KQSLYPZDXVNEIY-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCCC[C@H]1OCc1ccccc1)C2 ZINC001172098207 1049850410 /nfs/dbraw/zinc/85/04/10/1049850410.db2.gz BUXLJIZEAMZAEU-QMCAAQAGSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCCC[C@H]1OCc1ccccc1)C2 ZINC001172098207 1049850411 /nfs/dbraw/zinc/85/04/11/1049850411.db2.gz BUXLJIZEAMZAEU-QMCAAQAGSA-N 2 1 342.527 4.119 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccnc1 ZINC001172069612 1049852537 /nfs/dbraw/zinc/85/25/37/1049852537.db2.gz VTHZOJRCJNEBRA-AGOPTVSRSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccnc1 ZINC001172069612 1049852542 /nfs/dbraw/zinc/85/25/42/1049852542.db2.gz VTHZOJRCJNEBRA-AGOPTVSRSA-N 2 1 335.495 4.318 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@H](Sc3ccc(F)cc3)C1)C2 ZINC001172127693 1049853421 /nfs/dbraw/zinc/85/34/21/1049853421.db2.gz JKAXFLHWPPWBSE-FAJBIJEISA-N 2 1 334.504 4.007 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@H](Sc3ccc(F)cc3)C1)C2 ZINC001172127693 1049853422 /nfs/dbraw/zinc/85/34/22/1049853422.db2.gz JKAXFLHWPPWBSE-FAJBIJEISA-N 2 1 334.504 4.007 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CC[C@H](Sc3ccc(F)cc3)C1)C2 ZINC001172127693 1049853424 /nfs/dbraw/zinc/85/34/24/1049853424.db2.gz JKAXFLHWPPWBSE-FAJBIJEISA-N 2 1 334.504 4.007 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CC[C@H](Sc3ccc(F)cc3)C1)C2 ZINC001172127693 1049853426 /nfs/dbraw/zinc/85/34/26/1049853426.db2.gz JKAXFLHWPPWBSE-FAJBIJEISA-N 2 1 334.504 4.007 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@]3(CCc4c3cccc4F)C1)C2 ZINC001172133606 1049855076 /nfs/dbraw/zinc/85/50/76/1049855076.db2.gz UACFFLSCCOQYKS-BZDHPDOMSA-N 2 1 342.502 4.121 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@]3(CCc4c3cccc4F)C1)C2 ZINC001172133606 1049855077 /nfs/dbraw/zinc/85/50/77/1049855077.db2.gz UACFFLSCCOQYKS-BZDHPDOMSA-N 2 1 342.502 4.121 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@]3(CCc4c3cccc4F)C1)C2 ZINC001172133606 1049855079 /nfs/dbraw/zinc/85/50/79/1049855079.db2.gz UACFFLSCCOQYKS-BZDHPDOMSA-N 2 1 342.502 4.121 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1cccc(Cl)c1Cl)C2 ZINC001172103982 1049856515 /nfs/dbraw/zinc/85/65/15/1049856515.db2.gz YJBWADCSVWNWMH-QKDCVEJESA-N 2 1 327.299 4.141 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccccc1N1CCCCCC1)C2 ZINC001172103759 1049857652 /nfs/dbraw/zinc/85/76/52/1049857652.db2.gz XLTCMMHIEIBZKG-WKCHPHFGSA-N 2 1 341.543 4.172 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172118213 1049858076 /nfs/dbraw/zinc/85/80/76/1049858076.db2.gz OJLDNISDHUYWKT-FICVDOATSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1ccc(Cl)c(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172118213 1049858079 /nfs/dbraw/zinc/85/80/79/1049858079.db2.gz OJLDNISDHUYWKT-FICVDOATSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1ccc(Cl)c(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172118213 1049858080 /nfs/dbraw/zinc/85/80/80/1049858080.db2.gz OJLDNISDHUYWKT-FICVDOATSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccc1)Cc1cccnc1)C2 ZINC001172122999 1049858111 /nfs/dbraw/zinc/85/81/11/1049858111.db2.gz XARZRQDCIXVRLY-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccc1)Cc1cccnc1)C2 ZINC001172122999 1049858116 /nfs/dbraw/zinc/85/81/16/1049858116.db2.gz XARZRQDCIXVRLY-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+](Cc1ccccc1)Cc1cccnc1)C2 ZINC001172122999 1049858118 /nfs/dbraw/zinc/85/81/18/1049858118.db2.gz XARZRQDCIXVRLY-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+](Cc1ccccc1)Cc1cccnc1)C2 ZINC001172122999 1049858120 /nfs/dbraw/zinc/85/81/20/1049858120.db2.gz XARZRQDCIXVRLY-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](Cc1ccccc1)c1nccs1)C2 ZINC001172112227 1049858286 /nfs/dbraw/zinc/85/82/86/1049858286.db2.gz UFHQGPDPGPTCIZ-RDGPPVDQSA-N 2 1 341.524 4.032 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(Cc3cccc(F)c3)CCC1)C2 ZINC001172112555 1049858204 /nfs/dbraw/zinc/85/82/04/1049858204.db2.gz XPGPDJCLJZHIFH-ACDBMABISA-N 2 1 330.491 4.143 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](Cc1ccccc1)c1nccs1)C2 ZINC001172112227 1049858287 /nfs/dbraw/zinc/85/82/87/1049858287.db2.gz UFHQGPDPGPTCIZ-RDGPPVDQSA-N 2 1 341.524 4.032 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Oc3cccc(Cl)c3)CC1)C2 ZINC001172122328 1049858391 /nfs/dbraw/zinc/85/83/91/1049858391.db2.gz PCTHIFRYDXJIIJ-BCDXTJNWSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Oc3cccc(Cl)c3)CC1)C2 ZINC001172122328 1049858393 /nfs/dbraw/zinc/85/83/93/1049858393.db2.gz PCTHIFRYDXJIIJ-BCDXTJNWSA-N 2 1 348.918 4.199 20 0 EIADMP COc1cccc([C@@H]2CCCC[N@@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172124240 1049860553 /nfs/dbraw/zinc/86/05/53/1049860553.db2.gz JTGJLQZFFFBPMS-JTJHWIPRSA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@@H]2CCCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172124240 1049860555 /nfs/dbraw/zinc/86/05/55/1049860555.db2.gz JTGJLQZFFFBPMS-JTJHWIPRSA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@@H]2CCCC[NH+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172124240 1049860558 /nfs/dbraw/zinc/86/05/58/1049860558.db2.gz JTGJLQZFFFBPMS-JTJHWIPRSA-N 2 1 328.500 4.238 20 0 EIADMP COc1cccc([C@@H]2CCCC[NH+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172124240 1049860560 /nfs/dbraw/zinc/86/05/60/1049860560.db2.gz JTGJLQZFFFBPMS-JTJHWIPRSA-N 2 1 328.500 4.238 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)[C@@H]2CSc3ccccc3C2)CC1 ZINC001172203524 1049863427 /nfs/dbraw/zinc/86/34/27/1049863427.db2.gz XMQPAJKMAFMGFM-UFYCRDLUSA-N 2 1 344.568 4.466 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001172319420 1049877417 /nfs/dbraw/zinc/87/74/17/1049877417.db2.gz QUNPRFHXWOVOBT-BGJPATFMSA-N 2 1 344.543 4.080 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C[C@H]1C ZINC001172375053 1049885180 /nfs/dbraw/zinc/88/51/80/1049885180.db2.gz BSPJXIGMVIFUHO-JBYIUTFZSA-N 2 1 326.528 4.334 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C[C@H]1C ZINC001172375053 1049885186 /nfs/dbraw/zinc/88/51/86/1049885186.db2.gz BSPJXIGMVIFUHO-JBYIUTFZSA-N 2 1 326.528 4.334 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001172355740 1049893978 /nfs/dbraw/zinc/89/39/78/1049893978.db2.gz VVIGZIMKPNJNIS-SVFBPWRDSA-N 2 1 332.532 4.034 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001172355740 1049893984 /nfs/dbraw/zinc/89/39/84/1049893984.db2.gz VVIGZIMKPNJNIS-SVFBPWRDSA-N 2 1 332.532 4.034 20 0 EIADMP CCOCC[C@@H](C)[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172420247 1049900875 /nfs/dbraw/zinc/90/08/75/1049900875.db2.gz LIPGYAVJXIBKLB-ATZDWAIDSA-N 2 1 338.923 4.227 20 0 EIADMP CC(C)COCC[C@H](C)[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172475938 1049908258 /nfs/dbraw/zinc/90/82/58/1049908258.db2.gz NQPXAQNTCOGMRU-UNMCSNQZSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)COCC[C@H](C)[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172475938 1049908262 /nfs/dbraw/zinc/90/82/62/1049908262.db2.gz NQPXAQNTCOGMRU-UNMCSNQZSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)COCC[C@H](C)[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172475938 1049908265 /nfs/dbraw/zinc/90/82/65/1049908265.db2.gz NQPXAQNTCOGMRU-UNMCSNQZSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)OCC[C@@H](C)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172437569 1049912705 /nfs/dbraw/zinc/91/27/05/1049912705.db2.gz RKIXQVPGDRDMJT-BHIYHBOVSA-N 2 1 336.495 4.101 20 0 EIADMP CC(C)OCC[C@@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172436703 1049912714 /nfs/dbraw/zinc/91/27/14/1049912714.db2.gz HHVGBJKSTISEAM-QUCCMNQESA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)OCC[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172436703 1049912720 /nfs/dbraw/zinc/91/27/20/1049912720.db2.gz HHVGBJKSTISEAM-QUCCMNQESA-N 2 1 332.532 4.080 20 0 EIADMP Cc1ccc(C[N@H+]([C@H](C)CCOC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001172445527 1049915110 /nfs/dbraw/zinc/91/51/10/1049915110.db2.gz RINDMENROHRHFC-HMXCVIKNSA-N 2 1 332.532 4.271 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccnc2)[C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172554711 1049930131 /nfs/dbraw/zinc/93/01/31/1049930131.db2.gz BSWMPTLOXXKZTC-ODAXIHTASA-N 2 1 349.522 4.490 20 0 EIADMP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@H]1CCC[N@H+]1C ZINC001172568176 1049938281 /nfs/dbraw/zinc/93/82/81/1049938281.db2.gz OXUPDLNJZHBXJM-TZMCWYRMSA-N 2 1 330.850 4.013 20 0 EIADMP CC1(C)CC([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC(C)(C)O1 ZINC001172644816 1049954995 /nfs/dbraw/zinc/95/49/95/1049954995.db2.gz ZSGCMJYCJZNEPP-LJQANCHMSA-N 2 1 344.543 4.224 20 0 EIADMP CC1(C)CC([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC(C)(C)O1 ZINC001172644814 1049955048 /nfs/dbraw/zinc/95/50/48/1049955048.db2.gz ZSGCMJYCJZNEPP-IBGZPJMESA-N 2 1 344.543 4.224 20 0 EIADMP Clc1ccc2c(c1)C[C@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001172716989 1049963763 /nfs/dbraw/zinc/96/37/63/1049963763.db2.gz CQOYCAKNRKWRDN-VQTJNVASSA-N 2 1 332.919 4.148 20 0 EIADMP Cc1nccn1CCCC[N@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000246381272 1049965145 /nfs/dbraw/zinc/96/51/45/1049965145.db2.gz ZPMBSVJLYIKFJS-BEFAXECRSA-N 2 1 327.472 4.353 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000246381272 1049965152 /nfs/dbraw/zinc/96/51/52/1049965152.db2.gz ZPMBSVJLYIKFJS-BEFAXECRSA-N 2 1 327.472 4.353 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000246381272 1049965158 /nfs/dbraw/zinc/96/51/58/1049965158.db2.gz ZPMBSVJLYIKFJS-BEFAXECRSA-N 2 1 327.472 4.353 20 0 EIADMP CC(C)OC(=O)CC[C@@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172750809 1049971288 /nfs/dbraw/zinc/97/12/88/1049971288.db2.gz GFCIBTMYAMZHNG-ZHALLVOQSA-N 2 1 338.536 4.011 20 0 EIADMP Cc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)c1 ZINC000247120099 1050014734 /nfs/dbraw/zinc/01/47/34/1050014734.db2.gz RBPJYASZGUNPQP-OALUTQOASA-N 2 1 338.495 4.067 20 0 EIADMP Cc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)c1 ZINC000247120099 1050014741 /nfs/dbraw/zinc/01/47/41/1050014741.db2.gz RBPJYASZGUNPQP-OALUTQOASA-N 2 1 338.495 4.067 20 0 EIADMP CCOc1ccc([C@H](N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c2ccccc2)cc1 ZINC000247161697 1050015721 /nfs/dbraw/zinc/01/57/21/1050015721.db2.gz XUPHMEKJOBVXRJ-UCNVEGJOSA-N 2 1 338.495 4.247 20 0 EIADMP CCOc1ccc([C@H]([NH2+][C@@H]2CCN(C)[C@@H](C)C2)c2ccccc2)cc1 ZINC000247161697 1050015724 /nfs/dbraw/zinc/01/57/24/1050015724.db2.gz XUPHMEKJOBVXRJ-UCNVEGJOSA-N 2 1 338.495 4.247 20 0 EIADMP Cc1cccc2[nH]cc(CC[NH2+][C@@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)c21 ZINC000519719046 1050021128 /nfs/dbraw/zinc/02/11/28/1050021128.db2.gz XFBPGBSBBOODBB-IFMALSPDSA-N 2 1 347.506 4.444 20 0 EIADMP Cc1cccc2[nH]cc(CC[NH2+][C@@H]3CC[N@H+](C)[C@@H](c4ccccc4)C3)c21 ZINC000519719046 1050021140 /nfs/dbraw/zinc/02/11/40/1050021140.db2.gz XFBPGBSBBOODBB-IFMALSPDSA-N 2 1 347.506 4.444 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc1 ZINC000247983759 1050039478 /nfs/dbraw/zinc/03/94/78/1050039478.db2.gz IPPUPIQEFLIDHE-XAUMDUMWSA-N 2 1 344.524 4.490 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cc1 ZINC000247983759 1050039484 /nfs/dbraw/zinc/03/94/84/1050039484.db2.gz IPPUPIQEFLIDHE-XAUMDUMWSA-N 2 1 344.524 4.490 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C2CC2)[C@H]2CCCCO2)cc1 ZINC000655789073 1050092783 /nfs/dbraw/zinc/09/27/83/1050092783.db2.gz VFPXBBGCDBOYDC-IWMITWMQSA-N 2 1 339.483 4.179 20 0 EIADMP Clc1cc2c(c(Cl)c1)CC[C@H]2[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000089696001 1050128515 /nfs/dbraw/zinc/12/85/15/1050128515.db2.gz PRPLALUPGOEJQE-PIGZYNQJSA-N 2 1 325.283 4.055 20 0 EIADMP COCc1c(C)cc(C)c(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)c1C ZINC001177299368 1050179829 /nfs/dbraw/zinc/17/98/29/1050179829.db2.gz PIYJOGSJLHIXSD-QGZVFWFLSA-N 2 1 346.559 4.360 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@H]3CC[N@@H+]4CCCC[C@@H]34)cc2)c1 ZINC001177303102 1050180637 /nfs/dbraw/zinc/18/06/37/1050180637.db2.gz CARGDNOLROFULN-SFTDATJTSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@H]3CC[N@H+]4CCCC[C@@H]34)cc2)c1 ZINC001177303102 1050180641 /nfs/dbraw/zinc/18/06/41/1050180641.db2.gz CARGDNOLROFULN-SFTDATJTSA-N 2 1 340.442 4.334 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001177268447 1050182258 /nfs/dbraw/zinc/18/22/58/1050182258.db2.gz ZBYIBISSYQCFGE-KIZRIRGWSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001177268447 1050182265 /nfs/dbraw/zinc/18/22/65/1050182265.db2.gz ZBYIBISSYQCFGE-KIZRIRGWSA-N 2 1 344.543 4.224 20 0 EIADMP C(C[NH+]1CCCC1)[C@@H]1CCCC[N@H+]1C1CCC2(CCOCC2)CC1 ZINC001173049142 1050273241 /nfs/dbraw/zinc/27/32/41/1050273241.db2.gz AZEVRWNKAXDBFZ-IBGZPJMESA-N 2 1 334.548 4.066 20 0 EIADMP C[C@@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccc(F)c1 ZINC001177712022 1050285118 /nfs/dbraw/zinc/28/51/18/1050285118.db2.gz CIYUNTRLFKWOJF-KRWDZBQOSA-N 2 1 326.459 4.183 20 0 EIADMP CCCOC1CCC([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)CC1 ZINC001173097671 1050288273 /nfs/dbraw/zinc/28/82/73/1050288273.db2.gz IIJZWOJIBFBKAL-UHFFFAOYSA-N 2 1 334.548 4.065 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000252696002 1050289016 /nfs/dbraw/zinc/28/90/16/1050289016.db2.gz BAMQUSNITUXUDE-WDSOQIARSA-N 2 1 328.525 4.413 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000252696002 1050289024 /nfs/dbraw/zinc/28/90/24/1050289024.db2.gz BAMQUSNITUXUDE-WDSOQIARSA-N 2 1 328.525 4.413 20 0 EIADMP CCC(CC)[N@H+](C1CCC([NH+](CC)CC)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173106396 1050307964 /nfs/dbraw/zinc/30/79/64/1050307964.db2.gz NMYMFHFQRDKHQY-QEZSOMHNSA-N 3 1 337.596 4.400 20 0 EIADMP [NH3+]C1(c2cccnc2)CC[NH+](C2CCC3(CCCCC3)CC2)CC1 ZINC001173119193 1050315431 /nfs/dbraw/zinc/31/54/31/1050315431.db2.gz ZZWWIKFINWPHOA-UHFFFAOYSA-N 2 1 327.516 4.225 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)CCc1ccc(Cl)c(Cl)c1 ZINC001173544203 1050477731 /nfs/dbraw/zinc/47/77/31/1050477731.db2.gz QEDLHRIHHYELCE-GFCCVEGCSA-N 2 1 326.271 4.109 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCc2[nH+]ccn2CC1 ZINC001173549538 1050486107 /nfs/dbraw/zinc/48/61/07/1050486107.db2.gz HLNXUJHDFQJGLM-CYBMUJFWSA-N 2 1 338.282 4.069 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CCc2[nH+]ccn2CC1 ZINC001173549538 1050486118 /nfs/dbraw/zinc/48/61/18/1050486118.db2.gz HLNXUJHDFQJGLM-CYBMUJFWSA-N 2 1 338.282 4.069 20 0 EIADMP CC1(C)CCC[C@@H]1C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001178783725 1050553536 /nfs/dbraw/zinc/55/35/36/1050553536.db2.gz ZDCXJXLMTWCKJP-GOSISDBHSA-N 2 1 332.507 4.249 20 0 EIADMP CC[N@H+](CCC[NH2+]Cc1ccc(CC(C)C)nc1)C1CCCCC1 ZINC001179091613 1050628987 /nfs/dbraw/zinc/62/89/87/1050628987.db2.gz TXGBMTDMYZGEEH-UHFFFAOYSA-N 2 1 331.548 4.414 20 0 EIADMP CC[N@@H+](CCC[NH2+]Cc1ccc(CC(C)C)nc1)C1CCCCC1 ZINC001179091613 1050629000 /nfs/dbraw/zinc/62/90/00/1050629000.db2.gz TXGBMTDMYZGEEH-UHFFFAOYSA-N 2 1 331.548 4.414 20 0 EIADMP c1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc(-c2ccncc2)c1 ZINC000093683662 1050657979 /nfs/dbraw/zinc/65/79/79/1050657979.db2.gz KLKKOXVKRUQHQL-FQEVSTJZSA-N 2 1 335.495 4.056 20 0 EIADMP c1ccc(-c2cccc(C[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)c2)nc1 ZINC000093683704 1050659141 /nfs/dbraw/zinc/65/91/41/1050659141.db2.gz MDZOXWHVWOZCOR-HXUWFJFHSA-N 2 1 335.495 4.056 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001179338365 1050680304 /nfs/dbraw/zinc/68/03/04/1050680304.db2.gz GKMNTOZAAUPNIX-XXBNENTESA-N 2 1 348.534 4.292 20 0 EIADMP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+]Cc3cc(Cl)ccc3OC3CCCC3)[C@@H]2C1 ZINC001179817679 1050785742 /nfs/dbraw/zinc/78/57/42/1050785742.db2.gz RMUITMBGBZKFRQ-KYNGSXCRSA-N 2 1 348.918 4.091 20 0 EIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+]Cc3cc(Cl)ccc3OC3CCCC3)[C@@H]2C1 ZINC001179817679 1050785754 /nfs/dbraw/zinc/78/57/54/1050785754.db2.gz RMUITMBGBZKFRQ-KYNGSXCRSA-N 2 1 348.918 4.091 20 0 EIADMP C[C@@H]1Cc2[nH+]cn(Cc3ccc(C[NH+]4CCCCC4)cc3)c2C[C@@H]1C ZINC001189407651 1050983980 /nfs/dbraw/zinc/98/39/80/1050983980.db2.gz GSCOJZRYHVDWNN-MSOLQXFVSA-N 2 1 337.511 4.288 20 0 EIADMP CC(C)(C)[C@@]1(C[NH2+][C@H]2CSC2(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001181204819 1051180476 /nfs/dbraw/zinc/18/04/76/1051180476.db2.gz IMBBSNPNWGJUDA-GHTZIAJQSA-N 2 1 346.584 4.408 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2c3ccccc3C[C@H]2C)cc1F ZINC000153707796 1051218034 /nfs/dbraw/zinc/21/80/34/1051218034.db2.gz POPPWNBPDPTBKU-SZNDQCEHSA-N 2 1 335.426 4.343 20 0 EIADMP Cc1ccc(CC[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1C ZINC001181698599 1051291025 /nfs/dbraw/zinc/29/10/25/1051291025.db2.gz SYIQSSFCRDRLBB-DEOSSOPVSA-N 2 1 348.534 4.444 20 0 EIADMP Cc1ccc(CC[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)cc1C ZINC001181698599 1051291030 /nfs/dbraw/zinc/29/10/30/1051291030.db2.gz SYIQSSFCRDRLBB-DEOSSOPVSA-N 2 1 348.534 4.444 20 0 EIADMP Cc1ccc(CC[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1C ZINC001181698599 1051291036 /nfs/dbraw/zinc/29/10/36/1051291036.db2.gz SYIQSSFCRDRLBB-DEOSSOPVSA-N 2 1 348.534 4.444 20 0 EIADMP C[C@H](O)C[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CCCCC1 ZINC001190855562 1051291639 /nfs/dbraw/zinc/29/16/39/1051291639.db2.gz SYKMPHFJZNERDW-IBGZPJMESA-N 2 1 344.543 4.188 20 0 EIADMP [NH3+]C[C@]1(F)CCC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC001205546419 1051319465 /nfs/dbraw/zinc/31/94/65/1051319465.db2.gz VDLCWKLLDXLGEG-INIZCTEOSA-N 2 1 333.278 4.079 20 0 EIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)CC1 ZINC001205546380 1051320132 /nfs/dbraw/zinc/32/01/32/1051320132.db2.gz UOSBIZJMDCXUFL-CQSZACIVSA-N 2 1 338.776 4.012 20 0 EIADMP CCCOc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310872750 1051442059 /nfs/dbraw/zinc/44/20/59/1051442059.db2.gz GDZBVCWGXQJSPF-OAQYLSRUSA-N 2 1 338.495 4.087 20 0 EIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001205571450 1051553487 /nfs/dbraw/zinc/55/34/87/1051553487.db2.gz URGBZBWBMSRQIE-AWEZNQCLSA-N 2 1 338.776 4.012 20 0 EIADMP C[C@@H]1SCC[C@@H]1[NH2+]C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001182726492 1051689273 /nfs/dbraw/zinc/68/92/73/1051689273.db2.gz UBWVZDNFWOZPGK-CUWPLCDZSA-N 2 1 346.584 4.408 20 0 EIADMP CC(C)(C)c1cccc(OCCC[NH+]2CCC(C)([NH+]3CCC3)CC2)c1 ZINC001175669950 1051723067 /nfs/dbraw/zinc/72/30/67/1051723067.db2.gz WJHBREHTLWBLLO-UHFFFAOYSA-N 2 1 344.543 4.313 20 0 EIADMP C[C@@H]1CC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)CC[C@H]1C[NH3+] ZINC001205604867 1051791990 /nfs/dbraw/zinc/79/19/90/1051791990.db2.gz YIORDIYVIJNARP-HIFRSBDPSA-N 2 1 329.315 4.233 20 0 EIADMP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)ccc1C(F)(F)F ZINC001184301166 1051982314 /nfs/dbraw/zinc/98/23/14/1051982314.db2.gz GARQDWZFRRPWTE-BBWFWOEESA-N 2 1 340.433 4.176 20 0 EIADMP C[N@H+](Cc1cccc(F)c1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001203785616 1052034793 /nfs/dbraw/zinc/03/47/93/1052034793.db2.gz JFGZPPWOEAPYHC-UHFFFAOYSA-N 2 1 326.459 4.170 20 0 EIADMP CCC(CC)[C@H](c1ccc(Cl)cc1)[N@H+](C)C[C@@H](O)C[NH+](C)CC ZINC001193974317 1052035133 /nfs/dbraw/zinc/03/51/33/1052035133.db2.gz BOIUGEMZNICWEB-RBUKOAKNSA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@H](c1ccc(Cl)cc1)[N@@H+](C)C[C@@H](O)C[NH+](C)CC ZINC001193974317 1052035141 /nfs/dbraw/zinc/03/51/41/1052035141.db2.gz BOIUGEMZNICWEB-RBUKOAKNSA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@H](c1ccc(Cl)cc1)[NH+](C)C[C@@H](O)C[N@H+](C)CC ZINC001193974317 1052035142 /nfs/dbraw/zinc/03/51/42/1052035142.db2.gz BOIUGEMZNICWEB-RBUKOAKNSA-N 2 1 340.939 4.062 20 0 EIADMP CCC(CC)[C@H](c1ccc(Cl)cc1)[NH+](C)C[C@@H](O)C[N@@H+](C)CC ZINC001193974317 1052035156 /nfs/dbraw/zinc/03/51/56/1052035156.db2.gz BOIUGEMZNICWEB-RBUKOAKNSA-N 2 1 340.939 4.062 20 0 EIADMP Cc1ccsc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165309565 1052056425 /nfs/dbraw/zinc/05/64/25/1052056425.db2.gz DLVLXDIJMLATDM-MJGOQNOKSA-N 2 1 328.525 4.272 20 0 EIADMP Cc1ccsc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165309953 1052058242 /nfs/dbraw/zinc/05/82/42/1052058242.db2.gz DLVLXDIJMLATDM-PKOBYXMFSA-N 2 1 328.525 4.272 20 0 EIADMP c1cc(C[N@H+]2CCCSC[C@@H]2C2CC2)ccc1C[NH+]1CCCCC1 ZINC001176650356 1052168206 /nfs/dbraw/zinc/16/82/06/1052168206.db2.gz REURFYBCNBMUDD-OAQYLSRUSA-N 2 1 344.568 4.390 20 0 EIADMP Cc1c(Cl)cccc1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001177097805 1052229179 /nfs/dbraw/zinc/22/91/79/1052229179.db2.gz BXCKPMZNNULKNQ-UHFFFAOYSA-N 2 1 328.887 4.403 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000339066075 1052551944 /nfs/dbraw/zinc/55/19/44/1052551944.db2.gz FCEQNTHQKQVAJG-RZUBCFFCSA-N 2 1 344.543 4.399 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000174514900 1052568871 /nfs/dbraw/zinc/56/88/71/1052568871.db2.gz NXPRJIXUDMOWLL-AEFFLSMTSA-N 2 1 326.484 4.199 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000174514900 1052568879 /nfs/dbraw/zinc/56/88/79/1052568879.db2.gz NXPRJIXUDMOWLL-AEFFLSMTSA-N 2 1 326.484 4.199 20 0 EIADMP C[N@H+]1CC[C@@H](N[C@H](c2cccs2)c2ccc(F)cc2)CC1(C)C ZINC000623342025 1052625698 /nfs/dbraw/zinc/62/56/98/1052625698.db2.gz BHEAZOVKVWBUBN-AEFFLSMTSA-N 2 1 332.488 4.439 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CN[C@@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357836 1052631911 /nfs/dbraw/zinc/63/19/11/1052631911.db2.gz CAZRBZRLHWWQQM-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CN[C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357836 1052631917 /nfs/dbraw/zinc/63/19/17/1052631917.db2.gz CAZRBZRLHWWQQM-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CN[C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623357836 1052631919 /nfs/dbraw/zinc/63/19/19/1052631919.db2.gz CAZRBZRLHWWQQM-GHTZIAJQSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357836 1052631922 /nfs/dbraw/zinc/63/19/22/1052631922.db2.gz CAZRBZRLHWWQQM-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357836 1052631926 /nfs/dbraw/zinc/63/19/26/1052631926.db2.gz CAZRBZRLHWWQQM-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccccc1C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357836 1052631930 /nfs/dbraw/zinc/63/19/30/1052631930.db2.gz CAZRBZRLHWWQQM-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623357836 1052631932 /nfs/dbraw/zinc/63/19/32/1052631932.db2.gz CAZRBZRLHWWQQM-GHTZIAJQSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623487708 1052663904 /nfs/dbraw/zinc/66/39/04/1052663904.db2.gz NVIMUUGRBODESG-DZGCQCFKSA-N 2 1 328.422 4.099 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000623526032 1052672788 /nfs/dbraw/zinc/67/27/88/1052672788.db2.gz HTSDRMDCLTWKJB-AEFFLSMTSA-N 2 1 339.483 4.397 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2CCc3[nH]c4ccc(Cl)cc4c3C2)CC1(C)C ZINC000623556903 1052679842 /nfs/dbraw/zinc/67/98/42/1052679842.db2.gz CZYOPUPPQZWLNN-HUUCEWRRSA-N 2 1 345.918 4.141 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)ccc1OCCC(C)C ZINC000177901130 1052693379 /nfs/dbraw/zinc/69/33/79/1052693379.db2.gz NSRHRRAVZVMZRL-JENIJYKNSA-N 2 1 348.531 4.253 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1OCCC(C)C ZINC000177901130 1052693387 /nfs/dbraw/zinc/69/33/87/1052693387.db2.gz NSRHRRAVZVMZRL-JENIJYKNSA-N 2 1 348.531 4.253 20 0 EIADMP Clc1cccc2c1OCCC[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000178254348 1052703751 /nfs/dbraw/zinc/70/37/51/1052703751.db2.gz KDAYTCXPFVDXTJ-GOSISDBHSA-N 2 1 334.891 4.018 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC[N@@H+]1C ZINC000179598289 1052743580 /nfs/dbraw/zinc/74/35/80/1052743580.db2.gz QWFCCIPQIIGIAQ-AFAVFJNCSA-N 2 1 326.406 4.229 20 0 EIADMP C[C@H]1C[C@@H]([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC[N@H+]1C ZINC000179598289 1052743586 /nfs/dbraw/zinc/74/35/86/1052743586.db2.gz QWFCCIPQIIGIAQ-AFAVFJNCSA-N 2 1 326.406 4.229 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623862532 1052824478 /nfs/dbraw/zinc/82/44/78/1052824478.db2.gz WUCPOQLEUMPYPD-QGZVFWFLSA-N 2 1 329.513 4.151 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623862532 1052824480 /nfs/dbraw/zinc/82/44/80/1052824480.db2.gz WUCPOQLEUMPYPD-QGZVFWFLSA-N 2 1 329.513 4.151 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCc2c3cc(Cl)ccc3[nH]c21 ZINC000623867803 1052825798 /nfs/dbraw/zinc/82/57/98/1052825798.db2.gz LHKPIIJRVMWXQG-GOSISDBHSA-N 2 1 342.874 4.384 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCCC[C@H]1Sc1ccc(F)cc1 ZINC000623881417 1052829144 /nfs/dbraw/zinc/82/91/44/1052829144.db2.gz NKCMFXGQEKZQSB-ZWKOTPCHSA-N 2 1 333.476 4.024 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCCC[C@H]1Sc1ccc(F)cc1 ZINC000623881415 1052829173 /nfs/dbraw/zinc/82/91/73/1052829173.db2.gz NKCMFXGQEKZQSB-QZTJIDSGSA-N 2 1 333.476 4.024 20 0 EIADMP Cc1csc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)n1 ZINC000623924198 1052838833 /nfs/dbraw/zinc/83/88/33/1052838833.db2.gz VLRCZIRXESRYOW-ZIFCJYIRSA-N 2 1 343.540 4.403 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000624120223 1052867575 /nfs/dbraw/zinc/86/75/75/1052867575.db2.gz UPLSCUDDTUKNME-RHSMWYFYSA-N 2 1 326.431 4.061 20 0 EIADMP COc1ccc2cc([C@@H](C)[NH2+]C[C@@H]3CCCC[N@@H+](C)C3)ccc2c1 ZINC000624120027 1052867602 /nfs/dbraw/zinc/86/76/02/1052867602.db2.gz PROHRKJMUXKSMJ-SJORKVTESA-N 2 1 326.484 4.231 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]C[C@@H]3CCCC[N@H+](C)C3)oc21 ZINC000624122398 1052868260 /nfs/dbraw/zinc/86/82/60/1052868260.db2.gz QJUCJAJSSBETOF-HOTGVXAUSA-N 2 1 330.472 4.214 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]C[C@@H]3CCCC[N@@H+](C)C3)oc21 ZINC000624122398 1052868264 /nfs/dbraw/zinc/86/82/64/1052868264.db2.gz QJUCJAJSSBETOF-HOTGVXAUSA-N 2 1 330.472 4.214 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]C1(c2ccc(F)cc2F)CCCC1 ZINC000181247558 1052879005 /nfs/dbraw/zinc/87/90/05/1052879005.db2.gz KTQYAFZYCYVTMZ-UHFFFAOYSA-N 2 1 333.426 4.309 20 0 EIADMP C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381391039 1053072304 /nfs/dbraw/zinc/07/23/04/1053072304.db2.gz URPXJTRJDKKNLJ-FKPGQJDZSA-N 2 1 338.495 4.403 20 0 EIADMP C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381391039 1053072316 /nfs/dbraw/zinc/07/23/16/1053072316.db2.gz URPXJTRJDKKNLJ-FKPGQJDZSA-N 2 1 338.495 4.403 20 0 EIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(Cc2ccc(C)c(C)c2)CC1 ZINC001194854977 1053128261 /nfs/dbraw/zinc/12/82/61/1053128261.db2.gz PLGCKVZNHGNUSK-UHFFFAOYSA-N 2 1 325.500 4.153 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1cc2ccccc2[nH]1 ZINC000775623756 1053191719 /nfs/dbraw/zinc/19/17/19/1053191719.db2.gz VRETYJAMSRYNGR-KRWDZBQOSA-N 2 1 333.479 4.267 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1cc2ccccc2[nH]1 ZINC000775623756 1053191765 /nfs/dbraw/zinc/19/17/65/1053191765.db2.gz VRETYJAMSRYNGR-KRWDZBQOSA-N 2 1 333.479 4.267 20 0 EIADMP C[C@H]([NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000850466521 1053244895 /nfs/dbraw/zinc/24/48/95/1053244895.db2.gz LIFWFJAOLZKADK-HTAPYJJXSA-N 2 1 349.478 4.391 20 0 EIADMP C[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000850466521 1053244923 /nfs/dbraw/zinc/24/49/23/1053244923.db2.gz LIFWFJAOLZKADK-HTAPYJJXSA-N 2 1 349.478 4.391 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2C[C@H](O)c3ccccc32)cc1 ZINC000850527322 1053288117 /nfs/dbraw/zinc/28/81/17/1053288117.db2.gz FUUYWZGMFVQOHX-DLPLYFIVSA-N 2 1 333.435 4.010 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)[C@@H](C)C2CCCCC2)cn1 ZINC000765248637 1053476687 /nfs/dbraw/zinc/47/66/87/1053476687.db2.gz AAGHCYDNCMHEII-HZPDHXFCSA-N 2 1 326.488 4.270 20 0 EIADMP FC(F)c1ccc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cn1 ZINC000865436874 1053506657 /nfs/dbraw/zinc/50/66/57/1053506657.db2.gz SIWKEXAQCBDUHL-UHFFFAOYSA-N 2 1 337.458 4.154 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc2c(F)cccc2c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000865523484 1053534971 /nfs/dbraw/zinc/53/49/71/1053534971.db2.gz CFQLRQRFCUOGFV-QAPCUYQASA-N 2 1 341.474 4.117 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000385671923 1053541844 /nfs/dbraw/zinc/54/18/44/1053541844.db2.gz DXSHQXWENFQPIQ-LQWHRVPQSA-N 2 1 340.486 4.257 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)COc2ccccc2)cc1 ZINC000765435642 1053544844 /nfs/dbraw/zinc/54/48/44/1053544844.db2.gz CLOUPGVXRJAIEY-IAGOWNOFSA-N 2 1 335.451 4.299 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)COc2ccccc2)cc1 ZINC000765435521 1053545505 /nfs/dbraw/zinc/54/55/05/1053545505.db2.gz CLOUPGVXRJAIEY-DLBZAZTESA-N 2 1 335.451 4.299 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000765506205 1053587456 /nfs/dbraw/zinc/58/74/56/1053587456.db2.gz CYVYVDLNTWIZPU-CVEARBPZSA-N 2 1 340.602 4.470 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000765506205 1053587466 /nfs/dbraw/zinc/58/74/66/1053587466.db2.gz CYVYVDLNTWIZPU-CVEARBPZSA-N 2 1 340.602 4.470 20 0 EIADMP CC(C)[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C(C)C)c1ccccn1 ZINC000866231824 1053659161 /nfs/dbraw/zinc/65/91/61/1053659161.db2.gz AQJMBHBIRKOZEW-NRFANRHFSA-N 2 1 325.500 4.409 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866241122 1053660033 /nfs/dbraw/zinc/66/00/33/1053660033.db2.gz WPVWLVDNSSWZHI-RBBKRZOGSA-N 2 1 337.511 4.077 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866241122 1053660041 /nfs/dbraw/zinc/66/00/41/1053660041.db2.gz WPVWLVDNSSWZHI-RBBKRZOGSA-N 2 1 337.511 4.077 20 0 EIADMP C[C@H]1CCCCN1c1cccc(N2C[C@H](CC[NH3+])c3ccccc32)[nH+]1 ZINC001168544417 1053702286 /nfs/dbraw/zinc/70/22/86/1053702286.db2.gz OPMQTRPQWKYGPR-IRXDYDNUSA-N 2 1 336.483 4.045 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCC23CCOCC3)cc1 ZINC000866528604 1053768414 /nfs/dbraw/zinc/76/84/14/1053768414.db2.gz GPBMVBUXBDQUJZ-VQIMIIECSA-N 2 1 339.483 4.038 20 0 EIADMP CC(C)c1nc([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cs1 ZINC000172341569 1054206230 /nfs/dbraw/zinc/20/62/30/1054206230.db2.gz SLWKEOZDJSNTSU-HNNXBMFYSA-N 2 1 347.528 4.058 20 0 EIADMP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000872032508 1054350255 /nfs/dbraw/zinc/35/02/55/1054350255.db2.gz VICIDGYXKIORFS-MSOLQXFVSA-N 2 1 342.449 4.262 20 0 EIADMP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2C[C@H](C)C[C@H](C)C2)CCO1 ZINC001199310373 1054385894 /nfs/dbraw/zinc/38/58/94/1054385894.db2.gz TZUJWHJDPWKWHF-GMQQQROESA-N 2 1 344.543 4.212 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]Cc3cccc4ncccc34)CC2)cc1 ZINC000872124506 1054404413 /nfs/dbraw/zinc/40/44/13/1054404413.db2.gz OQGHNTPHSJEHOX-UHFFFAOYSA-N 2 1 345.490 4.032 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1c[nH]c2c1cccc2F ZINC001137059307 1054442498 /nfs/dbraw/zinc/44/24/98/1054442498.db2.gz WGYKMZXCPJAWTJ-DLBZAZTESA-N 2 1 329.463 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1c[nH]c2c1cccc2F ZINC001137059307 1054442506 /nfs/dbraw/zinc/44/25/06/1054442506.db2.gz WGYKMZXCPJAWTJ-DLBZAZTESA-N 2 1 329.463 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1c[nH]c2c1cccc2F ZINC001137059307 1054442511 /nfs/dbraw/zinc/44/25/11/1054442511.db2.gz WGYKMZXCPJAWTJ-DLBZAZTESA-N 2 1 329.463 4.146 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)c1cc(C)ccc1C ZINC000858353468 1054471008 /nfs/dbraw/zinc/47/10/08/1054471008.db2.gz HZVYDEYRZXOEHO-FQEVSTJZSA-N 2 1 334.467 4.433 20 0 EIADMP C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001199963327 1054504743 /nfs/dbraw/zinc/50/47/43/1054504743.db2.gz WJORURSJCVQHEV-IUODEOHRSA-N 2 1 329.315 4.387 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CC[NH+](Cc2cccs2)CC1 ZINC000060847361 1054726422 /nfs/dbraw/zinc/72/64/22/1054726422.db2.gz JZOPCPWPYJKRKL-UHFFFAOYSA-N 2 1 343.883 4.272 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](C[C@@H]1CC=CCC1)CC2 ZINC001201408956 1054789247 /nfs/dbraw/zinc/78/92/47/1054789247.db2.gz MXIJBXUSFNRJPA-QUCCMNQESA-N 2 1 328.500 4.312 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2)C1 ZINC001201559506 1054848458 /nfs/dbraw/zinc/84/84/58/1054848458.db2.gz ZEHIOMAJVAETLB-INIZCTEOSA-N 2 1 328.422 4.163 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccccc2CC(F)(F)F)C1 ZINC001201566936 1054852358 /nfs/dbraw/zinc/85/23/58/1054852358.db2.gz QJBLCRULSRMEAL-INIZCTEOSA-N 2 1 342.449 4.249 20 0 EIADMP c1ccc(CCC[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201681704 1054875250 /nfs/dbraw/zinc/87/52/50/1054875250.db2.gz CIZQLBIMNVMSIZ-ZEQRLZLVSA-N 2 1 348.534 4.463 20 0 EIADMP c1ccc(CCC[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201681704 1054875256 /nfs/dbraw/zinc/87/52/56/1054875256.db2.gz CIZQLBIMNVMSIZ-ZEQRLZLVSA-N 2 1 348.534 4.463 20 0 EIADMP c1ccc(CCC[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201681704 1054875261 /nfs/dbraw/zinc/87/52/61/1054875261.db2.gz CIZQLBIMNVMSIZ-ZEQRLZLVSA-N 2 1 348.534 4.463 20 0 EIADMP CCCCCC[N@H+]1CC[C@@]2(C[NH+](CC3CC3)C[C@@H]2COCC2CC2)C1 ZINC001201751397 1054896366 /nfs/dbraw/zinc/89/63/66/1054896366.db2.gz TVSDQUVIXNUKTE-YADHBBJMSA-N 2 1 348.575 4.027 20 0 EIADMP CCCCCC[NH+]1CC[C@]2(C1)C[N@H+](CC1CC1)C[C@@H]2COCC1CC1 ZINC001201751397 1054896369 /nfs/dbraw/zinc/89/63/69/1054896369.db2.gz TVSDQUVIXNUKTE-YADHBBJMSA-N 2 1 348.575 4.027 20 0 EIADMP CCCCCC[NH+]1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCC1CC1 ZINC001201751397 1054896372 /nfs/dbraw/zinc/89/63/72/1054896372.db2.gz TVSDQUVIXNUKTE-YADHBBJMSA-N 2 1 348.575 4.027 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000671750914 1054978446 /nfs/dbraw/zinc/97/84/46/1054978446.db2.gz CJCNDNLGKPFXNE-PELRDEGISA-N 2 1 337.511 4.484 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1Cl ZINC001202018624 1054982335 /nfs/dbraw/zinc/98/23/35/1054982335.db2.gz REHJRONLQIEYDF-INIZCTEOSA-N 2 1 338.923 4.481 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1Cl ZINC001202018624 1054982349 /nfs/dbraw/zinc/98/23/49/1054982349.db2.gz REHJRONLQIEYDF-INIZCTEOSA-N 2 1 338.923 4.481 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCCCS2)CC1 ZINC000671760237 1055044570 /nfs/dbraw/zinc/04/45/70/1055044570.db2.gz MHQUVAODBFZCTQ-MHJFOBGBSA-N 2 1 332.557 4.305 20 0 EIADMP FC(F)C1(C[NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000671762704 1055053805 /nfs/dbraw/zinc/05/38/05/1055053805.db2.gz GYPRWQFEIDKXDS-GBESFXJTSA-N 2 1 348.481 4.312 20 0 EIADMP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000877495656 1055065016 /nfs/dbraw/zinc/06/50/16/1055065016.db2.gz GQOIFDCLTZLKMR-QSAZIKIQSA-N 2 1 344.480 4.096 20 0 EIADMP Cc1cc([NH+]2CCCCCC2)ccc1N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000671766315 1055071753 /nfs/dbraw/zinc/07/17/53/1055071753.db2.gz CWVSLAHOOGJBMC-MOPGFXCFSA-N 2 1 327.516 4.414 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc3c(ccnc3Cl)o2)cc1 ZINC000877525197 1055071974 /nfs/dbraw/zinc/07/19/74/1055071974.db2.gz UTUAJCCPYDEEQA-UHFFFAOYSA-N 2 1 343.858 4.175 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000877546914 1055076988 /nfs/dbraw/zinc/07/69/88/1055076988.db2.gz NPUPSUNBSGIMEB-MFPFXBIISA-N 2 1 330.541 4.056 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+]CCC3SCCS3)CC[N@@H+]2C2CC2)cc1 ZINC000877636970 1055095328 /nfs/dbraw/zinc/09/53/28/1055095328.db2.gz LSQFGIGWIQOQEI-SJLPKXTDSA-N 2 1 348.581 4.140 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+]CCC3SCCS3)CC[N@H+]2C2CC2)cc1 ZINC000877636970 1055095343 /nfs/dbraw/zinc/09/53/43/1055095343.db2.gz LSQFGIGWIQOQEI-SJLPKXTDSA-N 2 1 348.581 4.140 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C3CCCCCC3)CC2)cs1 ZINC000111397477 1055221890 /nfs/dbraw/zinc/22/18/90/1055221890.db2.gz AZRUKGPAXXWCEZ-UHFFFAOYSA-N 2 1 335.561 4.230 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000542840191 1056205529 /nfs/dbraw/zinc/20/55/29/1056205529.db2.gz LJBUOVSIZLILQA-MRXNPFEDSA-N 2 1 346.421 4.141 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000542840191 1056205546 /nfs/dbraw/zinc/20/55/46/1056205546.db2.gz LJBUOVSIZLILQA-MRXNPFEDSA-N 2 1 346.421 4.141 20 0 EIADMP FC(F)Sc1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000743851442 1059155951 /nfs/dbraw/zinc/15/59/51/1059155951.db2.gz HWFVTFQHJGIZQP-INIZCTEOSA-N 2 1 340.483 4.309 20 0 EIADMP FC(F)Sc1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000743851442 1059155965 /nfs/dbraw/zinc/15/59/65/1059155965.db2.gz HWFVTFQHJGIZQP-INIZCTEOSA-N 2 1 340.483 4.309 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1nc(C)sc1C ZINC000390341328 1060295069 /nfs/dbraw/zinc/29/50/69/1060295069.db2.gz MPBYXKSCJQYHJL-CQSZACIVSA-N 2 1 331.529 4.453 20 0 EIADMP COc1ccc([C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000392742275 1060308409 /nfs/dbraw/zinc/30/84/09/1060308409.db2.gz SWMYUUHESBRBFL-TUNNFDKTSA-N 2 1 336.479 4.001 20 0 EIADMP COc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000392742275 1060308434 /nfs/dbraw/zinc/30/84/34/1060308434.db2.gz SWMYUUHESBRBFL-TUNNFDKTSA-N 2 1 336.479 4.001 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C)cnn1-c1ccccc1 ZINC000766384331 1060317186 /nfs/dbraw/zinc/31/71/86/1060317186.db2.gz KNCXUNRFFCUYKS-SFHVURJKSA-N 2 1 342.531 4.340 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(Cc3ccccc3)CCC(F)(F)CC1)C2 ZINC001169117140 1060646368 /nfs/dbraw/zinc/64/63/68/1060646368.db2.gz WKNUQGUQEBLWMZ-REPLKXPHSA-N 2 1 348.481 4.392 20 0 EIADMP CCCC[C@@H]([NH3+])Cc1cn([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc12 ZINC001169109484 1060658181 /nfs/dbraw/zinc/65/81/81/1060658181.db2.gz JDNYHUBZMNHQQG-ZRNYENFQSA-N 2 1 339.527 4.499 20 0 EIADMP 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 1060661290 /nfs/dbraw/zinc/66/12/90/1060661290.db2.gz OMLXCFHNMAOCEV-BGTYHANMSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CC[C@@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141062 1060661295 /nfs/dbraw/zinc/66/12/95/1060661295.db2.gz OMLXCFHNMAOCEV-BGTYHANMSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CC[C@@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141062 1060661305 /nfs/dbraw/zinc/66/13/05/1060661305.db2.gz OMLXCFHNMAOCEV-BGTYHANMSA-N 2 1 338.417 4.120 20 0 EIADMP C[N@H+]1CCCC[C@@H]1c1ccc(N[C@@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)nc1 ZINC001169141807 1060662315 /nfs/dbraw/zinc/66/23/15/1060662315.db2.gz KWSLKQMCLDDPLD-OPYAIIAOSA-N 2 1 344.547 4.194 20 0 EIADMP CC[NH+](CC)CCC[N@H+](C)C[C@@H](C)Oc1ccc(Cl)c(Cl)c1 ZINC001169262576 1060709318 /nfs/dbraw/zinc/70/93/18/1060709318.db2.gz ZXPLBUNTNKOKGC-CQSZACIVSA-N 2 1 347.330 4.424 20 0 EIADMP CC[NH+](CC)CCC[N@@H+](C)C[C@@H](C)Oc1ccc(Cl)c(Cl)c1 ZINC001169262576 1060709346 /nfs/dbraw/zinc/70/93/46/1060709346.db2.gz ZXPLBUNTNKOKGC-CQSZACIVSA-N 2 1 347.330 4.424 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(Br)s2)CC1 ZINC000038002095 213186019 /nfs/dbraw/zinc/18/60/19/213186019.db2.gz HNKBLVWQUCHOSA-NSHDSACASA-N 2 1 331.323 4.034 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)C1CCOCC1 ZINC000532192760 1032081610 /nfs/dbraw/zinc/08/16/10/1032081610.db2.gz KTJZSDOJBXNXNT-XMSQKQJNSA-N 2 1 344.543 4.356 20 0 EIADMP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000532225969 1032104364 /nfs/dbraw/zinc/10/43/64/1032104364.db2.gz GIPOACTXIFXJGR-FPOVZHCZSA-N 2 1 344.543 4.284 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000729678861 1032127980 /nfs/dbraw/zinc/12/79/80/1032127980.db2.gz UFNRBILCZJXEEV-KRWDZBQOSA-N 2 1 330.516 4.144 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCNCc1ccc(Sc2ccccn2)o1 ZINC000509672645 1032258563 /nfs/dbraw/zinc/25/85/63/1032258563.db2.gz KXBOBEIZUUTGKE-MRXNPFEDSA-N 2 1 345.512 4.180 20 0 EIADMP Clc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cn1 ZINC000245643838 1032361961 /nfs/dbraw/zinc/36/19/61/1032361961.db2.gz BGQXUBZTGBVVHI-LDLYASANSA-N 2 1 341.886 4.020 20 0 EIADMP Clc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cn1 ZINC000245643838 1032361972 /nfs/dbraw/zinc/36/19/72/1032361972.db2.gz BGQXUBZTGBVVHI-LDLYASANSA-N 2 1 341.886 4.020 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC000178701873 1032544303 /nfs/dbraw/zinc/54/43/03/1032544303.db2.gz SZDLDEBVUAHDKI-STQMWFEESA-N 2 1 325.378 4.197 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCSc2ccc(Cl)cc21 ZINC000178700652 1032544621 /nfs/dbraw/zinc/54/46/21/1032544621.db2.gz FLUZIUKNKLJEHS-LRDDRELGSA-N 2 1 335.904 4.308 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CCC3(CCC[N@@H+]3C)CC2)cc1)C(F)(F)F ZINC000450646697 1032598925 /nfs/dbraw/zinc/59/89/25/1032598925.db2.gz SDRRPCMUTBSBAR-OAHLLOKOSA-N 2 1 340.433 4.413 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CCC3(CCC[N@H+]3C)CC2)cc1)C(F)(F)F ZINC000450646697 1032598937 /nfs/dbraw/zinc/59/89/37/1032598937.db2.gz SDRRPCMUTBSBAR-OAHLLOKOSA-N 2 1 340.433 4.413 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc3[nH]ccc32)[C@H]1c1cccs1 ZINC000246170434 1032759581 /nfs/dbraw/zinc/75/95/81/1032759581.db2.gz MOKWSDFGHORVAP-JXFKEZNVSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc3[nH]ccc32)[C@H]1c1cccs1 ZINC000246170434 1032759602 /nfs/dbraw/zinc/75/96/02/1032759602.db2.gz MOKWSDFGHORVAP-JXFKEZNVSA-N 2 1 339.508 4.402 20 0 EIADMP Cc1cccc([C@@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2cccc(F)c2)c1 ZINC000643547868 1018930092 /nfs/dbraw/zinc/93/00/92/1018930092.db2.gz KAQYGXRDKYOTQC-NHCUHLMSSA-N 2 1 338.470 4.488 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH+]2CCC[C@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614639 1019486697 /nfs/dbraw/zinc/48/66/97/1019486697.db2.gz FCDSIUBPQNLEHT-YOEHRIQHSA-N 2 1 342.405 4.064 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH+]2CCC[C@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614639 1019486719 /nfs/dbraw/zinc/48/67/19/1019486719.db2.gz FCDSIUBPQNLEHT-YOEHRIQHSA-N 2 1 342.405 4.064 20 0 EIADMP C[NH+]1CCC[C@H](C[N@@H+]2CCC[C@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614639 1019486740 /nfs/dbraw/zinc/48/67/40/1019486740.db2.gz FCDSIUBPQNLEHT-YOEHRIQHSA-N 2 1 342.405 4.064 20 0 EIADMP C[NH+]1CCC[C@H](C[N@H+]2CCC[C@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614639 1019486758 /nfs/dbraw/zinc/48/67/58/1019486758.db2.gz FCDSIUBPQNLEHT-YOEHRIQHSA-N 2 1 342.405 4.064 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000683225054 1019530858 /nfs/dbraw/zinc/53/08/58/1019530858.db2.gz VWLFXZWBSMACDC-UHFFFAOYSA-N 2 1 339.405 4.377 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000683225054 1019530865 /nfs/dbraw/zinc/53/08/65/1019530865.db2.gz VWLFXZWBSMACDC-UHFFFAOYSA-N 2 1 339.405 4.377 20 0 EIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000236931349 1032839981 /nfs/dbraw/zinc/83/99/81/1032839981.db2.gz VGOVUDYSBILZFS-INIZCTEOSA-N 2 1 330.447 4.216 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000236931349 1032839982 /nfs/dbraw/zinc/83/99/82/1032839982.db2.gz VGOVUDYSBILZFS-INIZCTEOSA-N 2 1 330.447 4.216 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)[nH]c1C ZINC000579860332 1019715441 /nfs/dbraw/zinc/71/54/41/1019715441.db2.gz DCINZHVFTOPSKH-UHFFFAOYSA-N 2 1 340.515 4.081 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)[nH]c1C ZINC000579860332 1019715458 /nfs/dbraw/zinc/71/54/58/1019715458.db2.gz DCINZHVFTOPSKH-UHFFFAOYSA-N 2 1 340.515 4.081 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C(F)F)nc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000631108894 1019975172 /nfs/dbraw/zinc/97/51/72/1019975172.db2.gz IBFWDCZZCOPVOM-CRAIPNDOSA-N 2 1 345.437 4.019 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000530522685 1020047516 /nfs/dbraw/zinc/04/75/16/1020047516.db2.gz QCRUQZHTKDGISV-JSFXGIFRSA-N 2 1 344.543 4.082 20 0 EIADMP FC(F)(F)c1ccc2c(N[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc[nH+]c2c1 ZINC000443677836 1020206483 /nfs/dbraw/zinc/20/64/83/1020206483.db2.gz ZPYZJBSAZVFLGR-ZIAGYGMSSA-N 2 1 335.373 4.292 20 0 EIADMP FC(F)(F)c1ccc2c(N[C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc[nH+]c2c1 ZINC000443677836 1020206490 /nfs/dbraw/zinc/20/64/90/1020206490.db2.gz ZPYZJBSAZVFLGR-ZIAGYGMSSA-N 2 1 335.373 4.292 20 0 EIADMP FC(F)(F)c1ccc2c(c1)[nH+]ccc2N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000443672888 1020207639 /nfs/dbraw/zinc/20/76/39/1020207639.db2.gz HEBRVEHDKYQMQP-HNNXBMFYSA-N 2 1 349.400 4.318 20 0 EIADMP Fc1ccc(/C=C/C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1F ZINC000510209687 1020464239 /nfs/dbraw/zinc/46/42/39/1020464239.db2.gz RANQYVITXUPMRA-QPJJXVBHSA-N 2 1 342.433 4.232 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cnc2ccccc2c1 ZINC000398182559 1020524843 /nfs/dbraw/zinc/52/48/43/1020524843.db2.gz XHRNVYBEYQWKRG-GCJKJVERSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cnc2ccccc2c1 ZINC000398182559 1020524857 /nfs/dbraw/zinc/52/48/57/1020524857.db2.gz XHRNVYBEYQWKRG-GCJKJVERSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cnc2ccccc2c1 ZINC000398182565 1020525263 /nfs/dbraw/zinc/52/52/63/1020525263.db2.gz XHRNVYBEYQWKRG-XMSQKQJNSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cnc2ccccc2c1 ZINC000398182565 1020525271 /nfs/dbraw/zinc/52/52/71/1020525271.db2.gz XHRNVYBEYQWKRG-XMSQKQJNSA-N 2 1 345.490 4.235 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](CC[C@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255605 1020678102 /nfs/dbraw/zinc/67/81/02/1020678102.db2.gz JSZUAJWRNLHXIF-CVEARBPZSA-N 2 1 333.347 4.014 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CC[C@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255605 1020678110 /nfs/dbraw/zinc/67/81/10/1020678110.db2.gz JSZUAJWRNLHXIF-CVEARBPZSA-N 2 1 333.347 4.014 20 0 EIADMP c1cc(C[NH2+]Cc2ccc3c(n2)CCC3)cc(C[NH+]2CCCCCC2)c1 ZINC000579927075 1020841860 /nfs/dbraw/zinc/84/18/60/1020841860.db2.gz RFLFNJVIRGXRGS-UHFFFAOYSA-N 2 1 349.522 4.236 20 0 EIADMP COc1ccc2cc([C@@H](C)[NH2+]C[C@H](C)Cn3cc[nH+]c3C)ccc2c1 ZINC000121519920 1020998879 /nfs/dbraw/zinc/99/88/79/1020998879.db2.gz OFWHVGGCMSMGMI-JKSUJKDBSA-N 2 1 337.467 4.340 20 0 EIADMP CCOC1(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCCC1 ZINC000340465530 1021068829 /nfs/dbraw/zinc/06/88/29/1021068829.db2.gz NYQCDIUDRPHYQX-INIZCTEOSA-N 2 1 327.472 4.181 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc3ccc(Cl)cc3n2)CC1 ZINC001167321967 1021091566 /nfs/dbraw/zinc/09/15/66/1021091566.db2.gz MRXWCJQKAPENRO-UHFFFAOYSA-N 2 1 345.918 4.440 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3c(O)cccc32)c1 ZINC000340519546 1021187190 /nfs/dbraw/zinc/18/71/90/1021187190.db2.gz MPXVEPCQBHKTHE-NRFANRHFSA-N 2 1 338.495 4.400 20 0 EIADMP Oc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CCC2 ZINC000340523991 1021190255 /nfs/dbraw/zinc/19/02/55/1021190255.db2.gz JEZYBWHUFBTJCZ-OAQYLSRUSA-N 2 1 328.500 4.156 20 0 EIADMP CC[C@H]1C[N@H+](Cc2ccc(-c3nc4ccccc4s3)o2)CC[C@@H]1[NH3+] ZINC000647497294 1021597769 /nfs/dbraw/zinc/59/77/69/1021597769.db2.gz BWZPWMXBNDCDKU-ZFWWWQNUSA-N 2 1 341.480 4.116 20 0 EIADMP CC[C@H]1C[N@@H+](Cc2ccc(-c3nc4ccccc4s3)o2)CC[C@@H]1[NH3+] ZINC000647497294 1021597782 /nfs/dbraw/zinc/59/77/82/1021597782.db2.gz BWZPWMXBNDCDKU-ZFWWWQNUSA-N 2 1 341.480 4.116 20 0 EIADMP c1cc2cc(C[N@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)ccc2cn1 ZINC000683830258 1021746862 /nfs/dbraw/zinc/74/68/62/1021746862.db2.gz SJWAKBJZWPXEBW-FQEVSTJZSA-N 2 1 337.511 4.323 20 0 EIADMP c1cc2cc(C[N@@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)ccc2cn1 ZINC000683830258 1021746878 /nfs/dbraw/zinc/74/68/78/1021746878.db2.gz SJWAKBJZWPXEBW-FQEVSTJZSA-N 2 1 337.511 4.323 20 0 EIADMP C[N@H+](Cc1ccc2cnccc2c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000683830922 1021749094 /nfs/dbraw/zinc/74/90/94/1021749094.db2.gz ZNVJAAIGYURHSZ-NRFANRHFSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2cnccc2c1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000683830922 1021749109 /nfs/dbraw/zinc/74/91/09/1021749109.db2.gz ZNVJAAIGYURHSZ-NRFANRHFSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2cnccc2c1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000683830922 1021749122 /nfs/dbraw/zinc/74/91/22/1021749122.db2.gz ZNVJAAIGYURHSZ-NRFANRHFSA-N 2 1 345.490 4.189 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)c(C)c1 ZINC000414109580 1021868769 /nfs/dbraw/zinc/86/87/69/1021868769.db2.gz HLKZNTAKDJVFGR-QGZVFWFLSA-N 2 1 339.483 4.027 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c(C)c1 ZINC000414110192 1021870699 /nfs/dbraw/zinc/87/06/99/1021870699.db2.gz HXTJJNBDZOXUAT-QGZVFWFLSA-N 2 1 339.483 4.027 20 0 EIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CCCc1cncn1C ZINC000584537607 1022011925 /nfs/dbraw/zinc/01/19/25/1022011925.db2.gz NNNJCZVGHXJZKO-ZDUSSCGKSA-N 2 1 325.378 4.065 20 0 EIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CCCc1c[nH+]cn1C ZINC000584537607 1022011943 /nfs/dbraw/zinc/01/19/43/1022011943.db2.gz NNNJCZVGHXJZKO-ZDUSSCGKSA-N 2 1 325.378 4.065 20 0 EIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CCCc1c[nH+]cn1C ZINC000584537607 1022011958 /nfs/dbraw/zinc/01/19/58/1022011958.db2.gz NNNJCZVGHXJZKO-ZDUSSCGKSA-N 2 1 325.378 4.065 20 0 EIADMP CC[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000414168506 1022015022 /nfs/dbraw/zinc/01/50/22/1022015022.db2.gz AFEPZGYBROJFMW-RHSMWYFYSA-N 2 1 326.431 4.061 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]CC[C@H]3CCC[N@@H+](C)C3)c(C)c2c1 ZINC000414169290 1022018559 /nfs/dbraw/zinc/01/85/59/1022018559.db2.gz BAVQPIYAIUVMGJ-HZPDHXFCSA-N 2 1 330.472 4.132 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]CC[C@@H]3CCC[N@@H+](C)C3)c(C)c2c1 ZINC000414169289 1022018827 /nfs/dbraw/zinc/01/88/27/1022018827.db2.gz BAVQPIYAIUVMGJ-HOTGVXAUSA-N 2 1 330.472 4.132 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3nccc4ccccc43)CC2)[nH+]1 ZINC000377812580 1022022558 /nfs/dbraw/zinc/02/25/58/1022022558.db2.gz YDPHLWUAVVMJKZ-QGZVFWFLSA-N 2 1 346.478 4.258 20 0 EIADMP COc1ccc2cc([C@H](C)[NH2+]CC[C@H]3CCC[N@@H+](C)C3)ccc2c1 ZINC000414171310 1022024994 /nfs/dbraw/zinc/02/49/94/1022024994.db2.gz DFFQWXZJZKMYHY-DLBZAZTESA-N 2 1 326.484 4.231 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)c2ccccc12 ZINC000414173961 1022032294 /nfs/dbraw/zinc/03/22/94/1022032294.db2.gz HEMSHFWOHXDMIF-IAGOWNOFSA-N 2 1 326.484 4.231 20 0 EIADMP COc1ccsc1[C@H](C)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000471593616 1022201593 /nfs/dbraw/zinc/20/15/93/1022201593.db2.gz MJBLPSVVUAWZAB-SOLBZPMBSA-N 2 1 344.524 4.318 20 0 EIADMP COc1ccsc1[C@H](C)N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000471593616 1022201603 /nfs/dbraw/zinc/20/16/03/1022201603.db2.gz MJBLPSVVUAWZAB-SOLBZPMBSA-N 2 1 344.524 4.318 20 0 EIADMP FC(F)Oc1cccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000557262841 1022241833 /nfs/dbraw/zinc/24/18/33/1022241833.db2.gz OWGMUOUABUDTRS-UHFFFAOYSA-N 2 1 338.442 4.175 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)ccc1Cl ZINC000549041202 1022249575 /nfs/dbraw/zinc/24/95/75/1022249575.db2.gz FVLSDSUTFTYVOX-DLBZAZTESA-N 2 1 338.923 4.127 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000892574365 1022260355 /nfs/dbraw/zinc/26/03/55/1022260355.db2.gz ZKHCEEVNHVJEJN-INIZCTEOSA-N 2 1 341.499 4.210 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1 ZINC001167424317 1022314351 /nfs/dbraw/zinc/31/43/51/1022314351.db2.gz HDRVFCXYGZVGRE-MJGOQNOKSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)CC(F)(F)F ZINC000414279003 1022390153 /nfs/dbraw/zinc/39/01/53/1022390153.db2.gz IPGHZFJQVORJMU-OWLYRPNTSA-N 2 1 340.433 4.360 20 0 EIADMP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)C1 ZINC000651300803 1022399673 /nfs/dbraw/zinc/39/96/73/1022399673.db2.gz GENWZPIAOBJHOG-OKYOBFRVSA-N 2 1 334.454 4.207 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398165581 1022410347 /nfs/dbraw/zinc/41/03/47/1022410347.db2.gz GSYBSAHFRJSWIH-SVMVAKDDSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398165581 1022410362 /nfs/dbraw/zinc/41/03/62/1022410362.db2.gz GSYBSAHFRJSWIH-SVMVAKDDSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Br)cc1 ZINC000088164240 1022549684 /nfs/dbraw/zinc/54/96/84/1022549684.db2.gz FZVDUDLMWFEPMS-FCLXEUQJSA-N 2 1 337.305 4.115 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Br)cc1 ZINC000088164240 1022549701 /nfs/dbraw/zinc/54/97/01/1022549701.db2.gz FZVDUDLMWFEPMS-FCLXEUQJSA-N 2 1 337.305 4.115 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000310846190 1022645815 /nfs/dbraw/zinc/64/58/15/1022645815.db2.gz IKTMIQOSVWWJRU-PZJWPPBQSA-N 2 1 340.511 4.493 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000310846186 1022648324 /nfs/dbraw/zinc/64/83/24/1022648324.db2.gz IKTMIQOSVWWJRU-CTNGQTDRSA-N 2 1 340.511 4.493 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310891195 1022681695 /nfs/dbraw/zinc/68/16/95/1022681695.db2.gz KPYVCGHXNWWOMP-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H](Cc2ccccc2)C2CC2)C[C@H]1c1ccccc1 ZINC000580955652 1022745714 /nfs/dbraw/zinc/74/57/14/1022745714.db2.gz KVEMPZPDJUATCX-VABKMULXSA-N 2 1 334.507 4.433 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@@H](Cc2ccccc2)C2CC2)C[C@H]1c1ccccc1 ZINC000580955652 1022745731 /nfs/dbraw/zinc/74/57/31/1022745731.db2.gz KVEMPZPDJUATCX-VABKMULXSA-N 2 1 334.507 4.433 20 0 EIADMP c1sc(-c2ccccc2)nc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647543409 1022794845 /nfs/dbraw/zinc/79/48/45/1022794845.db2.gz MXXAHMSQWSYYQT-MSOLQXFVSA-N 2 1 341.524 4.022 20 0 EIADMP CC[C@@H](NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022522 1022815316 /nfs/dbraw/zinc/81/53/16/1022815316.db2.gz OMNLSDIEGRCWDH-UYAOXDASSA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022522 1022815320 /nfs/dbraw/zinc/81/53/20/1022815320.db2.gz OMNLSDIEGRCWDH-UYAOXDASSA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022522 1022815321 /nfs/dbraw/zinc/81/53/21/1022815321.db2.gz OMNLSDIEGRCWDH-UYAOXDASSA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022522 1022815328 /nfs/dbraw/zinc/81/53/28/1022815328.db2.gz OMNLSDIEGRCWDH-UYAOXDASSA-N 2 1 341.474 4.174 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@H+](C)[C@@H]1c1cccs1)c1cccnc1 ZINC000363863291 1022866239 /nfs/dbraw/zinc/86/62/39/1022866239.db2.gz KJAFPAAPZLAYFW-LNLFQRSKSA-N 2 1 329.513 4.267 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@@H]1c1cccs1)c1cccnc1 ZINC000363863291 1022866240 /nfs/dbraw/zinc/86/62/40/1022866240.db2.gz KJAFPAAPZLAYFW-LNLFQRSKSA-N 2 1 329.513 4.267 20 0 EIADMP CC[C@@H](C)c1ccc([C@H](C)[NH2+]CCCCN2CC[NH+](CC)CC2)cc1 ZINC000623861780 1022876608 /nfs/dbraw/zinc/87/66/08/1022876608.db2.gz CHJIOPAQVVMQSB-UXHICEINSA-N 2 1 345.575 4.268 20 0 EIADMP CSc1ccc2c(c1)[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)CCC2 ZINC000581251194 1022916825 /nfs/dbraw/zinc/91/68/25/1022916825.db2.gz HHKCZWIUHFFVPU-AUUYWEPGSA-N 2 1 329.513 4.217 20 0 EIADMP COc1cccc(C=C2CCN(CC[C@@H]3CCCC[N@H+]3C)CC2)c1 ZINC000473007770 1022955525 /nfs/dbraw/zinc/95/55/25/1022955525.db2.gz HOIHLCGRQWXHAW-FQEVSTJZSA-N 2 1 328.500 4.049 20 0 EIADMP COc1cccc(C=C2CC[NH+](CC[C@@H]3CCCC[N@@H+]3C)CC2)c1 ZINC000473007770 1022955533 /nfs/dbraw/zinc/95/55/33/1022955533.db2.gz HOIHLCGRQWXHAW-FQEVSTJZSA-N 2 1 328.500 4.049 20 0 EIADMP COc1cccc(C=C2CC[NH+](CC[C@@H]3CCCC[N@H+]3C)CC2)c1 ZINC000473007770 1022955544 /nfs/dbraw/zinc/95/55/44/1022955544.db2.gz HOIHLCGRQWXHAW-FQEVSTJZSA-N 2 1 328.500 4.049 20 0 EIADMP C[C@@]1(C[NH2+]Cc2ccnc3ccccc23)CC[N@@H+](Cc2ccccc2)C1 ZINC000382250757 1023088728 /nfs/dbraw/zinc/08/87/28/1023088728.db2.gz AKOMJIKXVJULDO-QHCPKHFHSA-N 2 1 345.490 4.237 20 0 EIADMP CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000473307875 1033107348 /nfs/dbraw/zinc/10/73/48/1033107348.db2.gz DVVWSWSNVBESKL-XLIONFOSSA-N 2 1 345.531 4.024 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000589836698 1023223304 /nfs/dbraw/zinc/22/33/04/1023223304.db2.gz QYEQHBHPIRFFLB-GOSISDBHSA-N 2 1 340.511 4.450 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000376612309 1023236216 /nfs/dbraw/zinc/23/62/16/1023236216.db2.gz VAXVXLAEDOSKRV-ALKREAHSSA-N 2 1 345.462 4.176 20 0 EIADMP Brc1cccc2c1CCC[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000341188587 1023341567 /nfs/dbraw/zinc/34/15/67/1023341567.db2.gz MWPJBJJWRZJEBD-DEYYWGMASA-N 2 1 349.316 4.043 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(N[C@@H](CCC[NH3+])c2ccccc2)CC1 ZINC000415052863 1023409637 /nfs/dbraw/zinc/40/96/37/1023409637.db2.gz LVQOOQNRRYKSRT-COPCDDAFSA-N 2 1 343.559 4.099 20 0 EIADMP C[N@@H+](CCCc1cc(-c2ccccc2)no1)CC[C@H]1CCCC[NH+]1C ZINC000472687125 1023412483 /nfs/dbraw/zinc/41/24/83/1023412483.db2.gz YSMGVDZOYJTRKC-LJQANCHMSA-N 2 1 341.499 4.080 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC(N[C@@H](CCC[NH3+])c3ccccc3)CC2)C1 ZINC000415061583 1023416076 /nfs/dbraw/zinc/41/60/76/1023416076.db2.gz YRSAXICYQKMCBS-QIJUGHKUSA-N 2 1 343.559 4.099 20 0 EIADMP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@H]([NH3+])CC(C)C)s2)cc1 ZINC000415096618 1023441313 /nfs/dbraw/zinc/44/13/13/1023441313.db2.gz BTOWOFXXGQXBIL-XJKSGUPXSA-N 2 1 347.528 4.151 20 0 EIADMP CCC[C@H](C[NH2+]C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1)c1ccccc1 ZINC000377300320 1023457913 /nfs/dbraw/zinc/45/79/13/1023457913.db2.gz UFIRXWVCWYVACA-HJNYFJLDSA-N 2 1 337.511 4.248 20 0 EIADMP CCC[C@H](C[NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)c1ccccc1 ZINC000377300320 1023457924 /nfs/dbraw/zinc/45/79/24/1023457924.db2.gz UFIRXWVCWYVACA-HJNYFJLDSA-N 2 1 337.511 4.248 20 0 EIADMP Cc1nn(C(C)C)c(C)c1C[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000893327166 1023462026 /nfs/dbraw/zinc/46/20/26/1023462026.db2.gz HTNHXBLVCFDMFR-UHFFFAOYSA-N 2 1 342.531 4.211 20 0 EIADMP C[C@@H]1OCC[C@@H]1[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000549261838 1023583820 /nfs/dbraw/zinc/58/38/20/1023583820.db2.gz PKNWWFYWKOILJI-YVBJXDOVSA-N 2 1 348.918 4.021 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(NCCC[N@@H+]2CCCC[C@@H]2C)nc1 ZINC001167750759 1023617301 /nfs/dbraw/zinc/61/73/01/1023617301.db2.gz BHEUNUPTUGBTLM-RBUKOAKNSA-N 2 1 344.547 4.132 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(NCCC[NH+]2CCCC[C@@H]2C)nc1 ZINC001167750759 1023617307 /nfs/dbraw/zinc/61/73/07/1023617307.db2.gz BHEUNUPTUGBTLM-RBUKOAKNSA-N 2 1 344.547 4.132 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NCCC[NH+]2CCCC[C@@H]2C)nc1 ZINC001167750759 1023617310 /nfs/dbraw/zinc/61/73/10/1023617310.db2.gz BHEUNUPTUGBTLM-RBUKOAKNSA-N 2 1 344.547 4.132 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1cccc(O)c1 ZINC000390676018 1023768747 /nfs/dbraw/zinc/76/87/47/1023768747.db2.gz UHQVIHYVWRMCSU-DYESRHJHSA-N 2 1 338.495 4.344 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1cccc(O)c1 ZINC000390676018 1023768753 /nfs/dbraw/zinc/76/87/53/1023768753.db2.gz UHQVIHYVWRMCSU-DYESRHJHSA-N 2 1 338.495 4.344 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccc1 ZINC000471756982 1023802134 /nfs/dbraw/zinc/80/21/34/1023802134.db2.gz GETJXUIJMXWACH-FQEVSTJZSA-N 2 1 339.870 4.190 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000500420899 1023814787 /nfs/dbraw/zinc/81/47/87/1023814787.db2.gz LYNUFAJNEXCBOS-QZFKAFNDSA-N 2 1 340.433 4.430 20 0 EIADMP CC[C@@H](CC(F)F)C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC000660496238 1023869026 /nfs/dbraw/zinc/86/90/26/1023869026.db2.gz FSTHSQXEIAAZCJ-JKSUJKDBSA-N 2 1 344.515 4.492 20 0 EIADMP CC[C@@H](CC(F)F)C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(C)s2)C1 ZINC000660496238 1023869031 /nfs/dbraw/zinc/86/90/31/1023869031.db2.gz FSTHSQXEIAAZCJ-JKSUJKDBSA-N 2 1 344.515 4.492 20 0 EIADMP CC[C@@H](CC(F)F)C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(C)s2)C1 ZINC000660496238 1023869035 /nfs/dbraw/zinc/86/90/35/1023869035.db2.gz FSTHSQXEIAAZCJ-JKSUJKDBSA-N 2 1 344.515 4.492 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@H]2C)o1 ZINC000581948650 1023923407 /nfs/dbraw/zinc/92/34/07/1023923407.db2.gz VHXHHOFUDNIDJS-AUUYWEPGSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@H]2C)o1 ZINC000581948650 1023923413 /nfs/dbraw/zinc/92/34/13/1023923413.db2.gz VHXHHOFUDNIDJS-AUUYWEPGSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)o1 ZINC000581948650 1023923420 /nfs/dbraw/zinc/92/34/20/1023923420.db2.gz VHXHHOFUDNIDJS-AUUYWEPGSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)o1 ZINC000581948650 1023923424 /nfs/dbraw/zinc/92/34/24/1023923424.db2.gz VHXHHOFUDNIDJS-AUUYWEPGSA-N 2 1 330.447 4.166 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1C(F)(F)F ZINC000131766635 1023972298 /nfs/dbraw/zinc/97/22/98/1023972298.db2.gz IFDAJTRZXYREGR-AVOUXACISA-N 2 1 326.406 4.371 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1C(F)(F)F ZINC000131766635 1023972309 /nfs/dbraw/zinc/97/23/09/1023972309.db2.gz IFDAJTRZXYREGR-AVOUXACISA-N 2 1 326.406 4.371 20 0 EIADMP Fc1ccccc1Oc1cccc(C[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC000651863389 1024115236 /nfs/dbraw/zinc/11/52/36/1024115236.db2.gz HDSNMYMVGPKQNK-UHFFFAOYSA-N 2 1 340.442 4.334 20 0 EIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2cccc(C)c2)c2cccc(F)c2)C1 ZINC000510648510 1024168019 /nfs/dbraw/zinc/16/80/19/1024168019.db2.gz FRPFRSDQCJQREI-UTKZUKDTSA-N 2 1 326.459 4.155 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2cccc(C)c2)c2cccc(F)c2)C1 ZINC000510648510 1024168023 /nfs/dbraw/zinc/16/80/23/1024168023.db2.gz FRPFRSDQCJQREI-UTKZUKDTSA-N 2 1 326.459 4.155 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCc2cc(Br)ccc21 ZINC000164599159 1024679445 /nfs/dbraw/zinc/67/94/45/1024679445.db2.gz ZGOCZTKUBIZUJE-QGZVFWFLSA-N 2 1 348.288 4.011 20 0 EIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652347472 1024699966 /nfs/dbraw/zinc/69/99/66/1024699966.db2.gz BLQMXDKCZYWXMM-ITBLURSFSA-N 2 1 338.495 4.119 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000548483354 1024829836 /nfs/dbraw/zinc/82/98/36/1024829836.db2.gz NPJZKVMHVJGIBO-QRFRQXIXSA-N 2 1 342.552 4.488 20 0 EIADMP COc1ccccc1[C@H]([NH2+]CCCn1cc[nH+]c1C)C1CCCC1 ZINC000510942860 1024857660 /nfs/dbraw/zinc/85/76/60/1024857660.db2.gz CPXBYHOHCABNAA-HXUWFJFHSA-N 2 1 327.472 4.111 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCc2ccccc2[C@@H]1Cc1ccccc1 ZINC000535678548 1024878292 /nfs/dbraw/zinc/87/82/92/1024878292.db2.gz CCWUPUVOMDWWCL-QHCPKHFHSA-N 2 1 345.490 4.424 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCc2ccccc2[C@@H]1Cc1ccccc1 ZINC000535678548 1024878296 /nfs/dbraw/zinc/87/82/96/1024878296.db2.gz CCWUPUVOMDWWCL-QHCPKHFHSA-N 2 1 345.490 4.424 20 0 EIADMP CCC[N@H+](C)CC(C)(C)[NH2+]CCCC(=O)Nc1c(C)cc(C)cc1C ZINC000662176416 1024894832 /nfs/dbraw/zinc/89/48/32/1024894832.db2.gz FBHKIOKRHGGLHC-UHFFFAOYSA-N 2 1 347.547 4.041 20 0 EIADMP CCC[N@@H+](C)CC(C)(C)[NH2+]CCCC(=O)Nc1c(C)cc(C)cc1C ZINC000662176416 1024894834 /nfs/dbraw/zinc/89/48/34/1024894834.db2.gz FBHKIOKRHGGLHC-UHFFFAOYSA-N 2 1 347.547 4.041 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc2cc(Cl)ccc2o1 ZINC000278858989 1024946153 /nfs/dbraw/zinc/94/61/53/1024946153.db2.gz AWZQZOOOSQJIOM-STQMWFEESA-N 2 1 329.831 4.196 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](CCc1ccccc1)Cc1ccccc1 ZINC000510990857 1025025153 /nfs/dbraw/zinc/02/51/53/1025025153.db2.gz FNPWIYQCKLCMMQ-HSZRJFAPSA-N 2 1 347.506 4.415 20 0 EIADMP Cc1oc(-c2cccs2)nc1C[N@@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000662315184 1025068706 /nfs/dbraw/zinc/06/87/06/1025068706.db2.gz RVFWFGMYWRZEFU-CZUORRHYSA-N 2 1 333.501 4.051 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(C)o3)CC2)cs1 ZINC000161794879 1025070779 /nfs/dbraw/zinc/07/07/79/1025070779.db2.gz YTISOGPIAKZBFT-HNNXBMFYSA-N 2 1 347.528 4.170 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccnc3ccccc23)C1 ZINC000535825430 1025073104 /nfs/dbraw/zinc/07/31/04/1025073104.db2.gz DYOWQYBFBGKSDB-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccnc3ccccc23)C1 ZINC000535825430 1025073113 /nfs/dbraw/zinc/07/31/13/1025073113.db2.gz DYOWQYBFBGKSDB-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccnc3ccccc23)C1 ZINC000535825430 1025073117 /nfs/dbraw/zinc/07/31/17/1025073117.db2.gz DYOWQYBFBGKSDB-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccnc3ccccc23)C1 ZINC000535825430 1025073125 /nfs/dbraw/zinc/07/31/25/1025073125.db2.gz DYOWQYBFBGKSDB-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP CC(C)(C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)CC(F)(F)F ZINC000663354931 1025173089 /nfs/dbraw/zinc/17/30/89/1025173089.db2.gz ACXSWIMIIGKUOX-UHFFFAOYSA-N 2 1 328.422 4.219 20 0 EIADMP COCCC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1 ZINC000663465254 1025389782 /nfs/dbraw/zinc/38/97/82/1025389782.db2.gz IUTILJYPQAACOD-WIYYLYMNSA-N 2 1 348.506 4.005 20 0 EIADMP c1ccc2c(c1)[nH]c1c2CCC[C@H]1[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663466121 1025392715 /nfs/dbraw/zinc/39/27/15/1025392715.db2.gz OGPKONRAAXYPMH-LAUBAEHRSA-N 2 1 337.511 4.257 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1Cl ZINC000663467360 1025397911 /nfs/dbraw/zinc/39/79/11/1025397911.db2.gz DZNBDXODMCLFLT-ZBFHGGJFSA-N 2 1 336.907 4.121 20 0 EIADMP CSc1ccccc1C[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467333 1025398464 /nfs/dbraw/zinc/39/84/64/1025398464.db2.gz DWCAFYHQDXYNPX-FUHWJXTLSA-N 2 1 332.557 4.051 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccccc2F)CC1 ZINC000303204497 1025476594 /nfs/dbraw/zinc/47/65/94/1025476594.db2.gz PBZBXCMYFIKOHV-UHFFFAOYSA-N 2 1 326.459 4.170 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCCc3ccc(C)cc32)cn1 ZINC000166239756 1025532512 /nfs/dbraw/zinc/53/25/12/1025532512.db2.gz ZNCHAINOBIKZCH-FQEVSTJZSA-N 2 1 332.451 4.051 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H](Oc2ccccc2OC)C1 ZINC001167827185 1025634024 /nfs/dbraw/zinc/63/40/24/1025634024.db2.gz UMYFNHCHSMEUCU-RBUKOAKNSA-N 2 1 348.531 4.049 20 0 EIADMP CC(C)Sc1ccc([C@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)cc1 ZINC000925784389 1025643754 /nfs/dbraw/zinc/64/37/54/1025643754.db2.gz RBRQMJJUQXUZRZ-DZGCQCFKSA-N 2 1 328.472 4.083 20 0 EIADMP C[N@@H+](CCCOc1cccc2ccccc21)CC[C@@H]1CCCC[NH+]1C ZINC001167508276 1025746659 /nfs/dbraw/zinc/74/66/59/1025746659.db2.gz FRTSUYTVKFESNC-FQEVSTJZSA-N 2 1 340.511 4.415 20 0 EIADMP C[NH+](CCCOc1cccc2ccccc21)CC[C@@H]1CCCC[N@@H+]1C ZINC001167508276 1025746684 /nfs/dbraw/zinc/74/66/84/1025746684.db2.gz FRTSUYTVKFESNC-FQEVSTJZSA-N 2 1 340.511 4.415 20 0 EIADMP C[NH+](CCCOc1cccc2ccccc21)CC[C@@H]1CCCC[N@H+]1C ZINC001167508276 1025746710 /nfs/dbraw/zinc/74/67/10/1025746710.db2.gz FRTSUYTVKFESNC-FQEVSTJZSA-N 2 1 340.511 4.415 20 0 EIADMP Clc1ccc2c(c1)CC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167966700 1025836553 /nfs/dbraw/zinc/83/65/53/1025836553.db2.gz ZYOPGBDRJNYJLV-AQDPXUSMSA-N 2 1 330.903 4.322 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000390891436 1025838429 /nfs/dbraw/zinc/83/84/29/1025838429.db2.gz ZJWWJSKSEMXASF-MSOLQXFVSA-N 2 1 336.470 4.312 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000390891436 1025838432 /nfs/dbraw/zinc/83/84/32/1025838432.db2.gz ZJWWJSKSEMXASF-MSOLQXFVSA-N 2 1 336.470 4.312 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1c1ccc(C(=O)OC)cc1 ZINC001167836398 1025846764 /nfs/dbraw/zinc/84/67/64/1025846764.db2.gz ZHBCKCYUTFODNU-YLJYHZDGSA-N 2 1 346.515 4.121 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2COc3ccccc32)cc1 ZINC000344011456 1025873412 /nfs/dbraw/zinc/87/34/12/1025873412.db2.gz DIWGPNSOEXWKQK-QAPCUYQASA-N 2 1 333.435 4.008 20 0 EIADMP Cc1cc([C@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)sc1Br ZINC000453393799 1025873776 /nfs/dbraw/zinc/87/37/76/1025873776.db2.gz GKTRQBAVQALMPH-LBPRGKRZSA-N 2 1 345.350 4.344 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000432412233 1025883947 /nfs/dbraw/zinc/88/39/47/1025883947.db2.gz FSAQSRXSGVXEEL-LPHOPBHVSA-N 2 1 338.923 4.128 20 0 EIADMP CCC[C@H]([NH2+][C@@H]1CC[N@@H+](CCCOCC)C[C@@H]1C)c1ccsc1 ZINC000187722501 1025887176 /nfs/dbraw/zinc/88/71/76/1025887176.db2.gz LOPPMPMVMMUCGZ-UHOSZYNNSA-N 2 1 338.561 4.316 20 0 EIADMP Cc1cc([C@H](C)[NH2+]CCC[N@@H+](C)C(C)C)sc1Br ZINC000512088708 1025923325 /nfs/dbraw/zinc/92/33/25/1025923325.db2.gz PTVHPGAXCHCTRT-LBPRGKRZSA-N 2 1 333.339 4.200 20 0 EIADMP Cc1cc([C@H](C)[NH2+]CCC[N@H+](C)C(C)C)sc1Br ZINC000512088708 1025923372 /nfs/dbraw/zinc/92/33/72/1025923372.db2.gz PTVHPGAXCHCTRT-LBPRGKRZSA-N 2 1 333.339 4.200 20 0 EIADMP CC[N@@H+](Cc1c(C)nn(C(C)C)c1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000894455737 1025991972 /nfs/dbraw/zinc/99/19/72/1025991972.db2.gz JFCUYRLYJIYLQG-UHFFFAOYSA-N 2 1 342.531 4.165 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)s1 ZINC000512105003 1026006336 /nfs/dbraw/zinc/00/63/36/1026006336.db2.gz KPBARWIQPLWGMJ-MSOLQXFVSA-N 2 1 329.513 4.021 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCCOc3c(C)cc(Cl)cc32)C1 ZINC000431347651 1026083634 /nfs/dbraw/zinc/08/36/34/1026083634.db2.gz GGIVQORIIKOZFS-YJBOKZPZSA-N 2 1 336.907 4.184 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H]2CCCC[C@@H]2Cc2ccccc2)s1 ZINC000512135407 1026106020 /nfs/dbraw/zinc/10/60/20/1026106020.db2.gz JVHSKQHOKCTOAY-MJGOQNOKSA-N 2 1 343.540 4.096 20 0 EIADMP CCc1ccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)nc1 ZINC000550121667 1026177818 /nfs/dbraw/zinc/17/78/18/1026177818.db2.gz AANRQQLCOSXXHG-UHFFFAOYSA-N 2 1 349.522 4.132 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccc4ncccc4c3)C2)CC1 ZINC000512170522 1026210230 /nfs/dbraw/zinc/21/02/30/1026210230.db2.gz SOPWQEOGMADSTI-FQEVSTJZSA-N 2 1 337.511 4.179 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccc4ncccc4c3)C2)CC1 ZINC000512170522 1026210248 /nfs/dbraw/zinc/21/02/48/1026210248.db2.gz SOPWQEOGMADSTI-FQEVSTJZSA-N 2 1 337.511 4.179 20 0 EIADMP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)Cc1cccc(F)c1 ZINC001167978564 1026345520 /nfs/dbraw/zinc/34/55/20/1026345520.db2.gz PDGFRZQVLMGNNO-SEJPIABJSA-N 2 1 344.518 4.389 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(C)nc3ccccc23)CC1 ZINC000506858816 1026428060 /nfs/dbraw/zinc/42/80/60/1026428060.db2.gz CCYNYVLDZHEHLI-UHFFFAOYSA-N 2 1 339.527 4.487 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2ccncc2s1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000657430594 1026645016 /nfs/dbraw/zinc/64/50/16/1026645016.db2.gz RSQZTABUPRTFDR-ZBFHGGJFSA-N 2 1 329.513 4.039 20 0 EIADMP CC[C@@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)c1ccccc1 ZINC000112547317 1026675238 /nfs/dbraw/zinc/67/52/38/1026675238.db2.gz RDQKWNMAQRNMLI-HXUWFJFHSA-N 2 1 341.499 4.244 20 0 EIADMP COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(-n3ccnc3)cs2)o1 ZINC000344898919 1026700372 /nfs/dbraw/zinc/70/03/72/1026700372.db2.gz VPUWFVKTQFFFOT-KRWDZBQOSA-N 2 1 343.452 4.010 20 0 EIADMP Cc1ccccc1C[N@@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000432673081 1026711228 /nfs/dbraw/zinc/71/12/28/1026711228.db2.gz VRSVDMOTHNCYRX-LJQANCHMSA-N 2 1 326.509 4.201 20 0 EIADMP Cc1cccc2[nH]c(C[NH2+]C[C@H]3CC[N@@H+](Cc4ccccc4)C3)cc21 ZINC000657452429 1026760483 /nfs/dbraw/zinc/76/04/83/1026760483.db2.gz FJARTXOLDIOFFB-LJQANCHMSA-N 2 1 333.479 4.088 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)[C@H]1CCCOC1 ZINC000507511131 1026822676 /nfs/dbraw/zinc/82/26/76/1026822676.db2.gz NXBRGJSJWCKNGF-NQIIRXRSSA-N 2 1 344.543 4.356 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Br)ccc2C)C[C@H]1C ZINC001167586226 1026827635 /nfs/dbraw/zinc/82/76/35/1026827635.db2.gz JEHPJOCQVQDRPH-PBHICJAKSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Br)ccc2C)C[C@H]1C ZINC001167586226 1026827638 /nfs/dbraw/zinc/82/76/38/1026827638.db2.gz JEHPJOCQVQDRPH-PBHICJAKSA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Br)ccc2C)C[C@@H]1C ZINC001167586228 1026827707 /nfs/dbraw/zinc/82/77/07/1026827707.db2.gz JEHPJOCQVQDRPH-WMLDXEAASA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Br)ccc2C)C[C@@H]1C ZINC001167586228 1026827712 /nfs/dbraw/zinc/82/77/12/1026827712.db2.gz JEHPJOCQVQDRPH-WMLDXEAASA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Br)ccc2C)C[C@@H]1C ZINC001167586230 1026828361 /nfs/dbraw/zinc/82/83/61/1026828361.db2.gz JEHPJOCQVQDRPH-YOEHRIQHSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Br)ccc2C)C[C@@H]1C ZINC001167586230 1026828365 /nfs/dbraw/zinc/82/83/65/1026828365.db2.gz JEHPJOCQVQDRPH-YOEHRIQHSA-N 2 1 339.321 4.062 20 0 EIADMP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc(Cl)sc1Cl)CC2 ZINC001140588938 1027037894 /nfs/dbraw/zinc/03/78/94/1027037894.db2.gz BCWUXPIPXYMYSI-UHFFFAOYSA-N 2 1 333.328 4.363 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000474477196 1027109656 /nfs/dbraw/zinc/10/96/56/1027109656.db2.gz RCBBSSSKCCLRQH-GUDVDZBRSA-N 2 1 332.532 4.431 20 0 EIADMP COc1ccc([C@@H](C)[C@H](C)[NH2+]CC2([NH+](C)C)CCCCC2)cc1OC ZINC000474484560 1027121182 /nfs/dbraw/zinc/12/11/82/1027121182.db2.gz KUTGCCJCHFPODC-IRXDYDNUSA-N 2 1 348.531 4.050 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCOC(C)(C)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168036123 1027144801 /nfs/dbraw/zinc/14/48/01/1027144801.db2.gz UBGWQLGWIYNOKQ-KOUHRCEDSA-N 2 1 344.543 4.223 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC1 ZINC000204973664 1027304001 /nfs/dbraw/zinc/30/40/01/1027304001.db2.gz LTOCAPWSJFNHRR-GOSISDBHSA-N 2 1 331.891 4.273 20 0 EIADMP CC(C)(C)[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccccc1 ZINC000655688119 1027420580 /nfs/dbraw/zinc/42/05/80/1027420580.db2.gz LVFIJAYAPWEPIB-WOJBJXKFSA-N 2 1 330.516 4.007 20 0 EIADMP Cc1ccc(F)c(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000453362277 1027425677 /nfs/dbraw/zinc/42/56/77/1027425677.db2.gz QZEFTFTURINELT-CTNGQTDRSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1ccc(F)c(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000453362277 1027425685 /nfs/dbraw/zinc/42/56/85/1027425685.db2.gz QZEFTFTURINELT-CTNGQTDRSA-N 2 1 326.459 4.102 20 0 EIADMP CC(C)C[C@@H](C[NH2+]C1CC[NH+](CCOC(C)C)CC1)c1ccccc1 ZINC000474796814 1027507286 /nfs/dbraw/zinc/50/72/86/1027507286.db2.gz WLISYJKEHCADCY-NRFANRHFSA-N 2 1 346.559 4.295 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)C1CCSCC1 ZINC000474803259 1027525638 /nfs/dbraw/zinc/52/56/38/1027525638.db2.gz ZGLUKMGNTQCIDV-MBOZVWFJSA-N 2 1 332.557 4.018 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)C1CCSCC1 ZINC000474803259 1027525664 /nfs/dbraw/zinc/52/56/64/1027525664.db2.gz ZGLUKMGNTQCIDV-MBOZVWFJSA-N 2 1 332.557 4.018 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000474818037 1027542036 /nfs/dbraw/zinc/54/20/36/1027542036.db2.gz RJOIYUWTFAWKDB-YOEHRIQHSA-N 2 1 328.422 4.100 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccc(O)cc32)CC[N@@H+]1Cc1ccccc1 ZINC000657693535 1027579314 /nfs/dbraw/zinc/57/93/14/1027579314.db2.gz MSMLXDZEWSFSFR-PERKRYKHSA-N 2 1 336.479 4.022 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccc(O)cc32)CC[N@H+]1Cc1ccccc1 ZINC000657693535 1027579321 /nfs/dbraw/zinc/57/93/21/1027579321.db2.gz MSMLXDZEWSFSFR-PERKRYKHSA-N 2 1 336.479 4.022 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000152457909 1027613016 /nfs/dbraw/zinc/61/30/16/1027613016.db2.gz BUMVDAZIDIQCHM-RYUDHWBXSA-N 2 1 344.833 4.076 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1OC(F)F ZINC000152457909 1027613042 /nfs/dbraw/zinc/61/30/42/1027613042.db2.gz BUMVDAZIDIQCHM-RYUDHWBXSA-N 2 1 344.833 4.076 20 0 EIADMP COc1ccccc1[C@@H]1CCC[N@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995604 1027786793 /nfs/dbraw/zinc/78/67/93/1027786793.db2.gz KONNVLVUFMAMAI-VHRCFOOQSA-N 2 1 340.511 4.238 20 0 EIADMP COc1ccccc1[C@@H]1CCC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167995604 1027786809 /nfs/dbraw/zinc/78/68/09/1027786809.db2.gz KONNVLVUFMAMAI-VHRCFOOQSA-N 2 1 340.511 4.238 20 0 EIADMP COc1ccccc1[C@@H]1CCC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167995604 1027786834 /nfs/dbraw/zinc/78/68/34/1027786834.db2.gz KONNVLVUFMAMAI-VHRCFOOQSA-N 2 1 340.511 4.238 20 0 EIADMP C[N@@H+]1CC[C@@H]2CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000474924699 1027804250 /nfs/dbraw/zinc/80/42/50/1027804250.db2.gz IRVJRCALAQBJGG-CRAIPNDOSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@@H]2CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000474924699 1027804254 /nfs/dbraw/zinc/80/42/54/1027804254.db2.gz IRVJRCALAQBJGG-CRAIPNDOSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@H+](CCCCc3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000474924699 1027804259 /nfs/dbraw/zinc/80/42/59/1027804259.db2.gz IRVJRCALAQBJGG-CRAIPNDOSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@@H+](CCCCc3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000474924699 1027804266 /nfs/dbraw/zinc/80/42/66/1027804266.db2.gz IRVJRCALAQBJGG-CRAIPNDOSA-N 2 1 341.326 4.342 20 0 EIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](CCCc4cccnc4)CC[C@@H]32)cc1 ZINC001167646334 1027828482 /nfs/dbraw/zinc/82/84/82/1027828482.db2.gz AUFPPRKHFPYAQU-PKTZIBPZSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](CCCc4cccnc4)CC[C@@H]32)cc1 ZINC001167646334 1027828499 /nfs/dbraw/zinc/82/84/99/1027828499.db2.gz AUFPPRKHFPYAQU-PKTZIBPZSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](CCCc4cccnc4)CC[C@@H]32)cc1 ZINC001167646334 1027828505 /nfs/dbraw/zinc/82/85/05/1027828505.db2.gz AUFPPRKHFPYAQU-PKTZIBPZSA-N 2 1 349.522 4.001 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000536301399 1027859390 /nfs/dbraw/zinc/85/93/90/1027859390.db2.gz APSBMRNFUWSMNE-KRWDZBQOSA-N 2 1 327.299 4.445 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCc3ccc(C)cc32)cc1F ZINC000153721240 1027888906 /nfs/dbraw/zinc/88/89/06/1027888906.db2.gz QCJDEDWJXRCLLG-FQEVSTJZSA-N 2 1 335.426 4.405 20 0 EIADMP Cc1ccc2cc(C[NH2+]CCCC[N@@H+]3CCC[C@H](C)C3)ccc2n1 ZINC000189256289 1028111644 /nfs/dbraw/zinc/11/16/44/1028111644.db2.gz WOFLPISZFPWNLP-KRWDZBQOSA-N 2 1 325.500 4.145 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000583174988 1028173050 /nfs/dbraw/zinc/17/30/50/1028173050.db2.gz LTXNOSJHYOIEIJ-LCJXNMAOSA-N 2 1 338.442 4.107 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000583174988 1028173060 /nfs/dbraw/zinc/17/30/60/1028173060.db2.gz LTXNOSJHYOIEIJ-LCJXNMAOSA-N 2 1 338.442 4.107 20 0 EIADMP CC1(C)[C@@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1(F)F ZINC000657738979 1028183974 /nfs/dbraw/zinc/18/39/74/1028183974.db2.gz PBHUWWVZDZJIRN-IAGOWNOFSA-N 2 1 334.454 4.065 20 0 EIADMP CC1(C)[C@@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1(F)F ZINC000657738979 1028183989 /nfs/dbraw/zinc/18/39/89/1028183989.db2.gz PBHUWWVZDZJIRN-IAGOWNOFSA-N 2 1 334.454 4.065 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000346174948 1028304386 /nfs/dbraw/zinc/30/43/86/1028304386.db2.gz NDGDSKISBYBQGQ-QFIPXVFZSA-N 2 1 344.462 4.228 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)CCn1cc[nH+]c1C ZINC000346335101 1028390198 /nfs/dbraw/zinc/39/01/98/1028390198.db2.gz YHKJWKZFIBXDLE-HNNXBMFYSA-N 2 1 340.496 4.316 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)CCn1cc[nH+]c1C ZINC000346335101 1028390217 /nfs/dbraw/zinc/39/02/17/1028390217.db2.gz YHKJWKZFIBXDLE-HNNXBMFYSA-N 2 1 340.496 4.316 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+][C@@H](c2ccc(F)cc2)c2cccnc2)c1 ZINC000346499837 1028472903 /nfs/dbraw/zinc/47/29/03/1028472903.db2.gz YSZSFTYQUCQOHA-QFIPXVFZSA-N 2 1 349.453 4.162 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)C[C@H]3CCC(F)(F)C3)C2)s1 ZINC000583325119 1028519704 /nfs/dbraw/zinc/51/97/04/1028519704.db2.gz APPVRYBLUIIIQQ-HOTGVXAUSA-N 2 1 342.499 4.246 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C[C@H]3CCC(F)(F)C3)C2)s1 ZINC000583325119 1028519721 /nfs/dbraw/zinc/51/97/21/1028519721.db2.gz APPVRYBLUIIIQQ-HOTGVXAUSA-N 2 1 342.499 4.246 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)C[C@H]3CCC(F)(F)C3)C2)s1 ZINC000583325119 1028519737 /nfs/dbraw/zinc/51/97/37/1028519737.db2.gz APPVRYBLUIIIQQ-HOTGVXAUSA-N 2 1 342.499 4.246 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2coc(-c3cccc(F)c3)n2)CC1 ZINC000524156214 1028723768 /nfs/dbraw/zinc/72/37/68/1028723768.db2.gz VBQJLPBENJPDKZ-UHFFFAOYSA-N 2 1 345.462 4.033 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000281605493 1028810437 /nfs/dbraw/zinc/81/04/37/1028810437.db2.gz ARQOCSFXBZVTSN-UHFFFAOYSA-N 2 1 336.470 4.373 20 0 EIADMP C(=C/C[N@H+]1CCC[C@@H]1c1cccnc1)\C[NH+]1CCC[C@@H]1c1cccnc1 ZINC000346978598 1028831807 /nfs/dbraw/zinc/83/18/07/1028831807.db2.gz UEZABGVONGZQNQ-HSMZSTHASA-N 2 1 348.494 4.007 20 0 EIADMP Cc1nc(C(C)C)oc1CN[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000428430027 1029126315 /nfs/dbraw/zinc/12/63/15/1029126315.db2.gz GUEYEGXSAWATCT-LPHOPBHVSA-N 2 1 341.499 4.107 20 0 EIADMP C[NH2+]Cc1ccc(N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168055389 1029198901 /nfs/dbraw/zinc/19/89/01/1029198901.db2.gz VOZZBDGHKIJRMF-OPMZPASUSA-N 2 1 337.511 4.260 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC[N@@H+]1C ZINC000157766279 1029220240 /nfs/dbraw/zinc/22/02/40/1029220240.db2.gz GLUXMVAHZSAEBA-TYNCELHUSA-N 2 1 343.298 4.279 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC[N@H+]1C ZINC000157766279 1029220250 /nfs/dbraw/zinc/22/02/50/1029220250.db2.gz GLUXMVAHZSAEBA-TYNCELHUSA-N 2 1 343.298 4.279 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2ccc3occc3c2)cc1F ZINC000352812502 1029255825 /nfs/dbraw/zinc/25/58/25/1029255825.db2.gz FRVDUARRDRFQDX-UHFFFAOYSA-N 2 1 335.382 4.356 20 0 EIADMP C[C@@H](c1ccco1)[N@@H+](C)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000131095826 1029279576 /nfs/dbraw/zinc/27/95/76/1029279576.db2.gz CKFGYVCFIARRFR-KRWDZBQOSA-N 2 1 341.499 4.003 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000157936114 1029287597 /nfs/dbraw/zinc/28/75/97/1029287597.db2.gz WIKYXDQVCGRQDY-OALUTQOASA-N 3 1 340.515 4.035 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@@]3(CC3(F)F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168058837 1029375834 /nfs/dbraw/zinc/37/58/34/1029375834.db2.gz CPEDYAHEHKEJCY-UKBAYJJMSA-N 2 1 334.454 4.159 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@]3(CC3(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168058837 1029375849 /nfs/dbraw/zinc/37/58/49/1029375849.db2.gz CPEDYAHEHKEJCY-UKBAYJJMSA-N 2 1 334.454 4.159 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@@]3(CC3(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168058837 1029375860 /nfs/dbraw/zinc/37/58/60/1029375860.db2.gz CPEDYAHEHKEJCY-UKBAYJJMSA-N 2 1 334.454 4.159 20 0 EIADMP Cc1ncccc1C[NH+](C)[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060241 1029468545 /nfs/dbraw/zinc/46/85/45/1029468545.db2.gz VZWIIVAXJCIOAN-OPMZPASUSA-N 2 1 337.511 4.263 20 0 EIADMP Cc1ncccc1C[NH+](C)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060241 1029468557 /nfs/dbraw/zinc/46/85/57/1029468557.db2.gz VZWIIVAXJCIOAN-OPMZPASUSA-N 2 1 337.511 4.263 20 0 EIADMP Cc1ncccc1C[N@@H+](C)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060241 1029468570 /nfs/dbraw/zinc/46/85/70/1029468570.db2.gz VZWIIVAXJCIOAN-OPMZPASUSA-N 2 1 337.511 4.263 20 0 EIADMP Cc1ncccc1C[N@H+](C)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060241 1029468581 /nfs/dbraw/zinc/46/85/81/1029468581.db2.gz VZWIIVAXJCIOAN-OPMZPASUSA-N 2 1 337.511 4.263 20 0 EIADMP C[C@@H](CCc1ccsc1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475265286 1029474614 /nfs/dbraw/zinc/47/46/14/1029474614.db2.gz IAKYENKSBAKLTK-PXNSSMCTSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@H](CCc1ccccc1F)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475279235 1029487121 /nfs/dbraw/zinc/48/71/21/1029487121.db2.gz XQWNNSPMYHPYEI-UYAOXDASSA-N 2 1 340.486 4.259 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)CCS2 ZINC000343571149 1029518589 /nfs/dbraw/zinc/51/85/89/1029518589.db2.gz LCVTVUSGYRIWOX-MAUKXSAKSA-N 2 1 334.529 4.086 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)CCS2 ZINC000343571149 1029518601 /nfs/dbraw/zinc/51/86/01/1029518601.db2.gz LCVTVUSGYRIWOX-MAUKXSAKSA-N 2 1 334.529 4.086 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@H](C(F)(F)F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168061389 1029540852 /nfs/dbraw/zinc/54/08/52/1029540852.db2.gz IFESMEYCIUAQKE-MVJTYMMSSA-N 2 1 340.433 4.312 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@H](C(F)(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168061389 1029540857 /nfs/dbraw/zinc/54/08/57/1029540857.db2.gz IFESMEYCIUAQKE-MVJTYMMSSA-N 2 1 340.433 4.312 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@H](C(F)(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168061389 1029540861 /nfs/dbraw/zinc/54/08/61/1029540861.db2.gz IFESMEYCIUAQKE-MVJTYMMSSA-N 2 1 340.433 4.312 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000623348125 1029545936 /nfs/dbraw/zinc/54/59/36/1029545936.db2.gz SIAIYKUISMMJOZ-TZMCWYRMSA-N 2 1 330.394 4.109 20 0 EIADMP c1[nH+]c(C2CCN(c3cc[nH+]c4ccccc43)CC2)n2c1CCCC2 ZINC000278586134 1029548376 /nfs/dbraw/zinc/54/83/76/1029548376.db2.gz DEEKMTGFNPDVFD-UHFFFAOYSA-N 2 1 332.451 4.152 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCC[NH+]1CCCCC1)CCCS2 ZINC000446747916 1029556410 /nfs/dbraw/zinc/55/64/10/1029556410.db2.gz JNGDQYUCTLWVOH-SFHVURJKSA-N 2 1 334.529 4.088 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000446766407 1029565508 /nfs/dbraw/zinc/56/55/08/1029565508.db2.gz HVRKHPVEAOKCTN-KRWDZBQOSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000446766407 1029565518 /nfs/dbraw/zinc/56/55/18/1029565518.db2.gz HVRKHPVEAOKCTN-KRWDZBQOSA-N 2 1 328.431 4.002 20 0 EIADMP Cc1ccc([C@H]([NH2+]CCCC[N@H+]2CCC[C@H]2CO)C2CCCC2)cc1 ZINC000446820465 1029588892 /nfs/dbraw/zinc/58/88/92/1029588892.db2.gz CWETZLZQBMBPDW-FCHUYYIVSA-N 2 1 344.543 4.053 20 0 EIADMP C[C@@H]1CC([N@@H+](C)CC2CC(F)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168063902 1029617492 /nfs/dbraw/zinc/61/74/92/1029617492.db2.gz NUYPBONUNMUUME-HZPDHXFCSA-N 2 1 336.470 4.405 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)s2)cc1C ZINC000655711518 1029625051 /nfs/dbraw/zinc/62/50/51/1029625051.db2.gz KUNZOEMOSMEAAJ-MSOLQXFVSA-N 2 1 341.524 4.143 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)s2)cc1C ZINC000655711518 1029625057 /nfs/dbraw/zinc/62/50/57/1029625057.db2.gz KUNZOEMOSMEAAJ-MSOLQXFVSA-N 2 1 341.524 4.143 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C2CC(CF)(CF)C2)cc1 ZINC000657836355 1029684393 /nfs/dbraw/zinc/68/43/93/1029684393.db2.gz KOTZOCDZRNHMSB-MRXNPFEDSA-N 2 1 336.470 4.238 20 0 EIADMP COc1ccc([C@@H](C)C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)cc1 ZINC000447075903 1029688362 /nfs/dbraw/zinc/68/83/62/1029688362.db2.gz HJEGSFPFWYNBQL-KRWDZBQOSA-N 2 1 340.467 4.046 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]C3CC(CF)(CF)C3)cc2)C1 ZINC000657836812 1029695491 /nfs/dbraw/zinc/69/54/91/1029695491.db2.gz OVRLTQCEVRJHOS-MRXNPFEDSA-N 2 1 336.470 4.096 20 0 EIADMP C[C@H](c1ccccc1F)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278746392 1029792447 /nfs/dbraw/zinc/79/24/47/1029792447.db2.gz AMOUYPVYAXMFTH-OAHLLOKOSA-N 2 1 327.447 4.299 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cc3ccccc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000090577303 1029867745 /nfs/dbraw/zinc/86/77/45/1029867745.db2.gz ZCWWCQNRPHHISF-RXVVDRJESA-N 2 1 347.506 4.353 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000090577303 1029867748 /nfs/dbraw/zinc/86/77/48/1029867748.db2.gz ZCWWCQNRPHHISF-RXVVDRJESA-N 2 1 347.506 4.353 20 0 EIADMP Fc1cccc(F)c1-c1ccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)o1 ZINC000092072187 1029898856 /nfs/dbraw/zinc/89/88/56/1029898856.db2.gz BMAQODBBWQSPEN-CYBMUJFWSA-N 2 1 343.377 4.328 20 0 EIADMP c1cc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc(-c2ccncc2)c1 ZINC000092066687 1029899722 /nfs/dbraw/zinc/89/97/22/1029899722.db2.gz YOXZFEVMKODDEY-FYYLOGMGSA-N 2 1 347.506 4.197 20 0 EIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000525694898 1029939882 /nfs/dbraw/zinc/93/98/82/1029939882.db2.gz QBVMMBUYMDLQKU-IRXDYDNUSA-N 2 1 326.484 4.356 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390682492 1030035636 /nfs/dbraw/zinc/03/56/36/1030035636.db2.gz WINOUGHSAKZNHW-GHTZIAJQSA-N 2 1 340.511 4.491 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390682492 1030035655 /nfs/dbraw/zinc/03/56/55/1030035655.db2.gz WINOUGHSAKZNHW-GHTZIAJQSA-N 2 1 340.511 4.491 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000450874918 1030067378 /nfs/dbraw/zinc/06/73/78/1030067378.db2.gz HLOOODGRZNCQNA-MRXNPFEDSA-N 2 1 337.458 4.224 20 0 EIADMP Cc1cncc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1 ZINC000184366964 1030070471 /nfs/dbraw/zinc/07/04/71/1030070471.db2.gz XWSXSZJHONLGCA-FCEWJHQRSA-N 2 1 329.513 4.185 20 0 EIADMP Cc1cncc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000184366964 1030070489 /nfs/dbraw/zinc/07/04/89/1030070489.db2.gz XWSXSZJHONLGCA-FCEWJHQRSA-N 2 1 329.513 4.185 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(-n2ccnc2)cc1 ZINC000392266005 1030078103 /nfs/dbraw/zinc/07/81/03/1030078103.db2.gz OGZVTOQPYLRTEK-GOSISDBHSA-N 2 1 340.515 4.178 20 0 EIADMP C[N@H+](Cc1nccs1)[C@H]1CC12CC[NH+](CCC1=CCCCC1)CC2 ZINC000450940269 1030121809 /nfs/dbraw/zinc/12/18/09/1030121809.db2.gz QZAZGHWNUZMAJM-SFHVURJKSA-N 2 1 345.556 4.320 20 0 EIADMP C[N@@H+](Cc1nccs1)[C@H]1CC12CC[NH+](CCC1=CCCCC1)CC2 ZINC000450940269 1030121820 /nfs/dbraw/zinc/12/18/20/1030121820.db2.gz QZAZGHWNUZMAJM-SFHVURJKSA-N 2 1 345.556 4.320 20 0 EIADMP CCOC1CCC([NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CC1 ZINC000657885671 1030183612 /nfs/dbraw/zinc/18/36/12/1030183612.db2.gz BFGFRVNBDTUSJL-LOTPSLMQSA-N 2 1 336.545 4.068 20 0 EIADMP CCOC1CCC([NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CC1 ZINC000657885671 1030183619 /nfs/dbraw/zinc/18/36/19/1030183619.db2.gz BFGFRVNBDTUSJL-LOTPSLMQSA-N 2 1 336.545 4.068 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000447578776 1030206071 /nfs/dbraw/zinc/20/60/71/1030206071.db2.gz HHPZPIHSPBNQDP-CADBVGFASA-N 2 1 334.454 4.350 20 0 EIADMP C[C@@H](CC(F)(F)F)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447601978 1030219708 /nfs/dbraw/zinc/21/97/08/1030219708.db2.gz RBPKUHFFCRJILV-QSPRXWTASA-N 2 1 326.406 4.113 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000447601016 1030220971 /nfs/dbraw/zinc/22/09/71/1030220971.db2.gz OLWXYLCKDDCTBF-OPYAIIAOSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000447601016 1030220993 /nfs/dbraw/zinc/22/09/93/1030220993.db2.gz OLWXYLCKDDCTBF-OPYAIIAOSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000526119005 1030289835 /nfs/dbraw/zinc/28/98/35/1030289835.db2.gz KUWMGCVVUFQNNA-IAGOWNOFSA-N 2 1 346.515 4.493 20 0 EIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000526119005 1030289839 /nfs/dbraw/zinc/28/98/39/1030289839.db2.gz KUWMGCVVUFQNNA-IAGOWNOFSA-N 2 1 346.515 4.493 20 0 EIADMP FC(F)(F)CCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000278778728 1030289936 /nfs/dbraw/zinc/28/99/36/1030289936.db2.gz PQRJFVMVEGQDFJ-BJWYYQGGSA-N 2 1 326.406 4.114 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000526119006 1030290576 /nfs/dbraw/zinc/29/05/76/1030290576.db2.gz KUWMGCVVUFQNNA-IRXDYDNUSA-N 2 1 346.515 4.493 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000526119006 1030290599 /nfs/dbraw/zinc/29/05/99/1030290599.db2.gz KUWMGCVVUFQNNA-IRXDYDNUSA-N 2 1 346.515 4.493 20 0 EIADMP C[N@H+](Cc1ccc2occc2c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000685417750 1030294416 /nfs/dbraw/zinc/29/44/16/1030294416.db2.gz TTZRKMDFQSYANT-HXUWFJFHSA-N 2 1 334.463 4.387 20 0 EIADMP C[NH+](Cc1ccc2occc2c1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000685417750 1030294433 /nfs/dbraw/zinc/29/44/33/1030294433.db2.gz TTZRKMDFQSYANT-HXUWFJFHSA-N 2 1 334.463 4.387 20 0 EIADMP C[NH+](Cc1ccc2occc2c1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000685417750 1030294449 /nfs/dbraw/zinc/29/44/49/1030294449.db2.gz TTZRKMDFQSYANT-HXUWFJFHSA-N 2 1 334.463 4.387 20 0 EIADMP c1c2ccccc2[nH]c1C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000685443055 1030320089 /nfs/dbraw/zinc/32/00/89/1030320089.db2.gz NIDKSDYQFJRBAO-HSZRJFAPSA-N 2 1 345.490 4.266 20 0 EIADMP c1c2ccccc2[nH]c1C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000685443055 1030320106 /nfs/dbraw/zinc/32/01/06/1030320106.db2.gz NIDKSDYQFJRBAO-HSZRJFAPSA-N 2 1 345.490 4.266 20 0 EIADMP c1c2ccccc2[nH]c1C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000685443055 1030320124 /nfs/dbraw/zinc/32/01/24/1030320124.db2.gz NIDKSDYQFJRBAO-HSZRJFAPSA-N 2 1 345.490 4.266 20 0 EIADMP c1c2ccccc2[nH]c1C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000685443055 1030320139 /nfs/dbraw/zinc/32/01/39/1030320139.db2.gz NIDKSDYQFJRBAO-HSZRJFAPSA-N 2 1 345.490 4.266 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3csc(Cl)c3Cl)C2)CC1 ZINC000685462787 1030341556 /nfs/dbraw/zinc/34/15/56/1030341556.db2.gz CIHCJKVSXFXTIC-GFCCVEGCSA-N 2 1 333.328 4.219 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3csc(Cl)c3Cl)C2)CC1 ZINC000685462787 1030341575 /nfs/dbraw/zinc/34/15/75/1030341575.db2.gz CIHCJKVSXFXTIC-GFCCVEGCSA-N 2 1 333.328 4.219 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685462156 1030343128 /nfs/dbraw/zinc/34/31/28/1030343128.db2.gz JUDOPLAKDHYAFY-UHFFFAOYSA-N 2 1 348.494 4.482 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(N(C)c2ccccc2)cc1 ZINC000685462156 1030343151 /nfs/dbraw/zinc/34/31/51/1030343151.db2.gz JUDOPLAKDHYAFY-UHFFFAOYSA-N 2 1 348.494 4.482 20 0 EIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(Br)cc1 ZINC000530371019 1030346939 /nfs/dbraw/zinc/34/69/39/1030346939.db2.gz DKKNNSFCEVBYGB-NVPAJSRCSA-N 2 1 337.305 4.117 20 0 EIADMP C[C@H](CCSc1ccccc1)[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000431609798 1030490791 /nfs/dbraw/zinc/49/07/91/1030490791.db2.gz XKEDUCBBWRPRFI-QGZVFWFLSA-N 2 1 343.540 4.246 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000530522686 1030496710 /nfs/dbraw/zinc/49/67/10/1030496710.db2.gz QCRUQZHTKDGISV-UBHSMVFVSA-N 2 1 344.543 4.082 20 0 EIADMP COc1ccc([C@H](Cc2ccccc2)[NH2+]CCCn2cc[nH+]c2C)cc1 ZINC000685597937 1030555642 /nfs/dbraw/zinc/55/56/42/1030555642.db2.gz FBSDVXUXOVEDID-QFIPXVFZSA-N 2 1 349.478 4.164 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)CCOc2ccc3ccccc3c2)CC1 ZINC000530666153 1030623776 /nfs/dbraw/zinc/62/37/76/1030623776.db2.gz YKXNANMZZDNFHR-UHFFFAOYSA-N 2 1 326.484 4.025 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCCSCC2)C[N@H+]1Cc1ccccc1 ZINC000657934216 1030633070 /nfs/dbraw/zinc/63/30/70/1030633070.db2.gz ZZRLTWMYIHHYPQ-RLLQIKCJSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@H]([NH2+]CCCCOc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000527354935 1030662723 /nfs/dbraw/zinc/66/27/23/1030662723.db2.gz OAFPUEYSCGKFCQ-OALUTQOASA-N 2 1 330.516 4.088 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccc(F)cc1 ZINC000398037983 1030690842 /nfs/dbraw/zinc/69/08/42/1030690842.db2.gz QOMYXALHUONLMM-WWMYMODYSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccc(F)cc1 ZINC000398037983 1030690858 /nfs/dbraw/zinc/69/08/58/1030690858.db2.gz QOMYXALHUONLMM-WWMYMODYSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1coc2ccccc12 ZINC000398108250 1030697276 /nfs/dbraw/zinc/69/72/76/1030697276.db2.gz CDZZNAMKPLQJRD-DYESRHJHSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1coc2ccccc12 ZINC000398108250 1030697286 /nfs/dbraw/zinc/69/72/86/1030697286.db2.gz CDZZNAMKPLQJRD-DYESRHJHSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CNCc1ccncc1Cl ZINC000527637812 1030792123 /nfs/dbraw/zinc/79/21/23/1030792123.db2.gz CWDWXADVZYJQSF-INIZCTEOSA-N 2 1 343.902 4.399 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccncc1Cl ZINC000527637812 1030792129 /nfs/dbraw/zinc/79/21/29/1030792129.db2.gz CWDWXADVZYJQSF-INIZCTEOSA-N 2 1 343.902 4.399 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccncc1Cl ZINC000527637812 1030792146 /nfs/dbraw/zinc/79/21/46/1030792146.db2.gz CWDWXADVZYJQSF-INIZCTEOSA-N 2 1 343.902 4.399 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2ccncc2Cl)cc1 ZINC000527640967 1030795626 /nfs/dbraw/zinc/79/56/26/1030795626.db2.gz ONWZHDPFOXJCPN-INIZCTEOSA-N 2 1 343.902 4.399 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2ccncc2Cl)cc1 ZINC000527640967 1030795649 /nfs/dbraw/zinc/79/56/49/1030795649.db2.gz ONWZHDPFOXJCPN-INIZCTEOSA-N 2 1 343.902 4.399 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]Cc3ccc4cc[nH]c4c3)C2)c1 ZINC000527650539 1030800143 /nfs/dbraw/zinc/80/01/43/1030800143.db2.gz QBZYKCCRALMURZ-KRWDZBQOSA-N 2 1 339.508 4.231 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]Cc3ccc4cc[nH]c4c3)C2)c1 ZINC000527650539 1030800147 /nfs/dbraw/zinc/80/01/47/1030800147.db2.gz QBZYKCCRALMURZ-KRWDZBQOSA-N 2 1 339.508 4.231 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+]Cc1cc(Cl)c(OC(C)C)cc1Cl ZINC000527650455 1030801273 /nfs/dbraw/zinc/80/12/73/1030801273.db2.gz PRLZDEUDXRAOTB-UHFFFAOYSA-N 2 1 342.270 4.075 20 0 EIADMP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3ccncc3Cl)c2)CC1 ZINC000527654589 1030812224 /nfs/dbraw/zinc/81/22/24/1030812224.db2.gz SCVIPCWYWLZAKX-UHFFFAOYSA-N 2 1 343.902 4.257 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)CC[N@@H+]1C ZINC000658252954 1030924087 /nfs/dbraw/zinc/92/40/87/1030924087.db2.gz GEVRCDSEBYWXLR-ZYHUDNBSSA-N 2 1 334.348 4.112 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)CC[N@H+]1C ZINC000658252954 1030924108 /nfs/dbraw/zinc/92/41/08/1030924108.db2.gz GEVRCDSEBYWXLR-ZYHUDNBSSA-N 2 1 334.348 4.112 20 0 EIADMP CC[NH+]1CCC([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)CC1 ZINC000658255074 1030925639 /nfs/dbraw/zinc/92/56/39/1030925639.db2.gz PDVYVEXYSPWRSJ-UHFFFAOYSA-N 2 1 334.348 4.114 20 0 EIADMP C[C@H](NC[C@@H]1CC[N@@H+]1C1CCCCC1)c1cnc2ccsc2c1 ZINC000527949023 1030965004 /nfs/dbraw/zinc/96/50/04/1030965004.db2.gz NQICBPAWJMESSN-YOEHRIQHSA-N 2 1 329.513 4.354 20 0 EIADMP C[C@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cccnc1 ZINC000658320508 1030983648 /nfs/dbraw/zinc/98/36/48/1030983648.db2.gz YWLGNKGGFLMZFN-RXVVDRJESA-N 2 1 335.495 4.035 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000310066031 1031013038 /nfs/dbraw/zinc/01/30/38/1031013038.db2.gz BLFIVZQJFQKBSH-NQIIRXRSSA-N 2 1 326.484 4.103 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCC1 ZINC000340306990 1031204982 /nfs/dbraw/zinc/20/49/82/1031204982.db2.gz WDZYUMRCPRISIP-UXHICEINSA-N 2 1 330.516 4.008 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCC1 ZINC000340306990 1031204995 /nfs/dbraw/zinc/20/49/95/1031204995.db2.gz WDZYUMRCPRISIP-UXHICEINSA-N 2 1 330.516 4.008 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@@H]3CC)CC2)cs1 ZINC000532505321 1031224918 /nfs/dbraw/zinc/22/49/18/1031224918.db2.gz CUAFRHDOQQLNHE-FUHWJXTLSA-N 2 1 335.561 4.086 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@@H](C)[C@H](C)c3ccccc3)CCCC2)CC1 ZINC000532514293 1031246715 /nfs/dbraw/zinc/24/67/15/1031246715.db2.gz GIXISHXEKCNYDD-OALUTQOASA-N 2 1 344.543 4.192 20 0 EIADMP CC(C)c1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@@H](C)c1nc2ccccc2o1 ZINC000375825403 1031308420 /nfs/dbraw/zinc/30/84/20/1031308420.db2.gz RMIXFEJOHQUTMQ-JKSUJKDBSA-N 2 1 338.455 4.373 20 0 EIADMP CC(C)c1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@@H](C)c1nc2ccccc2o1 ZINC000375825403 1031308436 /nfs/dbraw/zinc/30/84/36/1031308436.db2.gz RMIXFEJOHQUTMQ-JKSUJKDBSA-N 2 1 338.455 4.373 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000531535471 1031339317 /nfs/dbraw/zinc/33/93/17/1031339317.db2.gz WGLPUHUVVGOTQI-SFHVURJKSA-N 2 1 338.495 4.184 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000531535471 1031339328 /nfs/dbraw/zinc/33/93/28/1031339328.db2.gz WGLPUHUVVGOTQI-SFHVURJKSA-N 2 1 338.495 4.184 20 0 EIADMP Clc1ccc(C2=CC[C@H]([NH2+]C[C@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000449074345 1031426725 /nfs/dbraw/zinc/42/67/25/1031426725.db2.gz KPBATSWRXUUFFB-BEFAXECRSA-N 2 1 330.903 4.350 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000531614318 1031431848 /nfs/dbraw/zinc/43/18/48/1031431848.db2.gz BSAZSHKFOBXINT-QGZVFWFLSA-N 2 1 343.540 4.350 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]C2CCC(OC3CCCC3)CC2)C1 ZINC000449081660 1031438807 /nfs/dbraw/zinc/43/88/07/1031438807.db2.gz GYUINPOQOWOMHU-LWEYNCJUSA-N 2 1 336.564 4.359 20 0 EIADMP Fc1ccccc1-c1ncc(C[NH2+]C2CC[NH+](C3CCC3)CC2)s1 ZINC000449096649 1031440584 /nfs/dbraw/zinc/44/05/84/1031440584.db2.gz JHLOWEUMTAWJDJ-UHFFFAOYSA-N 2 1 345.487 4.056 20 0 EIADMP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)c1 ZINC000531688260 1031461219 /nfs/dbraw/zinc/46/12/19/1031461219.db2.gz DYWYNDRKGQJQSL-OAHLLOKOSA-N 2 1 340.458 4.367 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)Cc3coc4ccccc34)CC2)[nH+]1 ZINC000449143922 1031478731 /nfs/dbraw/zinc/47/87/31/1031478731.db2.gz RJZLPEYVTZZZIT-KRWDZBQOSA-N 2 1 349.478 4.326 20 0 EIADMP Cc1cccc(N2CCC([NH2+]C[C@H](C)c3cc(F)cc(F)c3)CC2)[nH+]1 ZINC000449141423 1031478935 /nfs/dbraw/zinc/47/89/35/1031478935.db2.gz LJPUDPNWRPQANM-AWEZNQCLSA-N 2 1 345.437 4.030 20 0 EIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000531715399 1031500821 /nfs/dbraw/zinc/50/08/21/1031500821.db2.gz ZOOLAGCFLCYWSC-HOCLYGCPSA-N 2 1 326.937 4.142 20 0 EIADMP C[NH+]1CCC([NH2+][C@@H](Cc2ccccc2Cl)c2ccsc2)CC1 ZINC000453098621 1031557686 /nfs/dbraw/zinc/55/76/86/1031557686.db2.gz VJNXRVOCNDWBAD-SFHVURJKSA-N 2 1 334.916 4.369 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(c2c[nH]c3ccccc32)CC1 ZINC000125437417 1031596167 /nfs/dbraw/zinc/59/61/67/1031596167.db2.gz SHHGAOGQGZQRRI-UHFFFAOYSA-N 2 1 336.483 4.333 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc3ccccc3n2)CC1 ZINC000531956069 1031872579 /nfs/dbraw/zinc/87/25/79/1031872579.db2.gz TZNLVWIMHWCYHP-VGSWGCGISA-N 2 1 337.511 4.368 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccccc2C(F)(F)F)C1 ZINC000531958969 1031878021 /nfs/dbraw/zinc/87/80/21/1031878021.db2.gz HCMKGAVIKAHKPO-CABCVRRESA-N 2 1 328.422 4.476 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(OCc2cccc(C)c2)cc1 ZINC000531964830 1031885294 /nfs/dbraw/zinc/88/52/94/1031885294.db2.gz UBRRZZZBJCBEMA-SFHVURJKSA-N 2 1 349.478 4.430 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1OC ZINC000453370688 1031916079 /nfs/dbraw/zinc/91/60/79/1031916079.db2.gz VTVKOZWXAGBSGS-BPIHKTFHSA-N 2 1 346.515 4.150 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CCCC[N@@H+](C)C3CC3)oc21 ZINC000453417539 1031952584 /nfs/dbraw/zinc/95/25/84/1031952584.db2.gz XUGYKEQVGUAKCT-OAHLLOKOSA-N 2 1 330.472 4.357 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000531993448 1031960423 /nfs/dbraw/zinc/96/04/23/1031960423.db2.gz REIDHIUROASVGN-URZJWIJPSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000531993448 1031960436 /nfs/dbraw/zinc/96/04/36/1031960436.db2.gz REIDHIUROASVGN-URZJWIJPSA-N 2 1 338.470 4.313 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)s1 ZINC000449774339 1031997483 /nfs/dbraw/zinc/99/74/83/1031997483.db2.gz OQLQHPVMYFFLDC-GDBMZVCRSA-N 2 1 349.931 4.284 20 0 EIADMP C[C@H](CCN[C@@H](C)c1ccc(Cl)nc1)[N@@H+](C)Cc1ccccc1 ZINC000179135355 1032015684 /nfs/dbraw/zinc/01/56/84/1032015684.db2.gz ZMHJBOORUBZAJO-CVEARBPZSA-N 2 1 331.891 4.296 20 0 EIADMP C[C@H](CC[NH2+][C@@H](C)c1ccc(Cl)nc1)[N@@H+](C)Cc1ccccc1 ZINC000179135355 1032015708 /nfs/dbraw/zinc/01/57/08/1032015708.db2.gz ZMHJBOORUBZAJO-CVEARBPZSA-N 2 1 331.891 4.296 20 0 EIADMP CC(C)(C)c1cccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001168264684 1032028203 /nfs/dbraw/zinc/02/82/03/1032028203.db2.gz LTKYTYDHUCOSQM-GHTZIAJQSA-N 2 1 326.528 4.433 20 0 EIADMP CC(C)(C)c1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001168264684 1032028218 /nfs/dbraw/zinc/02/82/18/1032028218.db2.gz LTKYTYDHUCOSQM-GHTZIAJQSA-N 2 1 326.528 4.433 20 0 EIADMP CC(C)(C)c1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001168264684 1032028231 /nfs/dbraw/zinc/02/82/31/1032028231.db2.gz LTKYTYDHUCOSQM-GHTZIAJQSA-N 2 1 326.528 4.433 20 0 EIADMP CCc1ccc(C[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)nc1 ZINC000549866455 1033489368 /nfs/dbraw/zinc/48/93/68/1033489368.db2.gz XNIPHBHOTAENEA-PGRDOPGGSA-N 2 1 337.511 4.129 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(-c3ccccc3)no2)CC1 ZINC000052209083 1034476967 /nfs/dbraw/zinc/47/69/67/1034476967.db2.gz VPATXYTWXUYPMV-UHFFFAOYSA-N 2 1 341.499 4.286 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[N@H+](C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000576438250 1034561802 /nfs/dbraw/zinc/56/18/02/1034561802.db2.gz LPHROHNRFAPWES-DKZLNJBMSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[NH+](C)[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000576438250 1034561815 /nfs/dbraw/zinc/56/18/15/1034561815.db2.gz LPHROHNRFAPWES-DKZLNJBMSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000576438250 1034561833 /nfs/dbraw/zinc/56/18/33/1034561833.db2.gz LPHROHNRFAPWES-DKZLNJBMSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC000576438250 1034561844 /nfs/dbraw/zinc/56/18/44/1034561844.db2.gz LPHROHNRFAPWES-DKZLNJBMSA-N 2 1 338.442 4.106 20 0 EIADMP 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 1034709248 /nfs/dbraw/zinc/70/92/48/1034709248.db2.gz GVMRSHOMCRAQES-WRPXMVFYSA-N 2 1 330.541 4.079 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+]([C@@H]3C[C@H]4C[C@H]4C3)C[C@@H]21 ZINC001167934138 1034709266 /nfs/dbraw/zinc/70/92/66/1034709266.db2.gz GVMRSHOMCRAQES-WRPXMVFYSA-N 2 1 330.541 4.079 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+]([C@@H]3C[C@H]4C[C@H]4C3)C[C@@H]21 ZINC001167934138 1034709292 /nfs/dbraw/zinc/70/92/92/1034709292.db2.gz GVMRSHOMCRAQES-WRPXMVFYSA-N 2 1 330.541 4.079 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CSc4ccccc43)CC2)C1 ZINC000513207721 1034835479 /nfs/dbraw/zinc/83/54/79/1034835479.db2.gz FEGAYTNUNOSWSB-AYBZRNKSSA-N 2 1 330.541 4.466 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H](c3cnn(C)c3)C(C)(C)C)CC2)C1 ZINC000513326331 1034879455 /nfs/dbraw/zinc/87/94/55/1034879455.db2.gz PECDWYSAFXXOHW-LSTHTHJFSA-N 2 1 346.563 4.140 20 0 EIADMP CCc1ccc([C@@H]2CCC[N@H+](CCCCn3cc[nH+]c3C)C2)cc1 ZINC000513378081 1034897100 /nfs/dbraw/zinc/89/71/00/1034897100.db2.gz YYVZWWWSSSAEHV-OAQYLSRUSA-N 2 1 325.500 4.414 20 0 EIADMP CCc1ccc([C@@H]2CCC[N@@H+](CCCCn3cc[nH+]c3C)C2)cc1 ZINC000513378081 1034897103 /nfs/dbraw/zinc/89/71/03/1034897103.db2.gz YYVZWWWSSSAEHV-OAQYLSRUSA-N 2 1 325.500 4.414 20 0 EIADMP CCOc1ccc(C[N@@H+](C)C2CCN(Cc3ccccc3)CC2)cc1 ZINC000513450364 1034961787 /nfs/dbraw/zinc/96/17/87/1034961787.db2.gz JQGHLAWGLKHSBS-UHFFFAOYSA-N 2 1 338.495 4.182 20 0 EIADMP CCOc1ccc(CN(C)C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000513450364 1034961793 /nfs/dbraw/zinc/96/17/93/1034961793.db2.gz JQGHLAWGLKHSBS-UHFFFAOYSA-N 2 1 338.495 4.182 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000509927399 1035011274 /nfs/dbraw/zinc/01/12/74/1035011274.db2.gz PEMNIHHGUWXXOG-NGYXKBBWSA-N 2 1 344.543 4.338 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501378234 1035433428 /nfs/dbraw/zinc/43/34/28/1035433428.db2.gz PACLTWOMMVQFQZ-CUXKYVRBSA-N 2 1 343.559 4.456 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000501466376 1035449340 /nfs/dbraw/zinc/44/93/40/1035449340.db2.gz JNXGAHNQKXKFCR-AWIOHZCQSA-N 2 1 326.406 4.181 20 0 EIADMP C[C@@H]1CCC[C@](C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)([NH+](C)C)C1 ZINC000501466973 1035449685 /nfs/dbraw/zinc/44/96/85/1035449685.db2.gz MEJQJPDWNCIPCX-QCFAMHMHSA-N 2 1 329.532 4.208 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420420614 1035576278 /nfs/dbraw/zinc/57/62/78/1035576278.db2.gz YAWLOXHRPIZJRC-INWMFGNUSA-N 2 1 347.890 4.281 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420420614 1035576287 /nfs/dbraw/zinc/57/62/87/1035576287.db2.gz YAWLOXHRPIZJRC-INWMFGNUSA-N 2 1 347.890 4.281 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000485257794 1035801069 /nfs/dbraw/zinc/80/10/69/1035801069.db2.gz HADPKMFKABLZFO-DKZVUGQWSA-N 2 1 338.470 4.313 20 0 EIADMP Fc1cccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000485469143 1035915950 /nfs/dbraw/zinc/91/59/50/1035915950.db2.gz SVPFSDHYMOJWOG-UHFFFAOYSA-N 2 1 338.470 4.314 20 0 EIADMP C[N@H+](Cc1ccc(Cl)c(Cl)c1)C1CC[NH+](CC2CC2)CC1 ZINC001168377987 1035921112 /nfs/dbraw/zinc/92/11/12/1035921112.db2.gz IXNMWHZSDYENNO-UHFFFAOYSA-N 2 1 327.299 4.300 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)c(Cl)c1)C1CC[NH+](CC2CC2)CC1 ZINC001168377987 1035921145 /nfs/dbraw/zinc/92/11/45/1035921145.db2.gz IXNMWHZSDYENNO-UHFFFAOYSA-N 2 1 327.299 4.300 20 0 EIADMP C[N@H+](Cc1cc(Cl)cc(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000261833745 1035989385 /nfs/dbraw/zinc/98/93/85/1035989385.db2.gz JHIJFOGKZUWYQX-YIONKMFJSA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+](Cc1cc(Cl)cc(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000261833745 1035989461 /nfs/dbraw/zinc/98/94/61/1035989461.db2.gz JHIJFOGKZUWYQX-YIONKMFJSA-N 2 1 332.797 4.074 20 0 EIADMP C[C@H](N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cnn(C2CCCC2)c1 ZINC000502469652 1036246031 /nfs/dbraw/zinc/24/60/31/1036246031.db2.gz CWWZEARNNUJVNN-BZSNNMDCSA-N 2 1 344.547 4.302 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cnn(C2CCCC2)c1 ZINC000502469652 1036246054 /nfs/dbraw/zinc/24/60/54/1036246054.db2.gz CWWZEARNNUJVNN-BZSNNMDCSA-N 2 1 344.547 4.302 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cnn(C2CCCC2)c1 ZINC000502469652 1036246078 /nfs/dbraw/zinc/24/60/78/1036246078.db2.gz CWWZEARNNUJVNN-BZSNNMDCSA-N 2 1 344.547 4.302 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC12CCSCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000421385524 1036343223 /nfs/dbraw/zinc/34/32/23/1036343223.db2.gz QAJVINTXXXXKEL-YSIASYRMSA-N 2 1 344.568 4.020 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC23CCSCC3)CC[N@@H+]1Cc1ccccc1 ZINC000421388015 1036346331 /nfs/dbraw/zinc/34/63/31/1036346331.db2.gz SSFNQHQDPSIPOF-YZGWKJHDSA-N 2 1 344.568 4.162 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC23CCSCC3)CC[N@H+]1Cc1ccccc1 ZINC000421388015 1036346352 /nfs/dbraw/zinc/34/63/52/1036346352.db2.gz SSFNQHQDPSIPOF-YZGWKJHDSA-N 2 1 344.568 4.162 20 0 EIADMP C[C@@H](NCCC[N@@H+](C)Cc1ccccc1)c1cnn(C2CCCC2)c1 ZINC000502683580 1036500183 /nfs/dbraw/zinc/50/01/83/1036500183.db2.gz DVFBFNHRKBAOAJ-GOSISDBHSA-N 2 1 340.515 4.171 20 0 EIADMP C[C@@H]([NH2+]CCCN(C)Cc1ccccc1)c1cnn(C2CCCC2)c1 ZINC000502683580 1036500203 /nfs/dbraw/zinc/50/02/03/1036500203.db2.gz DVFBFNHRKBAOAJ-GOSISDBHSA-N 2 1 340.515 4.171 20 0 EIADMP C[C@H]([NH2+]C/C=C/c1ccc(F)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486472924 1036721328 /nfs/dbraw/zinc/72/13/28/1036721328.db2.gz DPKARZYRVMHYLF-NLOMCHEHSA-N 2 1 338.470 4.339 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccncc2Cl)c1 ZINC000421826866 1036783896 /nfs/dbraw/zinc/78/38/96/1036783896.db2.gz VBFGOHGIJQYWTR-OAHLLOKOSA-N 2 1 331.891 4.426 20 0 EIADMP COc1ccc([C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C2CC2)c(F)c1 ZINC000421832450 1036793882 /nfs/dbraw/zinc/79/38/82/1036793882.db2.gz MPBSILVIYXDJPH-OAQYLSRUSA-N 2 1 346.490 4.282 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccncc1Cl ZINC000421819196 1036805080 /nfs/dbraw/zinc/80/50/80/1036805080.db2.gz FQUIXCPPFAWWAS-OAHLLOKOSA-N 2 1 331.891 4.426 20 0 EIADMP COc1cccc([C@H]2CCCC[N@H+]2C2CC[NH+](CC3CC3)CC2)c1 ZINC001168392661 1036853391 /nfs/dbraw/zinc/85/33/91/1036853391.db2.gz RUDHVKOUMPWGQD-OAQYLSRUSA-N 2 1 328.500 4.097 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2[nH]nc3ccccc32)C1 ZINC000589641077 1036857510 /nfs/dbraw/zinc/85/75/10/1036857510.db2.gz DCXROIPUOQRBNE-QGZVFWFLSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc4[nH]cnc4c3)cc2)C1 ZINC000589641136 1036858004 /nfs/dbraw/zinc/85/80/04/1036858004.db2.gz UFVIBJFZODGOME-KRWDZBQOSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc4nc[nH]c4c3)cc2)C1 ZINC000589641136 1036858010 /nfs/dbraw/zinc/85/80/10/1036858010.db2.gz UFVIBJFZODGOME-KRWDZBQOSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc4nc[nH]c4c3)cc2)C1 ZINC000589641136 1036858014 /nfs/dbraw/zinc/85/80/14/1036858014.db2.gz UFVIBJFZODGOME-KRWDZBQOSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000589836074 1036880000 /nfs/dbraw/zinc/88/00/00/1036880000.db2.gz FYWPEHLTHRBYIA-HNNXBMFYSA-N 2 1 344.421 4.187 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]C/C=C\c3ccncc3)cc2)C1 ZINC000486943620 1036897978 /nfs/dbraw/zinc/89/79/78/1036897978.db2.gz OBKWRIRGHWCTDJ-QDVBSOPMSA-N 2 1 335.495 4.117 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(C[NH2+]C/C=C/c3ccncc3)cc2)C1 ZINC000486989681 1036938837 /nfs/dbraw/zinc/93/88/37/1036938837.db2.gz UUVHQLXZIUMBGJ-IGVYDEPUSA-N 2 1 349.522 4.363 20 0 EIADMP c1cc2cccc(C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)C4(CC4)C3)c2[nH]1 ZINC000569722679 1037016891 /nfs/dbraw/zinc/01/68/91/1037016891.db2.gz APMKPYLVVWKNNP-OAQYLSRUSA-N 2 1 345.490 4.455 20 0 EIADMP c1cc2cccc(C[NH2+][C@@H]3CC[N@@H+](Cc4ccccc4)C4(CC4)C3)c2[nH]1 ZINC000569722679 1037016911 /nfs/dbraw/zinc/01/69/11/1037016911.db2.gz APMKPYLVVWKNNP-OAQYLSRUSA-N 2 1 345.490 4.455 20 0 EIADMP Clc1ccc(OC2CC[NH+](C3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC001168372759 1037135189 /nfs/dbraw/zinc/13/51/89/1037135189.db2.gz KTAKNOATNRIPFC-UHFFFAOYSA-N 2 1 348.918 4.058 20 0 EIADMP CCOCCC1(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000272711311 1037277345 /nfs/dbraw/zinc/27/73/45/1037277345.db2.gz COBHMDYZFCHCLH-FPOVZHCZSA-N 2 1 344.543 4.084 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000573596135 1037597153 /nfs/dbraw/zinc/59/71/53/1037597153.db2.gz CXUZOHUXCCXLCQ-OBHPCNEJSA-N 2 1 340.433 4.430 20 0 EIADMP Clc1ccccc1-c1ccc(C[NH+]2CCC3(CC[NH2+]3)CC2)s1 ZINC000422565344 1037759066 /nfs/dbraw/zinc/75/90/66/1037759066.db2.gz YOWIJAKIRDKBHB-UHFFFAOYSA-N 2 1 332.900 4.396 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH+]3CCC4(CC[NH2+]4)CC3)ccc21 ZINC000422565107 1037760241 /nfs/dbraw/zinc/76/02/41/1037760241.db2.gz XMBKGSUDPZQNQQ-UHFFFAOYSA-N 2 1 333.479 4.142 20 0 EIADMP CC[C@H](C(=O)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)[NH+](CC)CC ZINC000605425136 1037779767 /nfs/dbraw/zinc/77/97/67/1037779767.db2.gz WFQOCXCEMFBPLS-FXAWDEMLSA-N 2 1 345.531 4.120 20 0 EIADMP C[C@H](NC(C)(C)C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422733041 1037808340 /nfs/dbraw/zinc/80/83/40/1037808340.db2.gz QLWLXHJNNKYTJB-OYNPSCLESA-N 2 1 343.559 4.016 20 0 EIADMP Clc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc2)cc1 ZINC000422769790 1037828800 /nfs/dbraw/zinc/82/88/00/1037828800.db2.gz TYWYWSMPFFBLAL-JIRNRHONSA-N 2 1 326.871 4.302 20 0 EIADMP CC1CC[NH+](Cc2ccc(C[NH2+][C@H]3C[C@@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000422800323 1037836439 /nfs/dbraw/zinc/83/64/39/1037836439.db2.gz BGIKWOZIMUEWGY-PKTZIBPZSA-N 3 1 349.522 4.153 20 0 EIADMP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000422818965 1037845078 /nfs/dbraw/zinc/84/50/78/1037845078.db2.gz LULDDIQZPKLGMM-XMTFNYHQSA-N 2 1 340.433 4.438 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422863318 1037849320 /nfs/dbraw/zinc/84/93/20/1037849320.db2.gz OOGSDHXIGRQNMG-NLSFWIRASA-N 2 1 349.522 4.295 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422863318 1037849329 /nfs/dbraw/zinc/84/93/29/1037849329.db2.gz OOGSDHXIGRQNMG-NLSFWIRASA-N 3 1 349.522 4.295 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422863318 1037849332 /nfs/dbraw/zinc/84/93/32/1037849332.db2.gz OOGSDHXIGRQNMG-NLSFWIRASA-N 3 1 349.522 4.295 20 0 EIADMP Cc1sc(C[NH2+][C@H]2CC[NH2+]CC[C@@H]2C)nc1-c1ccc(Cl)cc1 ZINC000422936813 1037875165 /nfs/dbraw/zinc/87/51/65/1037875165.db2.gz BYWIITNKEJFSLI-LRDDRELGSA-N 2 1 349.931 4.250 20 0 EIADMP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423146212 1037994663 /nfs/dbraw/zinc/99/46/63/1037994663.db2.gz OPPUROHPGBOIAQ-WVSUBDOOSA-N 2 1 328.887 4.134 20 0 EIADMP CC(C)c1ccc(C[N@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)cc1 ZINC000414719447 1038009077 /nfs/dbraw/zinc/00/90/77/1038009077.db2.gz VGVFWRNPBJLIGT-JOCHJYFZSA-N 2 1 337.511 4.349 20 0 EIADMP CC(C)c1ccc(C[N@@H+](Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)cc1 ZINC000414719447 1038009095 /nfs/dbraw/zinc/00/90/95/1038009095.db2.gz VGVFWRNPBJLIGT-JOCHJYFZSA-N 2 1 337.511 4.349 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000503951589 1038040662 /nfs/dbraw/zinc/04/06/62/1038040662.db2.gz FXNFZTUSRCLBFV-XMSQKQJNSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000503951589 1038040679 /nfs/dbraw/zinc/04/06/79/1038040679.db2.gz FXNFZTUSRCLBFV-XMSQKQJNSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]([NH2+]CC(C)(C)[NH3+])c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423288859 1038093184 /nfs/dbraw/zinc/09/31/84/1038093184.db2.gz VLENDCJHXGKVOX-MRVPVSSYSA-N 2 1 328.300 4.112 20 0 EIADMP C[C@@H]([NH3+])c1ccc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cc1 ZINC000423291471 1038097767 /nfs/dbraw/zinc/09/77/67/1038097767.db2.gz IKOCHZXUNGLNJB-QGZVFWFLSA-N 3 1 345.575 4.475 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H]2CCCOc3c(Cl)cc(C)cc32)CC1 ZINC000489554067 1038116427 /nfs/dbraw/zinc/11/64/27/1038116427.db2.gz FHHBPGUHWGXZKE-SFHVURJKSA-N 2 1 336.907 4.326 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423374381 1038155398 /nfs/dbraw/zinc/15/53/98/1038155398.db2.gz JVXIMSJXLCFBIW-INMHGKMJSA-N 2 1 328.431 4.409 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423444690 1038225844 /nfs/dbraw/zinc/22/58/44/1038225844.db2.gz LXLOFJCCFZWHPP-PGRDOPGGSA-N 2 1 349.522 4.045 20 0 EIADMP Cc1noc(C)c1[C@H](C)[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000924965651 1038368751 /nfs/dbraw/zinc/36/87/51/1038368751.db2.gz YKZAKHPFDMBPKI-INIZCTEOSA-N 2 1 341.499 4.374 20 0 EIADMP CC(C)n1cncc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000424127467 1038617416 /nfs/dbraw/zinc/61/74/16/1038617416.db2.gz DGUWCEYXMAOABA-GOSISDBHSA-N 2 1 340.515 4.128 20 0 EIADMP CC(C)n1cncc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000424127467 1038617425 /nfs/dbraw/zinc/61/74/25/1038617425.db2.gz DGUWCEYXMAOABA-GOSISDBHSA-N 2 1 340.515 4.128 20 0 EIADMP Cc1cc(F)c(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(F)c1 ZINC000424138003 1038635950 /nfs/dbraw/zinc/63/59/50/1038635950.db2.gz STPGWQQJMBGTGA-UHFFFAOYSA-N 2 1 330.422 4.159 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000480772777 1038810191 /nfs/dbraw/zinc/81/01/91/1038810191.db2.gz GOTWPMAUYRBWQB-GOEBONIOSA-N 2 1 338.948 4.285 20 0 EIADMP CC(C)CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480775856 1038810657 /nfs/dbraw/zinc/81/06/57/1038810657.db2.gz QPKPYDLFMQXTRH-ROUUACIJSA-N 2 1 330.516 4.246 20 0 EIADMP CC(C)CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480775850 1038811365 /nfs/dbraw/zinc/81/13/65/1038811365.db2.gz QPKPYDLFMQXTRH-MSOLQXFVSA-N 2 1 330.516 4.246 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424377213 1038838012 /nfs/dbraw/zinc/83/80/12/1038838012.db2.gz QQHGIWILRYIAQF-HFBAOOFYSA-N 2 1 333.476 4.178 20 0 EIADMP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+][C@@H]3CCCC[C@H]3[NH3+])s2)cc1 ZINC000424380631 1038840289 /nfs/dbraw/zinc/84/02/89/1038840289.db2.gz XHIRJFHRBSGOFB-CSMYWGQOSA-N 2 1 345.512 4.048 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(C)nc2C)CC1)CC(C)C ZINC000480862769 1038851546 /nfs/dbraw/zinc/85/15/46/1038851546.db2.gz AVFMIYJLNIJWRH-UHFFFAOYSA-N 2 1 331.548 4.278 20 0 EIADMP CC(C)[C@@H]([NH3+])C[NH2+]Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000414789139 1038862556 /nfs/dbraw/zinc/86/25/56/1038862556.db2.gz FBZAHPPDCLMTIZ-KRWDZBQOSA-N 2 1 348.922 4.031 20 0 EIADMP CC(C)[N@H+](C)CC1CCN(c2cc[nH+]c3ccc(Cl)cc32)CC1 ZINC000539186320 1038875483 /nfs/dbraw/zinc/87/54/83/1038875483.db2.gz YOZAXPKCVMEBNF-UHFFFAOYSA-N 2 1 331.891 4.445 20 0 EIADMP CC(C)[N@@H+](C)CC1CCN(c2cc[nH+]c3ccc(Cl)cc32)CC1 ZINC000539186320 1038875487 /nfs/dbraw/zinc/87/54/87/1038875487.db2.gz YOZAXPKCVMEBNF-UHFFFAOYSA-N 2 1 331.891 4.445 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)C[C@H]1C ZINC000537614626 1038889630 /nfs/dbraw/zinc/88/96/30/1038889630.db2.gz MKHNEXBWDIZJJS-HZPDHXFCSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)o2)C[C@H]1C ZINC000537614626 1038889635 /nfs/dbraw/zinc/88/96/35/1038889635.db2.gz MKHNEXBWDIZJJS-HZPDHXFCSA-N 2 1 330.447 4.390 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3F)o2)C[C@H]1C ZINC000537614626 1038889642 /nfs/dbraw/zinc/88/96/42/1038889642.db2.gz MKHNEXBWDIZJJS-HZPDHXFCSA-N 2 1 330.447 4.390 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)C[C@H]1C ZINC000537614626 1038889643 /nfs/dbraw/zinc/88/96/43/1038889643.db2.gz MKHNEXBWDIZJJS-HZPDHXFCSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@@H]1C ZINC000537616540 1038890507 /nfs/dbraw/zinc/89/05/07/1038890507.db2.gz PHXBAZPBNWAIHE-JSGCOSHPSA-N 2 1 346.849 4.246 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@@H]1C ZINC000537616540 1038890512 /nfs/dbraw/zinc/89/05/12/1038890512.db2.gz PHXBAZPBNWAIHE-JSGCOSHPSA-N 2 1 346.849 4.246 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@@H]1C ZINC000537616540 1038890513 /nfs/dbraw/zinc/89/05/13/1038890513.db2.gz PHXBAZPBNWAIHE-JSGCOSHPSA-N 2 1 346.849 4.246 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@@H]1C ZINC000537616540 1038890519 /nfs/dbraw/zinc/89/05/19/1038890519.db2.gz PHXBAZPBNWAIHE-JSGCOSHPSA-N 2 1 346.849 4.246 20 0 EIADMP CC[N@@H+](Cc1cccc(Br)c1)C1CCC([NH+](C)C)CC1 ZINC001168327530 1038915561 /nfs/dbraw/zinc/91/55/61/1038915561.db2.gz NVPNCMRDKAHUDW-UHFFFAOYSA-N 2 1 339.321 4.144 20 0 EIADMP C[C@H](C[N@H+](C)[C@H]1CCC[NH+](C[C@@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333544 1039067488 /nfs/dbraw/zinc/06/74/88/1039067488.db2.gz TZEKGJJZFHRWMC-UPJWGTAASA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[N@@H+](C)[C@H]1CCC[NH+](C[C@@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333544 1039067510 /nfs/dbraw/zinc/06/75/10/1039067510.db2.gz TZEKGJJZFHRWMC-UPJWGTAASA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[NH+](C)[C@H]1CCC[N@H+](C[C@@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333544 1039067531 /nfs/dbraw/zinc/06/75/31/1039067531.db2.gz TZEKGJJZFHRWMC-UPJWGTAASA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[NH+](C)[C@H]1CCC[N@@H+](C[C@@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333544 1039067548 /nfs/dbraw/zinc/06/75/48/1039067548.db2.gz TZEKGJJZFHRWMC-UPJWGTAASA-N 2 1 348.375 4.170 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCc2ccccc21 ZINC000481185241 1039087735 /nfs/dbraw/zinc/08/77/35/1039087735.db2.gz WNSHJXDLVADSTJ-JZWVFAODSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)[C@@H]2CCC[C@@H]21 ZINC000552052886 1039106434 /nfs/dbraw/zinc/10/64/34/1039106434.db2.gz IUMLOVMOTVXYCR-JYJNAYRXSA-N 2 1 326.937 4.187 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(Cl)c2F)CCCC1 ZINC000477861498 1039143924 /nfs/dbraw/zinc/14/39/24/1039143924.db2.gz NOAWQAHFHZGAKD-PBHICJAKSA-N 2 1 338.898 4.221 20 0 EIADMP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+][C@H](C[NH3+])C1CCCCC1 ZINC000414833976 1039281763 /nfs/dbraw/zinc/28/17/63/1039281763.db2.gz GBLBUZXNPPQJKV-OXJNMPFZSA-N 2 1 345.531 4.024 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000090723824 1039290741 /nfs/dbraw/zinc/29/07/41/1039290741.db2.gz CCWHWIWTURAEBX-INIZCTEOSA-N 2 1 335.451 4.349 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000513863839 1039326894 /nfs/dbraw/zinc/32/68/94/1039326894.db2.gz MSJYBGFNYCEWLY-OAQYLSRUSA-N 2 1 326.459 4.443 20 0 EIADMP C[N@@H+](CCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1)C1CCCCC1 ZINC000534351248 1039338987 /nfs/dbraw/zinc/33/89/87/1039338987.db2.gz TWLFGMAGANENQH-UGKGYDQZSA-N 2 1 344.543 4.399 20 0 EIADMP C[NH+]1CCC([C@@H]2CCN(c3cc[nH+]c4ccc(Cl)cc43)C2)CC1 ZINC000534419372 1039389182 /nfs/dbraw/zinc/38/91/82/1039389182.db2.gz RHMKRXYRRGGDDT-OAHLLOKOSA-N 2 1 329.875 4.056 20 0 EIADMP Cc1cc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc(F)c1F ZINC001143610386 1039550036 /nfs/dbraw/zinc/55/00/36/1039550036.db2.gz WZMNJTCPDOCXNF-GOSISDBHSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1cc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc(F)c1F ZINC001143610386 1039550056 /nfs/dbraw/zinc/55/00/56/1039550056.db2.gz WZMNJTCPDOCXNF-GOSISDBHSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1cc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc(F)c1F ZINC001143610386 1039550074 /nfs/dbraw/zinc/55/00/74/1039550074.db2.gz WZMNJTCPDOCXNF-GOSISDBHSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1cc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc(F)c1F ZINC001143610386 1039550091 /nfs/dbraw/zinc/55/00/91/1039550091.db2.gz WZMNJTCPDOCXNF-GOSISDBHSA-N 2 1 344.449 4.227 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)[C@H]1CCC[NH2+]C1 ZINC000414846920 1039575935 /nfs/dbraw/zinc/57/59/35/1039575935.db2.gz FLQNREGUAAHYGH-KBPBESRZSA-N 2 1 341.480 4.034 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(Cl)c(Cl)c3)C2)CC1 ZINC000555801182 1039642720 /nfs/dbraw/zinc/64/27/20/1039642720.db2.gz LNHNTRLMLQUUQK-HNNXBMFYSA-N 2 1 327.299 4.157 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(Cl)c4cccnc34)C2)CC1 ZINC000555803552 1039655015 /nfs/dbraw/zinc/65/50/15/1039655015.db2.gz YUMNBEQYILGXJT-MRXNPFEDSA-N 2 1 343.902 4.052 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)Cc1ccccc1C(F)(F)F ZINC000481650584 1039689652 /nfs/dbraw/zinc/68/96/52/1039689652.db2.gz BILWXBVJPOCPKZ-UONOGXRCSA-N 2 1 339.405 4.067 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000061016362 1039782463 /nfs/dbraw/zinc/78/24/63/1039782463.db2.gz IMQRATTVXZVJOQ-UHFFFAOYSA-N 2 1 338.495 4.230 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000505465510 1039804188 /nfs/dbraw/zinc/80/41/88/1039804188.db2.gz VRNJWMOSSZGMJE-NYVOZVTQSA-N 2 1 334.507 4.217 20 0 EIADMP Cc1ccc(F)cc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434675408 1039809156 /nfs/dbraw/zinc/80/91/56/1039809156.db2.gz YOYPGKGGXWJRKI-UHFFFAOYSA-N 2 1 327.447 4.047 20 0 EIADMP Cc1cccc(CCC[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000434677350 1039811413 /nfs/dbraw/zinc/81/14/13/1039811413.db2.gz XIHCFPGZXCNJKS-UHFFFAOYSA-N 2 1 337.511 4.340 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H](CO)C2CCCCC2)cc1 ZINC000550898345 1039819141 /nfs/dbraw/zinc/81/91/41/1039819141.db2.gz XHPJBKLYMSLUCL-OXJNMPFZSA-N 2 1 341.499 4.020 20 0 EIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000550992201 1039856488 /nfs/dbraw/zinc/85/64/88/1039856488.db2.gz CCWSVMLWNGMBKW-ZDUSSCGKSA-N 2 1 334.813 4.179 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000550992201 1039856492 /nfs/dbraw/zinc/85/64/92/1039856492.db2.gz CCWSVMLWNGMBKW-ZDUSSCGKSA-N 2 1 334.813 4.179 20 0 EIADMP CCc1ncc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)s1 ZINC000537659944 1039873193 /nfs/dbraw/zinc/87/31/93/1039873193.db2.gz UEOGOVRALHRFQK-MRXNPFEDSA-N 2 1 335.561 4.182 20 0 EIADMP Cc1cccc2oc(CC[NH2+][C@@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)nc21 ZINC000551038888 1039897067 /nfs/dbraw/zinc/89/70/67/1039897067.db2.gz HAAJWKBZIUBWCU-MOPGFXCFSA-N 2 1 349.478 4.104 20 0 EIADMP Cc1cccc2oc(CC[NH2+][C@@H]3CC[N@H+](C)[C@H](c4ccccc4)C3)nc21 ZINC000551038888 1039897072 /nfs/dbraw/zinc/89/70/72/1039897072.db2.gz HAAJWKBZIUBWCU-MOPGFXCFSA-N 2 1 349.478 4.104 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(Cl)cc1 ZINC000481923496 1039899068 /nfs/dbraw/zinc/89/90/68/1039899068.db2.gz OQOFGLIBMMFBKR-YWZLYKJASA-N 2 1 328.887 4.437 20 0 EIADMP COc1cc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)ccc1OC(C)C ZINC000535082370 1039920543 /nfs/dbraw/zinc/92/05/43/1039920543.db2.gz XUTWWTLPARDSJW-UHFFFAOYSA-N 2 1 348.531 4.035 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+][C@H](C)CC[NH+](C)C ZINC000481976091 1039922962 /nfs/dbraw/zinc/92/29/62/1039922962.db2.gz XYTFXDCAPHFMIG-HUUCEWRRSA-N 2 1 331.529 4.033 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000551176431 1040022455 /nfs/dbraw/zinc/02/24/55/1040022455.db2.gz XPOZPJVJBOEJSW-ANULTFPQSA-N 2 1 330.516 4.005 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000551176431 1040022476 /nfs/dbraw/zinc/02/24/76/1040022476.db2.gz XPOZPJVJBOEJSW-ANULTFPQSA-N 2 1 330.516 4.005 20 0 EIADMP CC(C)=CCC[C@@H](C)CC[NH+]1CCN(CC[N@@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000482141710 1040050479 /nfs/dbraw/zinc/05/04/79/1040050479.db2.gz KXFSMXPDTQZBGV-VSKRKVRLSA-N 2 1 349.607 4.249 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)[C@@]1(C)CCCO1 ZINC000551268551 1040133640 /nfs/dbraw/zinc/13/36/40/1040133640.db2.gz XYHOSQDLBSAECN-DBXWQHBBSA-N 2 1 330.516 4.108 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2c3cc(F)ccc3C[C@@H]2C)c1 ZINC000482323920 1040166288 /nfs/dbraw/zinc/16/62/88/1040166288.db2.gz UJJGFRKNQMULGQ-BTYIYWSLSA-N 2 1 326.459 4.301 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)c1 ZINC000482353529 1040200642 /nfs/dbraw/zinc/20/06/42/1040200642.db2.gz DABIGEQNDKCVMQ-HOTGVXAUSA-N 2 1 340.458 4.367 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000482353529 1040200669 /nfs/dbraw/zinc/20/06/69/1040200669.db2.gz DABIGEQNDKCVMQ-HOTGVXAUSA-N 2 1 340.458 4.367 20 0 EIADMP Cc1ccc([C@@H]([NH2+]CCC[NH+]2CCC(O)CC2)C2CCCCC2)cc1 ZINC000479277108 1040233042 /nfs/dbraw/zinc/23/30/42/1040233042.db2.gz IXNKTARTAXXCKN-QFIPXVFZSA-N 2 1 344.543 4.053 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000514812798 1040262251 /nfs/dbraw/zinc/26/22/51/1040262251.db2.gz UEQQHFQKQQGNJF-OBHPCNEJSA-N 2 1 340.433 4.430 20 0 EIADMP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482455388 1040264663 /nfs/dbraw/zinc/26/46/63/1040264663.db2.gz YMTMZFLTWBKIGT-REWPJTCUSA-N 2 1 334.507 4.137 20 0 EIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+]CC1([NH+]2CCCC2)CCOCC1 ZINC000482562179 1040352863 /nfs/dbraw/zinc/35/28/63/1040352863.db2.gz TWCVJIHKKUYZLX-NRFANRHFSA-N 2 1 344.543 4.317 20 0 EIADMP Fc1ccc(F)c2c1CC[C@@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479464053 1040374539 /nfs/dbraw/zinc/37/45/39/1040374539.db2.gz KRPRPUOIOWVXOY-UZLBHIALSA-N 2 1 342.433 4.064 20 0 EIADMP Fc1ccc(F)c2c1CC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000479464053 1040374549 /nfs/dbraw/zinc/37/45/49/1040374549.db2.gz KRPRPUOIOWVXOY-UZLBHIALSA-N 2 1 342.433 4.064 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2ccccc2OC(F)F)C1 ZINC000515020054 1040420422 /nfs/dbraw/zinc/42/04/22/1040420422.db2.gz MSXKPCDSPVCMGH-QZFKAFNDSA-N 2 1 338.442 4.013 20 0 EIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccccc1OCc1ccccc1 ZINC000539507424 1040486971 /nfs/dbraw/zinc/48/69/71/1040486971.db2.gz NHGFOPPWVAPIHX-SFHVURJKSA-N 2 1 336.479 4.178 20 0 EIADMP CCO[C@@H]1C[C@@H]([NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)C1(C)C ZINC000539497145 1040487210 /nfs/dbraw/zinc/48/72/10/1040487210.db2.gz XQJDQAJIWZGALS-NSISKUIASA-N 2 1 330.516 4.005 20 0 EIADMP CN(C)c1cc[nH+]cc1C[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000435783102 1040631080 /nfs/dbraw/zinc/63/10/80/1040631080.db2.gz VGAXKEXMGWHPAC-CZIWCDLHSA-N 2 1 349.400 4.202 20 0 EIADMP Cc1cccc(N2CCC([NH2+]Cc3ccc4c(c3)CCCC4)CC2)[nH+]1 ZINC000491281628 1040721311 /nfs/dbraw/zinc/72/13/11/1040721311.db2.gz GDLXOIVFJNFZLW-UHFFFAOYSA-N 2 1 335.495 4.027 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000479876336 1040738747 /nfs/dbraw/zinc/73/87/47/1040738747.db2.gz SUOZNHMUWQMDEF-ZDUSSCGKSA-N 2 1 349.519 4.496 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000483170759 1040755106 /nfs/dbraw/zinc/75/51/06/1040755106.db2.gz ABWYIOOICXBBPA-OWQGQXMQSA-N 2 1 340.433 4.476 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000483170759 1040755118 /nfs/dbraw/zinc/75/51/18/1040755118.db2.gz ABWYIOOICXBBPA-OWQGQXMQSA-N 2 1 340.433 4.476 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+]CCC3CCCCC3)CC2)oc1C ZINC000483304265 1040809670 /nfs/dbraw/zinc/80/96/70/1040809670.db2.gz PTBPZMSJXKVGKI-UHFFFAOYSA-N 2 1 333.520 4.063 20 0 EIADMP CCCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)cc1OC ZINC000539817429 1040812373 /nfs/dbraw/zinc/81/23/73/1040812373.db2.gz YUKAVFOYRFBYRD-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)cc1OC ZINC000539817429 1040812377 /nfs/dbraw/zinc/81/23/77/1040812377.db2.gz YUKAVFOYRFBYRD-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](CC)[C@@H](C)C2)cc1OC ZINC000539817429 1040812383 /nfs/dbraw/zinc/81/23/83/1040812383.db2.gz YUKAVFOYRFBYRD-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)[C@@H](C)C2)cc1OC ZINC000539817429 1040812389 /nfs/dbraw/zinc/81/23/89/1040812389.db2.gz YUKAVFOYRFBYRD-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000539849475 1040837990 /nfs/dbraw/zinc/83/79/90/1040837990.db2.gz HNMAUJKJOFFVIE-OAHLLOKOSA-N 2 1 332.875 4.374 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000539849475 1040837996 /nfs/dbraw/zinc/83/79/96/1040837996.db2.gz HNMAUJKJOFFVIE-OAHLLOKOSA-N 2 1 332.875 4.374 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000539849475 1040838002 /nfs/dbraw/zinc/83/80/02/1040838002.db2.gz HNMAUJKJOFFVIE-OAHLLOKOSA-N 2 1 332.875 4.374 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000539849475 1040838008 /nfs/dbraw/zinc/83/80/08/1040838008.db2.gz HNMAUJKJOFFVIE-OAHLLOKOSA-N 2 1 332.875 4.374 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2cccc(OCc3ccccc3)c2)CC1 ZINC000480050408 1040889641 /nfs/dbraw/zinc/88/96/41/1040889641.db2.gz VSPGBAKBRLTZPF-GOSISDBHSA-N 2 1 338.495 4.401 20 0 EIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CCSc2ccc(Cl)cc2)C1 ZINC000470966842 1040948034 /nfs/dbraw/zinc/94/80/34/1040948034.db2.gz LDJSYEJGIPLGCS-MRXNPFEDSA-N 2 1 338.948 4.096 20 0 EIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](CCSc2ccc(Cl)cc2)C1 ZINC000470966842 1040948058 /nfs/dbraw/zinc/94/80/58/1040948058.db2.gz LDJSYEJGIPLGCS-MRXNPFEDSA-N 2 1 338.948 4.096 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](CCSc2ccc(Cl)cc2)C1 ZINC000470966842 1040948083 /nfs/dbraw/zinc/94/80/83/1040948083.db2.gz LDJSYEJGIPLGCS-MRXNPFEDSA-N 2 1 338.948 4.096 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](CCSc2ccc(Cl)cc2)C1 ZINC000470966842 1040948103 /nfs/dbraw/zinc/94/81/03/1040948103.db2.gz LDJSYEJGIPLGCS-MRXNPFEDSA-N 2 1 338.948 4.096 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2nccc3c2CCCC3)cc1 ZINC000903185983 1040949741 /nfs/dbraw/zinc/94/97/41/1040949741.db2.gz ZWIYYXUKWIPNSV-MRXNPFEDSA-N 2 1 346.478 4.305 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000462796986 1040950690 /nfs/dbraw/zinc/95/06/90/1040950690.db2.gz ALEGNUVKWCEITL-YUXAGFNASA-N 2 1 344.543 4.212 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)[C@@H](C)C1 ZINC000537989798 1040965261 /nfs/dbraw/zinc/96/52/61/1040965261.db2.gz FCLMZIYQTIDAFK-PGRDOPGGSA-N 2 1 338.495 4.086 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCc2c1cc(Cl)cc2Cl ZINC000537967792 1040970956 /nfs/dbraw/zinc/97/09/56/1040970956.db2.gz AMFACMYNTRLZEY-GTNSWQLSSA-N 2 1 338.282 4.412 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCOc2cccc(C)c2)cc1 ZINC000537971475 1040975267 /nfs/dbraw/zinc/97/52/67/1040975267.db2.gz QXDKCWPZYXVTAH-QGZVFWFLSA-N 2 1 335.451 4.219 20 0 EIADMP COCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Cl)c3ccccc32)CC1 ZINC000462844887 1041029344 /nfs/dbraw/zinc/02/93/44/1041029344.db2.gz JSCKOSTXKKYIPC-HNNXBMFYSA-N 2 1 346.902 4.255 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccc(Sc2ccc(F)cc2)cc1 ZINC000538097057 1041044715 /nfs/dbraw/zinc/04/47/15/1041044715.db2.gz OHMYDKFSQMEMBG-MGPUTAFESA-N 2 1 344.499 4.407 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@H](C1CC1)[NH+](C)C ZINC000462889225 1041050191 /nfs/dbraw/zinc/05/01/91/1041050191.db2.gz RNWZCZBPCCIJKO-QRWLVFNGSA-N 2 1 327.516 4.154 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)CC1 ZINC000462888276 1041051876 /nfs/dbraw/zinc/05/18/76/1041051876.db2.gz FFJSYLXUPYJUAC-MRXNPFEDSA-N 2 1 327.516 4.298 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+][C@@H](c3ccccc3)C3CC3)C2)cc1 ZINC000538103103 1041059290 /nfs/dbraw/zinc/05/92/90/1041059290.db2.gz UCVDGXKNAXNMFA-REWPJTCUSA-N 2 1 334.507 4.292 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000480208930 1041081480 /nfs/dbraw/zinc/08/14/80/1041081480.db2.gz LDRZBTVZHNGRJS-SIKLNZKXSA-N 2 1 334.507 4.218 20 0 EIADMP COc1cc([C@H](C)[NH2+]CC[C@H]2CCCC[N@@H+]2C)ccc1OC(C)C ZINC000538154818 1041096503 /nfs/dbraw/zinc/09/65/03/1041096503.db2.gz MTNAIKQHBRTUQQ-FUHWJXTLSA-N 2 1 334.504 4.007 20 0 EIADMP COc1cc([C@H](C)[NH2+]CC[C@H]2CCCC[N@H+]2C)ccc1OC(C)C ZINC000538154818 1041096517 /nfs/dbraw/zinc/09/65/17/1041096517.db2.gz MTNAIKQHBRTUQQ-FUHWJXTLSA-N 2 1 334.504 4.007 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1nc2c(s1)CCCC2 ZINC000540083802 1041103805 /nfs/dbraw/zinc/10/38/05/1041103805.db2.gz KBAYEMORCRGJAB-HZPDHXFCSA-N 2 1 335.561 4.327 20 0 EIADMP CCC[C@@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)C1CCCCC1 ZINC000484294787 1041199179 /nfs/dbraw/zinc/19/91/79/1041199179.db2.gz UJLJRYWJGLZJEL-HXUWFJFHSA-N 2 1 344.547 4.401 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000540150163 1041200050 /nfs/dbraw/zinc/20/00/50/1041200050.db2.gz CBIUQHJIFFEVLH-HOTGVXAUSA-N 2 1 340.458 4.307 20 0 EIADMP C[C@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000436399956 1041203915 /nfs/dbraw/zinc/20/39/15/1041203915.db2.gz GUVWAWGODCBOAG-LSDHHAIUSA-N 2 1 329.463 4.050 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)c1c(F)cccc1Cl ZINC000540188952 1041231078 /nfs/dbraw/zinc/23/10/78/1041231078.db2.gz MXWPAJHLSJZFEN-XJKCOSOUSA-N 2 1 326.887 4.075 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)[C@H](C)C1 ZINC000667666258 1041238317 /nfs/dbraw/zinc/23/83/17/1041238317.db2.gz HJKDVEFSROVGCN-BEFAXECRSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3scnc3C)cc2)[C@H](C)C1 ZINC000667666258 1041238328 /nfs/dbraw/zinc/23/83/28/1041238328.db2.gz HJKDVEFSROVGCN-BEFAXECRSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(-c3scnc3C)cc2)[C@H](C)C1 ZINC000667666258 1041238347 /nfs/dbraw/zinc/23/83/47/1041238347.db2.gz HJKDVEFSROVGCN-BEFAXECRSA-N 2 1 343.540 4.281 20 0 EIADMP CC[N@H+](CCC1CC[NH+]([C@@H](C)c2nc(C3CC3)no2)CC1)CC(C)C ZINC000540197149 1041272828 /nfs/dbraw/zinc/27/28/28/1041272828.db2.gz ZUVSSCABYOUNLN-INIZCTEOSA-N 2 1 348.535 4.088 20 0 EIADMP CC[N@@H+](CCC1CC[NH+]([C@@H](C)c2nc(C3CC3)no2)CC1)CC(C)C ZINC000540197149 1041272846 /nfs/dbraw/zinc/27/28/46/1041272846.db2.gz ZUVSSCABYOUNLN-INIZCTEOSA-N 2 1 348.535 4.088 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000484506254 1041287897 /nfs/dbraw/zinc/28/78/97/1041287897.db2.gz QWQIYKVHYFRSQP-GHTZIAJQSA-N 2 1 338.495 4.004 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000484506254 1041287915 /nfs/dbraw/zinc/28/79/15/1041287915.db2.gz QWQIYKVHYFRSQP-GHTZIAJQSA-N 2 1 338.495 4.004 20 0 EIADMP C[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000463089036 1041326537 /nfs/dbraw/zinc/32/65/37/1041326537.db2.gz PGEYQDXHYOLBLN-PMVMPFDFSA-N 2 1 334.507 4.244 20 0 EIADMP C[NH+](C[C@@H]1C[C@H]1c1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000463089036 1041326552 /nfs/dbraw/zinc/32/65/52/1041326552.db2.gz PGEYQDXHYOLBLN-PMVMPFDFSA-N 2 1 334.507 4.244 20 0 EIADMP C[NH+](C[C@@H]1C[C@H]1c1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000463089036 1041326564 /nfs/dbraw/zinc/32/65/64/1041326564.db2.gz PGEYQDXHYOLBLN-PMVMPFDFSA-N 2 1 334.507 4.244 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc(OCC3CCCCC3)c2)CC[N@H+]1C ZINC000538411214 1041330343 /nfs/dbraw/zinc/33/03/43/1041330343.db2.gz XUYZHNNVBKUPNU-YLJYHZDGSA-N 2 1 330.516 4.218 20 0 EIADMP Cc1cccc([C@H]([NH2+]C[C@H]2CCC[N@@H+](C)C2)c2cccc(F)c2)c1 ZINC000554725211 1041352719 /nfs/dbraw/zinc/35/27/19/1041352719.db2.gz PPYKYJGZXBXLJN-UTKZUKDTSA-N 2 1 326.459 4.155 20 0 EIADMP Cc1cccc([C@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)c2cccc(F)c2)c1 ZINC000554725211 1041352738 /nfs/dbraw/zinc/35/27/38/1041352738.db2.gz PPYKYJGZXBXLJN-UTKZUKDTSA-N 2 1 326.459 4.155 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000540302937 1041355566 /nfs/dbraw/zinc/35/55/66/1041355566.db2.gz WMRLMJXLVNKPBE-YOEHRIQHSA-N 2 1 328.422 4.334 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cccc(F)c2F)CC[N@@H+]1Cc1ccccc1 ZINC000463130487 1041355711 /nfs/dbraw/zinc/35/57/11/1041355711.db2.gz WUSQRFQFVWUWJF-APWZRJJASA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cccc(F)c2F)CC[N@H+]1Cc1ccccc1 ZINC000463130487 1041355723 /nfs/dbraw/zinc/35/57/23/1041355723.db2.gz WUSQRFQFVWUWJF-APWZRJJASA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314503 1041359647 /nfs/dbraw/zinc/35/96/47/1041359647.db2.gz QCMNEYBSHUVOFM-NLWGTHIKSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CCN(C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314503 1041359656 /nfs/dbraw/zinc/35/96/56/1041359656.db2.gz QCMNEYBSHUVOFM-NLWGTHIKSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314503 1041359663 /nfs/dbraw/zinc/35/96/63/1041359663.db2.gz QCMNEYBSHUVOFM-NLWGTHIKSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314503 1041359675 /nfs/dbraw/zinc/35/96/75/1041359675.db2.gz QCMNEYBSHUVOFM-NLWGTHIKSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCOC2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000463140782 1041360207 /nfs/dbraw/zinc/36/02/07/1041360207.db2.gz IILQDPBXVWTRJA-CTNGQTDRSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCOC2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000463140782 1041360217 /nfs/dbraw/zinc/36/02/17/1041360217.db2.gz IILQDPBXVWTRJA-CTNGQTDRSA-N 2 1 344.543 4.369 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000540317356 1041364246 /nfs/dbraw/zinc/36/42/46/1041364246.db2.gz NICLJUWYWPAOKC-HNNXBMFYSA-N 2 1 325.481 4.444 20 0 EIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1nc2ccccc2n1C ZINC000540312855 1041373147 /nfs/dbraw/zinc/37/31/47/1041373147.db2.gz DUFVDBPOTOLELL-OKZBNKHCSA-N 2 1 342.531 4.125 20 0 EIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1nc2ccccc2n1C ZINC000540312856 1041373527 /nfs/dbraw/zinc/37/35/27/1041373527.db2.gz DUFVDBPOTOLELL-SQNIBIBYSA-N 2 1 342.531 4.125 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000480629485 1041432277 /nfs/dbraw/zinc/43/22/77/1041432277.db2.gz DVGRKGHDZNNMQG-HZPDHXFCSA-N 2 1 340.458 4.451 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc(F)c(F)c(F)c1 ZINC000480630605 1041433969 /nfs/dbraw/zinc/43/39/69/1041433969.db2.gz KOSYQUUAICONBP-UONOGXRCSA-N 2 1 328.422 4.409 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccccc1OC(F)F ZINC000480618616 1041436306 /nfs/dbraw/zinc/43/63/06/1041436306.db2.gz TZBGZKUIYRRMAZ-HOTGVXAUSA-N 2 1 340.458 4.451 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](Cc1ccccc1Cl)c1ccccc1 ZINC000540407638 1041436690 /nfs/dbraw/zinc/43/66/90/1041436690.db2.gz LHCXPVGUFJUITI-HXUWFJFHSA-N 2 1 339.870 4.419 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(-n2cccn2)cc1 ZINC000480631814 1041444691 /nfs/dbraw/zinc/44/46/91/1041444691.db2.gz QXAXBFPIROSAGF-RBUKOAKNSA-N 2 1 340.515 4.178 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)s2)CC[N@@H+]1C ZINC000538717623 1041485542 /nfs/dbraw/zinc/48/55/42/1041485542.db2.gz NWAVJXOHKLSWBX-GJZGRUSLSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)s2)CC[N@H+]1C ZINC000538717623 1041485548 /nfs/dbraw/zinc/48/55/48/1041485548.db2.gz NWAVJXOHKLSWBX-GJZGRUSLSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3F)s2)CC[NH+]1C ZINC000538717623 1041485550 /nfs/dbraw/zinc/48/55/50/1041485550.db2.gz NWAVJXOHKLSWBX-GJZGRUSLSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)s2)CC[NH+]1C ZINC000538717623 1041485552 /nfs/dbraw/zinc/48/55/52/1041485552.db2.gz NWAVJXOHKLSWBX-GJZGRUSLSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)s2)CC[N@@H+]1C ZINC000538717625 1041486012 /nfs/dbraw/zinc/48/60/12/1041486012.db2.gz NWAVJXOHKLSWBX-LSDHHAIUSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccccc3F)s2)CC[N@H+]1C ZINC000538717625 1041486013 /nfs/dbraw/zinc/48/60/13/1041486013.db2.gz NWAVJXOHKLSWBX-LSDHHAIUSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3F)s2)CC[NH+]1C ZINC000538717625 1041486016 /nfs/dbraw/zinc/48/60/16/1041486016.db2.gz NWAVJXOHKLSWBX-LSDHHAIUSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)s2)CC[NH+]1C ZINC000538717625 1041486022 /nfs/dbraw/zinc/48/60/22/1041486022.db2.gz NWAVJXOHKLSWBX-LSDHHAIUSA-N 2 1 332.488 4.469 20 0 EIADMP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1F ZINC000480714267 1041494488 /nfs/dbraw/zinc/49/44/88/1041494488.db2.gz YGMDWABIOPVABH-LXZJYRNTSA-N 2 1 346.490 4.077 20 0 EIADMP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1F ZINC000480714269 1041494949 /nfs/dbraw/zinc/49/49/49/1041494949.db2.gz YGMDWABIOPVABH-XSYGEPLQSA-N 2 1 346.490 4.077 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000480733989 1041496463 /nfs/dbraw/zinc/49/64/63/1041496463.db2.gz BLHRAZKPJLFGAW-ZACQAIPSSA-N 2 1 338.948 4.427 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@H]([C@@H](C)[NH3+])C3)s2)cc1 ZINC000484903379 1041504357 /nfs/dbraw/zinc/50/43/57/1041504357.db2.gz FXFRZKDZJFSEKY-PBHICJAKSA-N 2 1 329.513 4.103 20 0 EIADMP C[C@@H]1C[NH+](CCCCC[N@H+]2CCC(F)(F)[C@@H](C)C2)CCC1(F)F ZINC000554946420 1041507363 /nfs/dbraw/zinc/50/73/63/1041507363.db2.gz SPUVNLAKEKBEGA-GASCZTMLSA-N 2 1 338.433 4.111 20 0 EIADMP C[C@@H]1C[N@H+](CCCCC[NH+]2CCC(F)(F)[C@@H](C)C2)CCC1(F)F ZINC000554946420 1041507384 /nfs/dbraw/zinc/50/73/84/1041507384.db2.gz SPUVNLAKEKBEGA-GASCZTMLSA-N 2 1 338.433 4.111 20 0 EIADMP C[C@@H]1C[N@@H+](CCCCC[NH+]2CCC(F)(F)[C@@H](C)C2)CCC1(F)F ZINC000554946420 1041507398 /nfs/dbraw/zinc/50/73/98/1041507398.db2.gz SPUVNLAKEKBEGA-GASCZTMLSA-N 2 1 338.433 4.111 20 0 EIADMP Cc1cccc(COc2ccc(C[NH2+][C@H]3CC[N@H+](C)C[C@@H]3C)cc2)c1 ZINC000480753973 1041509772 /nfs/dbraw/zinc/50/97/72/1041509772.db2.gz COSKOHGXJMVQEU-AVRDEDQJSA-N 2 1 338.495 4.004 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000540644250 1041584618 /nfs/dbraw/zinc/58/46/18/1041584618.db2.gz GTEQEIOGLGGPRH-UHFFFAOYSA-N 2 1 332.900 4.420 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000540708627 1041606777 /nfs/dbraw/zinc/60/67/77/1041606777.db2.gz ZMGCHYBLRFFWJO-ROUUACIJSA-N 2 1 338.417 4.193 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(C)c3ncccc3c2)CC1 ZINC000541536890 1042000623 /nfs/dbraw/zinc/00/06/23/1042000623.db2.gz BWQGIKHQAAOJNS-UHFFFAOYSA-N 2 1 339.527 4.487 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2ccco2)c2ccccc2)C1 ZINC000541549252 1042006317 /nfs/dbraw/zinc/00/63/17/1042006317.db2.gz PWOUUFIZYRXYQX-NQIIRXRSSA-N 2 1 326.484 4.471 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCn1c2ccccc2c2ccccc21 ZINC000541571133 1042019411 /nfs/dbraw/zinc/01/94/11/1042019411.db2.gz OSXMEAVDWABZPZ-HLIPFELVSA-N 2 1 335.495 4.113 20 0 EIADMP C[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1OC(F)F)C[NH+](C)C ZINC000425940478 1042020335 /nfs/dbraw/zinc/02/03/35/1042020335.db2.gz HCIWBHDUQLPJMR-ZIAGYGMSSA-N 2 1 336.426 4.290 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)CC(F)(F)F ZINC000402779439 1042029618 /nfs/dbraw/zinc/02/96/18/1042029618.db2.gz OPTRCZYNELXCEZ-UXLLHSPISA-N 2 1 328.422 4.075 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)CC(F)(F)F ZINC000402779439 1042029619 /nfs/dbraw/zinc/02/96/19/1042029619.db2.gz OPTRCZYNELXCEZ-UXLLHSPISA-N 2 1 328.422 4.075 20 0 EIADMP Cc1ccc2cc(C[NH2+]CCC[N@@H+]3CCc4ccccc4C3)ccc2n1 ZINC000438061448 1042034338 /nfs/dbraw/zinc/03/43/38/1042034338.db2.gz AXJOGHVMRLUGAC-UHFFFAOYSA-N 2 1 345.490 4.081 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCc2ccccc2C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603541 1042038707 /nfs/dbraw/zinc/03/87/07/1042038707.db2.gz WICIHGNPRGVDDH-WAOWUJCRSA-N 2 1 326.528 4.034 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)CC(F)(F)F ZINC000402796797 1042041026 /nfs/dbraw/zinc/04/10/26/1042041026.db2.gz VYJVFJGJJHIOAA-LEUOFYLZSA-N 2 1 340.433 4.075 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12)CC(F)(F)F ZINC000402796795 1042041066 /nfs/dbraw/zinc/04/10/66/1042041066.db2.gz VYJVFJGJJHIOAA-DZOHQFGASA-N 2 1 340.433 4.075 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@@H]3CCC4(CCCCC4)O3)CC2)cc1 ZINC000301961585 1042042149 /nfs/dbraw/zinc/04/21/49/1042042149.db2.gz MUBNUMHDHVPZBZ-NRFANRHFSA-N 2 1 342.527 4.123 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000438206040 1042087601 /nfs/dbraw/zinc/08/76/01/1042087601.db2.gz ZRTQPOIYRIIRPG-SJORKVTESA-N 2 1 346.515 4.320 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000438206040 1042087609 /nfs/dbraw/zinc/08/76/09/1042087609.db2.gz ZRTQPOIYRIIRPG-SJORKVTESA-N 2 1 346.515 4.320 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000464782620 1042162078 /nfs/dbraw/zinc/16/20/78/1042162078.db2.gz YTFUOVJONGUGBC-HUUCEWRRSA-N 2 1 328.422 4.430 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000464782620 1042162079 /nfs/dbraw/zinc/16/20/79/1042162079.db2.gz YTFUOVJONGUGBC-HUUCEWRRSA-N 2 1 328.422 4.430 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](CSC)c2ccc(C(F)(F)F)cc2)C1 ZINC000541916181 1042179303 /nfs/dbraw/zinc/17/93/03/1042179303.db2.gz DTIGOMLQKZAYKM-XJKSGUPXSA-N 2 1 346.462 4.041 20 0 EIADMP C[C@@H](c1ccc(F)cc1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464832144 1042189371 /nfs/dbraw/zinc/18/93/71/1042189371.db2.gz BVJFWQIOWBYLJM-HKUYNNGSSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@@H](c1ccc(F)cc1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464832144 1042189377 /nfs/dbraw/zinc/18/93/77/1042189377.db2.gz BVJFWQIOWBYLJM-HKUYNNGSSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@@H](c1ccc(F)cc1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464832144 1042189396 /nfs/dbraw/zinc/18/93/96/1042189396.db2.gz BVJFWQIOWBYLJM-HKUYNNGSSA-N 2 1 326.459 4.341 20 0 EIADMP C[N@H+](Cc1ccc2c(c1)CCC2)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845032 1042193510 /nfs/dbraw/zinc/19/35/10/1042193510.db2.gz DBJBIYJEJOWZDS-OAQYLSRUSA-N 2 1 334.507 4.129 20 0 EIADMP C[NH+](Cc1ccc2c(c1)CCC2)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464845032 1042193512 /nfs/dbraw/zinc/19/35/12/1042193512.db2.gz DBJBIYJEJOWZDS-OAQYLSRUSA-N 2 1 334.507 4.129 20 0 EIADMP C[NH+](Cc1ccc2c(c1)CCC2)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464845032 1042193517 /nfs/dbraw/zinc/19/35/17/1042193517.db2.gz DBJBIYJEJOWZDS-OAQYLSRUSA-N 2 1 334.507 4.129 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCCOc3ccc(F)cc3)C2)CC1 ZINC000302998424 1042231750 /nfs/dbraw/zinc/23/17/50/1042231750.db2.gz HIOGYLUKGIXUTF-IBGZPJMESA-N 2 1 348.506 4.039 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(CC)cc3)o2)C1 ZINC000465014013 1042281554 /nfs/dbraw/zinc/28/15/54/1042281554.db2.gz SPBDKLJJZLWORC-SFHVURJKSA-N 2 1 326.484 4.331 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(CC)cc3)o2)C1 ZINC000465014013 1042281563 /nfs/dbraw/zinc/28/15/63/1042281563.db2.gz SPBDKLJJZLWORC-SFHVURJKSA-N 2 1 326.484 4.331 20 0 EIADMP Cc1ccc(C)c(C[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000518273254 1042446922 /nfs/dbraw/zinc/44/69/22/1042446922.db2.gz PNDAATKDBFGOER-SFHVURJKSA-N 2 1 328.525 4.367 20 0 EIADMP Cc1ccc(C)c(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000518273254 1042446928 /nfs/dbraw/zinc/44/69/28/1042446928.db2.gz PNDAATKDBFGOER-SFHVURJKSA-N 2 1 328.525 4.367 20 0 EIADMP FC1(F)CCCC[C@H](C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000491596370 1042478953 /nfs/dbraw/zinc/47/89/53/1042478953.db2.gz JSJDWHPFSVBDDW-SFHVURJKSA-N 2 1 336.470 4.456 20 0 EIADMP CC(C)[N@@H+](C)CCCN[C@@H](c1ccc(Br)s1)C1CC1 ZINC000439142960 1042518190 /nfs/dbraw/zinc/51/81/90/1042518190.db2.gz QWNXBVYHOSVYAX-OAHLLOKOSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H](c1ccc(Br)s1)C1CC1 ZINC000439142960 1042518196 /nfs/dbraw/zinc/51/81/96/1042518196.db2.gz QWNXBVYHOSVYAX-OAHLLOKOSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](c1ccc(Br)s1)C1CC1 ZINC000439142960 1042518202 /nfs/dbraw/zinc/51/82/02/1042518202.db2.gz QWNXBVYHOSVYAX-OAHLLOKOSA-N 2 1 345.350 4.282 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)c2ncc(C(C)(C)C)o2)CC1 ZINC000175110420 1042738134 /nfs/dbraw/zinc/73/81/34/1042738134.db2.gz KCEQFIBTYKKVJZ-MRXNPFEDSA-N 2 1 335.536 4.477 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2ncc(C(C)(C)C)o2)CC1 ZINC000175110420 1042738142 /nfs/dbraw/zinc/73/81/42/1042738142.db2.gz KCEQFIBTYKKVJZ-MRXNPFEDSA-N 2 1 335.536 4.477 20 0 EIADMP c1csc(CCC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000518977271 1042778966 /nfs/dbraw/zinc/77/89/66/1042778966.db2.gz HCSJOCDQAKMGTF-LJQANCHMSA-N 2 1 340.536 4.468 20 0 EIADMP c1csc(CCC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000518977271 1042778975 /nfs/dbraw/zinc/77/89/75/1042778975.db2.gz HCSJOCDQAKMGTF-LJQANCHMSA-N 2 1 340.536 4.468 20 0 EIADMP Cc1ccc(F)c(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310235027 1042832409 /nfs/dbraw/zinc/83/24/09/1042832409.db2.gz KOKHXRXOVUOFPH-HKUYNNGSSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1ccc(F)c(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310235027 1042832411 /nfs/dbraw/zinc/83/24/11/1042832411.db2.gz KOKHXRXOVUOFPH-HKUYNNGSSA-N 2 1 326.459 4.134 20 0 EIADMP C[C@H]([NH2+][C@H]1CSc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310241569 1042832444 /nfs/dbraw/zinc/83/24/44/1042832444.db2.gz LUQHJMUOCXVFCP-QRFRQXIXSA-N 2 1 338.520 4.334 20 0 EIADMP C[C@H]([NH2+][C@H]1CSc2ccccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310241569 1042832447 /nfs/dbraw/zinc/83/24/47/1042832447.db2.gz LUQHJMUOCXVFCP-QRFRQXIXSA-N 2 1 338.520 4.334 20 0 EIADMP CC[C@H](NC[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)c1ccc(F)cn1 ZINC000493278731 1042891573 /nfs/dbraw/zinc/89/15/73/1042891573.db2.gz VKLLLNWGLQMDIF-URLQWDBASA-N 2 1 347.503 4.406 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCCN(C)[C@H]1c1cccs1)c1ccc(F)cn1 ZINC000493278731 1042891575 /nfs/dbraw/zinc/89/15/75/1042891575.db2.gz VKLLLNWGLQMDIF-URLQWDBASA-N 2 1 347.503 4.406 20 0 EIADMP COc1ccccc1C[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168006343 1043001195 /nfs/dbraw/zinc/00/11/95/1043001195.db2.gz NIDUDXQMYVTUSJ-ROUUACIJSA-N 2 1 338.495 4.226 20 0 EIADMP COc1ccc2oc(C[NH2+][C@@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)cc2c1 ZINC000183100916 1043037324 /nfs/dbraw/zinc/03/73/24/1043037324.db2.gz LLFPMPQQKFLGON-HOTGVXAUSA-N 2 1 342.483 4.184 20 0 EIADMP COc1ccc2oc(C[NH2+][C@@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)cc2c1 ZINC000183100916 1043037330 /nfs/dbraw/zinc/03/73/30/1043037330.db2.gz LLFPMPQQKFLGON-HOTGVXAUSA-N 2 1 342.483 4.184 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1c(Cl)cccc1Cl ZINC000166447540 1043085036 /nfs/dbraw/zinc/08/50/36/1043085036.db2.gz WPZSKDNJVNHWPM-MGPQQGTHSA-N 2 1 327.299 4.313 20 0 EIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000310140054 1043108595 /nfs/dbraw/zinc/10/85/95/1043108595.db2.gz CBUNRBMGOOIFPI-HXUWFJFHSA-N 2 1 326.459 4.136 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310365540 1043132195 /nfs/dbraw/zinc/13/21/95/1043132195.db2.gz LZGXTHWSAHMIFR-HKUYNNGSSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310365540 1043132201 /nfs/dbraw/zinc/13/22/01/1043132201.db2.gz LZGXTHWSAHMIFR-HKUYNNGSSA-N 2 1 326.459 4.389 20 0 EIADMP FC(F)(F)C1CCC(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000185522403 1043193158 /nfs/dbraw/zinc/19/31/58/1043193158.db2.gz WIUANNIINMIKRO-CSKOPFHVSA-N 2 1 344.465 4.304 20 0 EIADMP FC(F)(F)C1CCC(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000185522403 1043193167 /nfs/dbraw/zinc/19/31/67/1043193167.db2.gz WIUANNIINMIKRO-CSKOPFHVSA-N 2 1 344.465 4.304 20 0 EIADMP FC(F)(F)C1CCC(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000185522403 1043193176 /nfs/dbraw/zinc/19/31/76/1043193176.db2.gz WIUANNIINMIKRO-CSKOPFHVSA-N 2 1 344.465 4.304 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2[nH]ccc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311138181 1043225255 /nfs/dbraw/zinc/22/52/55/1043225255.db2.gz YESBTBOHVFOTRS-UTKZUKDTSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)C1CCSCC1 ZINC000187122132 1043328876 /nfs/dbraw/zinc/32/88/76/1043328876.db2.gz GWUCORRZDFNTMC-CVEARBPZSA-N 2 1 338.586 4.081 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCSCC1 ZINC000187122132 1043328881 /nfs/dbraw/zinc/32/88/81/1043328881.db2.gz GWUCORRZDFNTMC-CVEARBPZSA-N 2 1 338.586 4.081 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C1CCSCC1 ZINC000187283909 1043339179 /nfs/dbraw/zinc/33/91/79/1043339179.db2.gz QYYNBDUVRHHSTB-ZWOKBUDYSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C1CCSCC1 ZINC000187283909 1043339196 /nfs/dbraw/zinc/33/91/96/1043339196.db2.gz QYYNBDUVRHHSTB-ZWOKBUDYSA-N 2 1 332.557 4.161 20 0 EIADMP CCCC[N@@H+](C)CCCNC1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012144 1043417258 /nfs/dbraw/zinc/41/72/58/1043417258.db2.gz WWWWPYMMZRNMTK-PMACEKPBSA-N 2 1 345.575 4.140 20 0 EIADMP C[C@@H]1C[C@@H](Nc2ccc(CC[NH3+])cc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168012381 1043424321 /nfs/dbraw/zinc/42/43/21/1043424321.db2.gz ZHGCVKMRMZVSOY-OPMZPASUSA-N 2 1 337.511 4.041 20 0 EIADMP FC(F)(F)c1ccc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)cc1 ZINC000520951582 1043453624 /nfs/dbraw/zinc/45/36/24/1043453624.db2.gz CKSLRXJMNAAVEA-UHFFFAOYSA-N 2 1 348.412 4.243 20 0 EIADMP FC(F)(F)c1ccc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)cc1 ZINC000520951582 1043453635 /nfs/dbraw/zinc/45/36/35/1043453635.db2.gz CKSLRXJMNAAVEA-UHFFFAOYSA-N 2 1 348.412 4.243 20 0 EIADMP Cc1cscc1C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000494465827 1043498772 /nfs/dbraw/zinc/49/87/72/1043498772.db2.gz NYCQACMNNREOKP-YZGWKJHDSA-N 2 1 326.509 4.057 20 0 EIADMP COc1cccc(C2([NH2+][C@@H]3CC[NH2+][C@H](c4ccccc4)C3)CCC2)c1 ZINC000665283026 1043677495 /nfs/dbraw/zinc/67/74/95/1043677495.db2.gz GKTKYETZICIGHJ-CTNGQTDRSA-N 2 1 336.479 4.157 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000191019101 1043764126 /nfs/dbraw/zinc/76/41/26/1043764126.db2.gz ZMTOUURPIPFELT-BJLQDIEVSA-N 2 1 334.548 4.111 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cnn1C(C)C ZINC000191325104 1043808482 /nfs/dbraw/zinc/80/84/82/1043808482.db2.gz OOSJFIPDGVCXJN-ZWKOTPCHSA-N 2 1 342.531 4.334 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)cnn1C(C)C ZINC000191325104 1043808484 /nfs/dbraw/zinc/80/84/84/1043808484.db2.gz OOSJFIPDGVCXJN-ZWKOTPCHSA-N 2 1 342.531 4.334 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2Cc3[nH]c4ccccc4c3C2)c1 ZINC000442773798 1043829841 /nfs/dbraw/zinc/82/98/41/1043829841.db2.gz DBJRVCXUTIOIOU-IBGZPJMESA-N 2 1 347.506 4.265 20 0 EIADMP FC(F)C1CCC([NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000442777191 1043830410 /nfs/dbraw/zinc/83/04/10/1043830410.db2.gz IMCAQWDCJMDXAM-FHERZECASA-N 2 1 342.499 4.374 20 0 EIADMP FC(F)C1CCC([NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000442777191 1043830417 /nfs/dbraw/zinc/83/04/17/1043830417.db2.gz IMCAQWDCJMDXAM-FHERZECASA-N 2 1 342.499 4.374 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CCC(C(F)F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000442783430 1043834710 /nfs/dbraw/zinc/83/47/10/1043834710.db2.gz NCNOBHKSVNXMAD-HJZRJOMTSA-N 2 1 336.470 4.453 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CCC(C(F)F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000442783430 1043834717 /nfs/dbraw/zinc/83/47/17/1043834717.db2.gz NCNOBHKSVNXMAD-HJZRJOMTSA-N 2 1 336.470 4.453 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000442804911 1043838118 /nfs/dbraw/zinc/83/81/18/1043838118.db2.gz YIZJPBBMUHFTCE-AVRDEDQJSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000442804911 1043838122 /nfs/dbraw/zinc/83/81/22/1043838122.db2.gz YIZJPBBMUHFTCE-AVRDEDQJSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000442789836 1043841339 /nfs/dbraw/zinc/84/13/39/1043841339.db2.gz HUQZYOFYFXAZQF-GWFLUQINSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000442789836 1043841342 /nfs/dbraw/zinc/84/13/42/1043841342.db2.gz HUQZYOFYFXAZQF-GWFLUQINSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000442872453 1043871571 /nfs/dbraw/zinc/87/15/71/1043871571.db2.gz JNRWJFQWJJIIHR-CMKODMSKSA-N 2 1 338.495 4.344 20 0 EIADMP C[C@H](C[NH2+]Cc1c[nH+]ccc1N(C)C)c1ccc(C(F)(F)F)cc1 ZINC000442994563 1043940966 /nfs/dbraw/zinc/94/09/66/1043940966.db2.gz CMPZMDDDZHKULC-CYBMUJFWSA-N 2 1 337.389 4.060 20 0 EIADMP C[N@@H+](CCc1cccc(F)c1F)C1CCN(Cc2ccccc2)CC1 ZINC000543140452 1043962321 /nfs/dbraw/zinc/96/23/21/1043962321.db2.gz MFSMEWKPPCOTPD-UHFFFAOYSA-N 2 1 344.449 4.104 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000443008866 1043963700 /nfs/dbraw/zinc/96/37/00/1043963700.db2.gz WBVPYZUVWWHXTF-HNNXBMFYSA-N 2 1 328.422 4.224 20 0 EIADMP C[C@H](CCCC(C)(C)O)[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168015054 1043964701 /nfs/dbraw/zinc/96/47/01/1043964701.db2.gz ONLONCYDDAXERZ-WERVVEIQSA-N 2 1 346.559 4.347 20 0 EIADMP CC(C)CCOc1ccc(C[NH2+]C2CC[NH+](CC(C)C)CC2)cc1 ZINC000521820369 1044007705 /nfs/dbraw/zinc/00/77/05/1044007705.db2.gz OMVSTQYHGBUABL-UHFFFAOYSA-N 2 1 332.532 4.322 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC000544350628 1044056504 /nfs/dbraw/zinc/05/65/04/1044056504.db2.gz JUKNSHFGNDJSAF-OAQYLSRUSA-N 2 1 332.451 4.085 20 0 EIADMP CS[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)C(C)(C)C ZINC000542499928 1044243843 /nfs/dbraw/zinc/24/38/43/1044243843.db2.gz RTNWSLRFRBTEIY-BHIYHBOVSA-N 2 1 334.573 4.264 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)Cc1ccccc1 ZINC000542518735 1044435494 /nfs/dbraw/zinc/43/54/94/1044435494.db2.gz VCUREJMJBCGNKE-QUCCMNQESA-N 2 1 342.552 4.429 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)Cc1ccccc1 ZINC000542518735 1044435504 /nfs/dbraw/zinc/43/55/04/1044435504.db2.gz VCUREJMJBCGNKE-QUCCMNQESA-N 2 1 342.552 4.429 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)o1 ZINC000675787067 1044499231 /nfs/dbraw/zinc/49/92/31/1044499231.db2.gz SVTXWRNOXOGXNX-MJGOQNOKSA-N 2 1 326.484 4.405 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)o1 ZINC000675787067 1044499242 /nfs/dbraw/zinc/49/92/42/1044499242.db2.gz SVTXWRNOXOGXNX-MJGOQNOKSA-N 2 1 326.484 4.405 20 0 EIADMP CC1(C)CC[C@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)OC1 ZINC000713561097 1044514653 /nfs/dbraw/zinc/51/46/53/1044514653.db2.gz POMRNYHQUDNTSC-UXHICEINSA-N 2 1 344.543 4.082 20 0 EIADMP CC1(C)CC[C@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)OC1 ZINC000713561097 1044514668 /nfs/dbraw/zinc/51/46/68/1044514668.db2.gz POMRNYHQUDNTSC-UXHICEINSA-N 2 1 344.543 4.082 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542529914 1044567340 /nfs/dbraw/zinc/56/73/40/1044567340.db2.gz XPSMZAWWEFGTRQ-IEBWSBKVSA-N 2 1 330.516 4.216 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000542529914 1044567356 /nfs/dbraw/zinc/56/73/56/1044567356.db2.gz XPSMZAWWEFGTRQ-IEBWSBKVSA-N 2 1 330.516 4.216 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](C/C=C/c2ccncc2)CC1 ZINC000494984908 1044570628 /nfs/dbraw/zinc/57/06/28/1044570628.db2.gz HQEDPDXVFVUXNP-FHHGHWCOSA-N 2 1 327.516 4.071 20 0 EIADMP CSCC1CCC([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000395169775 1044617457 /nfs/dbraw/zinc/61/74/57/1044617457.db2.gz WCQVFJCAZZTGCA-GPJFCIFZSA-N 2 1 332.557 4.020 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000443658959 1044648035 /nfs/dbraw/zinc/64/80/35/1044648035.db2.gz OMWAELMAUFEAQA-PBHICJAKSA-N 2 1 328.422 4.176 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000443658959 1044648040 /nfs/dbraw/zinc/64/80/40/1044648040.db2.gz OMWAELMAUFEAQA-PBHICJAKSA-N 2 1 328.422 4.176 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000359943102 1044650515 /nfs/dbraw/zinc/65/05/15/1044650515.db2.gz PSPRUQWKDFYUCS-CRAIPNDOSA-N 2 1 336.520 4.464 20 0 EIADMP Brc1ccccc1[C@H]1CCC[N@@H+]1CC[C@@H]1CCCC[NH2+]1 ZINC001205000531 1044772246 /nfs/dbraw/zinc/77/22/46/1044772246.db2.gz GOQSTBLDYPJKKE-WMLDXEAASA-N 2 1 337.305 4.118 20 0 EIADMP Brc1ccccc1[C@H]1CCC[N@H+]1CC[C@@H]1CCCC[NH2+]1 ZINC001205000531 1044772266 /nfs/dbraw/zinc/77/22/66/1044772266.db2.gz GOQSTBLDYPJKKE-WMLDXEAASA-N 2 1 337.305 4.118 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861475 1044833239 /nfs/dbraw/zinc/83/32/39/1044833239.db2.gz TVGCUDSIDLIMQX-ZIAGYGMSSA-N 2 1 330.488 4.230 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861475 1044833240 /nfs/dbraw/zinc/83/32/40/1044833240.db2.gz TVGCUDSIDLIMQX-ZIAGYGMSSA-N 2 1 330.488 4.230 20 0 EIADMP COCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(-c3ccccc3)s2)CC1 ZINC000543591693 1044874278 /nfs/dbraw/zinc/87/42/78/1044874278.db2.gz LBDPVBDKSNPDAG-INIZCTEOSA-N 2 1 344.524 4.177 20 0 EIADMP CCC1([NH+]2CCC2)CC[NH+](Cc2cccc(-c3cccnc3)c2)CC1 ZINC000895828482 1044911377 /nfs/dbraw/zinc/91/13/77/1044911377.db2.gz VDHUECQOWFKIHM-UHFFFAOYSA-N 2 1 335.495 4.199 20 0 EIADMP c1csc(C[N@H+](CC2CCC3(CC3)CC2)[C@H]2CC23CC[NH2+]CC3)n1 ZINC000923347537 1045067528 /nfs/dbraw/zinc/06/75/28/1045067528.db2.gz RXDRPDSJOXGKGD-KRWDZBQOSA-N 2 1 345.556 4.058 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCC[C@H]1c1ccc(Br)cc1C ZINC000626010347 1045123809 /nfs/dbraw/zinc/12/38/09/1045123809.db2.gz OTKMYWPYIHLTBB-KRWDZBQOSA-N 2 1 348.288 4.100 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCC[C@H]1c1ccc(Br)cc1C ZINC000626010347 1045123828 /nfs/dbraw/zinc/12/38/28/1045123828.db2.gz OTKMYWPYIHLTBB-KRWDZBQOSA-N 2 1 348.288 4.100 20 0 EIADMP C[C@@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC([C@@H]2CCC[NH2+]CC2)CC1 ZINC000923508530 1045141409 /nfs/dbraw/zinc/14/14/09/1045141409.db2.gz WJUKUOYVHMPILF-JKSUJKDBSA-N 2 1 333.520 4.135 20 0 EIADMP FC(F)(F)CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc2c1CC[NH2+]C2 ZINC000923525604 1045149991 /nfs/dbraw/zinc/14/99/91/1045149991.db2.gz HOEVHEWAFZTYKF-FUCXHRTASA-N 2 1 338.417 4.028 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2Cc3ccccc32)CC1 ZINC000671746654 1045179772 /nfs/dbraw/zinc/17/97/72/1045179772.db2.gz QJQZRYNZIPPSIU-ITAUSPCMSA-N 2 1 334.507 4.359 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(F)F)cc2)C[C@@H]1C ZINC000740883935 1045239808 /nfs/dbraw/zinc/23/98/08/1045239808.db2.gz QRXKLPIGKUFONG-ZFWWWQNUSA-N 2 1 328.472 4.306 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(F)F)cc2)C[C@@H]1C ZINC000740883935 1045239817 /nfs/dbraw/zinc/23/98/17/1045239817.db2.gz QRXKLPIGKUFONG-ZFWWWQNUSA-N 2 1 328.472 4.306 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(SC(F)F)cc2)C[C@@H]1C ZINC000740883935 1045239825 /nfs/dbraw/zinc/23/98/25/1045239825.db2.gz QRXKLPIGKUFONG-ZFWWWQNUSA-N 2 1 328.472 4.306 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(SC(F)F)cc2)C[C@@H]1C ZINC000740883935 1045239836 /nfs/dbraw/zinc/23/98/36/1045239836.db2.gz QRXKLPIGKUFONG-ZFWWWQNUSA-N 2 1 328.472 4.306 20 0 EIADMP Clc1cc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c(Cl)s1 ZINC001235152248 1045272481 /nfs/dbraw/zinc/27/24/81/1045272481.db2.gz GDSFPUFJIKAMSY-ZDUSSCGKSA-N 2 1 333.328 4.409 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000237410424 1045384389 /nfs/dbraw/zinc/38/43/89/1045384389.db2.gz MQGFSUFDCFDWQX-HNNXBMFYSA-N 2 1 325.481 4.346 20 0 EIADMP C[C@H](CC[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000237463091 1045385600 /nfs/dbraw/zinc/38/56/00/1045385600.db2.gz REHDFNYQZCUUTD-IRLDBZIGSA-N 2 1 336.523 4.334 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000762915747 1045413683 /nfs/dbraw/zinc/41/36/83/1045413683.db2.gz FCNJMROJAUSQCL-KRWDZBQOSA-N 2 1 337.389 4.438 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000762915747 1045413687 /nfs/dbraw/zinc/41/36/87/1045413687.db2.gz FCNJMROJAUSQCL-KRWDZBQOSA-N 2 1 337.389 4.438 20 0 EIADMP CCc1c(C)[nH+]c2ccccc2c1N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000443965644 1045449808 /nfs/dbraw/zinc/44/98/08/1045449808.db2.gz WDLPJWGATYASAM-INIZCTEOSA-N 2 1 334.467 4.223 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2COc3ccccc32)cc1 ZINC000246432983 1045788613 /nfs/dbraw/zinc/78/86/13/1045788613.db2.gz NZYHVNFHVORNQK-CKJXQJPGSA-N 2 1 347.462 4.396 20 0 EIADMP COc1ccccc1[C@H](C)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398142364 1045831496 /nfs/dbraw/zinc/83/14/96/1045831496.db2.gz MUDSXZGCDMZNTG-LQWHRVPQSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398142364 1045831497 /nfs/dbraw/zinc/83/14/97/1045831497.db2.gz MUDSXZGCDMZNTG-LQWHRVPQSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398142364 1045831498 /nfs/dbraw/zinc/83/14/98/1045831498.db2.gz MUDSXZGCDMZNTG-LQWHRVPQSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398142364 1045831499 /nfs/dbraw/zinc/83/14/99/1045831499.db2.gz MUDSXZGCDMZNTG-LQWHRVPQSA-N 2 1 338.495 4.256 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000768910259 1045858954 /nfs/dbraw/zinc/85/89/54/1045858954.db2.gz DEHZOEZRMDSKLA-UHFFFAOYSA-N 2 1 336.401 4.399 20 0 EIADMP Cc1ccc(C[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(C)n1 ZINC000248558162 1045870509 /nfs/dbraw/zinc/87/05/09/1045870509.db2.gz LQHVYDXNLADJGO-PGRDOPGGSA-N 2 1 337.511 4.183 20 0 EIADMP Cc1ccc(C[N@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(C)n1 ZINC000248558162 1045870516 /nfs/dbraw/zinc/87/05/16/1045870516.db2.gz LQHVYDXNLADJGO-PGRDOPGGSA-N 2 1 337.511 4.183 20 0 EIADMP CC[C@@H]1C[C@@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)CCO1 ZINC001170176604 1045912998 /nfs/dbraw/zinc/91/29/98/1045912998.db2.gz AAEJAJVUHWWWJQ-AIKVAWSJSA-N 2 1 342.527 4.072 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(SC(F)(F)F)cc1 ZINC000237371270 1045933792 /nfs/dbraw/zinc/93/37/92/1045933792.db2.gz KQAGKXZFBFMRLP-LBPRGKRZSA-N 2 1 343.418 4.229 20 0 EIADMP CC[C@H]1C[C@H]([N@@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170194961 1045933994 /nfs/dbraw/zinc/93/39/94/1045933994.db2.gz PHMNLCQJQTZKDF-NCYKPQTJSA-N 2 1 330.516 4.025 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(SC(F)(F)F)cc2)CC[N@@H+]1C ZINC000769484505 1045972782 /nfs/dbraw/zinc/97/27/82/1045972782.db2.gz KPBUZWKDBOLFDI-OCCSQVGLSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(SC(F)(F)F)cc2)CC[N@H+]1C ZINC000769484505 1045972794 /nfs/dbraw/zinc/97/27/94/1045972794.db2.gz KPBUZWKDBOLFDI-OCCSQVGLSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(SC(F)(F)F)cc2)CC[NH+]1C ZINC000769484505 1045972801 /nfs/dbraw/zinc/97/28/01/1045972801.db2.gz KPBUZWKDBOLFDI-OCCSQVGLSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(SC(F)(F)F)cc2)CC[NH+]1C ZINC000769484505 1045972805 /nfs/dbraw/zinc/97/28/05/1045972805.db2.gz KPBUZWKDBOLFDI-OCCSQVGLSA-N 2 1 332.435 4.213 20 0 EIADMP Cc1ccc[nH+]c1N([C@H](C)Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001170293068 1045978068 /nfs/dbraw/zinc/97/80/68/1045978068.db2.gz KBOMIBSPZZOYQA-MRXNPFEDSA-N 2 1 343.902 4.233 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H](C)C3CCCC3)CC2)cs1 ZINC000161793208 1046036360 /nfs/dbraw/zinc/03/63/60/1046036360.db2.gz HJIZKSDJRSXEBT-OAHLLOKOSA-N 2 1 335.561 4.086 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)c(C)c1 ZINC000162288286 1046165610 /nfs/dbraw/zinc/16/56/10/1046165610.db2.gz DOVQFGAXGCMDLF-QGZVFWFLSA-N 2 1 338.499 4.030 20 0 EIADMP C[NH2+]C[C@H]1CCC[N@@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000262052730 1046175989 /nfs/dbraw/zinc/17/59/89/1046175989.db2.gz ZVFWEQXMRAYNRA-MRXNPFEDSA-N 2 1 344.449 4.028 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccsc1 ZINC000648571122 1046213522 /nfs/dbraw/zinc/21/35/22/1046213522.db2.gz LMGSDXHAXNIPSE-DLBZAZTESA-N 2 1 328.525 4.494 20 0 EIADMP C[C@H]([NH2+]CCc1cc(F)ccc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710415 1046363818 /nfs/dbraw/zinc/36/38/18/1046363818.db2.gz MXRSPFQFWTUGES-LPHOPBHVSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H](NC1(c2ccccc2F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508717801 1046376218 /nfs/dbraw/zinc/37/62/18/1046376218.db2.gz IBOBXUSGNOHDRE-PKOBYXMFSA-N 2 1 338.470 4.315 20 0 EIADMP C[C@H]([NH2+]C1(c2ccccc2F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508717801 1046376232 /nfs/dbraw/zinc/37/62/32/1046376232.db2.gz IBOBXUSGNOHDRE-PKOBYXMFSA-N 2 1 338.470 4.315 20 0 EIADMP C[C@H]([NH2+]C1(c2ccccc2F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508717801 1046376250 /nfs/dbraw/zinc/37/62/50/1046376250.db2.gz IBOBXUSGNOHDRE-PKOBYXMFSA-N 2 1 338.470 4.315 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cccc(Cl)n2)CC1)CC1CC1 ZINC000771476275 1046408590 /nfs/dbraw/zinc/40/85/90/1046408590.db2.gz WSTBJKVLQZUBKG-UHFFFAOYSA-N 2 1 335.923 4.069 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccnc(Cl)c2)CC1)CC1CC1 ZINC000771474677 1046408953 /nfs/dbraw/zinc/40/89/53/1046408953.db2.gz BUDIAEABERQTQJ-UHFFFAOYSA-N 2 1 335.923 4.069 20 0 EIADMP c1csc([C@H](Cc2ccccc2)[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC000459404960 1046604832 /nfs/dbraw/zinc/60/48/32/1046604832.db2.gz AKNOCQKMDPUQNW-IBGZPJMESA-N 2 1 326.509 4.248 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@H](C)C1 ZINC000536660003 1046629465 /nfs/dbraw/zinc/62/94/65/1046629465.db2.gz SASDIZZBPCSPCK-WBVHZDCISA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@H](C)C1 ZINC000536660003 1046629473 /nfs/dbraw/zinc/62/94/73/1046629473.db2.gz SASDIZZBPCSPCK-WBVHZDCISA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@H](C)C1 ZINC000536660003 1046629486 /nfs/dbraw/zinc/62/94/86/1046629486.db2.gz SASDIZZBPCSPCK-WBVHZDCISA-N 2 1 340.458 4.067 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCC[C@@H](C(F)(F)F)C3)CC2)[nH+]c1 ZINC000127366997 1046658612 /nfs/dbraw/zinc/65/86/12/1046658612.db2.gz MLRQAQXRRXZQTO-ZBFHGGJFSA-N 2 1 341.421 4.070 20 0 EIADMP C[C@H](c1ccc2c(c1)CCC2)[N@@H+]1CC[C@@H](C[NH+](C)Cc2cccnc2)C1 ZINC000459449014 1046678050 /nfs/dbraw/zinc/67/80/50/1046678050.db2.gz WXBOZTZIWBFDGI-QUCCMNQESA-N 2 1 349.522 4.085 20 0 EIADMP C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@@H](C[NH+](C)Cc2cccnc2)C1 ZINC000459449014 1046678068 /nfs/dbraw/zinc/67/80/68/1046678068.db2.gz WXBOZTZIWBFDGI-QUCCMNQESA-N 2 1 349.522 4.085 20 0 EIADMP C[C@H](c1ccc2c(c1)CCC2)[NH+]1CC[C@@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000459449014 1046678086 /nfs/dbraw/zinc/67/80/86/1046678086.db2.gz WXBOZTZIWBFDGI-QUCCMNQESA-N 2 1 349.522 4.085 20 0 EIADMP C[C@H](c1ccc2c(c1)CCC2)[NH+]1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000459449014 1046678107 /nfs/dbraw/zinc/67/81/07/1046678107.db2.gz WXBOZTZIWBFDGI-QUCCMNQESA-N 2 1 349.522 4.085 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(OC)c3ccccc23)C1 ZINC000536695779 1046690668 /nfs/dbraw/zinc/69/06/68/1046690668.db2.gz FOHCGYIKXYMJDF-QGZVFWFLSA-N 2 1 326.484 4.012 20 0 EIADMP C[C@@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)[C@H]1CC1(C)C ZINC000785497561 1046698537 /nfs/dbraw/zinc/69/85/37/1046698537.db2.gz SHSFEMITMMVZQS-OXQOHEQNSA-N 2 1 329.532 4.311 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cnc3ccccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379659212 1046751448 /nfs/dbraw/zinc/75/14/48/1046751448.db2.gz ZCQMMTVUJVWULD-PGRDOPGGSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cnc3ccccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379659212 1046751465 /nfs/dbraw/zinc/75/14/65/1046751465.db2.gz ZCQMMTVUJVWULD-PGRDOPGGSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cccc(F)c1F ZINC000536863757 1046829980 /nfs/dbraw/zinc/82/99/80/1046829980.db2.gz MSKUJLBHWZNHIN-JXFKEZNVSA-N 2 1 344.449 4.008 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CC(C)(C)c2c(F)cccc2Cl)[C@@H](C)C1 ZINC000536875852 1046839283 /nfs/dbraw/zinc/83/92/83/1046839283.db2.gz JFKJRTMHLMEYDP-XJKSGUPXSA-N 2 1 326.887 4.077 20 0 EIADMP C[C@H](C[NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000459725134 1046865075 /nfs/dbraw/zinc/86/50/75/1046865075.db2.gz BATFYJPYBJRHIE-HUUCEWRRSA-N 2 1 328.422 4.130 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000536961943 1046871138 /nfs/dbraw/zinc/87/11/38/1046871138.db2.gz VMVPKWCRSKGGDB-KXBFYZLASA-N 2 1 345.487 4.085 20 0 EIADMP CC(C)CCC[C@H](C)[NH+]1CCC2(CCC[N@H+]2Cc2cnn(C)c2)CC1 ZINC001170079617 1047066530 /nfs/dbraw/zinc/06/65/30/1047066530.db2.gz DYXMDFFDFCIEHM-IBGZPJMESA-N 2 1 346.563 4.065 20 0 EIADMP CC(C)=CCOc1ccc(CC[C@@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000537305199 1047084703 /nfs/dbraw/zinc/08/47/03/1047084703.db2.gz HAYSKWGVBQGOSE-LJQANCHMSA-N 2 1 342.527 4.204 20 0 EIADMP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000537305198 1047086527 /nfs/dbraw/zinc/08/65/27/1047086527.db2.gz HAYSKWGVBQGOSE-IBGZPJMESA-N 2 1 342.527 4.204 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](c2ccc(F)cn2)C(C)C)c1 ZINC000497816901 1047097744 /nfs/dbraw/zinc/09/77/44/1047097744.db2.gz KHKGCHQRZDNNSE-FQEVSTJZSA-N 2 1 329.463 4.159 20 0 EIADMP CC[NH+](CC)Cc1cc([C@H](C)Nc2cc(C)cc[nH+]2)ccc1OC ZINC000537406374 1047199776 /nfs/dbraw/zinc/19/97/76/1047199776.db2.gz GQEHARHOJVPVDG-INIZCTEOSA-N 2 1 327.472 4.414 20 0 EIADMP COc1ccc(C2([NH2+]C3CC[NH+]([C@@H]4CCC[C@H](C)C4)CC3)CC2)cc1 ZINC000537422491 1047213208 /nfs/dbraw/zinc/21/32/08/1047213208.db2.gz MGIZGPHTOLXTFB-FXAWDEMLSA-N 2 1 342.527 4.317 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC1 ZINC000537451683 1047239336 /nfs/dbraw/zinc/23/93/36/1047239336.db2.gz HGHOSCBVLFASOV-UHFFFAOYSA-N 2 1 326.406 4.159 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2COCc3cccc(Cl)c32)c1 ZINC000788595332 1047241618 /nfs/dbraw/zinc/24/16/18/1047241618.db2.gz SCUAUEJLNREISJ-LJQANCHMSA-N 2 1 344.886 4.153 20 0 EIADMP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2COCc3cccc(Cl)c32)c1 ZINC000788595332 1047241604 /nfs/dbraw/zinc/24/16/04/1047241604.db2.gz SCUAUEJLNREISJ-LJQANCHMSA-N 2 1 344.886 4.153 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccccc2Cl)C[C@@H]1c1ccccc1 ZINC000556062146 1047427378 /nfs/dbraw/zinc/42/73/78/1047427378.db2.gz NKDAHKBEOCVUJQ-AZUAARDMSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccccc2Cl)C[C@@H]1c1ccccc1 ZINC000556062146 1047427385 /nfs/dbraw/zinc/42/73/85/1047427385.db2.gz NKDAHKBEOCVUJQ-AZUAARDMSA-N 2 1 328.887 4.308 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](Cc1ccccc1Cl)C1CC1 ZINC000556077243 1047434352 /nfs/dbraw/zinc/43/43/52/1047434352.db2.gz VDCNXXPBFVAICB-LIRRHRJNSA-N 2 1 331.891 4.092 20 0 EIADMP Cc1cccc2c(CC[NH2+][C@@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)c[nH]c21 ZINC000556094496 1047445964 /nfs/dbraw/zinc/44/59/64/1047445964.db2.gz YIBDYVAFIWUWRI-IRLDBZIGSA-N 2 1 347.506 4.444 20 0 EIADMP Cc1cccc2c(CC[NH2+][C@@H]3CC[N@H+](C)[C@H](c4ccccc4)C3)c[nH]c21 ZINC000556094496 1047445970 /nfs/dbraw/zinc/44/59/70/1047445970.db2.gz YIBDYVAFIWUWRI-IRLDBZIGSA-N 2 1 347.506 4.444 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000897796002 1047484717 /nfs/dbraw/zinc/48/47/17/1047484717.db2.gz VUSHWYNCVIPERR-QXAKKESOSA-N 2 1 332.557 4.161 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)[C@@H]1CCOC1 ZINC000129870672 1047520733 /nfs/dbraw/zinc/52/07/33/1047520733.db2.gz JVLZYAAJTGNTJR-IFMALSPDSA-N 2 1 344.543 4.356 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000556236382 1047602602 /nfs/dbraw/zinc/60/26/02/1047602602.db2.gz KNHMRNYAOJZMIQ-CZAAIQMYSA-N 2 1 339.527 4.441 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000556236382 1047602607 /nfs/dbraw/zinc/60/26/07/1047602607.db2.gz KNHMRNYAOJZMIQ-CZAAIQMYSA-N 2 1 339.527 4.441 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(Cl)nc2)CC1 ZINC000763430262 1047630795 /nfs/dbraw/zinc/63/07/95/1047630795.db2.gz CQCYOBIPRLDFGO-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(Cl)nc2)CC1 ZINC000763430262 1047630807 /nfs/dbraw/zinc/63/08/07/1047630807.db2.gz CQCYOBIPRLDFGO-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP CCc1cnc(CC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)s1 ZINC000130287594 1047670247 /nfs/dbraw/zinc/67/02/47/1047670247.db2.gz SZXCFVSFCJGSIF-CQSZACIVSA-N 2 1 340.496 4.093 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000550606178 1047746769 /nfs/dbraw/zinc/74/67/69/1047746769.db2.gz FNEDSKRBVSTLST-RBBKRZOGSA-N 2 1 338.495 4.399 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)C1CCCC1 ZINC000550678076 1047813714 /nfs/dbraw/zinc/81/37/14/1047813714.db2.gz AERKODVVUKPUPF-BHIFYINESA-N 2 1 344.543 4.397 20 0 EIADMP CCO[C@H](CC[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)C1CCCC1 ZINC000550678076 1047813716 /nfs/dbraw/zinc/81/37/16/1047813716.db2.gz AERKODVVUKPUPF-BHIFYINESA-N 2 1 344.543 4.397 20 0 EIADMP CCOc1cc(C)ccc1CN[C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550681079 1047813933 /nfs/dbraw/zinc/81/39/33/1047813933.db2.gz UCEXDJJRBNXPSP-NHCUHLMSSA-N 2 1 338.495 4.319 20 0 EIADMP CCOc1cc(C)ccc1CN[C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550681079 1047813935 /nfs/dbraw/zinc/81/39/35/1047813935.db2.gz UCEXDJJRBNXPSP-NHCUHLMSSA-N 2 1 338.495 4.319 20 0 EIADMP Cc1cc(F)ccc1CC[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550680213 1047813962 /nfs/dbraw/zinc/81/39/62/1047813962.db2.gz JFRGNXJXGSXPGI-RTWAWAEBSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1cc(F)ccc1CC[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550680213 1047813966 /nfs/dbraw/zinc/81/39/66/1047813966.db2.gz JFRGNXJXGSXPGI-RTWAWAEBSA-N 2 1 326.459 4.102 20 0 EIADMP CC(C)[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1cccnc1 ZINC000550678468 1047816935 /nfs/dbraw/zinc/81/69/35/1047816935.db2.gz GVAHBLMKQNWKHW-FKBYEOEOSA-N 2 1 337.511 4.246 20 0 EIADMP CC(C)[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1cccnc1 ZINC000550678468 1047816938 /nfs/dbraw/zinc/81/69/38/1047816938.db2.gz GVAHBLMKQNWKHW-FKBYEOEOSA-N 2 1 337.511 4.246 20 0 EIADMP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000556589891 1047835140 /nfs/dbraw/zinc/83/51/40/1047835140.db2.gz QPMLMMWPJMIJCC-HRQSHJORSA-N 2 1 330.516 4.041 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cc3c(cccc3Cl)[nH]2)CC1 ZINC001136860853 1047858270 /nfs/dbraw/zinc/85/82/70/1047858270.db2.gz FCNCXWNNASIEIQ-UHFFFAOYSA-N 2 1 333.907 4.374 20 0 EIADMP C[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000824775078 1047932680 /nfs/dbraw/zinc/93/26/80/1047932680.db2.gz YFVHBNRDGSHPJV-USXIJHARSA-N 2 1 341.326 4.071 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000556857804 1048074362 /nfs/dbraw/zinc/07/43/62/1048074362.db2.gz HMYRKBIAFRQBKG-SUMWQHHRSA-N 2 1 342.405 4.110 20 0 EIADMP C[NH+]1CCC(C2CC[NH+](Cc3c(Cl)ccc(F)c3F)CC2)CC1 ZINC001143956836 1048315626 /nfs/dbraw/zinc/31/56/26/1048315626.db2.gz FZZAYCGRDWLSQU-UHFFFAOYSA-N 2 1 342.861 4.172 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CC2Cc4ccccc4C2)C3)cc1 ZINC000499224973 1048454854 /nfs/dbraw/zinc/45/48/54/1048454854.db2.gz YVOUHUFZVLWVOZ-JOZNFPNDSA-N 2 1 346.518 4.187 20 0 EIADMP Cc1ccc(OC(F)F)c(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC000809737630 1048508588 /nfs/dbraw/zinc/50/85/88/1048508588.db2.gz IIFLGYJSDKZEGD-UHFFFAOYSA-N 2 1 348.437 4.290 20 0 EIADMP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000815622222 1048548237 /nfs/dbraw/zinc/54/82/37/1048548237.db2.gz PRERQPXJGDLASI-PKOBYXMFSA-N 2 1 326.459 4.307 20 0 EIADMP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3cccc(C4=[NH+]CCC4)c3)c2c1 ZINC001171167742 1048614553 /nfs/dbraw/zinc/61/45/53/1048614553.db2.gz MGFLMSYOWNUQSR-MRXNPFEDSA-N 2 1 331.463 4.412 20 0 EIADMP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc([C@@H]4CC[N@@H+](C)C4)cc3)c2c1 ZINC001171167789 1048615104 /nfs/dbraw/zinc/61/51/04/1048615104.db2.gz MQQKKLQDVXNWPC-PKOBYXMFSA-N 2 1 347.506 4.248 20 0 EIADMP Clc1ccc2c(C[N@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c[nH]c2n1 ZINC001144414482 1048649349 /nfs/dbraw/zinc/64/93/49/1048649349.db2.gz ICWLVDXKTKDYAD-MRXNPFEDSA-N 2 1 346.906 4.057 20 0 EIADMP c1cc2cccc(C[NH+]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]4C3)c2[nH]1 ZINC001144718329 1048818865 /nfs/dbraw/zinc/81/88/65/1048818865.db2.gz HQZRWDQUAYKAET-RBBKRZOGSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2cccc(C[N@H+]3CC[C@H]4C[NH+](Cc5ccccc5)C[C@H]4C3)c2[nH]1 ZINC001144718329 1048818869 /nfs/dbraw/zinc/81/88/69/1048818869.db2.gz HQZRWDQUAYKAET-RBBKRZOGSA-N 2 1 345.490 4.122 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2ccccc2)CC1 ZINC000134155312 1048888502 /nfs/dbraw/zinc/88/85/02/1048888502.db2.gz PWAADVDGWUPYFG-UHFFFAOYSA-N 2 1 340.515 4.021 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000237405724 1048937050 /nfs/dbraw/zinc/93/70/50/1048937050.db2.gz DFFKUHICLRREBL-SFHVURJKSA-N 2 1 349.478 4.196 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3cc[nH]c32)CC[N@@H+]1Cc1ccccc1 ZINC000237482817 1048952464 /nfs/dbraw/zinc/95/24/64/1048952464.db2.gz JOSAJMPZFNWJTB-UTKZUKDTSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3cc[nH]c32)CC[N@H+]1Cc1ccccc1 ZINC000237482817 1048952489 /nfs/dbraw/zinc/95/24/89/1048952489.db2.gz JOSAJMPZFNWJTB-UTKZUKDTSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cccc3cc[nH]c32)CC[N@@H+]1Cc1ccccc1 ZINC000237716795 1048979390 /nfs/dbraw/zinc/97/93/90/1048979390.db2.gz JOSAJMPZFNWJTB-LAUBAEHRSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cccc3cc[nH]c32)CC[N@H+]1Cc1ccccc1 ZINC000237716795 1048979402 /nfs/dbraw/zinc/97/94/02/1048979402.db2.gz JOSAJMPZFNWJTB-LAUBAEHRSA-N 2 1 333.479 4.311 20 0 EIADMP CCCC[C@H](C[NH3+])[NH2+][C@H](C)c1ccc(SC(F)F)c(OC)c1 ZINC000817963091 1049070937 /nfs/dbraw/zinc/07/09/37/1049070937.db2.gz MXWQOLUDUIVXQQ-DGCLKSJQSA-N 2 1 332.460 4.178 20 0 EIADMP CCc1cccc(N([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)[nH+]1 ZINC001170647901 1049316072 /nfs/dbraw/zinc/31/60/72/1049316072.db2.gz QEKKKQRCSHCXEN-NLDTVIPQSA-N 2 1 335.495 4.276 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)C[C@H]1c1ccccc1 ZINC000517045141 1049373690 /nfs/dbraw/zinc/37/36/90/1049373690.db2.gz UQDGZIRZQCGVKR-NMIHRBCNSA-N 2 1 338.470 4.497 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)C[C@H]1c1ccccc1 ZINC000517045141 1049373699 /nfs/dbraw/zinc/37/36/99/1049373699.db2.gz UQDGZIRZQCGVKR-NMIHRBCNSA-N 2 1 338.470 4.497 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)cc3cccnc32)[C@H](C)C1 ZINC000081096712 1049624389 /nfs/dbraw/zinc/62/43/89/1049624389.db2.gz FJRCTWKZTARRIK-KDOFPFPSSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)cc3cccnc32)[C@H](C)C1 ZINC000081096712 1049624397 /nfs/dbraw/zinc/62/43/97/1049624397.db2.gz FJRCTWKZTARRIK-KDOFPFPSSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)cc3cccnc32)[C@H](C)C1 ZINC000081096712 1049624400 /nfs/dbraw/zinc/62/44/00/1049624400.db2.gz FJRCTWKZTARRIK-KDOFPFPSSA-N 2 1 331.891 4.050 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2c(F)cccc2C1 ZINC001171439397 1049690771 /nfs/dbraw/zinc/69/07/71/1049690771.db2.gz YKEDZPQBCRVPBI-OTWHNJEPSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@H]1CCc2c(F)cccc2C1 ZINC001171439397 1049690787 /nfs/dbraw/zinc/69/07/87/1049690787.db2.gz YKEDZPQBCRVPBI-OTWHNJEPSA-N 2 1 330.491 4.022 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171559089 1049754703 /nfs/dbraw/zinc/75/47/03/1049754703.db2.gz VGGJRKZYTOYHMJ-FKBYEOEOSA-N 2 1 349.522 4.019 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CC[N@@H+]1C ZINC000245511793 1049758345 /nfs/dbraw/zinc/75/83/45/1049758345.db2.gz ZDRAUEKUEALHPC-SZXPJGKVSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CC[N@H+]1C ZINC000245511793 1049758349 /nfs/dbraw/zinc/75/83/49/1049758349.db2.gz ZDRAUEKUEALHPC-SZXPJGKVSA-N 2 1 340.433 4.414 20 0 EIADMP COc1ccccc1[C@H]1CC[N@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)C1 ZINC001171628586 1049762353 /nfs/dbraw/zinc/76/23/53/1049762353.db2.gz BYCHIOWWIQFDHD-INIZCTEOSA-N 2 1 330.516 4.136 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2ccccc2C(F)(F)F)CC1(C)C ZINC001171617571 1049766314 /nfs/dbraw/zinc/76/63/14/1049766314.db2.gz NQYABVCBXAEWAB-UHFFFAOYSA-N 2 1 328.422 4.446 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1nc2c(s1)CCCC2 ZINC000245535848 1049769429 /nfs/dbraw/zinc/76/94/29/1049769429.db2.gz KSBHPZQJGDIKMT-HZPDHXFCSA-N 2 1 335.561 4.185 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH+]2CCC([NH3+])(c3ccccc3F)CC2)cc1 ZINC001171667752 1049774630 /nfs/dbraw/zinc/77/46/30/1049774630.db2.gz XWUBVEVLHRTSRY-SFHVURJKSA-N 2 1 340.486 4.405 20 0 EIADMP C[NH+]1C(C)(C)CC([N@@H+](Cc2ccccc2)C2CCOCC2)CC1(C)C ZINC001171639394 1049778903 /nfs/dbraw/zinc/77/89/03/1049778903.db2.gz IMDGENZHWYAWHZ-UHFFFAOYSA-N 2 1 344.543 4.319 20 0 EIADMP C[NH2+]Cc1ccc2c(ccn2[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC001171744480 1049789848 /nfs/dbraw/zinc/78/98/48/1049789848.db2.gz HARYVHNJWSHJRN-UTKZUKDTSA-N 2 1 333.479 4.196 20 0 EIADMP Cc1cccc(Cl)c1C(=[NH2+])N[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171742644 1049801936 /nfs/dbraw/zinc/80/19/36/1049801936.db2.gz XNPQQRWGWSPZKS-DOTOQJQBSA-N 2 1 341.886 4.226 20 0 EIADMP Cc1cccc(Cl)c1C(=[NH2+])N[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171742644 1049801941 /nfs/dbraw/zinc/80/19/41/1049801941.db2.gz XNPQQRWGWSPZKS-DOTOQJQBSA-N 2 1 341.886 4.226 20 0 EIADMP COC1CCC([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000813880889 1049830454 /nfs/dbraw/zinc/83/04/54/1049830454.db2.gz IXJKXAMNDOMHJC-QMIIDVESSA-N 2 1 342.527 4.119 20 0 EIADMP CC(C)[N@H+](C1CCOCC1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171991474 1049832858 /nfs/dbraw/zinc/83/28/58/1049832858.db2.gz XUHPDQPHELHIFX-OAQYLSRUSA-N 2 1 344.543 4.319 20 0 EIADMP CC(C)[N@@H+](C1CCOCC1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171991474 1049832859 /nfs/dbraw/zinc/83/28/59/1049832859.db2.gz XUHPDQPHELHIFX-OAQYLSRUSA-N 2 1 344.543 4.319 20 0 EIADMP CC(C)[NH+](C1CCOCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171991474 1049832862 /nfs/dbraw/zinc/83/28/62/1049832862.db2.gz XUHPDQPHELHIFX-OAQYLSRUSA-N 2 1 344.543 4.319 20 0 EIADMP CC(C)[NH+](C1CCOCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171991474 1049832865 /nfs/dbraw/zinc/83/28/65/1049832865.db2.gz XUHPDQPHELHIFX-OAQYLSRUSA-N 2 1 344.543 4.319 20 0 EIADMP CC1(C)C[C@H]([NH2+]C2(Cc3cccnc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171974960 1049837327 /nfs/dbraw/zinc/83/73/27/1049837327.db2.gz BJNAPFFCRQTLCN-OAQYLSRUSA-N 2 1 349.522 4.190 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cncc(F)c1 ZINC001171978455 1049837351 /nfs/dbraw/zinc/83/73/51/1049837351.db2.gz KVYACXZVJSYOOD-UZLBHIALSA-N 2 1 341.474 4.315 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cncc(F)c1 ZINC001171978455 1049837357 /nfs/dbraw/zinc/83/73/57/1049837357.db2.gz KVYACXZVJSYOOD-UZLBHIALSA-N 2 1 341.474 4.315 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CC2(c3ccccn3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171984155 1049840757 /nfs/dbraw/zinc/84/07/57/1049840757.db2.gz SFWFKTBEGDFXMN-FQEVSTJZSA-N 2 1 349.522 4.146 20 0 EIADMP CC[N@H+](Cc1cccnc1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984189 1049840819 /nfs/dbraw/zinc/84/08/19/1049840819.db2.gz IWFDXIYMMLSEKU-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@@H+](Cc1cccnc1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984189 1049840820 /nfs/dbraw/zinc/84/08/20/1049840820.db2.gz IWFDXIYMMLSEKU-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[NH+](Cc1cccnc1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984189 1049840823 /nfs/dbraw/zinc/84/08/23/1049840823.db2.gz IWFDXIYMMLSEKU-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP CC[NH+](Cc1cccnc1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984189 1049840831 /nfs/dbraw/zinc/84/08/31/1049840831.db2.gz IWFDXIYMMLSEKU-NRFANRHFSA-N 2 1 337.511 4.347 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[N@H+]2[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171986174 1049841081 /nfs/dbraw/zinc/84/10/81/1049841081.db2.gz GCAYABMUEPSNBF-HWPVKAJDSA-N 2 1 342.527 4.071 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171986174 1049841084 /nfs/dbraw/zinc/84/10/84/1049841084.db2.gz GCAYABMUEPSNBF-HWPVKAJDSA-N 2 1 342.527 4.071 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[NH+]2[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171986174 1049841088 /nfs/dbraw/zinc/84/10/88/1049841088.db2.gz GCAYABMUEPSNBF-HWPVKAJDSA-N 2 1 342.527 4.071 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[NH+]2[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171986174 1049841089 /nfs/dbraw/zinc/84/10/89/1049841089.db2.gz GCAYABMUEPSNBF-HWPVKAJDSA-N 2 1 342.527 4.071 20 0 EIADMP [NH3+]CCCCCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172077011 1049843803 /nfs/dbraw/zinc/84/38/03/1049843803.db2.gz NVHIFOWZYMTRDJ-KOUNCHBCSA-N 3 1 343.559 4.071 20 0 EIADMP [NH3+]CCCCCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2Cc1ccccc1 ZINC001172077011 1049843806 /nfs/dbraw/zinc/84/38/06/1049843806.db2.gz NVHIFOWZYMTRDJ-KOUNCHBCSA-N 2 1 343.559 4.071 20 0 EIADMP CC[N@H+](Cc1ccncc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172071940 1049844311 /nfs/dbraw/zinc/84/43/11/1049844311.db2.gz AWAAHARGSRCBPF-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP CC[N@@H+](Cc1ccncc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172071940 1049844314 /nfs/dbraw/zinc/84/43/14/1049844314.db2.gz AWAAHARGSRCBPF-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP CC[NH+](Cc1ccncc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172071940 1049844319 /nfs/dbraw/zinc/84/43/19/1049844319.db2.gz AWAAHARGSRCBPF-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP CC[NH+](Cc1ccncc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172071940 1049844325 /nfs/dbraw/zinc/84/43/25/1049844325.db2.gz AWAAHARGSRCBPF-JKHIJQBDSA-N 2 1 349.522 4.489 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@H]2CCc4cccnc42)C3)cc1 ZINC001172073575 1049845058 /nfs/dbraw/zinc/84/50/58/1049845058.db2.gz RZEDLHUXKUKJCE-LRSLUSHPSA-N 2 1 347.506 4.244 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@H]2CCc4cccnc42)C3)cc1 ZINC001172073575 1049845061 /nfs/dbraw/zinc/84/50/61/1049845061.db2.gz RZEDLHUXKUKJCE-LRSLUSHPSA-N 2 1 347.506 4.244 20 0 EIADMP C[N@@H+](C[C@H]1CCCCO1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076439 1049845249 /nfs/dbraw/zinc/84/52/49/1049845249.db2.gz YOKNTWVFPLFCQJ-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP C[NH+](C[C@H]1CCCCO1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076439 1049845251 /nfs/dbraw/zinc/84/52/51/1049845251.db2.gz YOKNTWVFPLFCQJ-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP C[NH+](C[C@H]1CCCCO1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076439 1049845253 /nfs/dbraw/zinc/84/52/53/1049845253.db2.gz YOKNTWVFPLFCQJ-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP FC1(F)C[C@@]12CC[N@H+]([C@H]1C[C@H]3CCC[C@@H](C1)[NH+]3Cc1ccccc1)C2 ZINC001172074405 1049845552 /nfs/dbraw/zinc/84/55/52/1049845552.db2.gz IRDZIINYEOOPCE-FUMNGEBKSA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)C[C@@]12CC[NH+]([C@H]1C[C@H]3CCC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001172074405 1049845557 /nfs/dbraw/zinc/84/55/57/1049845557.db2.gz IRDZIINYEOOPCE-FUMNGEBKSA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)C[C@@]12CC[NH+]([C@H]1C[C@H]3CCC[C@@H](C1)[N@@H+]3Cc1ccccc1)C2 ZINC001172074405 1049845560 /nfs/dbraw/zinc/84/55/60/1049845560.db2.gz IRDZIINYEOOPCE-FUMNGEBKSA-N 2 1 346.465 4.303 20 0 EIADMP Fc1ccccc1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245746915 1049845955 /nfs/dbraw/zinc/84/59/55/1049845955.db2.gz SSFBICODDTUSFK-MZADTFQBSA-N 2 1 338.470 4.153 20 0 EIADMP CC(C)O[C@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172082433 1049847559 /nfs/dbraw/zinc/84/75/59/1049847559.db2.gz JWBQXKNRWMHQCY-LRSLUSHPSA-N 2 1 342.527 4.071 20 0 EIADMP C[C@@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062339 1049850262 /nfs/dbraw/zinc/85/02/62/1049850262.db2.gz NELUWNOIFSTXJW-WLRLJWMZSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062339 1049850264 /nfs/dbraw/zinc/85/02/64/1049850264.db2.gz NELUWNOIFSTXJW-WLRLJWMZSA-N 2 1 335.495 4.318 20 0 EIADMP Cc1cccnc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172064533 1049852013 /nfs/dbraw/zinc/85/20/13/1049852013.db2.gz GYRIMTPVILYRAI-MZADTFQBSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1cccnc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172064533 1049852017 /nfs/dbraw/zinc/85/20/17/1049852017.db2.gz GYRIMTPVILYRAI-MZADTFQBSA-N 2 1 335.495 4.065 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Cc3ccccc3F)CC1)C2 ZINC001172126501 1049853191 /nfs/dbraw/zinc/85/31/91/1049853191.db2.gz WNDXEHIEDBSHRC-PMOLBWCYSA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Cc3ccccc3F)CC1)C2 ZINC001172126501 1049853192 /nfs/dbraw/zinc/85/31/92/1049853192.db2.gz WNDXEHIEDBSHRC-PMOLBWCYSA-N 2 1 330.491 4.096 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccnc1 ZINC001172069614 1049853380 /nfs/dbraw/zinc/85/33/80/1049853380.db2.gz VTHZOJRCJNEBRA-CIQXWFTPSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccnc1 ZINC001172069614 1049853381 /nfs/dbraw/zinc/85/33/81/1049853381.db2.gz VTHZOJRCJNEBRA-CIQXWFTPSA-N 2 1 335.495 4.318 20 0 EIADMP FC1(F)CC[C@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172068240 1049853437 /nfs/dbraw/zinc/85/34/37/1049853437.db2.gz PSESVDKMJHPNCN-OKYOBFRVSA-N 2 1 334.454 4.350 20 0 EIADMP CCC1([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCOCC1 ZINC001172070113 1049853584 /nfs/dbraw/zinc/85/35/84/1049853584.db2.gz MJZVUIBHXBMKTO-WKCHPHFGSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@H]1OC2(CC[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CC2)c2ccccc21 ZINC001172133958 1049855063 /nfs/dbraw/zinc/85/50/63/1049855063.db2.gz UUGCNAIWIKHFIE-AKHDSKFASA-N 2 1 340.511 4.084 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCCCCCCCCCCCO)C2 ZINC001172108837 1049857581 /nfs/dbraw/zinc/85/75/81/1049857581.db2.gz GPIIBWVFOYLUMV-WKCHPHFGSA-N 2 1 338.580 4.485 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccc1)Cc1ccncc1)C2 ZINC001172121641 1049858841 /nfs/dbraw/zinc/85/88/41/1049858841.db2.gz ROUCWBGNYKKMNB-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccc1)Cc1ccncc1)C2 ZINC001172121641 1049858843 /nfs/dbraw/zinc/85/88/43/1049858843.db2.gz ROUCWBGNYKKMNB-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+](Cc1ccccc1)Cc1ccncc1)C2 ZINC001172121641 1049858844 /nfs/dbraw/zinc/85/88/44/1049858844.db2.gz ROUCWBGNYKKMNB-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+](Cc1ccccc1)Cc1ccncc1)C2 ZINC001172121641 1049858845 /nfs/dbraw/zinc/85/88/45/1049858845.db2.gz ROUCWBGNYKKMNB-KOUNCHBCSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(c3nc4ccccc4o3)CC1)C2 ZINC001172113990 1049858926 /nfs/dbraw/zinc/85/89/26/1049858926.db2.gz NHVOOIIOMKIPEM-PIIMJCKOSA-N 2 1 339.483 4.023 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(c3nc4ccccc4o3)CC1)C2 ZINC001172113990 1049858927 /nfs/dbraw/zinc/85/89/27/1049858927.db2.gz NHVOOIIOMKIPEM-PIIMJCKOSA-N 2 1 339.483 4.023 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccc1)Cc1ccncc1)C2 ZINC001172121642 1049859221 /nfs/dbraw/zinc/85/92/21/1049859221.db2.gz ROUCWBGNYKKMNB-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccc1)Cc1ccncc1)C2 ZINC001172121642 1049859225 /nfs/dbraw/zinc/85/92/25/1049859225.db2.gz ROUCWBGNYKKMNB-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+](Cc1ccccc1)Cc1ccncc1)C2 ZINC001172121642 1049859227 /nfs/dbraw/zinc/85/92/27/1049859227.db2.gz ROUCWBGNYKKMNB-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+](Cc1ccccc1)Cc1ccncc1)C2 ZINC001172121642 1049859230 /nfs/dbraw/zinc/85/92/30/1049859230.db2.gz ROUCWBGNYKKMNB-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP CCOc1ccc([C@@H]2CCC[N@@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)cc1 ZINC001172124108 1049860182 /nfs/dbraw/zinc/86/01/82/1049860182.db2.gz JMLRWYHYHBEQJV-JTJHWIPRSA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@@H]2CCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)cc1 ZINC001172124108 1049860184 /nfs/dbraw/zinc/86/01/84/1049860184.db2.gz JMLRWYHYHBEQJV-JTJHWIPRSA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@@H]2CCC[NH+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172124108 1049860188 /nfs/dbraw/zinc/86/01/88/1049860188.db2.gz JMLRWYHYHBEQJV-JTJHWIPRSA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@@H]2CCC[NH+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172124108 1049860190 /nfs/dbraw/zinc/86/01/90/1049860190.db2.gz JMLRWYHYHBEQJV-JTJHWIPRSA-N 2 1 328.500 4.238 20 0 EIADMP c1ccc2c(c1)C[C@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CS2 ZINC001172203692 1049863275 /nfs/dbraw/zinc/86/32/75/1049863275.db2.gz VDCHGTQUHDFXGG-MOPGFXCFSA-N 2 1 330.541 4.044 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)C12CCC2 ZINC000245878540 1049867197 /nfs/dbraw/zinc/86/71/97/1049867197.db2.gz KKYMESATDVQLSL-QXCFHYIPSA-N 2 1 348.556 4.068 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)C12CCC2 ZINC000245878540 1049867200 /nfs/dbraw/zinc/86/72/00/1049867200.db2.gz KKYMESATDVQLSL-QXCFHYIPSA-N 2 1 348.556 4.068 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)C12CCC2 ZINC000245878535 1049867887 /nfs/dbraw/zinc/86/78/87/1049867887.db2.gz KKYMESATDVQLSL-LULLPPNCSA-N 2 1 348.556 4.068 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)C12CCC2 ZINC000245878535 1049867894 /nfs/dbraw/zinc/86/78/94/1049867894.db2.gz KKYMESATDVQLSL-LULLPPNCSA-N 2 1 348.556 4.068 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171024669 1049869473 /nfs/dbraw/zinc/86/94/73/1049869473.db2.gz GCKYUOWWTVTAOQ-SZMVWBNQSA-N 2 1 332.919 4.322 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)C[C@@H]1C ZINC001172381014 1049885696 /nfs/dbraw/zinc/88/56/96/1049885696.db2.gz ZSPZFTBVVNIWFL-SVFBPWRDSA-N 2 1 341.543 4.194 20 0 EIADMP CC[C@H](CC(C)C)[N@@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001172407088 1049898999 /nfs/dbraw/zinc/89/89/99/1049898999.db2.gz NFRKDORYPSIGFB-BDKRGJGYSA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001172407088 1049899002 /nfs/dbraw/zinc/89/90/02/1049899002.db2.gz NFRKDORYPSIGFB-BDKRGJGYSA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001172407088 1049899004 /nfs/dbraw/zinc/89/90/04/1049899004.db2.gz NFRKDORYPSIGFB-BDKRGJGYSA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001172407088 1049899006 /nfs/dbraw/zinc/89/90/06/1049899006.db2.gz NFRKDORYPSIGFB-BDKRGJGYSA-N 2 1 343.559 4.439 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C ZINC001172470549 1049908623 /nfs/dbraw/zinc/90/86/23/1049908623.db2.gz ZKHUCUVTMGGRGX-URVUXULASA-N 2 1 346.559 4.185 20 0 EIADMP CC(C)COCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172465283 1049917923 /nfs/dbraw/zinc/91/79/23/1049917923.db2.gz UJBSFTWZEPADIM-NMIHRBCNSA-N 2 1 344.543 4.223 20 0 EIADMP COc1ccccc1C1([NH3+])CC[NH+](C2CCC3(CCCC3)CC2)CC1 ZINC001172726803 1049967149 /nfs/dbraw/zinc/96/71/49/1049967149.db2.gz FELRTLFQLMDZSJ-UHFFFAOYSA-N 2 1 342.527 4.448 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000247044051 1050011346 /nfs/dbraw/zinc/01/13/46/1050011346.db2.gz OIONFXABPGHRHZ-GDZNZVCISA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000247044051 1050011348 /nfs/dbraw/zinc/01/13/48/1050011348.db2.gz OIONFXABPGHRHZ-GDZNZVCISA-N 2 1 347.503 4.391 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cncc(F)c1 ZINC000247124840 1050014506 /nfs/dbraw/zinc/01/45/06/1050014506.db2.gz RKBPSDPMGLZASS-DLBZAZTESA-N 2 1 341.474 4.446 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1cncc(F)c1 ZINC000247124840 1050014513 /nfs/dbraw/zinc/01/45/13/1050014513.db2.gz RKBPSDPMGLZASS-DLBZAZTESA-N 2 1 341.474 4.446 20 0 EIADMP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cncc(F)c1 ZINC000247231025 1050017268 /nfs/dbraw/zinc/01/72/68/1050017268.db2.gz WYOBNXHURKUDDL-WOYCLPQFSA-N 2 1 341.474 4.028 20 0 EIADMP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1cncc(F)c1 ZINC000247231025 1050017274 /nfs/dbraw/zinc/01/72/74/1050017274.db2.gz WYOBNXHURKUDDL-WOYCLPQFSA-N 2 1 341.474 4.028 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(CC)s2)[C@H](C)C1 ZINC000248174433 1050045896 /nfs/dbraw/zinc/04/58/96/1050045896.db2.gz VJBVKJMUFCTYPB-NUJGCVRESA-N 2 1 338.561 4.098 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000248172602 1050045977 /nfs/dbraw/zinc/04/59/77/1050045977.db2.gz VBBIDKDMYNBDSN-WBVHZDCISA-N 2 1 341.524 4.119 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000248172602 1050045983 /nfs/dbraw/zinc/04/59/83/1050045983.db2.gz VBBIDKDMYNBDSN-WBVHZDCISA-N 2 1 341.524 4.119 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCC2Cc3ccccc3C2)C[C@H]1c1ccccc1 ZINC000520621179 1050057305 /nfs/dbraw/zinc/05/73/05/1050057305.db2.gz WZTJYPLDYPZZAF-GOTSBHOMSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCC2Cc3ccccc3C2)C[C@H]1c1ccccc1 ZINC000520621179 1050057307 /nfs/dbraw/zinc/05/73/07/1050057307.db2.gz WZTJYPLDYPZZAF-GOTSBHOMSA-N 2 1 334.507 4.217 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000248728252 1050075140 /nfs/dbraw/zinc/07/51/40/1050075140.db2.gz VFIVEOUOCMHTAC-IRXDYDNUSA-N 2 1 340.433 4.199 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@H]3CCCc4occc43)C2)c1 ZINC000248831305 1050079450 /nfs/dbraw/zinc/07/94/50/1050079450.db2.gz HLDHEGANXGXYTB-YJBOKZPZSA-N 2 1 330.497 4.220 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3CCCc4occc43)C2)c1 ZINC000248831305 1050079453 /nfs/dbraw/zinc/07/94/53/1050079453.db2.gz HLDHEGANXGXYTB-YJBOKZPZSA-N 2 1 330.497 4.220 20 0 EIADMP COC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCCC1 ZINC000248876174 1050081895 /nfs/dbraw/zinc/08/18/95/1050081895.db2.gz JNVFOCBAGAZFCR-MZADTFQBSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1cccc(O)c1 ZINC000249380541 1050096674 /nfs/dbraw/zinc/09/66/74/1050096674.db2.gz BECWMRSHCLBGMU-ZWKOTPCHSA-N 2 1 338.495 4.475 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)C1CCSCC1 ZINC000249958604 1050109421 /nfs/dbraw/zinc/10/94/21/1050109421.db2.gz JLHCBNXBLPTMCE-YXJHDRRASA-N 2 1 338.586 4.252 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)C1CCSCC1 ZINC000249958604 1050109425 /nfs/dbraw/zinc/10/94/25/1050109425.db2.gz JLHCBNXBLPTMCE-YXJHDRRASA-N 2 1 338.586 4.252 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001172824064 1050163696 /nfs/dbraw/zinc/16/36/96/1050163696.db2.gz PSJALJJCOITNKC-HSZRJFAPSA-N 2 1 334.507 4.107 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(Br)c1 ZINC000251335478 1050168973 /nfs/dbraw/zinc/16/89/73/1050168973.db2.gz YTXFOVKGNLZJLO-IKGGRYGDSA-N 2 1 337.305 4.117 20 0 EIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(F)cc2Cl)[C@H](C)C1 ZINC001172864995 1050175449 /nfs/dbraw/zinc/17/54/49/1050175449.db2.gz JFLZOMWEYHLLBZ-LBTNJELSSA-N 2 1 326.887 4.119 20 0 EIADMP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2cnc(-c3ccsc3)s2)C1 ZINC001177294053 1050177270 /nfs/dbraw/zinc/17/72/70/1050177270.db2.gz CQRDHTRVKRTSOO-GJZGRUSLSA-N 2 1 349.569 4.329 20 0 EIADMP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2ccc(-c3ccccc3)o2)C1 ZINC001177294060 1050177999 /nfs/dbraw/zinc/17/79/99/1050177999.db2.gz CVIISVXVNXEHOJ-QZTJIDSGSA-N 2 1 326.484 4.404 20 0 EIADMP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2cnc(-c3ccsc3)s2)C1 ZINC001177294056 1050178599 /nfs/dbraw/zinc/17/85/99/1050178599.db2.gz CQRDHTRVKRTSOO-HUUCEWRRSA-N 2 1 349.569 4.329 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@@H+](C)C[C@@H]1CC[NH+](Cc3ccccc3)C1)CC2 ZINC001172844394 1050181291 /nfs/dbraw/zinc/18/12/91/1050181291.db2.gz SQCFVCBOKKWGHM-URXFXBBRSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH+](C)C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172844394 1050181312 /nfs/dbraw/zinc/18/13/12/1050181312.db2.gz SQCFVCBOKKWGHM-URXFXBBRSA-N 2 1 348.534 4.306 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH+](C)C[C@@H]1CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC001172844394 1050181320 /nfs/dbraw/zinc/18/13/20/1050181320.db2.gz SQCFVCBOKKWGHM-URXFXBBRSA-N 2 1 348.534 4.306 20 0 EIADMP COC1(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)CCCCC1 ZINC001177261959 1050182797 /nfs/dbraw/zinc/18/27/97/1050182797.db2.gz MBBRMQYBZHQQFW-LJQANCHMSA-N 2 1 344.543 4.357 20 0 EIADMP C[C@H](Cc1ccc(F)cc1Cl)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001172860341 1050198163 /nfs/dbraw/zinc/19/81/63/1050198163.db2.gz CMWHILMRNJKCCY-CABCVRRESA-N 2 1 326.887 4.251 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@@H]2C(C)=CCC[C@@H]2C)cc1F ZINC001177454607 1050212593 /nfs/dbraw/zinc/21/25/93/1050212593.db2.gz SXMBSFBPBNISKT-MAUKXSAKSA-N 2 1 327.447 4.402 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2cccc3c2CCC3)cc1F ZINC001177453736 1050212646 /nfs/dbraw/zinc/21/26/46/1050212646.db2.gz FHHCLLZZLGTLAT-UHFFFAOYSA-N 2 1 335.426 4.098 20 0 EIADMP CC[N@H+](CC[NH2+]CC(C)(C)c1ccc(Br)cc1)C(C)C ZINC001177612213 1050265181 /nfs/dbraw/zinc/26/51/81/1050265181.db2.gz RMTUOKUIIFASPA-UHFFFAOYSA-N 2 1 341.337 4.047 20 0 EIADMP CC[N@@H+](CC[NH2+]CC(C)(C)c1ccc(Br)cc1)C(C)C ZINC001177612213 1050265189 /nfs/dbraw/zinc/26/51/89/1050265189.db2.gz RMTUOKUIIFASPA-UHFFFAOYSA-N 2 1 341.337 4.047 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)C2CCC3(CCOCC3)CC2)CC1 ZINC001173044595 1050270454 /nfs/dbraw/zinc/27/04/54/1050270454.db2.gz UUIUKKFNXWASKD-MXVIHJGJSA-N 2 1 348.575 4.488 20 0 EIADMP CCCc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)s1 ZINC001177668979 1050273422 /nfs/dbraw/zinc/27/34/22/1050273422.db2.gz LXOWZNGBARDTCF-IBGZPJMESA-N 2 1 342.552 4.355 20 0 EIADMP C(C[NH+]1CCCC1)[C@H]1CCCC[N@H+]1C1CCC2(CCOCC2)CC1 ZINC001173049144 1050274651 /nfs/dbraw/zinc/27/46/51/1050274651.db2.gz AZEVRWNKAXDBFZ-LJQANCHMSA-N 2 1 334.548 4.066 20 0 EIADMP CCCOC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001173092094 1050283196 /nfs/dbraw/zinc/28/31/96/1050283196.db2.gz IVVUORPUCJZCFT-DWOCFRCJSA-N 2 1 344.543 4.367 20 0 EIADMP CCCOC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001173092094 1050283209 /nfs/dbraw/zinc/28/32/09/1050283209.db2.gz IVVUORPUCJZCFT-DWOCFRCJSA-N 2 1 344.543 4.367 20 0 EIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+][C@H]1CCCc2c(cccc2OC)C1 ZINC001177741878 1050290961 /nfs/dbraw/zinc/29/09/61/1050290961.db2.gz DZCQLOHBHKPSCG-PMACEKPBSA-N 2 1 344.543 4.187 20 0 EIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+][C@H]1CCCc2c(cccc2OC)C1 ZINC001177741878 1050290974 /nfs/dbraw/zinc/29/09/74/1050290974.db2.gz DZCQLOHBHKPSCG-PMACEKPBSA-N 2 1 344.543 4.187 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173109838 1050308450 /nfs/dbraw/zinc/30/84/50/1050308450.db2.gz INHCJPROHXSRRQ-IKVFXUPASA-N 3 1 349.607 4.402 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCO[C@@](C)(c3ccc(C)cc3)C2)CC1 ZINC001173114343 1050310153 /nfs/dbraw/zinc/31/01/53/1050310153.db2.gz HGZKEXMBNSFIHV-LZBANZJXSA-N 2 1 344.543 4.195 20 0 EIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Cl)cc2Br)CC1 ZINC001206311598 1050339194 /nfs/dbraw/zinc/33/91/94/1050339194.db2.gz REIWDZMTBZUBTB-OAHLLOKOSA-N 2 1 345.712 4.053 20 0 EIADMP CCCC[C@@H](CC(C)C)[N@@H+]1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1 ZINC001173263849 1050388432 /nfs/dbraw/zinc/38/84/32/1050388432.db2.gz XAUAEHVGKWWTOD-HBMCJLEFSA-N 2 1 329.532 4.050 20 0 EIADMP CCSC[C@H](C)[N@@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001173306090 1050404318 /nfs/dbraw/zinc/40/43/18/1050404318.db2.gz LLOWNZHHAGHMCY-KNTRFNDTSA-N 2 1 332.557 4.239 20 0 EIADMP CCSC[C@H](C)[NH+]1C[C@H]2c3ccccc3[C@H]([N@H+](C)C(C)C)[C@H]2C1 ZINC001173306090 1050404323 /nfs/dbraw/zinc/40/43/23/1050404323.db2.gz LLOWNZHHAGHMCY-KNTRFNDTSA-N 2 1 332.557 4.239 20 0 EIADMP CCSC[C@H](C)[NH+]1C[C@H]2c3ccccc3[C@H]([N@@H+](C)C(C)C)[C@H]2C1 ZINC001173306090 1050404329 /nfs/dbraw/zinc/40/43/29/1050404329.db2.gz LLOWNZHHAGHMCY-KNTRFNDTSA-N 2 1 332.557 4.239 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC001178284843 1050428551 /nfs/dbraw/zinc/42/85/51/1050428551.db2.gz CTZVDLJPZFNAEF-YTFSRNRJSA-N 2 1 334.507 4.385 20 0 EIADMP [NH3+]C1(c2cccnc2)CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173340119 1050430322 /nfs/dbraw/zinc/43/03/22/1050430322.db2.gz ALFQHZIKJOCJLV-IBGZPJMESA-N 2 1 327.516 4.225 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000253355504 1050455333 /nfs/dbraw/zinc/45/53/33/1050455333.db2.gz HNOFEUCVUDALQA-UGKGYDQZSA-N 2 1 335.495 4.045 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1(C)C ZINC001178430251 1050455969 /nfs/dbraw/zinc/45/59/69/1050455969.db2.gz CUOSDILMSHZBOU-FYZZASKESA-N 2 1 344.543 4.221 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1(C)C ZINC001178430251 1050455971 /nfs/dbraw/zinc/45/59/71/1050455971.db2.gz CUOSDILMSHZBOU-FYZZASKESA-N 2 1 344.543 4.221 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001178457725 1050474255 /nfs/dbraw/zinc/47/42/55/1050474255.db2.gz CGLPVPRKQIHJMJ-PKOBYXMFSA-N 2 1 330.516 4.216 20 0 EIADMP C[C@@H](CC[NH2+]Cc1ccc(SC(F)F)cc1)[NH+]1CCCCC1 ZINC001178463578 1050477075 /nfs/dbraw/zinc/47/70/75/1050477075.db2.gz RIAPZGDKHBDYGI-AWEZNQCLSA-N 2 1 328.472 4.355 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+]Cc2ccc(-c3cccs3)cc2)CCCO1 ZINC001178473530 1050479548 /nfs/dbraw/zinc/47/95/48/1050479548.db2.gz SKMRVSJCRVTKSX-KRWDZBQOSA-N 2 1 344.524 4.006 20 0 EIADMP C[C@@H]1CCC[C@H](C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)[C@@H]1C ZINC001178595461 1050503955 /nfs/dbraw/zinc/50/39/55/1050503955.db2.gz PNOOEISKIODRQO-QWFCFKBJSA-N 2 1 346.534 4.495 20 0 EIADMP CC(C)(C[NH2+]Cc1ccc(-c2ccc(F)cc2)o1)C[NH+]1CCCC1 ZINC001178614345 1050517001 /nfs/dbraw/zinc/51/70/01/1050517001.db2.gz LKBKVRZZKSVZED-UHFFFAOYSA-N 2 1 330.447 4.297 20 0 EIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1C ZINC001179110022 1050635179 /nfs/dbraw/zinc/63/51/79/1050635179.db2.gz FAQOCOTYYBSIBT-OFNKIYASSA-N 2 1 336.523 4.489 20 0 EIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1C ZINC001179110022 1050635185 /nfs/dbraw/zinc/63/51/85/1050635185.db2.gz FAQOCOTYYBSIBT-OFNKIYASSA-N 2 1 336.523 4.489 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000093770397 1050691613 /nfs/dbraw/zinc/69/16/13/1050691613.db2.gz JYMSEXIYFVGQBO-IBGZPJMESA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000093770397 1050691617 /nfs/dbraw/zinc/69/16/17/1050691617.db2.gz JYMSEXIYFVGQBO-IBGZPJMESA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000093770397 1050691621 /nfs/dbraw/zinc/69/16/21/1050691621.db2.gz JYMSEXIYFVGQBO-IBGZPJMESA-N 2 1 338.495 4.136 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccccc2N(C)C)c1 ZINC000093943469 1050724343 /nfs/dbraw/zinc/72/43/43/1050724343.db2.gz HTUKOQPYQCKDGL-SFHVURJKSA-N 2 1 339.527 4.444 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCC(C)(C)CO2)CC[N@@H+]1Cc1ccccc1 ZINC001179686366 1050747420 /nfs/dbraw/zinc/74/74/20/1050747420.db2.gz WMJLIOHKNRRLEQ-NRSPTQNISA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCC(C)(C)CO2)CC[N@H+]1Cc1ccccc1 ZINC001179686366 1050747427 /nfs/dbraw/zinc/74/74/27/1050747427.db2.gz WMJLIOHKNRRLEQ-NRSPTQNISA-N 2 1 344.543 4.224 20 0 EIADMP C[C@]1(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CCCS1 ZINC001179918978 1050833442 /nfs/dbraw/zinc/83/34/42/1050833442.db2.gz GEQHTJJWHJCDFZ-PCCBWWKXSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@]1(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)CCCS1 ZINC001179918978 1050833444 /nfs/dbraw/zinc/83/34/44/1050833444.db2.gz GEQHTJJWHJCDFZ-PCCBWWKXSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@]1(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)CCCS1 ZINC001179918978 1050833448 /nfs/dbraw/zinc/83/34/48/1050833448.db2.gz GEQHTJJWHJCDFZ-PCCBWWKXSA-N 2 1 344.568 4.259 20 0 EIADMP Cc1cc(NC2CC[NH+](C(C)(C)C)CC2)c[nH+]c1N1CCCC[C@H]1C ZINC001180300983 1050944787 /nfs/dbraw/zinc/94/47/87/1050944787.db2.gz HGDPIRZSAZJKRT-QGZVFWFLSA-N 2 1 344.547 4.444 20 0 EIADMP Cc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCO[C@H](C)C3)c2)c1 ZINC000153501824 1051060795 /nfs/dbraw/zinc/06/07/95/1051060795.db2.gz RBPJYASZGUNPQP-RTBURBONSA-N 2 1 338.495 4.067 20 0 EIADMP Cc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCO[C@H](C)C3)c2)c1 ZINC000153501824 1051060812 /nfs/dbraw/zinc/06/08/12/1051060812.db2.gz RBPJYASZGUNPQP-RTBURBONSA-N 2 1 338.495 4.067 20 0 EIADMP C[N@@H+]1CCC[C@@H]2C[NH+](CCCc3c(Cl)cccc3Cl)CC[C@@H]21 ZINC001204278336 1051066334 /nfs/dbraw/zinc/06/63/34/1051066334.db2.gz BAKKUOSSGRYTBE-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCc3c(Cl)cccc3Cl)CC[C@@H]21 ZINC001204278336 1051066344 /nfs/dbraw/zinc/06/63/44/1051066344.db2.gz BAKKUOSSGRYTBE-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCc3c(Cl)cccc3Cl)CC[C@@H]21 ZINC001204278336 1051066349 /nfs/dbraw/zinc/06/63/49/1051066349.db2.gz BAKKUOSSGRYTBE-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCc3c(Cl)cccc3Cl)CC[C@@H]21 ZINC001204278336 1051066356 /nfs/dbraw/zinc/06/63/56/1051066356.db2.gz BAKKUOSSGRYTBE-KDOFPFPSSA-N 2 1 341.326 4.342 20 0 EIADMP Fc1cccc(/C=C\C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC001181256568 1051200571 /nfs/dbraw/zinc/20/05/71/1051200571.db2.gz QVHAZCWOZVDDJH-XQRVVYSFSA-N 2 1 339.458 4.251 20 0 EIADMP CC[C@H]([NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1)[C@H]1CCOC1 ZINC000153853295 1051235487 /nfs/dbraw/zinc/23/54/87/1051235487.db2.gz VISRCJNNNABISC-IHPCNDPISA-N 2 1 330.516 4.055 20 0 EIADMP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533886 1051248405 /nfs/dbraw/zinc/24/84/05/1051248405.db2.gz COTKAVGURZDTKZ-KBXCAEBGSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533886 1051248414 /nfs/dbraw/zinc/24/84/14/1051248414.db2.gz COTKAVGURZDTKZ-KBXCAEBGSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533886 1051248427 /nfs/dbraw/zinc/24/84/27/1051248427.db2.gz COTKAVGURZDTKZ-KBXCAEBGSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2CCCc2c(Cl)cccc2Cl)C1 ZINC001181533886 1051248436 /nfs/dbraw/zinc/24/84/36/1051248436.db2.gz COTKAVGURZDTKZ-KBXCAEBGSA-N 2 1 341.326 4.342 20 0 EIADMP CC(C)(C[N@H+]1CCC[C@@](F)(C[NH3+])CC1)Sc1ccc(Cl)cc1 ZINC001205537929 1051254658 /nfs/dbraw/zinc/25/46/58/1051254658.db2.gz KQUIWSUSUAXUHU-KRWDZBQOSA-N 2 1 344.927 4.364 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2sc(-c3ccccc3F)nc2C)C1 ZINC000163230581 1051291282 /nfs/dbraw/zinc/29/12/82/1051291282.db2.gz CWXYCSHDNGMBCU-DZGCQCFKSA-N 2 1 347.503 4.250 20 0 EIADMP COCC[NH+]1CCC([NH2+][C@@H](C)c2cccc(-c3ccccc3)c2)CC1 ZINC000154817442 1051338848 /nfs/dbraw/zinc/33/88/48/1051338848.db2.gz IMNGZPNFTAMNHF-SFHVURJKSA-N 2 1 338.495 4.115 20 0 EIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H](C)Cc1ccc(Br)cc1 ZINC001182115996 1051396796 /nfs/dbraw/zinc/39/67/96/1051396796.db2.gz YSLDKJIHZLELPM-LSDHHAIUSA-N 2 1 341.337 4.090 20 0 EIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H](C)Cc1ccc(Br)cc1 ZINC001182115996 1051396806 /nfs/dbraw/zinc/39/68/06/1051396806.db2.gz YSLDKJIHZLELPM-LSDHHAIUSA-N 2 1 341.337 4.090 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000157003295 1051590242 /nfs/dbraw/zinc/59/02/42/1051590242.db2.gz RGKIAVNNJYRZDK-HZPDHXFCSA-N 2 1 329.488 4.356 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157138452 1051602244 /nfs/dbraw/zinc/60/22/44/1051602244.db2.gz UKONXNOPNFOVJY-RDJZCZTQSA-N 2 1 338.442 4.299 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157138452 1051602254 /nfs/dbraw/zinc/60/22/54/1051602254.db2.gz UKONXNOPNFOVJY-RDJZCZTQSA-N 2 1 338.442 4.299 20 0 EIADMP Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000157538144 1051648255 /nfs/dbraw/zinc/64/82/55/1051648255.db2.gz CLKKNRGGTHULKG-INIZCTEOSA-N 2 1 346.563 4.394 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CCC2 ZINC000157534818 1051648571 /nfs/dbraw/zinc/64/85/71/1051648571.db2.gz REBMUDXRWFHDSH-QGZVFWFLSA-N 2 1 347.572 4.470 20 0 EIADMP CCC(CC)(C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)SC ZINC000775511593 1051660044 /nfs/dbraw/zinc/66/00/44/1051660044.db2.gz DUIDCTFIHDIIPZ-IEBWSBKVSA-N 2 1 334.573 4.408 20 0 EIADMP CC(C)COc1cccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192323742 1051691649 /nfs/dbraw/zinc/69/16/49/1051691649.db2.gz FCNKMXJVYXYQAC-KNQAVFIVSA-N 2 1 342.527 4.170 20 0 EIADMP CC(C)COc1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001192323742 1051691659 /nfs/dbraw/zinc/69/16/59/1051691659.db2.gz FCNKMXJVYXYQAC-KNQAVFIVSA-N 2 1 342.527 4.170 20 0 EIADMP CC(C)COc1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001192323742 1051691670 /nfs/dbraw/zinc/69/16/70/1051691670.db2.gz FCNKMXJVYXYQAC-KNQAVFIVSA-N 2 1 342.527 4.170 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000158109680 1051712773 /nfs/dbraw/zinc/71/27/73/1051712773.db2.gz STNZCQWGZNPLOD-CABCVRRESA-N 2 1 348.437 4.434 20 0 EIADMP COc1ccccc1-c1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000158142511 1051720067 /nfs/dbraw/zinc/72/00/67/1051720067.db2.gz BJFQOAQJUJBIEY-ZWKOTPCHSA-N 2 1 338.495 4.355 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC(NC[C@@H]2CC[N@H+]2C2CCCCC2)CC1 ZINC001182918236 1051745723 /nfs/dbraw/zinc/74/57/23/1051745723.db2.gz KMLSZNISQLRKIH-BVYCBKJFSA-N 2 1 347.591 4.026 20 0 EIADMP CCC1([NH+]2CCCCC2)CC[NH+](C[C@H]2CC3(CO2)CCCCC3)CC1 ZINC001175768661 1051775801 /nfs/dbraw/zinc/77/58/01/1051775801.db2.gz MXAYDWJPLRDEQF-HXUWFJFHSA-N 2 1 348.575 4.456 20 0 EIADMP COCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000159082835 1051810357 /nfs/dbraw/zinc/81/03/57/1051810357.db2.gz YMCWTSIPGJNTDX-ZDUSSCGKSA-N 2 1 345.314 4.145 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC001183281083 1051813294 /nfs/dbraw/zinc/81/32/94/1051813294.db2.gz LQUNGGYLYYEMQN-SXWKCWPCSA-N 2 1 336.523 4.284 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)ccc1OC1CCCC1 ZINC000159265327 1051967922 /nfs/dbraw/zinc/96/79/22/1051967922.db2.gz MEDWPNXLJCHCMB-RYRKJORJSA-N 2 1 346.515 4.150 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1OC1CCCC1 ZINC000159265327 1051967933 /nfs/dbraw/zinc/96/79/33/1051967933.db2.gz MEDWPNXLJCHCMB-RYRKJORJSA-N 2 1 346.515 4.150 20 0 EIADMP CC(C)(C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)C1CCC1 ZINC000716731041 1051980433 /nfs/dbraw/zinc/98/04/33/1051980433.db2.gz JFDWZDGUZJSWDB-TYPHKJRUSA-N 2 1 326.528 4.455 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)c2ccccc12 ZINC000164616514 1052035071 /nfs/dbraw/zinc/03/50/71/1052035071.db2.gz PMSWFLUUDKOVSS-INIZCTEOSA-N 2 1 337.467 4.484 20 0 EIADMP CCc1c[nH]c2nc[nH+]c(NCc3ccccc3C[NH+]3CCCCC3)c12 ZINC001184658608 1052075807 /nfs/dbraw/zinc/07/58/07/1052075807.db2.gz FBTKSTZQZDNVDR-UHFFFAOYSA-N 2 1 349.482 4.118 20 0 EIADMP Cc1cc(C)c(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c(C)n1 ZINC001194270454 1052123343 /nfs/dbraw/zinc/12/33/43/1052123343.db2.gz XAJMMXKIDCGJKQ-HSZRJFAPSA-N 2 1 349.522 4.105 20 0 EIADMP Cc1cc(C)c(C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c(C)n1 ZINC001194270454 1052123350 /nfs/dbraw/zinc/12/33/50/1052123350.db2.gz XAJMMXKIDCGJKQ-HSZRJFAPSA-N 2 1 349.522 4.105 20 0 EIADMP Cc1cc(C)c(C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)c(C)n1 ZINC001194270454 1052123355 /nfs/dbraw/zinc/12/33/55/1052123355.db2.gz XAJMMXKIDCGJKQ-HSZRJFAPSA-N 2 1 349.522 4.105 20 0 EIADMP Cc1cc(C)c(C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c(C)n1 ZINC001194270454 1052123362 /nfs/dbraw/zinc/12/33/62/1052123362.db2.gz XAJMMXKIDCGJKQ-HSZRJFAPSA-N 2 1 349.522 4.105 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC(C)(C)[C@@H](c2ccccc2)C1 ZINC001176567067 1052133724 /nfs/dbraw/zinc/13/37/24/1052133724.db2.gz GURAHEMQQMICAJ-HXUWFJFHSA-N 2 1 325.500 4.487 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC(C)(C)[C@@H](c2ccccc2)C1 ZINC001176567067 1052133732 /nfs/dbraw/zinc/13/37/32/1052133732.db2.gz GURAHEMQQMICAJ-HXUWFJFHSA-N 2 1 325.500 4.487 20 0 EIADMP C[NH+](C)CCC[NH2+]Cc1ccccc1Oc1ccc(F)c(Cl)c1 ZINC001177081787 1052219801 /nfs/dbraw/zinc/21/98/01/1052219801.db2.gz OXAOOTYSAZDJOY-UHFFFAOYSA-N 2 1 336.838 4.313 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cccc2n[nH]cc21 ZINC000623358199 1052630830 /nfs/dbraw/zinc/63/08/30/1052630830.db2.gz SSWQEXIIXIDHIE-KRWDZBQOSA-N 2 1 348.494 4.227 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1OC(F)F ZINC000623355782 1052633971 /nfs/dbraw/zinc/63/39/71/1052633971.db2.gz VMTZTEDGFVVVFN-ZFWWWQNUSA-N 2 1 326.431 4.202 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1OC(F)F ZINC000623355782 1052633976 /nfs/dbraw/zinc/63/39/76/1052633976.db2.gz VMTZTEDGFVVVFN-ZFWWWQNUSA-N 2 1 326.431 4.202 20 0 EIADMP CC(C)OCC[NH+]1CCC([NH2+][C@@H](C)c2cccc3ccccc32)CC1 ZINC000177485902 1052677643 /nfs/dbraw/zinc/67/76/43/1052677643.db2.gz ARZHOEGWPIYKRJ-SFHVURJKSA-N 2 1 340.511 4.380 20 0 EIADMP CO[C@@H](C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccccc1 ZINC000178458168 1052705812 /nfs/dbraw/zinc/70/58/12/1052705812.db2.gz YHSQQJFIAILUPY-IERDGZPVSA-N 2 1 335.451 4.219 20 0 EIADMP FC(F)(F)C1(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CCCC1 ZINC000623786954 1052804584 /nfs/dbraw/zinc/80/45/84/1052804584.db2.gz RTGIELMWGXKYJV-UHFFFAOYSA-N 2 1 340.433 4.363 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000180550201 1052808074 /nfs/dbraw/zinc/80/80/74/1052808074.db2.gz UMPKNYHHUMCYPD-MRXNPFEDSA-N 2 1 343.368 4.394 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cc(Br)ccc1C ZINC000623867593 1052825932 /nfs/dbraw/zinc/82/59/32/1052825932.db2.gz FMPGFFGBQMRVDY-ZDUSSCGKSA-N 2 1 336.277 4.003 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623855151 1052826968 /nfs/dbraw/zinc/82/69/68/1052826968.db2.gz RFSWLMUTRJQTCO-QGZVFWFLSA-N 2 1 329.513 4.152 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(F)cc2C(F)(F)F)CC1 ZINC000623908330 1052836047 /nfs/dbraw/zinc/83/60/47/1052836047.db2.gz XSVCNOFXOHHLAO-GFCCVEGCSA-N 2 1 332.385 4.368 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000623999527 1052849912 /nfs/dbraw/zinc/84/99/12/1052849912.db2.gz SXFVBWIXIZANPC-STQMWFEESA-N 2 1 332.385 4.227 20 0 EIADMP COc1ccccc1[C@H](CC(C)C)[NH2+]CCCCn1cc[nH+]c1C ZINC000181698960 1052893705 /nfs/dbraw/zinc/89/37/05/1052893705.db2.gz NQMJMRKGJLSFPB-IBGZPJMESA-N 2 1 329.488 4.357 20 0 EIADMP C[NH+](C)C1(C[NH2+][C@@H](c2ccccc2)C2CCCCC2)CCOCC1 ZINC000183278589 1052968665 /nfs/dbraw/zinc/96/86/65/1052968665.db2.gz PEBAZDVYIFSUPR-FQEVSTJZSA-N 2 1 330.516 4.008 20 0 EIADMP Fc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000380899468 1053047096 /nfs/dbraw/zinc/04/70/96/1053047096.db2.gz FIQRJAWLZHIJBK-KRWDZBQOSA-N 2 1 332.850 4.091 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@H]3CCCSCC3)cc2)CC1 ZINC000850456402 1053234417 /nfs/dbraw/zinc/23/44/17/1053234417.db2.gz FJWDEHAUDFZDTC-SFHVURJKSA-N 2 1 347.572 4.162 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C1CCN(c3cccc(C)[nH+]3)CC1)CCC2 ZINC000339067098 1053241064 /nfs/dbraw/zinc/24/10/64/1053241064.db2.gz FUGZYYREOQJUCU-NRFANRHFSA-N 2 1 335.495 4.334 20 0 EIADMP COC1([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000850470608 1053248861 /nfs/dbraw/zinc/24/88/61/1053248861.db2.gz GAIMRDDYZRJUQQ-LBFURVHYSA-N 2 1 342.527 4.119 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccc(C[NH+](C)CCC(C)(C)C)cc2)C[C@H](C)O1 ZINC001195651937 1053455682 /nfs/dbraw/zinc/45/56/82/1053455682.db2.gz ZZCLOEJBYFFFNI-HDICACEKSA-N 2 1 332.532 4.164 20 0 EIADMP C[C@@H]1C[NH+](Cc2ccc(C[N@H+](C)CCC(C)(C)C)cc2)C[C@H](C)O1 ZINC001195651937 1053455690 /nfs/dbraw/zinc/45/56/90/1053455690.db2.gz ZZCLOEJBYFFFNI-HDICACEKSA-N 2 1 332.532 4.164 20 0 EIADMP C[C@@H]1C[NH+](Cc2ccc(C[N@@H+](C)CCC(C)(C)C)cc2)C[C@H](C)O1 ZINC001195651937 1053455701 /nfs/dbraw/zinc/45/57/01/1053455701.db2.gz ZZCLOEJBYFFFNI-HDICACEKSA-N 2 1 332.532 4.164 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](CC2CC2)c2ccccc2)cn1 ZINC000765250260 1053475766 /nfs/dbraw/zinc/47/57/66/1053475766.db2.gz IGDMJTYOZAWZDG-FQEVSTJZSA-N 2 1 332.451 4.207 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cnc(Cl)c(F)c2)c1 ZINC000865433135 1053504295 /nfs/dbraw/zinc/50/42/95/1053504295.db2.gz FXKUMKQXKOUHMA-UHFFFAOYSA-N 2 1 335.854 4.004 20 0 EIADMP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2c(Cl)cncc2Cl)c1 ZINC000865451757 1053511967 /nfs/dbraw/zinc/51/19/67/1053511967.db2.gz YSVWOUTUABWPQL-UHFFFAOYSA-N 2 1 338.282 4.130 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2c(Cl)cncc2Cl)c1 ZINC000865451757 1053511979 /nfs/dbraw/zinc/51/19/79/1053511979.db2.gz YSVWOUTUABWPQL-UHFFFAOYSA-N 2 1 338.282 4.130 20 0 EIADMP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000765450258 1053549524 /nfs/dbraw/zinc/54/95/24/1053549524.db2.gz PBYNWNYEOWEPQC-HKUYNNGSSA-N 2 1 334.573 4.408 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccnc(Cl)c1 ZINC000765449394 1053551903 /nfs/dbraw/zinc/55/19/03/1053551903.db2.gz JJJAPKMQMWUBKW-FUHWJXTLSA-N 2 1 343.902 4.298 20 0 EIADMP CC(C)([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)[C@@H]1CCCCO1 ZINC000865743939 1053583980 /nfs/dbraw/zinc/58/39/80/1053583980.db2.gz KERHMOIRVNPYTN-UXHICEINSA-N 2 1 342.527 4.121 20 0 EIADMP CC(C)([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)[C@@H]1CCCCO1 ZINC000865743939 1053583987 /nfs/dbraw/zinc/58/39/87/1053583987.db2.gz KERHMOIRVNPYTN-UXHICEINSA-N 2 1 342.527 4.121 20 0 EIADMP Fc1cccc2c1SCC[C@@H]2[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000853239141 1053655825 /nfs/dbraw/zinc/65/58/25/1053655825.db2.gz ATHQDANHRUPJMJ-QAPCUYQASA-N 2 1 334.504 4.074 20 0 EIADMP Fc1cccc2c1SCC[C@@H]2[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000853239141 1053655831 /nfs/dbraw/zinc/65/58/31/1053655831.db2.gz ATHQDANHRUPJMJ-QAPCUYQASA-N 2 1 334.504 4.074 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)C1 ZINC000866259793 1053666426 /nfs/dbraw/zinc/66/64/26/1053666426.db2.gz GBNVVNLCWDFRAO-ZIAGYGMSSA-N 2 1 335.879 4.252 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)C1 ZINC000866259793 1053666437 /nfs/dbraw/zinc/66/64/37/1053666437.db2.gz GBNVVNLCWDFRAO-ZIAGYGMSSA-N 2 1 335.879 4.252 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)CCc2cncc3ccccc32)C1 ZINC000866260912 1053666902 /nfs/dbraw/zinc/66/69/02/1053666902.db2.gz PHORDZFIMHHLHA-RBUKOAKNSA-N 2 1 339.527 4.266 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cccc(OC)c1OC ZINC000866289516 1053678473 /nfs/dbraw/zinc/67/84/73/1053678473.db2.gz HOKWLOFJEFMACJ-KRWDZBQOSA-N 2 1 334.504 4.007 20 0 EIADMP CCOc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000386416508 1053712976 /nfs/dbraw/zinc/71/29/76/1053712976.db2.gz YTOLFOWGZUAATJ-GHTZIAJQSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@@]1(C)C[NH+](CC1CCCCC1)C2 ZINC001196962259 1053814213 /nfs/dbraw/zinc/81/42/13/1053814213.db2.gz PZWZQYNMLPJBRQ-VXKWHMMOSA-N 2 1 326.528 4.411 20 0 EIADMP CC(C)C[N@H+](Cc1cc(Cl)ccc1F)CC1CC[NH+](C)CC1 ZINC001197194253 1053850593 /nfs/dbraw/zinc/85/05/93/1053850593.db2.gz KOKYIJZXZRLMAK-UHFFFAOYSA-N 2 1 326.887 4.279 20 0 EIADMP CC(C)C[N@H+](Cc1cnc(-c2ccccc2)o1)CC1CC[NH+](C)CC1 ZINC001197194523 1053851292 /nfs/dbraw/zinc/85/12/92/1053851292.db2.gz PGIQYXSTVHVWRK-UHFFFAOYSA-N 2 1 341.499 4.141 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]CCc2ccc(C(C)C)cc2)cn1 ZINC000122236500 1053921160 /nfs/dbraw/zinc/92/11/60/1053921160.db2.gz HWTMLFYJUHHXKC-UHFFFAOYSA-N 2 1 334.467 4.031 20 0 EIADMP c1ccc(C[NH+]2CCC[N@@H+](CC3CCCCCC3)CCOCC2)cc1 ZINC001198141280 1054078524 /nfs/dbraw/zinc/07/85/24/1054078524.db2.gz YLBQXDJTVQETHI-UHFFFAOYSA-N 2 1 344.543 4.181 20 0 EIADMP c1ccc(C[NH+]2CCC[N@H+](CC3CCCCCC3)CCOCC2)cc1 ZINC001198141280 1054078540 /nfs/dbraw/zinc/07/85/40/1054078540.db2.gz YLBQXDJTVQETHI-UHFFFAOYSA-N 2 1 344.543 4.181 20 0 EIADMP c1ccc(C[N@H+]2CCC[NH+](CC3CCCCCC3)CCOCC2)cc1 ZINC001198141280 1054078556 /nfs/dbraw/zinc/07/85/56/1054078556.db2.gz YLBQXDJTVQETHI-UHFFFAOYSA-N 2 1 344.543 4.181 20 0 EIADMP c1ccc(C[N@@H+]2CCC[NH+](CC3CCCCCC3)CCOCC2)cc1 ZINC001198141280 1054078574 /nfs/dbraw/zinc/07/85/74/1054078574.db2.gz YLBQXDJTVQETHI-UHFFFAOYSA-N 2 1 344.543 4.181 20 0 EIADMP CC(C)[N@@H+](C)Cc1cc(O[C@@H]2CC[NH+](C[C@H](C)C(C)(C)C)C2)ccn1 ZINC000856558419 1054085684 /nfs/dbraw/zinc/08/56/84/1054085684.db2.gz IGNGOVBHKKLAIH-FXAWDEMLSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@@H]2CC[N@H+](C[C@H](C)C(C)(C)C)C2)ccn1 ZINC000856558419 1054085697 /nfs/dbraw/zinc/08/56/97/1054085697.db2.gz IGNGOVBHKKLAIH-FXAWDEMLSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@@H]2CC[N@@H+](C[C@H](C)C(C)(C)C)C2)ccn1 ZINC000856558419 1054085711 /nfs/dbraw/zinc/08/57/11/1054085711.db2.gz IGNGOVBHKKLAIH-FXAWDEMLSA-N 2 1 347.547 4.057 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccn(C)n1 ZINC000542670291 1054187575 /nfs/dbraw/zinc/18/75/75/1054187575.db2.gz JBWULFXDOAPWJE-PXNSSMCTSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1ccn(C)n1 ZINC000542670291 1054187585 /nfs/dbraw/zinc/18/75/85/1054187585.db2.gz JBWULFXDOAPWJE-PXNSSMCTSA-N 2 1 340.515 4.035 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+]Cc1ccc(Br)cc1 ZINC001198892069 1054302759 /nfs/dbraw/zinc/30/27/59/1054302759.db2.gz TZLDMCDAWVNSSJ-UHFFFAOYSA-N 2 1 327.310 4.051 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1ccc(OCC2CC2)cc1)C1CCCCC1 ZINC001198918202 1054305129 /nfs/dbraw/zinc/30/51/29/1054305129.db2.gz JCQYKALESAHGKM-UHFFFAOYSA-N 2 1 330.516 4.220 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1ccc(OCC2CC2)cc1)C1CCCCC1 ZINC001198918202 1054305146 /nfs/dbraw/zinc/30/51/46/1054305146.db2.gz JCQYKALESAHGKM-UHFFFAOYSA-N 2 1 330.516 4.220 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cccc(O)c1F ZINC000872021965 1054337800 /nfs/dbraw/zinc/33/78/00/1054337800.db2.gz HACLAVIUFWOOAG-HNNXBMFYSA-N 2 1 330.447 4.222 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cccc(O)c1F ZINC000872021965 1054337804 /nfs/dbraw/zinc/33/78/04/1054337804.db2.gz HACLAVIUFWOOAG-HNNXBMFYSA-N 2 1 330.447 4.222 20 0 EIADMP CCCOc1cccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC001199320036 1054390604 /nfs/dbraw/zinc/39/06/04/1054390604.db2.gz HAGSUXFCMGHING-KDURUIRLSA-N 2 1 332.532 4.323 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)CC1(C)C ZINC000858123188 1054419975 /nfs/dbraw/zinc/41/99/75/1054419975.db2.gz YXFWCBHVROGJPD-OAHLLOKOSA-N 2 1 326.406 4.157 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)CC1(C)C ZINC000858123188 1054419982 /nfs/dbraw/zinc/41/99/82/1054419982.db2.gz YXFWCBHVROGJPD-OAHLLOKOSA-N 2 1 326.406 4.157 20 0 EIADMP COc1ccc(-c2ccccc2C)cc1C[NH2+][C@@H](C)CC[NH+](C)C ZINC001199907471 1054487316 /nfs/dbraw/zinc/48/73/16/1054487316.db2.gz XAYBTGNAWZFHPQ-KRWDZBQOSA-N 2 1 326.484 4.100 20 0 EIADMP [NH3+][C@H](C[C@@H]1CCC[N@@H+](Cc2cnc(C3CC3)s2)C1)C1CCCC1 ZINC000873232526 1054509974 /nfs/dbraw/zinc/50/99/74/1054509974.db2.gz SDZZWXWQRPDLKB-KBXCAEBGSA-N 2 1 333.545 4.140 20 0 EIADMP Cc1ccc2ncc(C[N@H+](C)Cc3ccc(C[NH+](C)C)cc3)cc2c1 ZINC000859213340 1054644683 /nfs/dbraw/zinc/64/46/83/1054644683.db2.gz WCMLZLIUPRLSMC-UHFFFAOYSA-N 2 1 333.479 4.237 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(-c3ccccc3)no2)cc1 ZINC000859214579 1054645725 /nfs/dbraw/zinc/64/57/25/1054645725.db2.gz KXGCLARJYUGQBN-UHFFFAOYSA-N 2 1 335.451 4.035 20 0 EIADMP COc1cc(NC2=C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[nH+]cc1C ZINC001201474644 1054827811 /nfs/dbraw/zinc/82/78/11/1054827811.db2.gz ISVBJYFNMZURFR-MOPGFXCFSA-N 2 1 335.451 4.131 20 0 EIADMP CCC[C@@H](C)C[NH+]1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001201543839 1054837374 /nfs/dbraw/zinc/83/73/74/1054837374.db2.gz LBXRLFACSMYEEQ-GOSISDBHSA-N 2 1 329.532 4.194 20 0 EIADMP CCC(CC)C[N@@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201528635 1054845575 /nfs/dbraw/zinc/84/55/75/1054845575.db2.gz VFZSXAINRAPSLZ-SESVDKBCSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201528635 1054845578 /nfs/dbraw/zinc/84/55/78/1054845578.db2.gz VFZSXAINRAPSLZ-SESVDKBCSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201528635 1054845581 /nfs/dbraw/zinc/84/55/81/1054845581.db2.gz VFZSXAINRAPSLZ-SESVDKBCSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201528635 1054845584 /nfs/dbraw/zinc/84/55/84/1054845584.db2.gz VFZSXAINRAPSLZ-SESVDKBCSA-N 2 1 329.532 4.050 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2)C1 ZINC001201559507 1054849068 /nfs/dbraw/zinc/84/90/68/1054849068.db2.gz ZEHIOMAJVAETLB-MRXNPFEDSA-N 2 1 328.422 4.163 20 0 EIADMP C[C@H]([NH2+]Cc1cnc(C(C)(C)C)s1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201947394 1054963579 /nfs/dbraw/zinc/96/35/79/1054963579.db2.gz XFXBOSZVEYFKHJ-LSDHHAIUSA-N 2 1 335.561 4.183 20 0 EIADMP C[C@H]([NH2+]Cc1cnc(C(C)(C)C)s1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001201947394 1054963590 /nfs/dbraw/zinc/96/35/90/1054963590.db2.gz XFXBOSZVEYFKHJ-LSDHHAIUSA-N 2 1 335.561 4.183 20 0 EIADMP CS[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000877070926 1055010634 /nfs/dbraw/zinc/01/06/34/1055010634.db2.gz YVAQTJYWMDZCNL-XEYPJELSSA-N 2 1 330.541 4.228 20 0 EIADMP CS[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000877070926 1055010649 /nfs/dbraw/zinc/01/06/49/1055010649.db2.gz YVAQTJYWMDZCNL-XEYPJELSSA-N 2 1 330.541 4.228 20 0 EIADMP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000877070924 1055012384 /nfs/dbraw/zinc/01/23/84/1055012384.db2.gz YVAQTJYWMDZCNL-ONCXSQPRSA-N 2 1 330.541 4.228 20 0 EIADMP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000877070924 1055012397 /nfs/dbraw/zinc/01/23/97/1055012397.db2.gz YVAQTJYWMDZCNL-ONCXSQPRSA-N 2 1 330.541 4.228 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[NH+](CCC(C)(C)C)C[C@H]21 ZINC001202079159 1055020129 /nfs/dbraw/zinc/02/01/29/1055020129.db2.gz XUYMFHPOHPYNLZ-DFQSSKMNSA-N 2 1 329.532 4.050 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[NH+](CCC(C)(C)C)C[C@H]21 ZINC001202079159 1055020141 /nfs/dbraw/zinc/02/01/41/1055020141.db2.gz XUYMFHPOHPYNLZ-DFQSSKMNSA-N 2 1 329.532 4.050 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[N@H+](CCC(C)(C)C)C[C@H]21 ZINC001202079159 1055020154 /nfs/dbraw/zinc/02/01/54/1055020154.db2.gz XUYMFHPOHPYNLZ-DFQSSKMNSA-N 2 1 329.532 4.050 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[N@@H+](CCC(C)(C)C)C[C@H]21 ZINC001202079159 1055020169 /nfs/dbraw/zinc/02/01/69/1055020169.db2.gz XUYMFHPOHPYNLZ-DFQSSKMNSA-N 2 1 329.532 4.050 20 0 EIADMP Cc1c(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)ccnc1F ZINC000862270820 1055041255 /nfs/dbraw/zinc/04/12/55/1055041255.db2.gz TTZDLMNGLMUVBP-MRXNPFEDSA-N 2 1 341.474 4.193 20 0 EIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3csc(C(F)(F)F)c3)C2)CC1 ZINC000862352446 1055051697 /nfs/dbraw/zinc/05/16/97/1055051697.db2.gz HJDOHBQWDQUUGL-UHFFFAOYSA-N 2 1 332.435 4.075 20 0 EIADMP Cc1cc([NH+]2CCCCCC2)ccc1N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000671766316 1055072246 /nfs/dbraw/zinc/07/22/46/1055072246.db2.gz CWVSLAHOOGJBMC-OALUTQOASA-N 2 1 327.516 4.414 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CC[C@@H]3CCSC3)CC[N@@H+]2C2CC2)cc1 ZINC000877661545 1055101513 /nfs/dbraw/zinc/10/15/13/1055101513.db2.gz DTLXRJAVMCMWGO-KPFFTGBYSA-N 2 1 330.541 4.087 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CC[C@@H]3CCSC3)CC[N@H+]2C2CC2)cc1 ZINC000877661545 1055101522 /nfs/dbraw/zinc/10/15/22/1055101522.db2.gz DTLXRJAVMCMWGO-KPFFTGBYSA-N 2 1 330.541 4.087 20 0 EIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](CCC(F)(F)F)C[C@@H]21 ZINC001202328548 1055142642 /nfs/dbraw/zinc/14/26/42/1055142642.db2.gz HNJRBGOQNWHGLN-CWRNSKLLSA-N 2 1 346.462 4.233 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@H+](CCC(F)(F)F)C[C@@H]21 ZINC001202328548 1055142649 /nfs/dbraw/zinc/14/26/49/1055142649.db2.gz HNJRBGOQNWHGLN-CWRNSKLLSA-N 2 1 346.462 4.233 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@@H+](CCC(F)(F)F)C[C@@H]21 ZINC001202328548 1055142655 /nfs/dbraw/zinc/14/26/55/1055142655.db2.gz HNJRBGOQNWHGLN-CWRNSKLLSA-N 2 1 346.462 4.233 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccnc(Cl)c1 ZINC000126844183 1055176952 /nfs/dbraw/zinc/17/69/52/1055176952.db2.gz PPVULDUTGGKNCS-GJZGRUSLSA-N 2 1 349.931 4.359 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccnc(Cl)c1 ZINC000126844183 1055176958 /nfs/dbraw/zinc/17/69/58/1055176958.db2.gz PPVULDUTGGKNCS-GJZGRUSLSA-N 2 1 349.931 4.359 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000850035895 1055328021 /nfs/dbraw/zinc/32/80/21/1055328021.db2.gz FMBUSYJQVGODEI-UHFFFAOYSA-N 2 1 343.540 4.471 20 0 EIADMP Cc1cc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)ccc1Oc1cccnc1 ZINC000623656529 1055526631 /nfs/dbraw/zinc/52/66/31/1055526631.db2.gz WFPBPVXGNAXWRB-IBGZPJMESA-N 2 1 339.483 4.004 20 0 EIADMP C[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1cncs1 ZINC000903312415 1055573153 /nfs/dbraw/zinc/57/31/53/1055573153.db2.gz VQDUIQLAXQGPMM-FAEJEUNOSA-N 2 1 329.513 4.237 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474473025 1055884410 /nfs/dbraw/zinc/88/44/10/1055884410.db2.gz PLWYKDMHWRBJGI-KCNJBTMXSA-N 2 1 331.426 4.174 20 0 EIADMP C[C@H]([NH2+]CCCc1cccs1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000542818644 1056119208 /nfs/dbraw/zinc/11/92/08/1056119208.db2.gz XZRXJUXHEZVART-PKOBYXMFSA-N 2 1 328.525 4.181 20 0 EIADMP CSC[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(C(F)(F)F)cc1 ZINC000542844125 1056221752 /nfs/dbraw/zinc/22/17/52/1056221752.db2.gz NNMVDUYNLWJBND-MRXNPFEDSA-N 2 1 346.462 4.185 20 0 EIADMP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000180143853 1058379906 /nfs/dbraw/zinc/37/99/06/1058379906.db2.gz FXFACPCRCAEDRM-BBWFWOEESA-N 2 1 340.515 4.047 20 0 EIADMP S=c1ccn(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c2ccccc12 ZINC000742169646 1058530696 /nfs/dbraw/zinc/53/06/96/1058530696.db2.gz FHXFYZAWNQJYBT-QGZVFWFLSA-N 2 1 341.524 4.136 20 0 EIADMP c1cc2cnccc2c(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000183252256 1059964710 /nfs/dbraw/zinc/96/47/10/1059964710.db2.gz ZFRZTBFKYPXKPJ-IBGZPJMESA-N 2 1 337.511 4.323 20 0 EIADMP C[C@@H]1CCCC[C@@H]1C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001168825268 1060430471 /nfs/dbraw/zinc/43/04/71/1060430471.db2.gz HRUOHJMONODKKW-UYAOXDASSA-N 2 1 329.532 4.446 20 0 EIADMP [NH3+]Cc1ccc2ncn(-c3cc[nH+]c4ccc(C(F)(F)F)cc43)c2c1 ZINC001168848274 1060483450 /nfs/dbraw/zinc/48/34/50/1060483450.db2.gz TYDJFRZVCWPFPO-UHFFFAOYSA-N 2 1 342.324 4.051 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCCc1ccc(Cl)cc1Cl)C2 ZINC001169101883 1060635903 /nfs/dbraw/zinc/63/59/03/1060635903.db2.gz VXDDJCCFSFWRMG-PHZGNYQRSA-N 2 1 327.299 4.141 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CC(C)(c1ccccc1)c1ccccc1)C2 ZINC001169089555 1060644788 /nfs/dbraw/zinc/64/47/88/1060644788.db2.gz CPVBCJOHMCNHSX-KOUNCHBCSA-N 2 1 334.507 4.207 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+](CCc1ccccc1)Cc1ccccc1)C2 ZINC001169148094 1060666720 /nfs/dbraw/zinc/66/67/20/1060666720.db2.gz YPZWHUWNCUQCLC-JKHIJQBDSA-N 2 1 334.507 4.357 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+](CCc1ccccc1)Cc1ccccc1)C2 ZINC001169148094 1060666724 /nfs/dbraw/zinc/66/67/24/1060666724.db2.gz YPZWHUWNCUQCLC-JKHIJQBDSA-N 2 1 334.507 4.357 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+](CCc1ccccc1)Cc1ccccc1)C2 ZINC001169148094 1060666732 /nfs/dbraw/zinc/66/67/32/1060666732.db2.gz YPZWHUWNCUQCLC-JKHIJQBDSA-N 2 1 334.507 4.357 20 0 EIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169154948 1060670427 /nfs/dbraw/zinc/67/04/27/1060670427.db2.gz VBBSRQTUACIPOC-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP CC[NH+](Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169154948 1060670435 /nfs/dbraw/zinc/67/04/35/1060670435.db2.gz VBBSRQTUACIPOC-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP CC[NH+](Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169154948 1060670444 /nfs/dbraw/zinc/67/04/44/1060670444.db2.gz VBBSRQTUACIPOC-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154260 1060670684 /nfs/dbraw/zinc/67/06/84/1060670684.db2.gz PCDDHHYQTQGNMG-MHORFTMASA-N 2 1 338.417 4.468 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154260 1060670690 /nfs/dbraw/zinc/67/06/90/1060670690.db2.gz PCDDHHYQTQGNMG-MHORFTMASA-N 2 1 338.417 4.468 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154260 1060670699 /nfs/dbraw/zinc/67/06/99/1060670699.db2.gz PCDDHHYQTQGNMG-MHORFTMASA-N 2 1 338.417 4.468 20 0 EIADMP C[C@H](c1cccc(Br)c1)[N@@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169162480 1060674195 /nfs/dbraw/zinc/67/41/95/1060674195.db2.gz TZKBJVHQKJIXTQ-VDNDLQMASA-N 2 1 337.305 4.067 20 0 EIADMP CCC[N@H+](Cc1cccc(Br)c1)C1CC[NH+](CC)CC1 ZINC001169265737 1060714307 /nfs/dbraw/zinc/71/43/07/1060714307.db2.gz QYKPVLOUAVNBPW-UHFFFAOYSA-N 2 1 339.321 4.145 20 0 EIADMP CCC[N@@H+](Cc1cccc(Br)c1)C1CC[NH+](CC)CC1 ZINC001169265737 1060714338 /nfs/dbraw/zinc/71/43/38/1060714338.db2.gz QYKPVLOUAVNBPW-UHFFFAOYSA-N 2 1 339.321 4.145 20 0 EIADMP CC[NH+]1CCC([NH2+]C(C)(C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001169240847 1060717067 /nfs/dbraw/zinc/71/70/67/1060717067.db2.gz DUYKAZCKJAJLHQ-UHFFFAOYSA-N 2 1 328.422 4.100 20 0 EIADMP CC[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC001169261443 1060727460 /nfs/dbraw/zinc/72/74/60/1060727460.db2.gz FWHMNHYLYFPTOP-KRWDZBQOSA-N 2 1 326.406 4.327 20 0 EIADMP CC[NH+]1CCC([N@H+]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC001169261443 1060727486 /nfs/dbraw/zinc/72/74/86/1060727486.db2.gz FWHMNHYLYFPTOP-KRWDZBQOSA-N 2 1 326.406 4.327 20 0 EIADMP C[C@H]1C[N@@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CCC[C@@H]1C[NH3+] ZINC001206011911 1060841647 /nfs/dbraw/zinc/84/16/47/1060841647.db2.gz HANOUXUPGYBENU-WCQYABFASA-N 2 1 334.813 4.166 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CCC[C@@H]1C[NH3+] ZINC001206011910 1060842602 /nfs/dbraw/zinc/84/26/02/1060842602.db2.gz HANOUXUPGYBENU-DGCLKSJQSA-N 2 1 334.813 4.166 20 0 EIADMP Cc1ccccc1CCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC001169566943 1060859921 /nfs/dbraw/zinc/85/99/21/1060859921.db2.gz KUAROABLZDJOEM-REWPJTCUSA-N 2 1 336.523 4.428 20 0 EIADMP Cc1ccccc1CCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001169566943 1060859928 /nfs/dbraw/zinc/85/99/28/1060859928.db2.gz KUAROABLZDJOEM-REWPJTCUSA-N 2 1 336.523 4.428 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ccc([C@H]2CC[N@H+](C)C2)cc1 ZINC001169690534 1060902574 /nfs/dbraw/zinc/90/25/74/1060902574.db2.gz WSWYFEDAXUMUDI-RXVVDRJESA-N 2 1 335.495 4.346 20 0 EIADMP C[N@H+]1CCC[C@H]1CCN1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370737 1061215515 /nfs/dbraw/zinc/21/55/15/1061215515.db2.gz DTVZWJPXPHGDJA-YOEHRIQHSA-N 2 1 326.406 4.327 20 0 EIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370737 1061215535 /nfs/dbraw/zinc/21/55/35/1061215535.db2.gz DTVZWJPXPHGDJA-YOEHRIQHSA-N 2 1 326.406 4.327 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370737 1061215552 /nfs/dbraw/zinc/21/55/52/1061215552.db2.gz DTVZWJPXPHGDJA-YOEHRIQHSA-N 2 1 326.406 4.327 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370737 1061215569 /nfs/dbraw/zinc/21/55/69/1061215569.db2.gz DTVZWJPXPHGDJA-YOEHRIQHSA-N 2 1 326.406 4.327 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370737 1061215585 /nfs/dbraw/zinc/21/55/85/1061215585.db2.gz DTVZWJPXPHGDJA-YOEHRIQHSA-N 2 1 326.406 4.327 20 0 EIADMP CC(C)=CCOc1ccc(CC[C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000532225971 1032103054 /nfs/dbraw/zinc/10/30/54/1032103054.db2.gz GIPOACTXIFXJGR-TZIWHRDSSA-N 2 1 344.543 4.284 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000532225075 1032103214 /nfs/dbraw/zinc/10/32/14/1032103214.db2.gz KFTFQOYVURGCFD-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2cccc(F)c2)CC[N@@H+]1C ZINC000532226298 1032107763 /nfs/dbraw/zinc/10/77/63/1032107763.db2.gz WFIQHIDZCUJWOM-YJBOKZPZSA-N 2 1 328.431 4.190 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2cccc(F)c2)CC[N@H+]1C ZINC000532226298 1032107777 /nfs/dbraw/zinc/10/77/77/1032107777.db2.gz WFIQHIDZCUJWOM-YJBOKZPZSA-N 2 1 328.431 4.190 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1OC ZINC000310781984 1032240671 /nfs/dbraw/zinc/24/06/71/1032240671.db2.gz PBFKQCDJZCZOOK-NRFANRHFSA-N 2 1 338.495 4.401 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000532967766 1032418037 /nfs/dbraw/zinc/41/80/37/1032418037.db2.gz UKONXNOPNFOVJY-NVXWUHKLSA-N 2 1 338.442 4.299 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000532967766 1032418044 /nfs/dbraw/zinc/41/80/44/1032418044.db2.gz UKONXNOPNFOVJY-NVXWUHKLSA-N 2 1 338.442 4.299 20 0 EIADMP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)C1CC(F)(F)C1 ZINC000529547952 1032438858 /nfs/dbraw/zinc/43/88/58/1032438858.db2.gz ZHAGYXRYZAPTAB-OLMMMNRUSA-N 2 1 336.470 4.166 20 0 EIADMP C[C@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)C1CC(F)(F)C1 ZINC000529547950 1032440239 /nfs/dbraw/zinc/44/02/39/1032440239.db2.gz ZHAGYXRYZAPTAB-CYJAXWMASA-N 2 1 336.470 4.166 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529575083 1032455455 /nfs/dbraw/zinc/45/54/55/1032455455.db2.gz PTTVBMCICXBFGK-FUHWJXTLSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@@H](c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427246 1032487202 /nfs/dbraw/zinc/48/72/02/1032487202.db2.gz FFOPRUKBJWKTEV-RDJZCZTQSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427246 1032487215 /nfs/dbraw/zinc/48/72/15/1032487215.db2.gz FFOPRUKBJWKTEV-RDJZCZTQSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)cc1)C(F)(F)F ZINC000450431105 1032494927 /nfs/dbraw/zinc/49/49/27/1032494927.db2.gz XPOJINKSSNXVRP-GDBMZVCRSA-N 2 1 328.422 4.126 20 0 EIADMP C[C@H](c1ccc(C[NH+](C)C[C@@H]2CCC[N@@H+](C)C2)cc1)C(F)(F)F ZINC000450431105 1032494932 /nfs/dbraw/zinc/49/49/32/1032494932.db2.gz XPOJINKSSNXVRP-GDBMZVCRSA-N 2 1 328.422 4.126 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](CCOC(C)C)CC1)c1ccc(Cl)cc1 ZINC000177488872 1032499240 /nfs/dbraw/zinc/49/92/40/1032499240.db2.gz XIRJEPNMGJRJPN-LJQANCHMSA-N 2 1 338.923 4.270 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCO3)cc1 ZINC000177791450 1032506555 /nfs/dbraw/zinc/50/65/55/1032506555.db2.gz MNRCULXXEGHYJM-GJZGRUSLSA-N 2 1 349.434 4.321 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2)cc1 ZINC000178134606 1032529454 /nfs/dbraw/zinc/52/94/54/1032529454.db2.gz ANKMRMAMGNKVTM-CVEARBPZSA-N 2 1 337.471 4.370 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(Br)s1 ZINC000178698030 1032544025 /nfs/dbraw/zinc/54/40/25/1032544025.db2.gz CHVVFXNGTQOMDL-GHMZBOCLSA-N 2 1 342.306 4.002 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000178698009 1032544494 /nfs/dbraw/zinc/54/44/94/1032544494.db2.gz CHVVFXNGTQOMDL-MNOVXSKESA-N 2 1 342.306 4.002 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@@H](C)c3ccccc3Cl)CC2)nc(C)[nH+]1 ZINC000178695192 1032544737 /nfs/dbraw/zinc/54/47/37/1032544737.db2.gz VVCVFZFMYXPTQT-AWEZNQCLSA-N 2 1 344.890 4.066 20 0 EIADMP C[N@@H+](C[C@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1 ZINC000450569482 1032561156 /nfs/dbraw/zinc/56/11/56/1032561156.db2.gz WUQOOUBBXLQHOJ-GOSISDBHSA-N 2 1 336.470 4.408 20 0 EIADMP C[N@H+](C[C@H]1CCCCC1(F)F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000450569482 1032561162 /nfs/dbraw/zinc/56/11/62/1032561162.db2.gz WUQOOUBBXLQHOJ-GOSISDBHSA-N 2 1 336.470 4.408 20 0 EIADMP C[N@@H+](C[C@H]1CCCCC1(F)F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000450569482 1032561167 /nfs/dbraw/zinc/56/11/67/1032561167.db2.gz WUQOOUBBXLQHOJ-GOSISDBHSA-N 2 1 336.470 4.408 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000760174783 1032572266 /nfs/dbraw/zinc/57/22/66/1032572266.db2.gz ZCJCNBODKRODBJ-FUHWJXTLSA-N 2 1 343.902 4.298 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H]1CCC(F)(F)C1 ZINC000450654489 1032625381 /nfs/dbraw/zinc/62/53/81/1032625381.db2.gz RQMWEAQCIRUGKI-KRWDZBQOSA-N 2 1 337.458 4.055 20 0 EIADMP CCC[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619756 1032726865 /nfs/dbraw/zinc/72/68/65/1032726865.db2.gz UQRIWIGODPXZCC-AZUAARDMSA-N 2 1 325.500 4.423 20 0 EIADMP CCC[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619756 1032726869 /nfs/dbraw/zinc/72/68/69/1032726869.db2.gz UQRIWIGODPXZCC-AZUAARDMSA-N 2 1 325.500 4.423 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000432793003 1032812729 /nfs/dbraw/zinc/81/27/29/1032812729.db2.gz NAJVQQBFOINWFJ-OAHLLOKOSA-N 2 1 332.488 4.470 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000432793003 1032812738 /nfs/dbraw/zinc/81/27/38/1032812738.db2.gz NAJVQQBFOINWFJ-OAHLLOKOSA-N 2 1 332.488 4.470 20 0 EIADMP Cc1cnc([C@H](C)C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000274752187 1019188811 /nfs/dbraw/zinc/18/88/11/1019188811.db2.gz HTZQEHKJOKIWON-SZVBFZGTSA-N 2 1 343.540 4.055 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)o1 ZINC000432799774 1032823753 /nfs/dbraw/zinc/82/37/53/1032823753.db2.gz ZMYZOUGKXVFSIQ-QGZVFWFLSA-N 2 1 330.447 4.310 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)o1 ZINC000432799774 1032823755 /nfs/dbraw/zinc/82/37/55/1032823755.db2.gz ZMYZOUGKXVFSIQ-QGZVFWFLSA-N 2 1 330.447 4.310 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000274794982 1019567467 /nfs/dbraw/zinc/56/74/67/1019567467.db2.gz SSUVZQWOUATOLP-RYRKJORJSA-N 2 1 343.902 4.296 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274794982 1019567481 /nfs/dbraw/zinc/56/74/81/1019567481.db2.gz SSUVZQWOUATOLP-RYRKJORJSA-N 2 1 343.902 4.296 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)c1 ZINC000274945396 1019875504 /nfs/dbraw/zinc/87/55/04/1019875504.db2.gz UJNUDPJXELPALK-HNNXBMFYSA-N 2 1 331.891 4.426 20 0 EIADMP c1c[nH]c([C@@H]2CCC[NH+]2CCCCC[N@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000533491656 1019888040 /nfs/dbraw/zinc/88/80/40/1019888040.db2.gz GYDGRFNBCFSBRP-SFTDATJTSA-N 2 1 340.515 4.487 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C)sc1Br ZINC000510199093 1020433461 /nfs/dbraw/zinc/43/34/61/1020433461.db2.gz LSSVAMJMCXMVMR-LLVKDONJSA-N 2 1 333.339 4.057 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398187928 1020531735 /nfs/dbraw/zinc/53/17/35/1020531735.db2.gz LVOYFKRDSBKHFI-JBYIUTFZSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398187928 1020531746 /nfs/dbraw/zinc/53/17/46/1020531746.db2.gz LVOYFKRDSBKHFI-JBYIUTFZSA-N 2 1 340.486 4.257 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)sc1Br ZINC000510257638 1020720020 /nfs/dbraw/zinc/72/00/20/1020720020.db2.gz MZLCQAMVNZTREI-GFCCVEGCSA-N 2 1 345.350 4.342 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C[C@H]3CC[N@@H+](C(C)C)C3)s2)cc1C ZINC000655721601 1020916360 /nfs/dbraw/zinc/91/63/60/1020916360.db2.gz QIEKSAPZMLXISR-QGZVFWFLSA-N 2 1 343.540 4.247 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C[C@H]3CC[N@H+](C(C)C)C3)s2)cc1C ZINC000655721601 1020916363 /nfs/dbraw/zinc/91/63/63/1020916363.db2.gz QIEKSAPZMLXISR-QGZVFWFLSA-N 2 1 343.540 4.247 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CCCNc4ccccc43)C2)cc1 ZINC000683690498 1021098583 /nfs/dbraw/zinc/09/85/83/1021098583.db2.gz LXCNRXJQOCVLDR-NFBKMPQASA-N 2 1 349.522 4.435 20 0 EIADMP CC[N@H+](CCCc1c[nH+]cn1C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000570407708 1021399136 /nfs/dbraw/zinc/39/91/36/1021399136.db2.gz JMTSBVXDOBJTNB-CQSZACIVSA-N 2 1 339.405 4.455 20 0 EIADMP CC[N@@H+](CCCc1c[nH+]cn1C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000570407708 1021399155 /nfs/dbraw/zinc/39/91/55/1021399155.db2.gz JMTSBVXDOBJTNB-CQSZACIVSA-N 2 1 339.405 4.455 20 0 EIADMP c1nc(C2CC2)c(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000683767405 1021409288 /nfs/dbraw/zinc/40/92/88/1021409288.db2.gz RMVUSCJIDCAKBI-QGZVFWFLSA-N 2 1 341.524 4.022 20 0 EIADMP c1nc(C2CC2)c(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000683767405 1021409330 /nfs/dbraw/zinc/40/93/30/1021409330.db2.gz RMVUSCJIDCAKBI-QGZVFWFLSA-N 2 1 341.524 4.022 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1cncs1 ZINC000155768393 1021609292 /nfs/dbraw/zinc/60/92/92/1021609292.db2.gz DWCCRZDBAOPXLF-CVEARBPZSA-N 2 1 329.513 4.226 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cscc2C(F)(F)F)CC1 ZINC000685834621 1021654182 /nfs/dbraw/zinc/65/41/82/1021654182.db2.gz QKSPZQRRNDHEDW-UHFFFAOYSA-N 2 1 334.451 4.319 20 0 EIADMP CCCO[C@@H]1CCC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC001167363522 1021734767 /nfs/dbraw/zinc/73/47/67/1021734767.db2.gz AUTMZCUEXLQQPK-JOCHJYFZSA-N 2 1 344.543 4.454 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000580225600 1021779464 /nfs/dbraw/zinc/77/94/64/1021779464.db2.gz UTMDEGDQYQEHMI-PKOBYXMFSA-N 2 1 332.536 4.133 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)c2ccccc12 ZINC000414173960 1022030770 /nfs/dbraw/zinc/03/07/70/1022030770.db2.gz HEMSHFWOHXDMIF-DLBZAZTESA-N 2 1 326.484 4.231 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000398053768 1022051185 /nfs/dbraw/zinc/05/11/85/1022051185.db2.gz YTONRPZHVFJZJR-MGPUTAFESA-N 2 1 346.877 4.479 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)sc1Br ZINC000414193284 1022086373 /nfs/dbraw/zinc/08/63/73/1022086373.db2.gz SYLISOSGWOFARE-OLZOCXBDSA-N 2 1 345.350 4.202 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000236665625 1022185106 /nfs/dbraw/zinc/18/51/06/1022185106.db2.gz JNZBQTOSWYHEHI-UHFFFAOYSA-N 2 1 332.875 4.176 20 0 EIADMP Cc1cc(F)ncc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000892570762 1022240682 /nfs/dbraw/zinc/24/06/82/1022240682.db2.gz NSFIOPSFCUIXSH-QGZVFWFLSA-N 2 1 341.474 4.193 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310858206 1022523169 /nfs/dbraw/zinc/52/31/69/1022523169.db2.gz BYMOXHZFKZYYNU-PGRDOPGGSA-N 2 1 338.495 4.258 20 0 EIADMP FC(F)(F)Sc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000373941197 1022715807 /nfs/dbraw/zinc/71/58/07/1022715807.db2.gz DCBVOXZHNIBODL-KBPBESRZSA-N 2 1 330.419 4.015 20 0 EIADMP FC(F)(F)Sc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000373941197 1022715825 /nfs/dbraw/zinc/71/58/25/1022715825.db2.gz DCBVOXZHNIBODL-KBPBESRZSA-N 2 1 330.419 4.015 20 0 EIADMP c1nc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)sc1-c1ccccc1 ZINC000647542745 1022779457 /nfs/dbraw/zinc/77/94/57/1022779457.db2.gz BJFDCXQURDSEQC-MSOLQXFVSA-N 2 1 341.524 4.022 20 0 EIADMP Clc1ccc2cccnc2c1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543393 1022794231 /nfs/dbraw/zinc/79/42/31/1022794231.db2.gz MNGJNWHCSWRADH-DLBZAZTESA-N 2 1 343.902 4.100 20 0 EIADMP Clc1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c2ncccc12 ZINC000647543835 1022797319 /nfs/dbraw/zinc/79/73/19/1022797319.db2.gz SRFKPSBBSHAPRI-HZPDHXFCSA-N 2 1 343.902 4.100 20 0 EIADMP CS[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000581131478 1022847885 /nfs/dbraw/zinc/84/78/85/1022847885.db2.gz RKORXKPMNUBNIJ-VAMGGRTRSA-N 2 1 344.568 4.447 20 0 EIADMP CS[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000581131478 1022847892 /nfs/dbraw/zinc/84/78/92/1022847892.db2.gz RKORXKPMNUBNIJ-VAMGGRTRSA-N 2 1 344.568 4.447 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3cc(N)ccc32)C[C@H]1c1ccccc1 ZINC000423369631 1022860842 /nfs/dbraw/zinc/86/08/42/1022860842.db2.gz SUBYGKHTHQEKMK-BVSLBCMMSA-N 2 1 335.495 4.071 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCc3cc(N)ccc32)C[C@H]1c1ccccc1 ZINC000423369631 1022860849 /nfs/dbraw/zinc/86/08/49/1022860849.db2.gz SUBYGKHTHQEKMK-BVSLBCMMSA-N 2 1 335.495 4.071 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)ccc1SC ZINC000164675575 1022948202 /nfs/dbraw/zinc/94/82/02/1022948202.db2.gz HQYKFRWVWOAUFD-CQSZACIVSA-N 2 1 333.501 4.053 20 0 EIADMP CC[N@@H+](Cc1ccc(C(=O)Nc2ccc([C@@H](C)[NH3+])cc2)cc1)C(C)C ZINC000178219439 1023074037 /nfs/dbraw/zinc/07/40/37/1023074037.db2.gz HXTDAWJMBBPRCY-MRXNPFEDSA-N 2 1 339.483 4.189 20 0 EIADMP Brc1cccc2c1CCC[C@H]2[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000341197494 1023358828 /nfs/dbraw/zinc/35/88/28/1023358828.db2.gz WLDPSVQQSFCLGY-GOSISDBHSA-N 2 1 349.316 4.043 20 0 EIADMP COc1cccc(SCC[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000660257462 1023395873 /nfs/dbraw/zinc/39/58/73/1023395873.db2.gz TZZSCRKNKKBFNG-DLBZAZTESA-N 2 1 348.556 4.030 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H](OC)c1ccc(Cl)cc1 ZINC000549163194 1023405315 /nfs/dbraw/zinc/40/53/15/1023405315.db2.gz ZDBOCFFMFXVEME-SFHVURJKSA-N 2 1 349.906 4.199 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H](OC)c1ccc(Cl)cc1 ZINC000549163194 1023405317 /nfs/dbraw/zinc/40/53/17/1023405317.db2.gz ZDBOCFFMFXVEME-SFHVURJKSA-N 2 1 349.906 4.199 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC(N[C@@H](CCC[NH3+])c3ccccc3)CC2)C1 ZINC000415061582 1023415380 /nfs/dbraw/zinc/41/53/80/1023415380.db2.gz YRSAXICYQKMCBS-COPCDDAFSA-N 2 1 343.559 4.099 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000310714684 1023427017 /nfs/dbraw/zinc/42/70/17/1023427017.db2.gz VKIBXSTUSBWXDC-IBGZPJMESA-N 2 1 348.494 4.045 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415083350 1023432810 /nfs/dbraw/zinc/43/28/10/1023432810.db2.gz NCWXBOMBWCRSTK-XPGWFJOJSA-N 2 1 326.871 4.410 20 0 EIADMP FC(F)(F)c1ccccc1CC[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415087154 1023437360 /nfs/dbraw/zinc/43/73/60/1023437360.db2.gz VMJLSIWNOHDVOU-IEBWSBKVSA-N 2 1 348.412 4.331 20 0 EIADMP CC[C@H](c1ccc(Br)cc1)[N@@H+](C)C[C@H]1CCCN(C)C1 ZINC000472737617 1023474891 /nfs/dbraw/zinc/47/48/91/1023474891.db2.gz KLPBVDSFEFTOMX-WMLDXEAASA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@H](c1ccc(Br)cc1)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000472737617 1023474892 /nfs/dbraw/zinc/47/48/92/1023474892.db2.gz KLPBVDSFEFTOMX-WMLDXEAASA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@H](c1ccc(Br)cc1)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000472737617 1023474893 /nfs/dbraw/zinc/47/48/93/1023474893.db2.gz KLPBVDSFEFTOMX-WMLDXEAASA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@H](c1ccc(Br)cc1)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000472737617 1023474894 /nfs/dbraw/zinc/47/48/94/1023474894.db2.gz KLPBVDSFEFTOMX-WMLDXEAASA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@H](c1ccc(Br)cc1)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000472737617 1023474896 /nfs/dbraw/zinc/47/48/96/1023474896.db2.gz KLPBVDSFEFTOMX-WMLDXEAASA-N 2 1 339.321 4.174 20 0 EIADMP c1nc(-c2ccccc2)sc1C[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656785937 1023534383 /nfs/dbraw/zinc/53/43/83/1023534383.db2.gz NNNHCPCUVISDRZ-SFHVURJKSA-N 2 1 341.524 4.022 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1nc(C(F)(F)F)cs1 ZINC000343844492 1023552461 /nfs/dbraw/zinc/55/24/61/1023552461.db2.gz XGTGQVOYVHZICI-NSHDSACASA-N 2 1 343.418 4.074 20 0 EIADMP C[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310081719 1023589952 /nfs/dbraw/zinc/58/99/52/1023589952.db2.gz JTWWQSHTFVIRIJ-LAUBAEHRSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCNc1cccc2c1C1(C=C2)CC[NH2+]CC1 ZINC001167751961 1023623189 /nfs/dbraw/zinc/62/31/89/1023623189.db2.gz QCYHWIXMLNZNMU-GOSISDBHSA-N 2 1 339.527 4.011 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000398019222 1023643214 /nfs/dbraw/zinc/64/32/14/1023643214.db2.gz JDWYDUWUNOQQJA-FOIQADDNSA-N 2 1 346.877 4.479 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000398019222 1023643221 /nfs/dbraw/zinc/64/32/21/1023643221.db2.gz JDWYDUWUNOQQJA-FOIQADDNSA-N 2 1 346.877 4.479 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[N@H+](C)C[C@@H]1CCc2[nH+]ccn2C1 ZINC000377699905 1023695710 /nfs/dbraw/zinc/69/57/10/1023695710.db2.gz QVWBJDVLRYCWDP-KBPBESRZSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[N@@H+](C)C[C@@H]1CCc2[nH+]ccn2C1 ZINC000377699905 1023695714 /nfs/dbraw/zinc/69/57/14/1023695714.db2.gz QVWBJDVLRYCWDP-KBPBESRZSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@@H]1C[NH+](C[C@H](C[N@@H+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483568 1023740551 /nfs/dbraw/zinc/74/05/51/1023740551.db2.gz XGHBKCQKOSKYBZ-VIZSFHNOSA-N 2 1 336.523 4.490 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1cccc(O)c1 ZINC000390676021 1023768358 /nfs/dbraw/zinc/76/83/58/1023768358.db2.gz UHQVIHYVWRMCSU-UWJYYQICSA-N 2 1 338.495 4.344 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1cccc(O)c1 ZINC000390676021 1023768366 /nfs/dbraw/zinc/76/83/66/1023768366.db2.gz UHQVIHYVWRMCSU-UWJYYQICSA-N 2 1 338.495 4.344 20 0 EIADMP CC[C@@H](CC(F)F)C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000660436511 1023794559 /nfs/dbraw/zinc/79/45/59/1023794559.db2.gz RMFJWRZRZCFJMI-AWEZNQCLSA-N 2 1 325.447 4.080 20 0 EIADMP CCCOc1ccc(C[N@H+](C)C2CC[NH+](CCC)CC2)cc1OCC ZINC000510470970 1023803971 /nfs/dbraw/zinc/80/39/71/1023803971.db2.gz YYZCKZYLNZVZHC-UHFFFAOYSA-N 2 1 348.531 4.180 20 0 EIADMP CCCOc1ccc(C[N@@H+](C)C2CC[NH+](CCC)CC2)cc1OCC ZINC000510470970 1023803976 /nfs/dbraw/zinc/80/39/76/1023803976.db2.gz YYZCKZYLNZVZHC-UHFFFAOYSA-N 2 1 348.531 4.180 20 0 EIADMP Cc1c([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cnn1C(C)C ZINC000364467969 1023804451 /nfs/dbraw/zinc/80/44/51/1023804451.db2.gz WSROPOXYKFETSX-LDQXTDLNSA-N 2 1 340.515 4.116 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CO2 ZINC000581962207 1023938482 /nfs/dbraw/zinc/93/84/82/1023938482.db2.gz PLZIPDQNBSZQFV-IIZPIQPGSA-N 2 1 348.490 4.214 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3Cc1ccccc1)CO2 ZINC000581962207 1023938493 /nfs/dbraw/zinc/93/84/93/1023938493.db2.gz PLZIPDQNBSZQFV-IIZPIQPGSA-N 2 1 348.490 4.214 20 0 EIADMP CC[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000430718154 1023976587 /nfs/dbraw/zinc/97/65/87/1023976587.db2.gz CFGUGCOAVKURKM-YSGRDPCXSA-N 2 1 347.547 4.308 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000537939340 1024022759 /nfs/dbraw/zinc/02/27/59/1024022759.db2.gz MBVYCCPJRSHGJZ-LNLFQRSKSA-N 2 1 341.474 4.172 20 0 EIADMP COCC(C)(C)CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000647210917 1024099871 /nfs/dbraw/zinc/09/98/71/1024099871.db2.gz IAXQPWDPTYTZPR-HXUWFJFHSA-N 2 1 344.543 4.226 20 0 EIADMP COCC(C)(C)CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000647210917 1024099885 /nfs/dbraw/zinc/09/98/85/1024099885.db2.gz IAXQPWDPTYTZPR-HXUWFJFHSA-N 2 1 344.543 4.226 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cc3cnccc3o2)CC1)CC1CC1 ZINC000651664886 1024120676 /nfs/dbraw/zinc/12/06/76/1024120676.db2.gz FDPJXDHJOHJMQP-UHFFFAOYSA-N 2 1 341.499 4.162 20 0 EIADMP Cc1cccc([C@H]([NH2+][C@H]2CCN(C)[C@@H](C)C2)c2cccc(F)c2)c1 ZINC000510736767 1024378611 /nfs/dbraw/zinc/37/86/11/1024378611.db2.gz RFGWTPIKFYZAIN-NDXORKPFSA-N 2 1 326.459 4.296 20 0 EIADMP Cc1[nH+]ccn1CCCN1C[C@H](c2cccc(Cl)c2)OCC1(C)C ZINC000661740757 1024424575 /nfs/dbraw/zinc/42/45/75/1024424575.db2.gz RVLCAHAPUTXEEE-GOSISDBHSA-N 2 1 347.890 4.087 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000164707329 1024820125 /nfs/dbraw/zinc/82/01/25/1024820125.db2.gz WEPQCHOHKCMFLH-ZDUSSCGKSA-N 2 1 341.377 4.221 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000548483978 1024830894 /nfs/dbraw/zinc/83/08/94/1024830894.db2.gz RGRSLFXTVNAJIW-BTHPGYMESA-N 2 1 332.557 4.161 20 0 EIADMP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]CCCn2cc[nH+]c2C)cc1F ZINC000510931964 1024851539 /nfs/dbraw/zinc/85/15/39/1024851539.db2.gz UGXRTASUEFWWCK-HKUYNNGSSA-N 2 1 345.462 4.045 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC3c4ccccc4C2c2ccccc23)CC[N@H+]1C ZINC000246937161 1024863928 /nfs/dbraw/zinc/86/39/28/1024863928.db2.gz HKSRUBZRQXHUFG-OMYRSMHSSA-N 2 1 346.518 4.356 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCc3ccccc32)[C@@H]1c1cccs1 ZINC000247972802 1024868528 /nfs/dbraw/zinc/86/85/28/1024868528.db2.gz HNFQAAFVRZQAHY-IMFGXOCKSA-N 2 1 326.509 4.408 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCc3ccccc32)[C@@H]1c1cccs1 ZINC000247972802 1024868530 /nfs/dbraw/zinc/86/85/30/1024868530.db2.gz HNFQAAFVRZQAHY-IMFGXOCKSA-N 2 1 326.509 4.408 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3csc(C)n3)CC2)o1 ZINC000161762837 1025072401 /nfs/dbraw/zinc/07/24/01/1025072401.db2.gz YXAJTSGQOQQUBN-AWEZNQCLSA-N 2 1 347.528 4.170 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3csc(C)n3)CC2)o1 ZINC000161762712 1025072959 /nfs/dbraw/zinc/07/29/59/1025072959.db2.gz YXAJTSGQOQQUBN-CQSZACIVSA-N 2 1 347.528 4.170 20 0 EIADMP Clc1ccc(C2CC([NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)C2)cc1 ZINC000663466140 1025392276 /nfs/dbraw/zinc/39/22/76/1025392276.db2.gz ONUZGLPLPFHTCF-PPDQVPDSSA-N 2 1 332.919 4.298 20 0 EIADMP Clc1ccc(C2CC([NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)C2)cc1 ZINC000663466141 1025392995 /nfs/dbraw/zinc/39/29/95/1025392995.db2.gz ONUZGLPLPFHTCF-VQSBYGRUSA-N 2 1 332.919 4.298 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2ncc(Cl)s2)C[N@H+]1Cc1ccccc1 ZINC000472037152 1025460992 /nfs/dbraw/zinc/46/09/92/1025460992.db2.gz HQRSXQKRRPEMEJ-ZBFHGGJFSA-N 2 1 349.931 4.187 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@H](c2ccc(C)cc2)C[C@H]1C ZINC000426539585 1025492295 /nfs/dbraw/zinc/49/22/95/1025492295.db2.gz NEHVQJLHHAYKKK-YLJYHZDGSA-N 2 1 346.478 4.262 20 0 EIADMP Cc1cccc([C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2cccc(F)c2)c1 ZINC000643547870 1025751502 /nfs/dbraw/zinc/75/15/02/1025751502.db2.gz KAQYGXRDKYOTQC-SFTDATJTSA-N 2 1 338.470 4.488 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1Cl ZINC001167836177 1025844583 /nfs/dbraw/zinc/84/45/83/1025844583.db2.gz WZDWTUVAPSXSAM-BZSNNMDCSA-N 2 1 349.950 4.113 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)C(c1ccccc1)c1ccccc1 ZINC000278955967 1025864928 /nfs/dbraw/zinc/86/49/28/1025864928.db2.gz LVLYXNODVCPAEX-RBUKOAKNSA-N 2 1 345.490 4.256 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](CC(C)C)CC1)CCCS2 ZINC000187743996 1025889375 /nfs/dbraw/zinc/88/93/75/1025889375.db2.gz MIBQCKKCVYCALX-LJQANCHMSA-N 2 1 348.556 4.332 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCOC[C@@H]1c1ccccc1Cl ZINC001167842033 1025893859 /nfs/dbraw/zinc/89/38/59/1025893859.db2.gz WAVKUBISTMJBRW-QFBILLFUSA-N 2 1 338.923 4.224 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCOC[C@@H]1c1ccccc1Cl ZINC001167842033 1025893861 /nfs/dbraw/zinc/89/38/61/1025893861.db2.gz WAVKUBISTMJBRW-QFBILLFUSA-N 2 1 338.923 4.224 20 0 EIADMP Clc1cc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)ccn1 ZINC001167968808 1025910648 /nfs/dbraw/zinc/91/06/48/1025910648.db2.gz VOOZSLFJTARSMU-DLZDZTESSA-N 2 1 345.918 4.181 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cncc(F)c1 ZINC000157666772 1025923033 /nfs/dbraw/zinc/92/30/33/1025923033.db2.gz RKBPSDPMGLZASS-IRXDYDNUSA-N 2 1 341.474 4.446 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1cncc(F)c1 ZINC000157666772 1025923055 /nfs/dbraw/zinc/92/30/55/1025923055.db2.gz RKBPSDPMGLZASS-IRXDYDNUSA-N 2 1 341.474 4.446 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2COc3c(C)cccc3C2)cc1 ZINC000582032709 1025994361 /nfs/dbraw/zinc/99/43/61/1025994361.db2.gz VQMNPBUJEPHDGB-OXQOHEQNSA-N 2 1 347.462 4.143 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccncc1 ZINC000638718845 1026032241 /nfs/dbraw/zinc/03/22/41/1026032241.db2.gz MMLXTZDIKYUINP-NQSCKRDGSA-N 2 1 335.495 4.143 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccncc1 ZINC000638718845 1026032267 /nfs/dbraw/zinc/03/22/67/1026032267.db2.gz MMLXTZDIKYUINP-NQSCKRDGSA-N 2 1 335.495 4.143 20 0 EIADMP C[C@@H](CC(C)(C)c1ccccc1)[NH2+]Cc1ncc(C[NH+](C)C)s1 ZINC000512129083 1026074195 /nfs/dbraw/zinc/07/41/95/1026074195.db2.gz HDVHWLSXIDFSMZ-HNNXBMFYSA-N 2 1 331.529 4.051 20 0 EIADMP Fc1ccccc1[C@@H](F)C1CC[NH+](CCC[NH+]2CCCCC2)CC1 ZINC000511066130 1026079554 /nfs/dbraw/zinc/07/95/54/1026079554.db2.gz QMHPCFAQKSQRET-FQEVSTJZSA-N 2 1 336.470 4.424 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000431350092 1026112538 /nfs/dbraw/zinc/11/25/38/1026112538.db2.gz NMLCYCFWEFKRIB-JZXOWHBKSA-N 2 1 334.891 4.079 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000431350092 1026112551 /nfs/dbraw/zinc/11/25/51/1026112551.db2.gz NMLCYCFWEFKRIB-JZXOWHBKSA-N 2 1 334.891 4.079 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC([C@H](F)c2ccccc2F)CC1 ZINC000511075251 1026187702 /nfs/dbraw/zinc/18/77/02/1026187702.db2.gz RGDCFJQBNDXMSG-PXNSSMCTSA-N 2 1 336.470 4.423 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3ccncc3s2)c1 ZINC000657348029 1026211713 /nfs/dbraw/zinc/21/17/13/1026211713.db2.gz IXKUSEYTDDLBJZ-UHFFFAOYSA-N 2 1 325.481 4.038 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCc2cccc(OC)c2)CC1 ZINC000303911019 1026272118 /nfs/dbraw/zinc/27/21/18/1026272118.db2.gz MTUXOYJKQFBBGD-UHFFFAOYSA-N 2 1 332.532 4.072 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1OC ZINC000467834282 1026293412 /nfs/dbraw/zinc/29/34/12/1026293412.db2.gz IEFSAHODHCTBLJ-KSZLIROESA-N 2 1 348.531 4.113 20 0 EIADMP CCC[C@H](C)[C@H](CC)[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000162759738 1026299901 /nfs/dbraw/zinc/29/99/01/1026299901.db2.gz LERHUGIPMOODAB-KXBFYZLASA-N 2 1 335.536 4.308 20 0 EIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCCS2 ZINC000119703979 1026363157 /nfs/dbraw/zinc/36/31/57/1026363157.db2.gz UVXMRRWQZWQYBT-KRWDZBQOSA-N 2 1 336.932 4.483 20 0 EIADMP CCc1nc(C)c([C@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)s1 ZINC000163454252 1026372962 /nfs/dbraw/zinc/37/29/62/1026372962.db2.gz BTISSIAKBWSAIK-AWEZNQCLSA-N 2 1 344.528 4.037 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCSc4ccccc43)CC2)[nH+]c1 ZINC000163470935 1026373670 /nfs/dbraw/zinc/37/36/70/1026373670.db2.gz PPEJPPJTASJLCQ-SFHVURJKSA-N 2 1 339.508 4.186 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCSc4ccccc43)CC2)[nH+]c1 ZINC000163470831 1026374104 /nfs/dbraw/zinc/37/41/04/1026374104.db2.gz PPEJPPJTASJLCQ-GOSISDBHSA-N 2 1 339.508 4.186 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cccc3cc[nH]c32)C1 ZINC000512214517 1026477383 /nfs/dbraw/zinc/47/73/83/1026477383.db2.gz WOIPRMWVYADPDZ-ROUUACIJSA-N 2 1 325.500 4.254 20 0 EIADMP Fc1cc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc(C(F)(F)F)c1 ZINC000506873689 1026492670 /nfs/dbraw/zinc/49/26/70/1026492670.db2.gz GVJTXVJXWJMQKL-UHFFFAOYSA-N 2 1 344.396 4.152 20 0 EIADMP FC(F)(F)CCCC[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512287909 1026654872 /nfs/dbraw/zinc/65/48/72/1026654872.db2.gz WNCTWFYKKOUFTO-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCCC[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512287909 1026654878 /nfs/dbraw/zinc/65/48/78/1026654878.db2.gz WNCTWFYKKOUFTO-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCCC[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000512287909 1026654887 /nfs/dbraw/zinc/65/48/87/1026654887.db2.gz WNCTWFYKKOUFTO-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCCC[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000512287909 1026654894 /nfs/dbraw/zinc/65/48/94/1026654894.db2.gz WNCTWFYKKOUFTO-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000119805428 1026655311 /nfs/dbraw/zinc/65/53/11/1026655311.db2.gz YGHQNAKVMHCOAZ-QGZVFWFLSA-N 3 1 348.494 4.093 20 0 EIADMP CC(C)(C)OCCCC[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512293898 1026659578 /nfs/dbraw/zinc/65/95/78/1026659578.db2.gz NDFPYPUWRAAVBQ-QFIPXVFZSA-N 2 1 344.543 4.180 20 0 EIADMP CC(C)(C)OCCCC[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000512293898 1026659584 /nfs/dbraw/zinc/65/95/84/1026659584.db2.gz NDFPYPUWRAAVBQ-QFIPXVFZSA-N 2 1 344.543 4.180 20 0 EIADMP CC(C)(C)OCCCC[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000512293898 1026659589 /nfs/dbraw/zinc/65/95/89/1026659589.db2.gz NDFPYPUWRAAVBQ-QFIPXVFZSA-N 2 1 344.543 4.180 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)CCOc2cccc3ccccc32)CC1 ZINC000507360965 1026765236 /nfs/dbraw/zinc/76/52/36/1026765236.db2.gz NZMFORCFMIIFRM-UHFFFAOYSA-N 2 1 326.484 4.023 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCOc2cccc3ccccc32)CC1 ZINC000507360965 1026765242 /nfs/dbraw/zinc/76/52/42/1026765242.db2.gz NZMFORCFMIIFRM-UHFFFAOYSA-N 2 1 326.484 4.023 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000507447445 1026797274 /nfs/dbraw/zinc/79/72/74/1026797274.db2.gz HUIWZBCSJJATQT-BBTUJRGHSA-N 2 1 337.511 4.205 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000507447445 1026797288 /nfs/dbraw/zinc/79/72/88/1026797288.db2.gz HUIWZBCSJJATQT-BBTUJRGHSA-N 2 1 337.511 4.205 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)C1 ZINC000507507623 1026820764 /nfs/dbraw/zinc/82/07/64/1026820764.db2.gz IOOLLBJQJRQTIL-FCGDIQPGSA-N 2 1 334.454 4.065 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Br)ccc2C)C[C@H]1C ZINC001167586227 1026827910 /nfs/dbraw/zinc/82/79/10/1026827910.db2.gz JEHPJOCQVQDRPH-RHSMWYFYSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Br)ccc2C)C[C@H]1C ZINC001167586227 1026827918 /nfs/dbraw/zinc/82/79/18/1026827918.db2.gz JEHPJOCQVQDRPH-RHSMWYFYSA-N 2 1 339.321 4.062 20 0 EIADMP C[C@H](Cc1ccsc1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000582586270 1026834065 /nfs/dbraw/zinc/83/40/65/1026834065.db2.gz LHWAMJVGWAAZDD-OTNPHJDUSA-N 2 1 340.536 4.464 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)c(C)s1 ZINC000152819643 1026853025 /nfs/dbraw/zinc/85/30/25/1026853025.db2.gz LPDVUIBYWYMGTL-INIZCTEOSA-N 2 1 343.540 4.118 20 0 EIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000519724171 1026961606 /nfs/dbraw/zinc/96/16/06/1026961606.db2.gz NTHMAKTXWPCOEU-LBPRGKRZSA-N 2 1 334.813 4.179 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000519724171 1026961616 /nfs/dbraw/zinc/96/16/16/1026961616.db2.gz NTHMAKTXWPCOEU-LBPRGKRZSA-N 2 1 334.813 4.179 20 0 EIADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000519724041 1026962049 /nfs/dbraw/zinc/96/20/49/1026962049.db2.gz NTHMAKTXWPCOEU-GFCCVEGCSA-N 2 1 334.813 4.179 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000519724041 1026962056 /nfs/dbraw/zinc/96/20/56/1026962056.db2.gz NTHMAKTXWPCOEU-GFCCVEGCSA-N 2 1 334.813 4.179 20 0 EIADMP Cc1ncsc1CC[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168035738 1027106898 /nfs/dbraw/zinc/10/68/98/1027106898.db2.gz USSNKFGBUAGNNF-HGKCTWBKSA-N 2 1 343.540 4.025 20 0 EIADMP CCc1c(C)[nH+]c2ccccc2c1N1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000302073044 1027208386 /nfs/dbraw/zinc/20/83/86/1027208386.db2.gz WMJZLPMXMBHXSA-KRWDZBQOSA-N 2 1 348.494 4.298 20 0 EIADMP Cc1ccc2[nH+]ccc(NCc3ccc(C)[nH+]c3N3CCCC3)c2c1 ZINC000302227387 1027270132 /nfs/dbraw/zinc/27/01/32/1027270132.db2.gz QFYCOLGMFNOUCR-UHFFFAOYSA-N 2 1 332.451 4.459 20 0 EIADMP CC[N@H+](Cc1ccncc1)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168038900 1027315797 /nfs/dbraw/zinc/31/57/97/1027315797.db2.gz AAYHCVIKXITOFS-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP CC[N@@H+](Cc1ccncc1)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168038900 1027315822 /nfs/dbraw/zinc/31/58/22/1027315822.db2.gz AAYHCVIKXITOFS-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP CC[NH+](Cc1ccncc1)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168038900 1027315842 /nfs/dbraw/zinc/31/58/42/1027315842.db2.gz AAYHCVIKXITOFS-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP CC[NH+](Cc1ccncc1)[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168038900 1027315860 /nfs/dbraw/zinc/31/58/60/1027315860.db2.gz AAYHCVIKXITOFS-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000119687114 1027370751 /nfs/dbraw/zinc/37/07/51/1027370751.db2.gz NTHISYUIDLMDNC-UONOGXRCSA-N 2 1 329.513 4.005 20 0 EIADMP CN1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c2ccccc21 ZINC000453348350 1027417404 /nfs/dbraw/zinc/41/74/04/1027417404.db2.gz GCYYCWMHUNINKH-NWSQWKLXSA-N 2 1 349.522 4.383 20 0 EIADMP CN1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c2ccccc21 ZINC000453348350 1027417414 /nfs/dbraw/zinc/41/74/14/1027417414.db2.gz GCYYCWMHUNINKH-NWSQWKLXSA-N 2 1 349.522 4.383 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)C[C@H]1c1ccccc1 ZINC000453353990 1027423206 /nfs/dbraw/zinc/42/32/06/1027423206.db2.gz OABKIFVURGNWTK-SFTDATJTSA-N 2 1 338.470 4.326 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)C[C@H]1c1ccccc1 ZINC000453353990 1027423214 /nfs/dbraw/zinc/42/32/14/1027423214.db2.gz OABKIFVURGNWTK-SFTDATJTSA-N 2 1 338.470 4.326 20 0 EIADMP Cc1ccc(C)c(OCCC[N@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)c1 ZINC000441399025 1027521029 /nfs/dbraw/zinc/52/10/29/1027521029.db2.gz UEJKRHDGQKEZTK-CTNGQTDRSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441399025 1027521044 /nfs/dbraw/zinc/52/10/44/1027521044.db2.gz UEJKRHDGQKEZTK-CTNGQTDRSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441399025 1027521056 /nfs/dbraw/zinc/52/10/56/1027521056.db2.gz UEJKRHDGQKEZTK-CTNGQTDRSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1ccc(C)c(OCCC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441399025 1027521064 /nfs/dbraw/zinc/52/10/64/1027521064.db2.gz UEJKRHDGQKEZTK-CTNGQTDRSA-N 2 1 342.527 4.021 20 0 EIADMP CC(C)OC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000090771942 1027581543 /nfs/dbraw/zinc/58/15/43/1027581543.db2.gz BGLCSXKHDHRJOE-PMJAUZGISA-N 2 1 344.543 4.365 20 0 EIADMP CC(C)OC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000090771942 1027581567 /nfs/dbraw/zinc/58/15/67/1027581567.db2.gz BGLCSXKHDHRJOE-PMJAUZGISA-N 2 1 344.543 4.365 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)cc1F ZINC000112524258 1027581588 /nfs/dbraw/zinc/58/15/88/1027581588.db2.gz DGOORUVECOMIGP-HNNXBMFYSA-N 2 1 330.422 4.411 20 0 EIADMP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000657706270 1027760962 /nfs/dbraw/zinc/76/09/62/1027760962.db2.gz KYOPEPAYXVVQLE-QWHCGFSZSA-N 2 1 346.359 4.256 20 0 EIADMP c1ccc(C[C@H]2CCC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)C2)cc1 ZINC001167995501 1027777126 /nfs/dbraw/zinc/77/71/26/1027777126.db2.gz HTIJQYCABLVOIZ-SSWODZADSA-N 2 1 338.539 4.347 20 0 EIADMP c1ccc(C[C@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167995501 1027777146 /nfs/dbraw/zinc/77/71/46/1027777146.db2.gz HTIJQYCABLVOIZ-SSWODZADSA-N 2 1 338.539 4.347 20 0 EIADMP c1ccc(C[C@H]2CCC[N@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167995501 1027777163 /nfs/dbraw/zinc/77/71/63/1027777163.db2.gz HTIJQYCABLVOIZ-SSWODZADSA-N 2 1 338.539 4.347 20 0 EIADMP CC[NH+]1CCC([N@H+](C)C/C(C)=C\c2ccccc2OC(F)F)CC1 ZINC000582969624 1027783973 /nfs/dbraw/zinc/78/39/73/1027783973.db2.gz BSBRZXNTPUQDGP-SQFISAMPSA-N 2 1 338.442 4.107 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)C/C(C)=C\c2ccccc2OC(F)F)CC1 ZINC000582969624 1027783980 /nfs/dbraw/zinc/78/39/80/1027783980.db2.gz BSBRZXNTPUQDGP-SQFISAMPSA-N 2 1 338.442 4.107 20 0 EIADMP C[C@H]([NH2+][C@@H](C)C1CCSCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000474942042 1027809262 /nfs/dbraw/zinc/80/92/62/1027809262.db2.gz KKSJKFHPEWBXPL-ABSDTBQOSA-N 2 1 332.557 4.018 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCc3cc(F)ccc32)cc1F ZINC000153686179 1027867204 /nfs/dbraw/zinc/86/72/04/1027867204.db2.gz QCKGUSGXVDPTRJ-LJQANCHMSA-N 2 1 339.389 4.236 20 0 EIADMP C[C@H](Cc1ccco1)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000796682291 1027984877 /nfs/dbraw/zinc/98/48/77/1027984877.db2.gz IDVIPCINMNUIFJ-QHGAOEGBSA-N 2 1 326.484 4.243 20 0 EIADMP CC(C)O[C@H](C[NH+]1CCC([NH+]2CCCCC2)CC1)c1ccccc1 ZINC000428446839 1028022244 /nfs/dbraw/zinc/02/22/44/1028022244.db2.gz KRQLYQCRILMNAB-OAQYLSRUSA-N 2 1 330.516 4.103 20 0 EIADMP C[C@H](c1ccncc1)[N@@H+](C)CCCCC[NH+](C)[C@@H](C)c1ccncc1 ZINC000091988587 1028148441 /nfs/dbraw/zinc/14/84/41/1028148441.db2.gz IGWFOTRNYNMTDV-KDURUIRLSA-N 2 1 340.515 4.333 20 0 EIADMP C[C@H](c1ccncc1)[NH+](C)CCCCC[N@H+](C)[C@@H](C)c1ccncc1 ZINC000091988587 1028148451 /nfs/dbraw/zinc/14/84/51/1028148451.db2.gz IGWFOTRNYNMTDV-KDURUIRLSA-N 2 1 340.515 4.333 20 0 EIADMP C[C@H](c1ccncc1)[NH+](C)CCCCC[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000091988587 1028148468 /nfs/dbraw/zinc/14/84/68/1028148468.db2.gz IGWFOTRNYNMTDV-KDURUIRLSA-N 2 1 340.515 4.333 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000324148540 1028162534 /nfs/dbraw/zinc/16/25/34/1028162534.db2.gz AXPCNKZXIZKNJI-MRXNPFEDSA-N 2 1 326.484 4.349 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](CCO)C2CCCCC2)cc1 ZINC000343093750 1028188311 /nfs/dbraw/zinc/18/83/11/1028188311.db2.gz BUCJIVBXPVYPJY-IERDGZPVSA-N 2 1 341.499 4.163 20 0 EIADMP c1ccc2c(c1)cccc2OCCC[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000523556992 1028211482 /nfs/dbraw/zinc/21/14/82/1028211482.db2.gz XFYDAWBKHMEDBN-LJQANCHMSA-N 2 1 338.495 4.026 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC001167659935 1028263748 /nfs/dbraw/zinc/26/37/48/1028263748.db2.gz XTZFJCMFKLFAPR-INIZCTEOSA-N 2 1 336.470 4.441 20 0 EIADMP C[N@@H+](CCCCC(F)(F)F)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000154725012 1028276200 /nfs/dbraw/zinc/27/62/00/1028276200.db2.gz MCLNJUGGFQEWCA-QGZVFWFLSA-N 2 1 328.422 4.173 20 0 EIADMP C[NH+](CCCCC(F)(F)F)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000154725012 1028276219 /nfs/dbraw/zinc/27/62/19/1028276219.db2.gz MCLNJUGGFQEWCA-QGZVFWFLSA-N 2 1 328.422 4.173 20 0 EIADMP C[NH+](CCCCC(F)(F)F)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000154725012 1028276236 /nfs/dbraw/zinc/27/62/36/1028276236.db2.gz MCLNJUGGFQEWCA-QGZVFWFLSA-N 2 1 328.422 4.173 20 0 EIADMP CC[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@H](C)c1ccc(F)cc1 ZINC000346142147 1028277962 /nfs/dbraw/zinc/27/79/62/1028277962.db2.gz ACBMKYVCDDNBAO-MRXNPFEDSA-N 2 1 338.430 4.298 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2nc(C)sc2C)cc1 ZINC000319815384 1028654780 /nfs/dbraw/zinc/65/47/80/1028654780.db2.gz LEDBQDSLIBKQJC-AWEZNQCLSA-N 2 1 331.529 4.453 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2csc(-c3ccsc3)n2)CC1 ZINC000524156050 1028725383 /nfs/dbraw/zinc/72/53/83/1028725383.db2.gz DPIUREIQHBYQOM-UHFFFAOYSA-N 2 1 349.569 4.424 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2csc(-c3ccsc3)n2)CC1 ZINC000524156050 1028725397 /nfs/dbraw/zinc/72/53/97/1028725397.db2.gz DPIUREIQHBYQOM-UHFFFAOYSA-N 2 1 349.569 4.424 20 0 EIADMP CC(C)C[C@H](C[N@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1)c1ccccc1 ZINC000650707698 1028833043 /nfs/dbraw/zinc/83/30/43/1028833043.db2.gz LAIKJXQJALFBMG-DXBBTUNJSA-N 2 1 344.543 4.035 20 0 EIADMP Fc1ccc(C[NH+]2CCC3(CCC[N@@H+](Cc4ccc[nH]4)C3)CC2)cc1 ZINC001279144785 1029033392 /nfs/dbraw/zinc/03/33/92/1029033392.db2.gz PLZLXRVETHUGMW-UHFFFAOYSA-N 2 1 341.474 4.032 20 0 EIADMP Cc1cccnc1CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000583692971 1029045146 /nfs/dbraw/zinc/04/51/46/1029045146.db2.gz RQDJKSUOFLIEHT-OAQYLSRUSA-N 2 1 349.522 4.109 20 0 EIADMP Cc1cccnc1CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000583692971 1029045156 /nfs/dbraw/zinc/04/51/56/1029045156.db2.gz RQDJKSUOFLIEHT-OAQYLSRUSA-N 2 1 349.522 4.109 20 0 EIADMP CCC[N@H+]1CC[C@@H](CN[C@@H](C)c2nc(-c3ccccc3)cs2)C1 ZINC000151136431 1029145747 /nfs/dbraw/zinc/14/57/47/1029145747.db2.gz QVDJXEVDCKRJMK-HOTGVXAUSA-N 2 1 329.513 4.193 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3O)cc1 ZINC000130454531 1029182841 /nfs/dbraw/zinc/18/28/41/1029182841.db2.gz SFYZFYVIWWTWEY-JLTOFOAXSA-N 2 1 333.435 4.224 20 0 EIADMP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000583826819 1029243825 /nfs/dbraw/zinc/24/38/25/1029243825.db2.gz CBHZFJDSRJVGLJ-INIZCTEOSA-N 2 1 325.500 4.076 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2c[nH]nc2C(C)(C)C)CC1)CC1CC1 ZINC000536141294 1029255293 /nfs/dbraw/zinc/25/52/93/1029255293.db2.gz QLQMRTRIJIIIPR-UHFFFAOYSA-N 2 1 346.563 4.041 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[N@H+]2[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168057921 1029355249 /nfs/dbraw/zinc/35/52/49/1029355249.db2.gz OPOKHMVJPAKWFO-BWODRTSOSA-N 2 1 342.527 4.070 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168057921 1029355264 /nfs/dbraw/zinc/35/52/64/1029355264.db2.gz OPOKHMVJPAKWFO-BWODRTSOSA-N 2 1 342.527 4.070 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[NH+]2[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168057921 1029355283 /nfs/dbraw/zinc/35/52/83/1029355283.db2.gz OPOKHMVJPAKWFO-BWODRTSOSA-N 2 1 342.527 4.070 20 0 EIADMP COC1C[C@H]2CC[C@@H](C1)[NH+]2[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168057921 1029355298 /nfs/dbraw/zinc/35/52/98/1029355298.db2.gz OPOKHMVJPAKWFO-BWODRTSOSA-N 2 1 342.527 4.070 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)CCS2 ZINC000343494393 1029367806 /nfs/dbraw/zinc/36/78/06/1029367806.db2.gz FIHMCEFVRORSJR-APWZRJJASA-N 2 1 348.556 4.334 20 0 EIADMP CCC[N@@H+](C1CCOCC1)[C@@H]1C[C@@H](C)N(Cc2ccccc2)[C@@H](C)C1 ZINC001168059632 1029436803 /nfs/dbraw/zinc/43/68/03/1029436803.db2.gz USQPLUTXAFCUSS-HATOLVCRSA-N 2 1 344.543 4.319 20 0 EIADMP CCC[N@H+](C1CCOCC1)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168059632 1029436811 /nfs/dbraw/zinc/43/68/11/1029436811.db2.gz USQPLUTXAFCUSS-HATOLVCRSA-N 2 1 344.543 4.319 20 0 EIADMP CCC[N@@H+](C1CCOCC1)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168059632 1029436819 /nfs/dbraw/zinc/43/68/19/1029436819.db2.gz USQPLUTXAFCUSS-HATOLVCRSA-N 2 1 344.543 4.319 20 0 EIADMP CCC[NH+](C1CCOCC1)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168059632 1029436824 /nfs/dbraw/zinc/43/68/24/1029436824.db2.gz USQPLUTXAFCUSS-HATOLVCRSA-N 2 1 344.543 4.319 20 0 EIADMP CCC[NH+](C1CCOCC1)[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168059632 1029436841 /nfs/dbraw/zinc/43/68/41/1029436841.db2.gz USQPLUTXAFCUSS-HATOLVCRSA-N 2 1 344.543 4.319 20 0 EIADMP C[C@H](CCc1ccsc1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475265287 1029475271 /nfs/dbraw/zinc/47/52/71/1029475271.db2.gz IAKYENKSBAKLTK-XLIONFOSSA-N 2 1 328.525 4.181 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CC[C@H](c4ccccc4)C3)C2)cc1 ZINC000475276618 1029481745 /nfs/dbraw/zinc/48/17/45/1029481745.db2.gz PHGFMRLCTISBTC-AKIFATBCSA-N 2 1 334.507 4.434 20 0 EIADMP C[C@H](CCc1ccc(F)cc1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475270423 1029486754 /nfs/dbraw/zinc/48/67/54/1029486754.db2.gz SEXAYVRXHQITJI-WIYYLYMNSA-N 2 1 340.486 4.259 20 0 EIADMP CC(C)(C)c1ncc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000192926314 1029646019 /nfs/dbraw/zinc/64/60/19/1029646019.db2.gz BHSXSVYCUCCGHL-KRWDZBQOSA-N 2 1 343.540 4.052 20 0 EIADMP CC(C)(C)c1ncc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000192926314 1029646029 /nfs/dbraw/zinc/64/60/29/1029646029.db2.gz BHSXSVYCUCCGHL-KRWDZBQOSA-N 2 1 343.540 4.052 20 0 EIADMP COc1cccc([C@@H](CNc2cc[nH+]c3ccsc32)[NH+](C)C)c1 ZINC000301349981 1029713360 /nfs/dbraw/zinc/71/33/60/1029713360.db2.gz JMIMPSGIEJIGEH-QGZVFWFLSA-N 2 1 327.453 4.020 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000708510422 1029743384 /nfs/dbraw/zinc/74/33/84/1029743384.db2.gz JXVSRBSVBCUHFN-UZLBHIALSA-N 2 1 344.449 4.482 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNCc1ccccc1Cl ZINC000708519854 1029743857 /nfs/dbraw/zinc/74/38/57/1029743857.db2.gz KCVXAEZIGVYGHM-LPHOPBHVSA-N 2 1 328.887 4.198 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccccc1Cl ZINC000708519854 1029743862 /nfs/dbraw/zinc/74/38/62/1029743862.db2.gz KCVXAEZIGVYGHM-LPHOPBHVSA-N 2 1 328.887 4.198 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccccc1Cl ZINC000708519854 1029743872 /nfs/dbraw/zinc/74/38/72/1029743872.db2.gz KCVXAEZIGVYGHM-LPHOPBHVSA-N 2 1 328.887 4.198 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)c2c1 ZINC000301763398 1029805031 /nfs/dbraw/zinc/80/50/31/1029805031.db2.gz GOJMHBLYQYLONF-AUUYWEPGSA-N 2 1 341.886 4.341 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000301763398 1029805034 /nfs/dbraw/zinc/80/50/34/1029805034.db2.gz GOJMHBLYQYLONF-AUUYWEPGSA-N 2 1 341.886 4.341 20 0 EIADMP Cc1cc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c2cc(F)ccc2[nH+]1 ZINC000301793062 1029809669 /nfs/dbraw/zinc/80/96/69/1029809669.db2.gz RQKBFVPMNMBWAL-FOIQADDNSA-N 2 1 339.458 4.135 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccc(F)cn1 ZINC000092739287 1029841413 /nfs/dbraw/zinc/84/14/13/1029841413.db2.gz OAQSRBLYJZDOQE-KRWDZBQOSA-N 2 1 341.474 4.303 20 0 EIADMP FC(F)(F)c1cccc([C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CC2)c1 ZINC000091284506 1029882185 /nfs/dbraw/zinc/88/21/85/1029882185.db2.gz UDAASVJVOSSRAX-UGSOOPFHSA-N 2 1 338.417 4.230 20 0 EIADMP FC(F)(F)c1cccc([C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CC2)c1 ZINC000091284508 1029882559 /nfs/dbraw/zinc/88/25/59/1029882559.db2.gz UDAASVJVOSSRAX-ACJLOTCBSA-N 2 1 338.417 4.230 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cccnc1 ZINC000091313590 1029883283 /nfs/dbraw/zinc/88/32/83/1029883283.db2.gz TXPDWNSVXUDSTC-XLIONFOSSA-N 2 1 343.540 4.342 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccnc1 ZINC000091313590 1029883284 /nfs/dbraw/zinc/88/32/84/1029883284.db2.gz TXPDWNSVXUDSTC-XLIONFOSSA-N 2 1 343.540 4.342 20 0 EIADMP CC(C)[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1)c1cccnc1 ZINC000091310345 1029883676 /nfs/dbraw/zinc/88/36/76/1029883676.db2.gz SZBKJFJSLSFOQK-OAQYLSRUSA-N 2 1 325.500 4.409 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)s2)cc1 ZINC000092073920 1029899913 /nfs/dbraw/zinc/89/99/13/1029899913.db2.gz UZXRSIDLULWDBM-INIZCTEOSA-N 2 1 338.480 4.221 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccc(F)cn1 ZINC000092720871 1029932165 /nfs/dbraw/zinc/93/21/65/1029932165.db2.gz XLWAEKYMSYRKCK-MRXNPFEDSA-N 2 1 327.447 4.057 20 0 EIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000525694897 1029937378 /nfs/dbraw/zinc/93/73/78/1029937378.db2.gz QBVMMBUYMDLQKU-IAGOWNOFSA-N 2 1 326.484 4.356 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000525786790 1030002938 /nfs/dbraw/zinc/00/29/38/1030002938.db2.gz OGDVIPIGJGNITI-CABCVRRESA-N 2 1 342.405 4.064 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000525786790 1030002949 /nfs/dbraw/zinc/00/29/49/1030002949.db2.gz OGDVIPIGJGNITI-CABCVRRESA-N 2 1 342.405 4.064 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(Br)s1 ZINC000525859027 1030081659 /nfs/dbraw/zinc/08/16/59/1030081659.db2.gz OXJSUDRTNVKMNW-NSHDSACASA-N 2 1 343.334 4.036 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2c(Cl)cccc2Cl)CCC1 ZINC000447571379 1030158731 /nfs/dbraw/zinc/15/87/31/1030158731.db2.gz XXIAANBZCJNINZ-XJKSGUPXSA-N 2 1 341.326 4.345 20 0 EIADMP CCOC1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000657881766 1030163678 /nfs/dbraw/zinc/16/36/78/1030163678.db2.gz VIQJKHDJUFIXLK-QMIIDVESSA-N 2 1 342.527 4.119 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H](c2cccnc2)C2CC2)C3)cc1 ZINC000447588805 1030187711 /nfs/dbraw/zinc/18/77/11/1030187711.db2.gz VNTDPFGVYHXBDI-BXXSPATCSA-N 2 1 347.506 4.318 20 0 EIADMP FC1(F)CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000447578777 1030207185 /nfs/dbraw/zinc/20/71/85/1030207185.db2.gz HHPZPIHSPBNQDP-MKXGPGLRSA-N 2 1 334.454 4.350 20 0 EIADMP FC1(F)CC(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC000451064398 1030212584 /nfs/dbraw/zinc/21/25/84/1030212584.db2.gz IQMIGBKYGIXCNC-UHFFFAOYSA-N 2 1 334.454 4.020 20 0 EIADMP C[C@@H](CC[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000447735316 1030311851 /nfs/dbraw/zinc/31/18/51/1030311851.db2.gz CVXCFBZANCNWSL-SLFFLAALSA-N 2 1 344.543 4.001 20 0 EIADMP CC(C)CCOc1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000685443828 1030320523 /nfs/dbraw/zinc/32/05/23/1030320523.db2.gz WVCYPTZADFCUGY-YOFSQIOKSA-N 2 1 330.516 4.169 20 0 EIADMP CC(C)CCOc1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000685443828 1030320537 /nfs/dbraw/zinc/32/05/37/1030320537.db2.gz WVCYPTZADFCUGY-YOFSQIOKSA-N 2 1 330.516 4.169 20 0 EIADMP CC(C)CCOc1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000685443828 1030320551 /nfs/dbraw/zinc/32/05/51/1030320551.db2.gz WVCYPTZADFCUGY-YOFSQIOKSA-N 2 1 330.516 4.169 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358421 1030338314 /nfs/dbraw/zinc/33/83/14/1030338314.db2.gz ZQKPMSQORVLIAF-VAMGGRTRSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358421 1030338332 /nfs/dbraw/zinc/33/83/32/1030338332.db2.gz ZQKPMSQORVLIAF-VAMGGRTRSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358421 1030338349 /nfs/dbraw/zinc/33/83/49/1030338349.db2.gz ZQKPMSQORVLIAF-VAMGGRTRSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358421 1030338363 /nfs/dbraw/zinc/33/83/63/1030338363.db2.gz ZQKPMSQORVLIAF-VAMGGRTRSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358421 1030338380 /nfs/dbraw/zinc/33/83/80/1030338380.db2.gz ZQKPMSQORVLIAF-VAMGGRTRSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1cccc2cccnc21 ZINC000708571138 1030392404 /nfs/dbraw/zinc/39/24/04/1030392404.db2.gz QRYGAPPCCUQJCV-PGRDOPGGSA-N 2 1 345.490 4.093 20 0 EIADMP Cc1cc(C(C)(C)C)cc2c1OCCC[C@@H]2[NH2+]CCc1c[nH+]cn1C ZINC000530460420 1030437329 /nfs/dbraw/zinc/43/73/29/1030437329.db2.gz TVVSXBRCBKBHAZ-IBGZPJMESA-N 2 1 341.499 4.072 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1nccn1-c1ccccc1 ZINC000190706540 1030576673 /nfs/dbraw/zinc/57/66/73/1030576673.db2.gz QZAIEDVVYMNXBL-UHFFFAOYSA-N 2 1 348.494 4.004 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3csc(Cl)c3)CC2)[nH+]c1 ZINC000191306259 1030614600 /nfs/dbraw/zinc/61/46/00/1030614600.db2.gz OMCWWSXGGKAPKJ-CYBMUJFWSA-N 2 1 335.904 4.425 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)C[C@H]1C ZINC000530663225 1030618633 /nfs/dbraw/zinc/61/86/33/1030618633.db2.gz YNSHKOXVEPOUSC-ZBFHGGJFSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Cl)c3cccnc23)C[C@H]1C ZINC000530663225 1030618641 /nfs/dbraw/zinc/61/86/41/1030618641.db2.gz YNSHKOXVEPOUSC-ZBFHGGJFSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c3cccnc23)C[C@H]1C ZINC000530663225 1030618649 /nfs/dbraw/zinc/61/86/49/1030618649.db2.gz YNSHKOXVEPOUSC-ZBFHGGJFSA-N 2 1 331.891 4.193 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccncc3s2)C1 ZINC000657932155 1030637910 /nfs/dbraw/zinc/63/79/10/1030637910.db2.gz UQPQMHBWDDNADY-JKSUJKDBSA-N 2 1 331.529 4.315 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527349641 1030640953 /nfs/dbraw/zinc/64/09/53/1030640953.db2.gz PVYVVBGCFVMPMX-NXHRZFHOSA-N 2 1 342.449 4.464 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(F)cc1F ZINC000122351270 1030808937 /nfs/dbraw/zinc/80/89/37/1030808937.db2.gz ZESAIWNUNVULLP-LJQANCHMSA-N 2 1 348.437 4.146 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccc3cc[nH]c3c2)CC1 ZINC000527659566 1030813412 /nfs/dbraw/zinc/81/34/12/1030813412.db2.gz BBJBHVOIVOUCRM-KRWDZBQOSA-N 2 1 333.479 4.483 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)c1ccccn1 ZINC000658066534 1030814639 /nfs/dbraw/zinc/81/46/39/1030814639.db2.gz MJXQFIANKRHLSJ-KPUOSGPGSA-N 2 1 349.522 4.218 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCCOC(C)(C)C)CC1 ZINC000658188627 1030872777 /nfs/dbraw/zinc/87/27/77/1030872777.db2.gz SLPVXUVWVYAWCR-UHFFFAOYSA-N 2 1 332.532 4.224 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC[C@@]2(C)CC2(F)F)CC1 ZINC000658217931 1030893850 /nfs/dbraw/zinc/89/38/50/1030893850.db2.gz BEMAXWXEVWKOJD-ACBHZAAOSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCSc2ccccc2Cl)CC[N@@H+]1C ZINC000531143400 1030917777 /nfs/dbraw/zinc/91/77/77/1030917777.db2.gz IZOICXCKQWSUAQ-HUUCEWRRSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCSc2ccccc2Cl)CC[N@H+]1C ZINC000531143400 1030917791 /nfs/dbraw/zinc/91/77/91/1030917791.db2.gz IZOICXCKQWSUAQ-HUUCEWRRSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)CCCSc2ccccc2Cl)CC[NH+]1C ZINC000531143400 1030917800 /nfs/dbraw/zinc/91/78/00/1030917800.db2.gz IZOICXCKQWSUAQ-HUUCEWRRSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCSc2ccccc2Cl)CC[NH+]1C ZINC000531143400 1030917803 /nfs/dbraw/zinc/91/78/03/1030917803.db2.gz IZOICXCKQWSUAQ-HUUCEWRRSA-N 2 1 326.937 4.237 20 0 EIADMP CC1(C)[C@@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1(F)F ZINC000658280752 1030937852 /nfs/dbraw/zinc/93/78/52/1030937852.db2.gz LCKZLVROWVDLOO-XMTFNYHQSA-N 2 1 334.454 4.063 20 0 EIADMP CC1(C)[C@@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1(F)F ZINC000658280753 1030939352 /nfs/dbraw/zinc/93/93/52/1030939352.db2.gz LCKZLVROWVDLOO-ZJPYXAASSA-N 2 1 334.454 4.063 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCCc1c(F)cccc1F ZINC000653642817 1030983938 /nfs/dbraw/zinc/98/39/38/1030983938.db2.gz XUHNOQOKAQYVIG-UHFFFAOYSA-N 2 1 335.442 4.069 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCCc1c(F)cccc1F ZINC000653642817 1030983961 /nfs/dbraw/zinc/98/39/61/1030983961.db2.gz XUHNOQOKAQYVIG-UHFFFAOYSA-N 2 1 335.442 4.069 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)C1CCOCC1 ZINC000532459777 1031109049 /nfs/dbraw/zinc/10/90/49/1031109049.db2.gz IVSHHGSSUUXKFV-XMSQKQJNSA-N 2 1 344.543 4.213 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)C1CCOCC1 ZINC000532459774 1031109699 /nfs/dbraw/zinc/10/96/99/1031109699.db2.gz IVSHHGSSUUXKFV-AVRDEDQJSA-N 2 1 344.543 4.213 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@H]3CC)CC2)cs1 ZINC000532505322 1031223938 /nfs/dbraw/zinc/22/39/38/1031223938.db2.gz CUAFRHDOQQLNHE-SJLPKXTDSA-N 2 1 335.561 4.086 20 0 EIADMP FC1(C[NH+]2CCC(c3c(Cl)cccc3Cl)CC2)CC[NH2+]CC1 ZINC001204847722 1031313248 /nfs/dbraw/zinc/31/32/48/1031313248.db2.gz FIRRBYVMWVVKGZ-UHFFFAOYSA-N 2 1 345.289 4.265 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@@H]1C ZINC000532589649 1031321484 /nfs/dbraw/zinc/32/14/84/1031321484.db2.gz ROVIOMMRJWFCJD-QFBILLFUSA-N 2 1 330.516 4.119 20 0 EIADMP CCN1CC[C@@H]([N@H+](C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@@H]1C ZINC000532589649 1031321502 /nfs/dbraw/zinc/32/15/02/1031321502.db2.gz ROVIOMMRJWFCJD-QFBILLFUSA-N 2 1 330.516 4.119 20 0 EIADMP CCN1CC[C@@H]([N@@H+](C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@@H]1C ZINC000532589649 1031321518 /nfs/dbraw/zinc/32/15/18/1031321518.db2.gz ROVIOMMRJWFCJD-QFBILLFUSA-N 2 1 330.516 4.119 20 0 EIADMP COc1cccc2c(C[NH+]3CCC(Cc4[nH+]ccn4C)CC3)cccc12 ZINC000449029113 1031362912 /nfs/dbraw/zinc/36/29/12/1031362912.db2.gz PXFGDBMEGVFFDT-UHFFFAOYSA-N 2 1 349.478 4.037 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]CC2=Cc3ccccc3OC2)CC1 ZINC000116368267 1031383901 /nfs/dbraw/zinc/38/39/01/1031383901.db2.gz CTVNRDVFIUPVME-SFHVURJKSA-N 2 1 348.490 4.278 20 0 EIADMP Cn1ncc2c1CCC[C@@H]2[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449075061 1031428484 /nfs/dbraw/zinc/42/84/84/1031428484.db2.gz MFVUBIKKZSZNJM-SFHVURJKSA-N 2 1 346.563 4.066 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@H]2CCOC3(CCC3)C2)cc1 ZINC000449080390 1031435286 /nfs/dbraw/zinc/43/52/86/1031435286.db2.gz VTTAYHOTQNXRDC-NQIIRXRSSA-N 2 1 342.527 4.252 20 0 EIADMP CCc1nc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)cs1 ZINC000531655488 1031449413 /nfs/dbraw/zinc/44/94/13/1031449413.db2.gz MFSTZXMKEBWOLJ-INIZCTEOSA-N 2 1 335.561 4.182 20 0 EIADMP CCc1nc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)cs1 ZINC000531655488 1031449425 /nfs/dbraw/zinc/44/94/25/1031449425.db2.gz MFSTZXMKEBWOLJ-INIZCTEOSA-N 2 1 335.561 4.182 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000531692291 1031463445 /nfs/dbraw/zinc/46/34/45/1031463445.db2.gz KIBKQQGOJYOFMX-QGZVFWFLSA-N 2 1 344.474 4.037 20 0 EIADMP Cc1cccc(N2CCC([NH2+]C[C@@H](C)c3cc(F)cc(F)c3)CC2)[nH+]1 ZINC000449141424 1031478616 /nfs/dbraw/zinc/47/86/16/1031478616.db2.gz LJPUDPNWRPQANM-CQSZACIVSA-N 2 1 345.437 4.030 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3cc(C)ccc32)c1 ZINC000123914428 1031493263 /nfs/dbraw/zinc/49/32/63/1031493263.db2.gz SOTGBNULVKXIRS-NRFANRHFSA-N 2 1 338.495 4.450 20 0 EIADMP Cn1ccc(C[NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)c1 ZINC000124102363 1031505429 /nfs/dbraw/zinc/50/54/29/1031505429.db2.gz QDBSOVXOZNCEOD-UHFFFAOYSA-N 2 1 325.500 4.079 20 0 EIADMP CC(C)[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1CC1 ZINC000531725026 1031526900 /nfs/dbraw/zinc/52/69/00/1031526900.db2.gz UMRHQYGJKLFRPZ-OAQYLSRUSA-N 2 1 326.484 4.436 20 0 EIADMP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](c2cccnc2)C2CC2)CC1 ZINC000449202808 1031546753 /nfs/dbraw/zinc/54/67/53/1031546753.db2.gz GRKCEVGKIMDXDF-FDDCHVKYSA-N 2 1 349.522 4.218 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C1(c2cccc(Br)c2)CCC1 ZINC000125084111 1031570944 /nfs/dbraw/zinc/57/09/44/1031570944.db2.gz KHAABCPGPQDYDU-UHFFFAOYSA-N 2 1 348.288 4.013 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CCCc3ccccn3)[C@H]3CCC[C@H]32)cc1 ZINC000453163303 1031665147 /nfs/dbraw/zinc/66/51/47/1031665147.db2.gz PXXDVVCJCTYYCO-XPWALMASSA-N 2 1 349.522 4.047 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CCCc3ccccn3)[C@@H]3CCC[C@H]32)cc1 ZINC000453163297 1031665180 /nfs/dbraw/zinc/66/51/80/1031665180.db2.gz PXXDVVCJCTYYCO-RJGXRXQPSA-N 2 1 349.522 4.047 20 0 EIADMP Cc1nccn1CCC[N@H+](CC(C)C)[C@@H]1CCCc2cccnc21 ZINC000126884340 1031666980 /nfs/dbraw/zinc/66/69/80/1031666980.db2.gz RIHFREFOVVWDQO-LJQANCHMSA-N 2 1 326.488 4.012 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](CC(C)C)[C@@H]1CCCc2cccnc21 ZINC000126884340 1031666987 /nfs/dbraw/zinc/66/69/87/1031666987.db2.gz RIHFREFOVVWDQO-LJQANCHMSA-N 2 1 326.488 4.012 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](CC(C)C)[C@@H]1CCCc2cccnc21 ZINC000126884340 1031666996 /nfs/dbraw/zinc/66/69/96/1031666996.db2.gz RIHFREFOVVWDQO-LJQANCHMSA-N 2 1 326.488 4.012 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccn2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449411958 1031696090 /nfs/dbraw/zinc/69/60/90/1031696090.db2.gz DKPLFRXNWBKQJW-QFIPXVFZSA-N 2 1 349.522 4.204 20 0 EIADMP COc1cccc([C@H]2C[N@H+](CCCCn3cc[nH+]c3C)CC2(C)C)c1 ZINC000528627557 1031705133 /nfs/dbraw/zinc/70/51/33/1031705133.db2.gz VWOACJOSCJGKSN-HXUWFJFHSA-N 2 1 341.499 4.106 20 0 EIADMP COc1cccc([C@H]2C[N@@H+](CCCCn3cc[nH+]c3C)CC2(C)C)c1 ZINC000528627557 1031705147 /nfs/dbraw/zinc/70/51/47/1031705147.db2.gz VWOACJOSCJGKSN-HXUWFJFHSA-N 2 1 341.499 4.106 20 0 EIADMP FC(F)C1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)CC1 ZINC000453228676 1031748054 /nfs/dbraw/zinc/74/80/54/1031748054.db2.gz UTBGRQFFYXVERG-KSZLIROESA-N 2 1 334.454 4.065 20 0 EIADMP C/C=C/COc1ccc(CC[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000449560322 1031847738 /nfs/dbraw/zinc/84/77/38/1031847738.db2.gz JJJMNEODENUPIH-ZIXFQYOSSA-N 2 1 342.527 4.177 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccccc2C(F)(F)F)C1 ZINC000531958971 1031878523 /nfs/dbraw/zinc/87/85/23/1031878523.db2.gz HCMKGAVIKAHKPO-HUUCEWRRSA-N 2 1 328.422 4.476 20 0 EIADMP C[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@@H+](C)C[C@@H]1C)c1c(Cl)cccc1Cl ZINC000531963664 1031883824 /nfs/dbraw/zinc/88/38/24/1031883824.db2.gz LNNLFEFSMYYNES-OQMKEHIESA-N 2 1 329.315 4.415 20 0 EIADMP CCOc1ccccc1C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000132221532 1031909648 /nfs/dbraw/zinc/90/96/48/1031909648.db2.gz HHKVVTNIMNWHTF-MRXNPFEDSA-N 2 1 335.451 4.430 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cccc(Br)c21 ZINC000453366822 1031909525 /nfs/dbraw/zinc/90/95/25/1031909525.db2.gz SWLNWJYQITZZPD-JYCGFUEUSA-N 2 1 349.316 4.212 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453373227 1031919554 /nfs/dbraw/zinc/91/95/54/1031919554.db2.gz WZFLZFSHYSQAGU-KRXYWNSISA-N 2 1 328.500 4.239 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000531980848 1031925238 /nfs/dbraw/zinc/92/52/38/1031925238.db2.gz WOLAVFKONUKRRB-YDHLFZDLSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000531980848 1031925255 /nfs/dbraw/zinc/92/52/55/1031925255.db2.gz WOLAVFKONUKRRB-YDHLFZDLSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000531980848 1031925265 /nfs/dbraw/zinc/92/52/65/1031925265.db2.gz WOLAVFKONUKRRB-YDHLFZDLSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000531980848 1031925275 /nfs/dbraw/zinc/92/52/75/1031925275.db2.gz WOLAVFKONUKRRB-YDHLFZDLSA-N 2 1 347.503 4.391 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)c2ccccc12 ZINC000453405874 1031941712 /nfs/dbraw/zinc/94/17/12/1031941712.db2.gz QQFKQWVOVBKQRH-MRXNPFEDSA-N 2 1 326.484 4.373 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(F)c(Br)c1 ZINC000453408200 1031943430 /nfs/dbraw/zinc/94/34/30/1031943430.db2.gz SMWSMUIIWFMGFK-LBPRGKRZSA-N 2 1 343.284 4.113 20 0 EIADMP C[N@@H+](CCCC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)C1CC1 ZINC000453411464 1031947396 /nfs/dbraw/zinc/94/73/96/1031947396.db2.gz VNXBGPSRBDCXBG-UHFFFAOYSA-N 3 1 337.596 4.130 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000531993446 1031959431 /nfs/dbraw/zinc/95/94/31/1031959431.db2.gz REIDHIUROASVGN-HVETUWLQSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000531993446 1031959447 /nfs/dbraw/zinc/95/94/47/1031959447.db2.gz REIDHIUROASVGN-HVETUWLQSA-N 2 1 338.470 4.313 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)s1 ZINC000449774341 1031998050 /nfs/dbraw/zinc/99/80/50/1031998050.db2.gz OQLQHPVMYFFLDC-HOCLYGCPSA-N 2 1 349.931 4.284 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000512646588 1033613245 /nfs/dbraw/zinc/61/32/45/1033613245.db2.gz BMWAUGSCCQIEGO-FUMNGEBKSA-N 2 1 348.481 4.455 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@@H+]([C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000411275241 1033787849 /nfs/dbraw/zinc/78/78/49/1033787849.db2.gz XTHXIBHESMJIIV-UZLBHIALSA-N 2 1 328.887 4.313 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@H+]([C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000411275241 1033787867 /nfs/dbraw/zinc/78/78/67/1033787867.db2.gz XTHXIBHESMJIIV-UZLBHIALSA-N 2 1 328.887 4.313 20 0 EIADMP c1cc(C[N@H+]2CCC[C@@H]2C2CCOCC2)cc(C[NH+]2CCCCC2)c1 ZINC000411500007 1033941502 /nfs/dbraw/zinc/94/15/02/1033941502.db2.gz REVLKJUHOYSYQW-JOCHJYFZSA-N 2 1 342.527 4.064 20 0 EIADMP C[C@@H](C[NH2+]Cc1ccccc1OCc1ccccc1)C[NH+]1CCCC1 ZINC000513070416 1034489639 /nfs/dbraw/zinc/48/96/39/1034489639.db2.gz PHDNGPANAYKWDM-IBGZPJMESA-N 2 1 338.495 4.087 20 0 EIADMP c1cnc2ccc(C[N@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)cc2c1 ZINC000513419302 1034925065 /nfs/dbraw/zinc/92/50/65/1034925065.db2.gz GPEKUWNWPVGPBM-HXUWFJFHSA-N 2 1 337.511 4.323 20 0 EIADMP c1cnc2ccc(C[N@@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)cc2c1 ZINC000513419302 1034925075 /nfs/dbraw/zinc/92/50/75/1034925075.db2.gz GPEKUWNWPVGPBM-HXUWFJFHSA-N 2 1 337.511 4.323 20 0 EIADMP CCOc1cccc(C[N@@H+](C)C2CCN(Cc3ccccc3)CC2)c1 ZINC000513449823 1034961228 /nfs/dbraw/zinc/96/12/28/1034961228.db2.gz ABLDLHDOLPHAMB-UHFFFAOYSA-N 2 1 338.495 4.182 20 0 EIADMP CCOc1cccc(CN(C)C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000513449823 1034961243 /nfs/dbraw/zinc/96/12/43/1034961243.db2.gz ABLDLHDOLPHAMB-UHFFFAOYSA-N 2 1 338.495 4.182 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2ccc(Cl)o2)C[N@H+]1Cc1ccccc1 ZINC000513501539 1034998254 /nfs/dbraw/zinc/99/82/54/1034998254.db2.gz TVTQRHXIURNJQL-DOTOQJQBSA-N 2 1 332.875 4.323 20 0 EIADMP C[NH+](C)[C@H](CNc1cc[nH+]c2ccc(Cl)cc12)c1cccs1 ZINC000513651978 1035080693 /nfs/dbraw/zinc/08/06/93/1035080693.db2.gz HGLPTSUNSJGKLA-MRXNPFEDSA-N 2 1 331.872 4.086 20 0 EIADMP C[C@@H](c1cccc(F)c1)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501018137 1035350832 /nfs/dbraw/zinc/35/08/32/1035350832.db2.gz CUPGQHHRXTWCRD-INIZCTEOSA-N 2 1 327.447 4.130 20 0 EIADMP C[C@H](c1cccc(F)c1)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501018138 1035351026 /nfs/dbraw/zinc/35/10/26/1035351026.db2.gz CUPGQHHRXTWCRD-MRXNPFEDSA-N 2 1 327.447 4.130 20 0 EIADMP C[C@@H](c1ccccc1F)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501049479 1035358952 /nfs/dbraw/zinc/35/89/52/1035358952.db2.gz JHLICUHVRMTBQA-INIZCTEOSA-N 2 1 327.447 4.130 20 0 EIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501417421 1035440172 /nfs/dbraw/zinc/44/01/72/1035440172.db2.gz AYCWEIYDUWCEIA-GGPKGHCWSA-N 2 1 329.532 4.208 20 0 EIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501417421 1035440179 /nfs/dbraw/zinc/44/01/79/1035440179.db2.gz AYCWEIYDUWCEIA-GGPKGHCWSA-N 2 1 329.532 4.208 20 0 EIADMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2nc(-c3ccccc3Cl)cs2)C1 ZINC000420303715 1035505439 /nfs/dbraw/zinc/50/54/39/1035505439.db2.gz DAJVVVUVSDZXSM-CYBMUJFWSA-N 2 1 335.904 4.024 20 0 EIADMP Clc1ccccc1-c1csc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)n1 ZINC000420308696 1035507165 /nfs/dbraw/zinc/50/71/65/1035507165.db2.gz NVVZCDHMIZIBEI-UHFFFAOYSA-N 2 1 347.915 4.039 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315684 1035509304 /nfs/dbraw/zinc/50/93/04/1035509304.db2.gz XEPDGSZYZDPIMX-ZFZWDLNGSA-N 2 1 345.874 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315684 1035509318 /nfs/dbraw/zinc/50/93/18/1035509318.db2.gz XEPDGSZYZDPIMX-ZFZWDLNGSA-N 2 1 345.874 4.034 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420326859 1035533423 /nfs/dbraw/zinc/53/34/23/1035533423.db2.gz XSWMONHUSDQKKZ-IAGOWNOFSA-N 2 1 343.540 4.419 20 0 EIADMP Brc1ccc([C@@H]2CCC[N@H+]2CCC2CC[NH2+]CC2)s1 ZINC000420377150 1035560259 /nfs/dbraw/zinc/56/02/59/1035560259.db2.gz RRLZEZOMUWZFPB-ZDUSSCGKSA-N 2 1 343.334 4.037 20 0 EIADMP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)CC3 ZINC000491043099 1035793546 /nfs/dbraw/zinc/79/35/46/1035793546.db2.gz YZIYFYSDOWEDAL-ROUUACIJSA-N 2 1 339.527 4.044 20 0 EIADMP CC(C)[NH2+]CCCC[C@H]([NH3+])c1nc(-c2cccc3ccccc32)no1 ZINC001212145215 1035898043 /nfs/dbraw/zinc/89/80/43/1035898043.db2.gz OMMRYMZJPFTROF-SFHVURJKSA-N 2 1 338.455 4.058 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090593 1035943466 /nfs/dbraw/zinc/94/34/66/1035943466.db2.gz GHUSSRTXJLVXLT-KDOFPFPSSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090593 1035943506 /nfs/dbraw/zinc/94/35/06/1035943506.db2.gz GHUSSRTXJLVXLT-KDOFPFPSSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090593 1035943531 /nfs/dbraw/zinc/94/35/31/1035943531.db2.gz GHUSSRTXJLVXLT-KDOFPFPSSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(F)c(-c2cccs2)c1 ZINC000571090593 1035943572 /nfs/dbraw/zinc/94/35/72/1035943572.db2.gz GHUSSRTXJLVXLT-KDOFPFPSSA-N 2 1 332.488 4.326 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000502285034 1036041420 /nfs/dbraw/zinc/04/14/20/1036041420.db2.gz SWPJOXCVANDCNI-RBFDBLARSA-N 2 1 340.433 4.382 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000502285034 1036041442 /nfs/dbraw/zinc/04/14/42/1036041442.db2.gz SWPJOXCVANDCNI-RBFDBLARSA-N 2 1 340.433 4.382 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000502285034 1036041463 /nfs/dbraw/zinc/04/14/63/1036041463.db2.gz SWPJOXCVANDCNI-RBFDBLARSA-N 2 1 340.433 4.382 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000502285034 1036041488 /nfs/dbraw/zinc/04/14/88/1036041488.db2.gz SWPJOXCVANDCNI-RBFDBLARSA-N 2 1 340.433 4.382 20 0 EIADMP C[C@@H](N[C@@H](C)c1cnn(C2CCCC2)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000502469653 1036247348 /nfs/dbraw/zinc/24/73/48/1036247348.db2.gz CWWZEARNNUJVNN-FGTMMUONSA-N 2 1 344.547 4.302 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cnn(C2CCCC2)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000502469653 1036247367 /nfs/dbraw/zinc/24/73/67/1036247367.db2.gz CWWZEARNNUJVNN-FGTMMUONSA-N 2 1 344.547 4.302 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cnn(C2CCCC2)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000502469653 1036247391 /nfs/dbraw/zinc/24/73/91/1036247391.db2.gz CWWZEARNNUJVNN-FGTMMUONSA-N 2 1 344.547 4.302 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CC23CCSCC3)cc1 ZINC000421374267 1036324450 /nfs/dbraw/zinc/32/44/50/1036324450.db2.gz HGLZTJSBLGMTCT-CRAIPNDOSA-N 2 1 341.524 4.365 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC23CCSCC3)CC[N@@H+]1Cc1ccccc1 ZINC000421388014 1036348237 /nfs/dbraw/zinc/34/82/37/1036348237.db2.gz SSFNQHQDPSIPOF-RLLQIKCJSA-N 2 1 344.568 4.162 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC23CCSCC3)CC[N@H+]1Cc1ccccc1 ZINC000421388014 1036348261 /nfs/dbraw/zinc/34/82/61/1036348261.db2.gz SSFNQHQDPSIPOF-RLLQIKCJSA-N 2 1 344.568 4.162 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2ccc(F)cc2F)CCCC1 ZINC000486079829 1036465834 /nfs/dbraw/zinc/46/58/34/1036465834.db2.gz QGLMYQLUFRVJFR-VCBZYWHSSA-N 2 1 336.470 4.095 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)oc1C ZINC000502708264 1036547385 /nfs/dbraw/zinc/54/73/85/1036547385.db2.gz OVGFYDXPYWWLPT-XLIONFOSSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)oc1C ZINC000502708264 1036547412 /nfs/dbraw/zinc/54/74/12/1036547412.db2.gz OVGFYDXPYWWLPT-XLIONFOSSA-N 2 1 326.484 4.112 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)CC1 ZINC000602709886 1036581665 /nfs/dbraw/zinc/58/16/65/1036581665.db2.gz JKAKYPCQCGQEFL-AZUAARDMSA-N 2 1 344.568 4.477 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)CC1 ZINC000602709886 1036581687 /nfs/dbraw/zinc/58/16/87/1036581687.db2.gz JKAKYPCQCGQEFL-AZUAARDMSA-N 2 1 344.568 4.477 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+][C@@H]3CCC[C@H]3C(C)(C)C)sc2C1 ZINC000414541473 1036641208 /nfs/dbraw/zinc/64/12/08/1036641208.db2.gz WBWNMHVZSHEJSH-HUUCEWRRSA-N 2 1 335.561 4.214 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+][C@@H]3CCC[C@H]3C(C)(C)C)sc2C1 ZINC000414541473 1036641212 /nfs/dbraw/zinc/64/12/12/1036641212.db2.gz WBWNMHVZSHEJSH-HUUCEWRRSA-N 2 1 335.561 4.214 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+][C@H]3CCC[C@H]3C(C)(C)C)sc2C1 ZINC000414541470 1036641493 /nfs/dbraw/zinc/64/14/93/1036641493.db2.gz WBWNMHVZSHEJSH-CABCVRRESA-N 2 1 335.561 4.214 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+][C@H]3CCC[C@H]3C(C)(C)C)sc2C1 ZINC000414541470 1036641500 /nfs/dbraw/zinc/64/15/00/1036641500.db2.gz WBWNMHVZSHEJSH-CABCVRRESA-N 2 1 335.561 4.214 20 0 EIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168389173 1036736424 /nfs/dbraw/zinc/73/64/24/1036736424.db2.gz KWXGLFMONBVRRY-IBGZPJMESA-N 2 1 330.541 4.420 20 0 EIADMP CC(C)c1ncc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000486565882 1036770033 /nfs/dbraw/zinc/77/00/33/1036770033.db2.gz NIVSOSPRXLQRMF-WMZOPIPTSA-N 2 1 343.540 4.267 20 0 EIADMP CC(C)c1ncc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000486565882 1036770055 /nfs/dbraw/zinc/77/00/55/1036770055.db2.gz NIVSOSPRXLQRMF-WMZOPIPTSA-N 2 1 343.540 4.267 20 0 EIADMP CC(C)c1ncc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000486565879 1036771260 /nfs/dbraw/zinc/77/12/60/1036771260.db2.gz NIVSOSPRXLQRMF-FUHWJXTLSA-N 2 1 343.540 4.267 20 0 EIADMP CC(C)c1ncc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000486565879 1036771272 /nfs/dbraw/zinc/77/12/72/1036771272.db2.gz NIVSOSPRXLQRMF-FUHWJXTLSA-N 2 1 343.540 4.267 20 0 EIADMP COc1ccc([C@H]([NH2+]C2CC[NH+](C(C)(C)C)CC2)C2CC2)c(F)c1 ZINC000421847158 1036823155 /nfs/dbraw/zinc/82/31/55/1036823155.db2.gz WFQQBUPVNKOUIV-LJQANCHMSA-N 2 1 334.479 4.138 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CC12CCSCC2 ZINC000421869870 1036839548 /nfs/dbraw/zinc/83/95/48/1036839548.db2.gz DYFYOEIPJOPGHU-YZGWKJHDSA-N 2 1 344.568 4.020 20 0 EIADMP COc1cccc([C@@H]2CCCC[N@H+]2C2CC[NH+](CC3CC3)CC2)c1 ZINC001168392660 1036852734 /nfs/dbraw/zinc/85/27/34/1036852734.db2.gz RUDHVKOUMPWGQD-NRFANRHFSA-N 2 1 328.500 4.097 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CNCc3ccc(Cl)o3)cc2)C1 ZINC000589832005 1036879396 /nfs/dbraw/zinc/87/93/96/1036879396.db2.gz ULZRYFUVYBXSLB-OAHLLOKOSA-N 2 1 332.875 4.455 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(Cl)o3)cc2)C1 ZINC000589832005 1036879397 /nfs/dbraw/zinc/87/93/97/1036879397.db2.gz ULZRYFUVYBXSLB-OAHLLOKOSA-N 2 1 332.875 4.455 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc(Cl)o3)cc2)C1 ZINC000589832005 1036879399 /nfs/dbraw/zinc/87/93/99/1036879399.db2.gz ULZRYFUVYBXSLB-OAHLLOKOSA-N 2 1 332.875 4.455 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2CCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000503078750 1036895326 /nfs/dbraw/zinc/89/53/26/1036895326.db2.gz SINVKFPAGNXCFU-QFBILLFUSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2CCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000503078750 1036895328 /nfs/dbraw/zinc/89/53/28/1036895328.db2.gz SINVKFPAGNXCFU-QFBILLFUSA-N 2 1 336.470 4.455 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(OCc2ccc(C)cc2)cc1 ZINC000509958359 1036914573 /nfs/dbraw/zinc/91/45/73/1036914573.db2.gz NSCIHZDHSOJAGV-UHFFFAOYSA-N 2 1 349.478 4.259 20 0 EIADMP c1cc2c(cccc2CC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)[nH]1 ZINC000503122299 1036923335 /nfs/dbraw/zinc/92/33/35/1036923335.db2.gz PQCBJGUILVEVFH-UHFFFAOYSA-N 2 1 347.506 4.007 20 0 EIADMP C[N@@H+](Cc1ccccc1C[NH2+]C[C@H]1CCSC1)C1CCCCC1 ZINC000486979785 1036930622 /nfs/dbraw/zinc/93/06/22/1036930622.db2.gz GNKBATLSYJMYPJ-QGZVFWFLSA-N 2 1 332.557 4.294 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]C/C=C\c2ccncc2)C1 ZINC000486980343 1036930670 /nfs/dbraw/zinc/93/06/70/1036930670.db2.gz MLNZGQKTTZRNBH-GGJLBNBESA-N 2 1 349.522 4.363 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)oc1C ZINC000669699102 1037018668 /nfs/dbraw/zinc/01/86/68/1037018668.db2.gz HKBRCQWTEDSGDM-PXNSSMCTSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000669699102 1037018691 /nfs/dbraw/zinc/01/86/91/1037018691.db2.gz HKBRCQWTEDSGDM-PXNSSMCTSA-N 2 1 326.484 4.459 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000272048001 1037085604 /nfs/dbraw/zinc/08/56/04/1037085604.db2.gz RIUBIRWGCDJFGR-FVTFTPSCSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000272048001 1037085617 /nfs/dbraw/zinc/08/56/17/1037085617.db2.gz RIUBIRWGCDJFGR-FVTFTPSCSA-N 2 1 344.543 4.223 20 0 EIADMP CCC(CC)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(F)ccc2C1 ZINC001168415895 1037088253 /nfs/dbraw/zinc/08/82/53/1037088253.db2.gz FXQSHNKCXMHWAT-JBACZVJFSA-N 2 1 332.507 4.444 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCSc2ccc(Cl)cc2)CC1 ZINC000590786501 1037166070 /nfs/dbraw/zinc/16/60/70/1037166070.db2.gz YZFZBRCTFTZBHA-UHFFFAOYSA-N 2 1 340.964 4.484 20 0 EIADMP C[C@@H](N[C@@H](C)c1cccnc1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272355883 1037171164 /nfs/dbraw/zinc/17/11/64/1037171164.db2.gz RJMMXOBPDPJWQW-RYRKJORJSA-N 2 1 343.902 4.296 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)[C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168416355 1037237345 /nfs/dbraw/zinc/23/73/45/1037237345.db2.gz IMFUMACMMGSCJH-FKBYEOEOSA-N 2 1 344.518 4.445 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=[NH2+])Nc2ccccc2)C1 ZINC000057887188 1037289093 /nfs/dbraw/zinc/28/90/93/1037289093.db2.gz UJXKHDAUKSJDSQ-KRWDZBQOSA-N 2 1 336.483 4.055 20 0 EIADMP C[NH+](C)CC[C@H]([NH2+]Cc1ccc(Br)cc1F)C(C)(C)C ZINC000604770950 1037509020 /nfs/dbraw/zinc/50/90/20/1037509020.db2.gz PFCMEGHUROJPLZ-HNNXBMFYSA-N 2 1 345.300 4.044 20 0 EIADMP CC(C)(C)c1cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)no1 ZINC000573648974 1037633372 /nfs/dbraw/zinc/63/33/72/1037633372.db2.gz UMBSXMCNXWNOEB-UHFFFAOYSA-N 2 1 333.520 4.060 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000488547750 1037660388 /nfs/dbraw/zinc/66/03/88/1037660388.db2.gz SWQCUERTPJFSGT-LEAZDLGRSA-N 2 1 332.557 4.017 20 0 EIADMP Cc1nc2c(s1)[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CCC2 ZINC000157545127 1037672728 /nfs/dbraw/zinc/67/27/28/1037672728.db2.gz SRFHRMDWZNABLP-GOSISDBHSA-N 2 1 333.545 4.216 20 0 EIADMP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000422801910 1037835732 /nfs/dbraw/zinc/83/57/32/1037835732.db2.gz COECIXQKVGXKCO-QWRGUYRKSA-N 2 1 343.418 4.044 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+][C@H](C)c3c[nH+]ccc3N)cc2)cs1 ZINC000422810748 1037837494 /nfs/dbraw/zinc/83/74/94/1037837494.db2.gz UTOPXWJYMIIFMM-QWHCGFSZSA-N 2 1 338.480 4.338 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCCc3cc(OC(F)F)ccc32)c2ccccc21 ZINC000422835017 1037843577 /nfs/dbraw/zinc/84/35/77/1037843577.db2.gz XWWNJRYUTBTWAG-QYZOEREBSA-N 2 1 344.405 4.400 20 0 EIADMP Fc1cccc([C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2cccc(Cl)c2)c1 ZINC000422873146 1037858204 /nfs/dbraw/zinc/85/82/04/1037858204.db2.gz KFUPLPUIQLXYQS-MOPGFXCFSA-N 2 1 332.850 4.300 20 0 EIADMP Clc1ccc2c(c1Cl)OCCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422899573 1037861793 /nfs/dbraw/zinc/86/17/93/1037861793.db2.gz HQVMUBVENWXVTN-OUEWMDHJSA-N 2 1 341.282 4.080 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)c1cccc(OC(F)(F)F)c1 ZINC000422928650 1037872657 /nfs/dbraw/zinc/87/26/57/1037872657.db2.gz LVGQDLNBRIVMCG-YMRXKLBXSA-N 2 1 336.357 4.381 20 0 EIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3Br)c2ccccc21 ZINC000422952742 1037887647 /nfs/dbraw/zinc/88/76/47/1037887647.db2.gz DDCQBHJTTIWDQH-KZNAEPCWSA-N 2 1 343.268 4.171 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c2ccccc21 ZINC000423019752 1037908529 /nfs/dbraw/zinc/90/85/29/1037908529.db2.gz WZVNPLBIODRIHF-YRXWBPOGSA-N 2 1 346.833 4.044 20 0 EIADMP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000423048928 1037912340 /nfs/dbraw/zinc/91/23/40/1037912340.db2.gz AMHFKNHDWNZVTR-CWSCBRNRSA-N 2 1 342.327 4.414 20 0 EIADMP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423093427 1037953164 /nfs/dbraw/zinc/95/31/64/1037953164.db2.gz HKTDJSRNZAWWBY-JRJVTICQSA-N 2 1 328.887 4.134 20 0 EIADMP Cc1sc(C2([NH2+][C@@H](C)C[C@H](C)[NH3+])CCC2)nc1-c1ccccc1F ZINC000423144227 1038016387 /nfs/dbraw/zinc/01/63/87/1038016387.db2.gz GJRFNVZILBAVFD-STQMWFEESA-N 2 1 347.503 4.352 20 0 EIADMP c1csc([C@@H]([NH2+]CCC[NH2+]Cc2cccnc2)C2CCCC2)c1 ZINC000423184390 1038017020 /nfs/dbraw/zinc/01/70/20/1038017020.db2.gz HUCQEOUDKIDIMI-IBGZPJMESA-N 2 1 329.513 4.144 20 0 EIADMP Cc1sc(C2([NH2+][C@H](C)C[C@H](C)[NH3+])CCC2)nc1-c1ccccc1F ZINC000423144226 1038017376 /nfs/dbraw/zinc/01/73/76/1038017376.db2.gz GJRFNVZILBAVFD-QWHCGFSZSA-N 2 1 347.503 4.352 20 0 EIADMP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(-c2ccccc2)o1 ZINC000423179873 1038035432 /nfs/dbraw/zinc/03/54/32/1038035432.db2.gz ALSSQPZYISRGRQ-KRWDZBQOSA-N 2 1 335.451 4.172 20 0 EIADMP Fc1cccc([C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2cccc(Cl)c2)c1 ZINC000423209637 1038038752 /nfs/dbraw/zinc/03/87/52/1038038752.db2.gz IYYZMIWEJYJLQH-LIRRHRJNSA-N 2 1 332.850 4.158 20 0 EIADMP CCSc1ccccc1[C@@H](C)[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000423191570 1038044766 /nfs/dbraw/zinc/04/47/66/1038044766.db2.gz SXRQOMWQSBUYFE-MRXNPFEDSA-N 2 1 329.513 4.024 20 0 EIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000423192245 1038046965 /nfs/dbraw/zinc/04/69/65/1038046965.db2.gz UYPLJPUBVKGOHG-OAQYLSRUSA-N 2 1 348.494 4.018 20 0 EIADMP c1csc(C[N@H+](CC2CCCCCC2)[C@H]2CC23CC[NH2+]CC3)n1 ZINC000414725789 1038057233 /nfs/dbraw/zinc/05/72/33/1038057233.db2.gz WXSCDRQFBJYRBY-KRWDZBQOSA-N 2 1 333.545 4.058 20 0 EIADMP C[C@H](C[NH3+])[NH2+][C@H](C)c1ccc(-c2ccccc2Br)s1 ZINC000423318763 1038112563 /nfs/dbraw/zinc/11/25/63/1038112563.db2.gz DQSSFZFKZMEXAJ-GHMZBOCLSA-N 2 1 339.302 4.175 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCCOc2c(C)cc(C(C)(C)C)cc21 ZINC000489500035 1038076473 /nfs/dbraw/zinc/07/64/73/1038076473.db2.gz NHFVYLNJVDRKAB-IBGZPJMESA-N 2 1 341.499 4.301 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423311340 1038104272 /nfs/dbraw/zinc/10/42/72/1038104272.db2.gz BWKODGGMDFRMSG-AMIZOPFISA-N 2 1 340.311 4.112 20 0 EIADMP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1csc(-c2ccccc2F)n1 ZINC000423277793 1038105440 /nfs/dbraw/zinc/10/54/40/1038105440.db2.gz ORXFPEWYOYTDEQ-ZENOOKHLSA-N 2 1 333.476 4.117 20 0 EIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C[C@H]([NH3+])C1CC1 ZINC000423331028 1038143297 /nfs/dbraw/zinc/14/32/97/1038143297.db2.gz UNUBPZSXZYJCON-BONVTDFDSA-N 2 1 335.904 4.160 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000423356673 1038169064 /nfs/dbraw/zinc/16/90/64/1038169064.db2.gz RBSSQOBAVIGSIL-ZQMYSKGWSA-N 2 1 349.522 4.146 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000423356673 1038169085 /nfs/dbraw/zinc/16/90/85/1038169085.db2.gz RBSSQOBAVIGSIL-ZQMYSKGWSA-N 2 1 349.522 4.146 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000423362803 1038176672 /nfs/dbraw/zinc/17/66/72/1038176672.db2.gz YGTOHOUOXBFCQJ-KPDCDPCYSA-N 2 1 349.522 4.146 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc2c1CCCN2 ZINC000423422165 1038213872 /nfs/dbraw/zinc/21/38/72/1038213872.db2.gz YKFWFZVBRHMVBX-GCJKJVERSA-N 2 1 349.522 4.045 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000423444789 1038225495 /nfs/dbraw/zinc/22/54/95/1038225495.db2.gz MCXAKZSBEREZHE-PGRDOPGGSA-N 2 1 349.522 4.045 20 0 EIADMP COCc1cc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)ccc1OC ZINC000157937702 1038295284 /nfs/dbraw/zinc/29/52/84/1038295284.db2.gz HTLGHNLSZZZISO-ROUUACIJSA-N 2 1 348.531 4.004 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1)c1ccc(F)cn1 ZINC000490123230 1038352352 /nfs/dbraw/zinc/35/23/52/1038352352.db2.gz AGLZZUVUAXUEJD-LJQANCHMSA-N 2 1 329.463 4.302 20 0 EIADMP CC[N@H+]1CC[C@@H](CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167131 1038367731 /nfs/dbraw/zinc/36/77/31/1038367731.db2.gz FYARYIKMISZVGT-JXFKEZNVSA-N 2 1 328.887 4.361 20 0 EIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167131 1038367755 /nfs/dbraw/zinc/36/77/55/1038367755.db2.gz FYARYIKMISZVGT-JXFKEZNVSA-N 2 1 328.887 4.361 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167131 1038367765 /nfs/dbraw/zinc/36/77/65/1038367765.db2.gz FYARYIKMISZVGT-JXFKEZNVSA-N 2 1 328.887 4.361 20 0 EIADMP c1cc2c(s1)CCC[NH+](CCC[N@@H+]1CCCc3sccc3C1)C2 ZINC000607152122 1038394249 /nfs/dbraw/zinc/39/42/49/1038394249.db2.gz FOOIVQPREDOAAO-UHFFFAOYSA-N 2 1 346.565 4.396 20 0 EIADMP c1cc2c(s1)CCC[NH+](CCC[N@H+]1CCCc3sccc3C1)C2 ZINC000607152122 1038394262 /nfs/dbraw/zinc/39/42/62/1038394262.db2.gz FOOIVQPREDOAAO-UHFFFAOYSA-N 2 1 346.565 4.396 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC[N@H+]1C ZINC000608061497 1038440956 /nfs/dbraw/zinc/44/09/56/1038440956.db2.gz WIQARCLZVWEGLI-KBXCAEBGSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC[N@H+]1C ZINC000608061502 1038453122 /nfs/dbraw/zinc/45/31/22/1038453122.db2.gz WIQARCLZVWEGLI-RDTXWAMCSA-N 2 1 346.421 4.329 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000608067799 1038485429 /nfs/dbraw/zinc/48/54/29/1038485429.db2.gz TVURLRNJGCECBL-IAQYHMDHSA-N 2 1 334.813 4.179 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000608067799 1038485440 /nfs/dbraw/zinc/48/54/40/1038485440.db2.gz TVURLRNJGCECBL-IAQYHMDHSA-N 2 1 334.813 4.179 20 0 EIADMP CC(C)n1cncc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000424139121 1038635712 /nfs/dbraw/zinc/63/57/12/1038635712.db2.gz DWZOAQNPVTUQCP-UHFFFAOYSA-N 2 1 340.515 4.130 20 0 EIADMP Cc1ccc(-c2nc(C[N@@H+]3CC4(C[C@@H]3C)CC[NH2+]CC4)cs2)cc1 ZINC000424284647 1038794370 /nfs/dbraw/zinc/79/43/70/1038794370.db2.gz DLHGDIAWHCCYRJ-INIZCTEOSA-N 2 1 341.524 4.083 20 0 EIADMP CO[C@H]1C[C@H]2C[C@@H]([NH2+][C@@H](C)c3ccc(-n4cc[nH+]c4C)cc3)C[C@H]2C1 ZINC000424307186 1038814441 /nfs/dbraw/zinc/81/44/41/1038814441.db2.gz XAMHQQCIEMMKDK-SZCFVHRKSA-N 2 1 339.483 4.035 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000539163214 1038864722 /nfs/dbraw/zinc/86/47/22/1038864722.db2.gz ONUNWJJIMVWOOT-RDTXWAMCSA-N 2 1 340.433 4.476 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccccc1F)C1CCCC1 ZINC000539218453 1038887866 /nfs/dbraw/zinc/88/78/66/1038887866.db2.gz USLBIANKHZDXGM-FOIQADDNSA-N 2 1 329.463 4.488 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccccc1F)C1CCCC1 ZINC000539218456 1038888187 /nfs/dbraw/zinc/88/81/87/1038888187.db2.gz USLBIANKHZDXGM-QRWLVFNGSA-N 2 1 329.463 4.488 20 0 EIADMP COc1cccc(C2(N[C@@H]3CC[N@H+](C)[C@@H](c4ccccc4)C3)CC2)c1 ZINC000550754228 1038900600 /nfs/dbraw/zinc/90/06/00/1038900600.db2.gz RISJLTJIYDIYOO-TZIWHRDSSA-N 2 1 336.479 4.109 20 0 EIADMP COc1cccc(C2(N[C@@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)CC2)c1 ZINC000550754228 1038900631 /nfs/dbraw/zinc/90/06/31/1038900631.db2.gz RISJLTJIYDIYOO-TZIWHRDSSA-N 2 1 336.479 4.109 20 0 EIADMP COc1cccc(C2(N[C@H]3CC[N@H+](C)[C@@H](c4ccccc4)C3)CC2)c1 ZINC000550754225 1038900855 /nfs/dbraw/zinc/90/08/55/1038900855.db2.gz RISJLTJIYDIYOO-PZJWPPBQSA-N 2 1 336.479 4.109 20 0 EIADMP COc1cccc(C2(N[C@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)CC2)c1 ZINC000550754225 1038900867 /nfs/dbraw/zinc/90/08/67/1038900867.db2.gz RISJLTJIYDIYOO-PZJWPPBQSA-N 2 1 336.479 4.109 20 0 EIADMP CC[C@@H](C)[C@@H]([NH2+]C1CC[NH+](CCOC)CC1)c1ccc(Cl)cc1 ZINC000462117780 1038933344 /nfs/dbraw/zinc/93/33/44/1038933344.db2.gz CKBSXWKDUHALHY-DNVCBOLYSA-N 2 1 338.923 4.128 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cnn(C(C)(C)C)c2)CC1 ZINC000537619455 1038941096 /nfs/dbraw/zinc/94/10/96/1038941096.db2.gz DCAMSRZJTZGCCO-SFHVURJKSA-N 2 1 346.563 4.115 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537620573 1038953557 /nfs/dbraw/zinc/95/35/57/1038953557.db2.gz YZBVTCGVENBGLC-SFHVURJKSA-N 2 1 326.484 4.012 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537620573 1038953573 /nfs/dbraw/zinc/95/35/73/1038953573.db2.gz YZBVTCGVENBGLC-SFHVURJKSA-N 2 1 326.484 4.012 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537620573 1038953592 /nfs/dbraw/zinc/95/35/92/1038953592.db2.gz YZBVTCGVENBGLC-SFHVURJKSA-N 2 1 326.484 4.012 20 0 EIADMP FC(F)(F)CC[NH2+][C@@H]1CCCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000552042740 1039058955 /nfs/dbraw/zinc/05/89/55/1039058955.db2.gz ZPCDSZWSWVOHKW-OKZBNKHCSA-N 2 1 340.433 4.219 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC[N@@H+]1C ZINC000552043411 1039062606 /nfs/dbraw/zinc/06/26/06/1039062606.db2.gz LVAHWQDGHUGHOR-PVUWLOKVSA-N 2 1 342.405 4.109 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC[N@H+]1C ZINC000552043411 1039062627 /nfs/dbraw/zinc/06/26/27/1039062627.db2.gz LVAHWQDGHUGHOR-PVUWLOKVSA-N 2 1 342.405 4.109 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC[N@@H+]1C ZINC000552043410 1039063741 /nfs/dbraw/zinc/06/37/41/1039063741.db2.gz LVAHWQDGHUGHOR-ISTRZQFTSA-N 2 1 342.405 4.109 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC[N@H+]1C ZINC000552043410 1039063760 /nfs/dbraw/zinc/06/37/60/1039063760.db2.gz LVAHWQDGHUGHOR-ISTRZQFTSA-N 2 1 342.405 4.109 20 0 EIADMP Clc1cc2c(c(Cl)c1)CC[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000534057986 1039076511 /nfs/dbraw/zinc/07/65/11/1039076511.db2.gz FIBPYDOCPJBYRJ-GOSISDBHSA-N 2 1 339.310 4.445 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@@H]1C ZINC000552070778 1039094491 /nfs/dbraw/zinc/09/44/91/1039094491.db2.gz DJZFMJRANKPBFA-MAUKXSAKSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@@H]1C ZINC000552070778 1039094513 /nfs/dbraw/zinc/09/45/13/1039094513.db2.gz DJZFMJRANKPBFA-MAUKXSAKSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@@H]1C ZINC000552070778 1039094532 /nfs/dbraw/zinc/09/45/32/1039094532.db2.gz DJZFMJRANKPBFA-MAUKXSAKSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@H]1C ZINC000552070777 1039097422 /nfs/dbraw/zinc/09/74/22/1039097422.db2.gz DJZFMJRANKPBFA-CRAIPNDOSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@H]1C ZINC000552070777 1039097437 /nfs/dbraw/zinc/09/74/37/1039097437.db2.gz DJZFMJRANKPBFA-CRAIPNDOSA-N 2 1 330.447 4.390 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@H]1C ZINC000552070777 1039097457 /nfs/dbraw/zinc/09/74/57/1039097457.db2.gz DJZFMJRANKPBFA-CRAIPNDOSA-N 2 1 330.447 4.390 20 0 EIADMP CCCOc1ccc(CN(C)[C@@H]2CC[N@@H+](CC)[C@H](C)C2)cc1OCC ZINC000552071107 1039099890 /nfs/dbraw/zinc/09/98/90/1039099890.db2.gz PTRQOOFOOMKJQX-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP CCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)cc1OCC ZINC000552071107 1039099915 /nfs/dbraw/zinc/09/99/15/1039099915.db2.gz PTRQOOFOOMKJQX-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP CCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)cc1OCC ZINC000552071107 1039099936 /nfs/dbraw/zinc/09/99/36/1039099936.db2.gz PTRQOOFOOMKJQX-IEBWSBKVSA-N 2 1 348.531 4.179 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(Cl)c2F)CCCC1 ZINC000477861510 1039142178 /nfs/dbraw/zinc/14/21/78/1039142178.db2.gz NOAWQAHFHZGAKD-RHSMWYFYSA-N 2 1 338.898 4.221 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)s1 ZINC000090406552 1039221305 /nfs/dbraw/zinc/22/13/05/1039221305.db2.gz HMAZGXVJIRAFOE-DZGCQCFKSA-N 2 1 335.542 4.076 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000090409167 1039222570 /nfs/dbraw/zinc/22/25/70/1039222570.db2.gz NIZBCNXFITUOFB-FMJMRLDVSA-N 2 1 341.524 4.298 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)s1 ZINC000090409167 1039222590 /nfs/dbraw/zinc/22/25/90/1039222590.db2.gz NIZBCNXFITUOFB-FMJMRLDVSA-N 2 1 341.524 4.298 20 0 EIADMP C[N@@H+](CCC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1)C1CCCCC1 ZINC000534351245 1039338808 /nfs/dbraw/zinc/33/88/08/1039338808.db2.gz TWLFGMAGANENQH-DENIHFKCSA-N 2 1 344.543 4.399 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](C[C@H]3CCCC(F)(F)C3)C2)CC1 ZINC000513882640 1039343022 /nfs/dbraw/zinc/34/30/22/1039343022.db2.gz MYLNQFIQCCADMP-ZWKOTPCHSA-N 2 1 328.491 4.256 20 0 EIADMP CCOc1ccc(C2=CC[N@H+](CCCCn3cc[nH+]c3C)CC2)cc1 ZINC000091811191 1039402350 /nfs/dbraw/zinc/40/23/50/1039402350.db2.gz XLRHHYNRGPHEGW-UHFFFAOYSA-N 2 1 339.483 4.160 20 0 EIADMP CCOc1ccc(C2=CC[N@@H+](CCCCn3cc[nH+]c3C)CC2)cc1 ZINC000091811191 1039402373 /nfs/dbraw/zinc/40/23/73/1039402373.db2.gz XLRHHYNRGPHEGW-UHFFFAOYSA-N 2 1 339.483 4.160 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000121805038 1039491616 /nfs/dbraw/zinc/49/16/16/1039491616.db2.gz BOQJXKBTNGGIDQ-HXUWFJFHSA-N 2 1 328.500 4.240 20 0 EIADMP c1coc(-c2cc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)no2)c1 ZINC000121893315 1039528012 /nfs/dbraw/zinc/52/80/12/1039528012.db2.gz QNHQQDWAUQSSRY-UHFFFAOYSA-N 2 1 343.471 4.023 20 0 EIADMP C[C@@H](CC[NH2+][C@H](c1cccnc1)C1CCC1)[N@@H+](C)Cc1ccccc1 ZINC000481666501 1039718049 /nfs/dbraw/zinc/71/80/49/1039718049.db2.gz IXANJMWBOPJLSZ-AVRDEDQJSA-N 2 1 337.511 4.423 20 0 EIADMP C[C@H](CC[NH2+][C@@H](c1cccnc1)C1CCC1)[N@@H+](C)Cc1ccccc1 ZINC000481666507 1039719468 /nfs/dbraw/zinc/71/94/68/1039719468.db2.gz IXANJMWBOPJLSZ-XMSQKQJNSA-N 2 1 337.511 4.423 20 0 EIADMP Clc1ccccc1CC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434684688 1039816461 /nfs/dbraw/zinc/81/64/61/1039816461.db2.gz JZYVRAYXWZAXNQ-UHFFFAOYSA-N 2 1 343.902 4.295 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CC(C)(C)C[C@@H]3C)CC2)cs1 ZINC000434754668 1039860371 /nfs/dbraw/zinc/86/03/71/1039860371.db2.gz IVZCHNYOFHUNPB-MAUKXSAKSA-N 2 1 349.588 4.332 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CC(C)(C)C[C@H]3C)CC2)cs1 ZINC000434754666 1039860690 /nfs/dbraw/zinc/86/06/90/1039860690.db2.gz IVZCHNYOFHUNPB-CRAIPNDOSA-N 2 1 349.588 4.332 20 0 EIADMP CSc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551007502 1039860961 /nfs/dbraw/zinc/86/09/61/1039860961.db2.gz PDDBFXQQLZHQQE-QUCCMNQESA-N 2 1 326.509 4.334 20 0 EIADMP CSc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551007502 1039860964 /nfs/dbraw/zinc/86/09/64/1039860964.db2.gz PDDBFXQQLZHQQE-QUCCMNQESA-N 2 1 326.509 4.334 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000534956102 1039870185 /nfs/dbraw/zinc/87/01/85/1039870185.db2.gz RRNYRIZYWQTWHF-UHFFFAOYSA-N 2 1 326.271 4.413 20 0 EIADMP Cc1cc(C)cc(OCC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551014359 1039877124 /nfs/dbraw/zinc/87/71/24/1039877124.db2.gz SIQYIRQHVBCDSP-RBBKRZOGSA-N 2 1 338.495 4.107 20 0 EIADMP Cc1cc(C)cc(OCC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551014359 1039877130 /nfs/dbraw/zinc/87/71/30/1039877130.db2.gz SIQYIRQHVBCDSP-RBBKRZOGSA-N 2 1 338.495 4.107 20 0 EIADMP c1c2ccccc2sc1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000537692199 1039909520 /nfs/dbraw/zinc/90/95/20/1039909520.db2.gz GKCMHQRFDBPXSI-VQIMIIECSA-N 2 1 326.509 4.350 20 0 EIADMP c1c2ccccc2sc1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000537692199 1039909549 /nfs/dbraw/zinc/90/95/49/1039909549.db2.gz GKCMHQRFDBPXSI-VQIMIIECSA-N 2 1 326.509 4.350 20 0 EIADMP c1c2ccccc2sc1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000537692199 1039909573 /nfs/dbraw/zinc/90/95/73/1039909573.db2.gz GKCMHQRFDBPXSI-VQIMIIECSA-N 2 1 326.509 4.350 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CC2(C)Cc3ccccc3C2)C[C@@H]1c1ccccc1 ZINC000551087035 1039967269 /nfs/dbraw/zinc/96/72/69/1039967269.db2.gz KSXRVEDOMGWYFD-FCHUYYIVSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC2(C)Cc3ccccc3C2)C[C@@H]1c1ccccc1 ZINC000551087035 1039967283 /nfs/dbraw/zinc/96/72/83/1039967283.db2.gz KSXRVEDOMGWYFD-FCHUYYIVSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cnc(C4CCCCC4)s3)CC[C@@H]21 ZINC000537695390 1039972629 /nfs/dbraw/zinc/97/26/29/1039972629.db2.gz NUABRROLCQVIGW-WMZOPIPTSA-N 2 1 333.545 4.107 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](Cc3cnc(C4CCCCC4)s3)CC[C@@H]21 ZINC000537695390 1039972645 /nfs/dbraw/zinc/97/26/45/1039972645.db2.gz NUABRROLCQVIGW-WMZOPIPTSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](Cc3cnc(C4CCCCC4)s3)CC[C@@H]21 ZINC000537695390 1039972662 /nfs/dbraw/zinc/97/26/62/1039972662.db2.gz NUABRROLCQVIGW-WMZOPIPTSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](Cc3cnc(C4CCCCC4)s3)CC[C@@H]21 ZINC000537695390 1039972675 /nfs/dbraw/zinc/97/26/75/1039972675.db2.gz NUABRROLCQVIGW-WMZOPIPTSA-N 2 1 333.545 4.107 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000482122545 1040034031 /nfs/dbraw/zinc/03/40/31/1040034031.db2.gz NYCYNOCAXFQFIF-CYBMUJFWSA-N 2 1 329.444 4.410 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC[C@H](c2ccccc2)C(F)(F)F)[C@@H](C)C1 ZINC000551238871 1040084863 /nfs/dbraw/zinc/08/48/63/1040084863.db2.gz FENIDPXKWAYUGS-UAGQMJEPSA-N 2 1 328.422 4.043 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)[C@H](C)C1 ZINC000551238870 1040086066 /nfs/dbraw/zinc/08/60/66/1040086066.db2.gz FENIDPXKWAYUGS-PVAVHDDUSA-N 2 1 328.422 4.043 20 0 EIADMP Clc1cccc(Cl)c1CCC[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000482242596 1040098112 /nfs/dbraw/zinc/09/81/12/1040098112.db2.gz UEZDIMZSLIVIRF-KBPBESRZSA-N 2 1 327.299 4.142 20 0 EIADMP Clc1cccc(Cl)c1CCC[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000482242602 1040098689 /nfs/dbraw/zinc/09/86/89/1040098689.db2.gz UEZDIMZSLIVIRF-ZIAGYGMSSA-N 2 1 327.299 4.142 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CC(C)(C)c3ccc(Br)cc32)CC1 ZINC000479402071 1040304125 /nfs/dbraw/zinc/30/41/25/1040304125.db2.gz KEKJVMCBKYCQMS-KRWDZBQOSA-N 2 1 349.316 4.023 20 0 EIADMP Cc1ccc(F)cc1C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000491247726 1040360119 /nfs/dbraw/zinc/36/01/19/1040360119.db2.gz FPQRWNKUGZAWDG-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(F)cc1C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000491247726 1040360136 /nfs/dbraw/zinc/36/01/36/1040360136.db2.gz FPQRWNKUGZAWDG-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(F)cc1C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000491247726 1040360148 /nfs/dbraw/zinc/36/01/48/1040360148.db2.gz FPQRWNKUGZAWDG-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(F)cc1C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000491247726 1040360168 /nfs/dbraw/zinc/36/01/68/1040360168.db2.gz FPQRWNKUGZAWDG-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2c(s1)CCC2 ZINC000479467132 1040391169 /nfs/dbraw/zinc/39/11/69/1040391169.db2.gz VDPXLYFPHNQKBN-FUHWJXTLSA-N 2 1 340.536 4.410 20 0 EIADMP CC[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(OC(F)F)cc1 ZINC000479515076 1040434817 /nfs/dbraw/zinc/43/48/17/1040434817.db2.gz XSEJOVFDDQXTDV-LEOMRAHMSA-N 2 1 338.442 4.346 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1nccc2ccccc21 ZINC000515019138 1040436071 /nfs/dbraw/zinc/43/60/71/1040436071.db2.gz HZSYULOATZWXPC-KSZLIROESA-N 2 1 325.500 4.253 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1nccc2ccccc21 ZINC000515019138 1040436083 /nfs/dbraw/zinc/43/60/83/1040436083.db2.gz HZSYULOATZWXPC-KSZLIROESA-N 2 1 325.500 4.253 20 0 EIADMP FC(F)(F)c1cc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)ccc1Cl ZINC000666998147 1040437872 /nfs/dbraw/zinc/43/78/72/1040437872.db2.gz FHIMDTRLMTWUQG-GFCCVEGCSA-N 2 1 332.797 4.123 20 0 EIADMP Brc1ccc2c(c1)CC[C@H]2[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479540937 1040446125 /nfs/dbraw/zinc/44/61/25/1040446125.db2.gz KAYKMUZJHXGNMT-LEOMRAHMSA-N 2 1 349.316 4.043 20 0 EIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](CCCc4ccncc4)CC[C@@H]32)cc1 ZINC000462314227 1040473599 /nfs/dbraw/zinc/47/35/99/1040473599.db2.gz JBUAKLCMTLYAFJ-PKTZIBPZSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](CCCc4ccncc4)CC[C@@H]32)cc1 ZINC000462314227 1040473615 /nfs/dbraw/zinc/47/36/15/1040473615.db2.gz JBUAKLCMTLYAFJ-PKTZIBPZSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](CCCc4ccncc4)CC[C@@H]32)cc1 ZINC000462314227 1040473629 /nfs/dbraw/zinc/47/36/29/1040473629.db2.gz JBUAKLCMTLYAFJ-PKTZIBPZSA-N 2 1 349.522 4.001 20 0 EIADMP CCOc1ccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1Cl ZINC000551813757 1040624086 /nfs/dbraw/zinc/62/40/86/1040624086.db2.gz XCWAORROSBMCGB-UHFFFAOYSA-N 2 1 336.907 4.235 20 0 EIADMP COCCC[NH+]1CCC([NH2+][C@H](c2cc3ccccc3o2)C(C)C)CC1 ZINC000553935526 1040643179 /nfs/dbraw/zinc/64/31/79/1040643179.db2.gz FYOXTJFCBPMHAW-NRFANRHFSA-N 2 1 344.499 4.220 20 0 EIADMP Cc1ccc(C[N@@H+](Cc2ccnn2-c2cc[nH+]cc2)C(C)C)s1 ZINC000667555803 1040648634 /nfs/dbraw/zinc/64/86/34/1040648634.db2.gz NQLLYICQXYTQQO-UHFFFAOYSA-N 2 1 326.469 4.048 20 0 EIADMP CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000483258615 1040796015 /nfs/dbraw/zinc/79/60/15/1040796015.db2.gz NJGSIKZABLLINO-FXAWDEMLSA-N 2 1 345.531 4.166 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000162568217 1040816603 /nfs/dbraw/zinc/81/66/03/1040816603.db2.gz JELSPPXATHVDAA-UHFFFAOYSA-N 2 1 332.385 4.197 20 0 EIADMP Cc1cc(F)ccc1C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000539828133 1040823778 /nfs/dbraw/zinc/82/37/78/1040823778.db2.gz BMCMMDSPXVUQRA-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)ccc1C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000539828133 1040823779 /nfs/dbraw/zinc/82/37/79/1040823779.db2.gz BMCMMDSPXVUQRA-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)ccc1C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539828133 1040823782 /nfs/dbraw/zinc/82/37/82/1040823782.db2.gz BMCMMDSPXVUQRA-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)ccc1C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539828133 1040823793 /nfs/dbraw/zinc/82/37/93/1040823793.db2.gz BMCMMDSPXVUQRA-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP CN(C/C=C/c1ccc(F)cc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539834038 1040829796 /nfs/dbraw/zinc/82/97/96/1040829796.db2.gz WFTRWPXVSWSNQU-FERLCFGISA-N 2 1 338.470 4.293 20 0 EIADMP C[NH+](C/C=C/c1ccc(F)cc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539834038 1040829806 /nfs/dbraw/zinc/82/98/06/1040829806.db2.gz WFTRWPXVSWSNQU-FERLCFGISA-N 2 1 338.470 4.293 20 0 EIADMP C[NH+](C/C=C/c1ccc(F)cc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539834038 1040829809 /nfs/dbraw/zinc/82/98/09/1040829809.db2.gz WFTRWPXVSWSNQU-FERLCFGISA-N 2 1 338.470 4.293 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000539851075 1040842097 /nfs/dbraw/zinc/84/20/97/1040842097.db2.gz KMFPVIIXLFCGIG-LJQANCHMSA-N 2 1 330.516 4.172 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000539851075 1040842111 /nfs/dbraw/zinc/84/21/11/1040842111.db2.gz KMFPVIIXLFCGIG-LJQANCHMSA-N 2 1 330.516 4.172 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1cccc(F)c1F ZINC000537845142 1040850587 /nfs/dbraw/zinc/85/05/87/1040850587.db2.gz FXPAOTCSYTWRMV-UHFFFAOYSA-N 2 1 345.437 4.098 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](c2ccccc2F)C2CCOCC2)C1 ZINC000903090959 1040898663 /nfs/dbraw/zinc/89/86/63/1040898663.db2.gz KAKOUIHRIQXDMR-DYESRHJHSA-N 2 1 348.506 4.003 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCC2)CC[N@H+]1C ZINC000537964481 1040937395 /nfs/dbraw/zinc/93/73/95/1040937395.db2.gz RYNOQPCATQMHGK-HIFRSBDPSA-N 2 1 341.326 4.487 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC000537976244 1040947464 /nfs/dbraw/zinc/94/74/64/1040947464.db2.gz PRNPXOXWDJRLOH-XMSQKQJNSA-N 2 1 333.479 4.401 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC000537976243 1040948208 /nfs/dbraw/zinc/94/82/08/1040948208.db2.gz PRNPXOXWDJRLOH-PGRDOPGGSA-N 2 1 333.479 4.401 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C(C)C)CC1)CCCO2 ZINC000537972325 1040975562 /nfs/dbraw/zinc/97/55/62/1040975562.db2.gz GAVAAWWLECZIJP-HXUWFJFHSA-N 2 1 330.516 4.486 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@H]3CC[C@H](c4ccccc4)C3)C2)cc1 ZINC000436241150 1040989410 /nfs/dbraw/zinc/98/94/10/1040989410.db2.gz QNCYICSGDBNDEB-NHTMILBNSA-N 2 1 348.534 4.477 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(SCC(F)F)cc1 ZINC000483735971 1040989741 /nfs/dbraw/zinc/98/97/41/1040989741.db2.gz XOWGQNLGAYOVEB-KCQAQPDRSA-N 2 1 328.472 4.177 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(SCC(F)F)cc1 ZINC000483735971 1040989763 /nfs/dbraw/zinc/98/97/63/1040989763.db2.gz XOWGQNLGAYOVEB-KCQAQPDRSA-N 2 1 328.472 4.177 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000483741371 1040994063 /nfs/dbraw/zinc/99/40/63/1040994063.db2.gz FTAXEQCWBIEJNK-ZRCAFCQKSA-N 2 1 326.484 4.372 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000483741371 1040994091 /nfs/dbraw/zinc/99/40/91/1040994091.db2.gz FTAXEQCWBIEJNK-ZRCAFCQKSA-N 2 1 326.484 4.372 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000483755959 1041000364 /nfs/dbraw/zinc/00/03/64/1041000364.db2.gz QCMNEYBSHUVOFM-WSTZPKSXSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000483755959 1041000378 /nfs/dbraw/zinc/00/03/78/1041000378.db2.gz QCMNEYBSHUVOFM-WSTZPKSXSA-N 2 1 338.495 4.399 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1ccc(SCC(F)F)cc1 ZINC000480189356 1041064157 /nfs/dbraw/zinc/06/41/57/1041064157.db2.gz IJZHVHIODLPTQS-AWEZNQCLSA-N 2 1 330.488 4.425 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1ccc(SCC(F)F)cc1 ZINC000480189356 1041064178 /nfs/dbraw/zinc/06/41/78/1041064178.db2.gz IJZHVHIODLPTQS-AWEZNQCLSA-N 2 1 330.488 4.425 20 0 EIADMP Cc1ccc(SC2(C[NH2+][C@H]3CC[N@@H+](C)[C@H](C)C3)CCCC2)cc1 ZINC000484287863 1041196638 /nfs/dbraw/zinc/19/66/38/1041196638.db2.gz CYHWAVGHHIMLBB-MSOLQXFVSA-N 2 1 332.557 4.472 20 0 EIADMP COC1(C[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)CCCCC1 ZINC000480369808 1041255708 /nfs/dbraw/zinc/25/57/08/1041255708.db2.gz IOSRWFVIBKRLSF-GOSISDBHSA-N 2 1 330.516 4.151 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1OC(F)(F)F ZINC000484487182 1041258588 /nfs/dbraw/zinc/25/85/88/1041258588.db2.gz MFYLABSGJZVQQK-IHRRRGAJSA-N 2 1 330.394 4.109 20 0 EIADMP Cc1cccc(N2CCC([NH2+]C3CC(C)(c4ccccc4)C3)CC2)[nH+]1 ZINC000436469496 1041267298 /nfs/dbraw/zinc/26/72/98/1041267298.db2.gz CHHKBSMCFUVEGA-UHFFFAOYSA-N 2 1 335.495 4.069 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cc(F)ccc1F ZINC000484471950 1041267348 /nfs/dbraw/zinc/26/73/48/1041267348.db2.gz JAVFSMHULNLQSC-HRAATJIYSA-N 2 1 344.449 4.008 20 0 EIADMP CCc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)cc1 ZINC000064616103 1041293008 /nfs/dbraw/zinc/29/30/08/1041293008.db2.gz RAVGJTZYCDRVNL-LJQANCHMSA-N 2 1 328.525 4.312 20 0 EIADMP CCc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)cc1 ZINC000064616103 1041293028 /nfs/dbraw/zinc/29/30/28/1041293028.db2.gz RAVGJTZYCDRVNL-LJQANCHMSA-N 2 1 328.525 4.312 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000540301592 1041353527 /nfs/dbraw/zinc/35/35/27/1041353527.db2.gz LQUYJOUCDUESDK-SJCJKPOMSA-N 2 1 327.299 4.376 20 0 EIADMP CCCCn1cc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)c(C)n1 ZINC000540318200 1041365069 /nfs/dbraw/zinc/36/50/69/1041365069.db2.gz NBTPLQABPBSWCW-UWJYYQICSA-N 2 1 346.563 4.124 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)C1(c2ccccc2)CCCC1 ZINC000554734347 1041365615 /nfs/dbraw/zinc/36/56/15/1041365615.db2.gz JRLPSQQKFVYBIN-ZWKOTPCHSA-N 2 1 325.500 4.318 20 0 EIADMP Cc1ccccc1[C@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463137422 1041370277 /nfs/dbraw/zinc/37/02/77/1041370277.db2.gz KOIBNJFBRCJDBJ-SFHVURJKSA-N 2 1 340.486 4.492 20 0 EIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1nc2ccccc2n1C ZINC000540312851 1041373193 /nfs/dbraw/zinc/37/31/93/1041373193.db2.gz DUFVDBPOTOLELL-BZSNNMDCSA-N 2 1 342.531 4.125 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463138085 1041373357 /nfs/dbraw/zinc/37/33/57/1041373357.db2.gz UNOZMODIRBJRIK-UTKZUKDTSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463138085 1041373363 /nfs/dbraw/zinc/37/33/63/1041373363.db2.gz UNOZMODIRBJRIK-UTKZUKDTSA-N 2 1 326.459 4.011 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463141464 1041375399 /nfs/dbraw/zinc/37/53/99/1041375399.db2.gz ZDONDTLABANVOK-ONTIZHBOSA-N 3 1 345.575 4.140 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463141464 1041375405 /nfs/dbraw/zinc/37/54/05/1041375405.db2.gz ZDONDTLABANVOK-ONTIZHBOSA-N 3 1 345.575 4.140 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCC[C@H]1Oc1ccccc1C ZINC000484635022 1041379933 /nfs/dbraw/zinc/37/99/33/1041379933.db2.gz HZMYEPHQCJGKFY-TZIWHRDSSA-N 2 1 341.499 4.260 20 0 EIADMP Clc1ccccc1[C@H]1CCC[C@@H]1[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000414888146 1041385739 /nfs/dbraw/zinc/38/57/39/1041385739.db2.gz XRNHORPVUASYMM-QUCCMNQESA-N 2 1 343.902 4.141 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000463194977 1041410254 /nfs/dbraw/zinc/41/02/54/1041410254.db2.gz XRJIQWGTOXKTKO-HLAWJBBLSA-N 2 1 332.532 4.080 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000463194977 1041410256 /nfs/dbraw/zinc/41/02/56/1041410256.db2.gz XRJIQWGTOXKTKO-HLAWJBBLSA-N 2 1 332.532 4.080 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463188318 1041417663 /nfs/dbraw/zinc/41/76/63/1041417663.db2.gz CIFDTCISOAMZPS-WIYYLYMNSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463188318 1041417666 /nfs/dbraw/zinc/41/76/66/1041417666.db2.gz CIFDTCISOAMZPS-WIYYLYMNSA-N 2 1 338.495 4.146 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)CC[N@@H+]1Cc1ccccc1 ZINC000463205214 1041419741 /nfs/dbraw/zinc/41/97/41/1041419741.db2.gz LUZZSRDFVNUKQF-VYJJCVKJSA-N 2 1 346.518 4.215 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)CC[N@H+]1Cc1ccccc1 ZINC000463205214 1041419753 /nfs/dbraw/zinc/41/97/53/1041419753.db2.gz LUZZSRDFVNUKQF-VYJJCVKJSA-N 2 1 346.518 4.215 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000480629486 1041432108 /nfs/dbraw/zinc/43/21/08/1041432108.db2.gz DVGRKGHDZNNMQG-JKSUJKDBSA-N 2 1 340.458 4.451 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)cc1N(C)C ZINC000480634113 1041446848 /nfs/dbraw/zinc/44/68/48/1041446848.db2.gz ZMQNUJHQHXWMSA-IRXDYDNUSA-N 2 1 335.511 4.054 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCc2ccccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463248123 1041452617 /nfs/dbraw/zinc/45/26/17/1041452617.db2.gz RQHUKUACBXWZJK-GHTZIAJQSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCc2ccccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463248123 1041452624 /nfs/dbraw/zinc/45/26/24/1041452624.db2.gz RQHUKUACBXWZJK-GHTZIAJQSA-N 2 1 340.486 4.401 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CC(C)(C)C2=CCCCC2)[C@@H](C)C1 ZINC000480693755 1041476233 /nfs/dbraw/zinc/47/62/33/1041476233.db2.gz NDDNXLGUXHNUAM-AZUAARDMSA-N 2 1 336.564 4.240 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(OC(F)(F)F)cc1 ZINC000484879269 1041478005 /nfs/dbraw/zinc/47/80/05/1041478005.db2.gz DTGDTFRKOHCGLF-DZGCQCFKSA-N 2 1 330.394 4.110 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC000195133223 1041484608 /nfs/dbraw/zinc/48/46/08/1041484608.db2.gz KOGIPFUHFQOKQY-AEFFLSMTSA-N 2 1 342.458 4.007 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000195138196 1041486529 /nfs/dbraw/zinc/48/65/29/1041486529.db2.gz NYQSPSIALCMJEX-WMZOPIPTSA-N 2 1 342.458 4.007 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000195138196 1041486535 /nfs/dbraw/zinc/48/65/35/1041486535.db2.gz NYQSPSIALCMJEX-WMZOPIPTSA-N 2 1 342.458 4.007 20 0 EIADMP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1F ZINC000480714265 1041491951 /nfs/dbraw/zinc/49/19/51/1041491951.db2.gz YGMDWABIOPVABH-JPLJXNOCSA-N 2 1 346.490 4.077 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc3[nH]cnc3c2)CC1 ZINC000538724660 1041496102 /nfs/dbraw/zinc/49/61/02/1041496102.db2.gz VKFIGKQBSGZAAY-KRWDZBQOSA-N 2 1 340.515 4.039 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3nc[nH]c3c2)CC1 ZINC000538724660 1041496111 /nfs/dbraw/zinc/49/61/11/1041496111.db2.gz VKFIGKQBSGZAAY-KRWDZBQOSA-N 2 1 340.515 4.039 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc3nc[nH]c3c2)CC1 ZINC000538724660 1041496116 /nfs/dbraw/zinc/49/61/16/1041496116.db2.gz VKFIGKQBSGZAAY-KRWDZBQOSA-N 2 1 340.515 4.039 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccccc2OC2CCCC2)[C@@H](C)C1 ZINC000538738291 1041508720 /nfs/dbraw/zinc/50/87/20/1041508720.db2.gz LRPRUKRMVPGWLD-PXNSSMCTSA-N 2 1 330.516 4.170 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2OC2CCCC2)[C@@H](C)C1 ZINC000538738291 1041508734 /nfs/dbraw/zinc/50/87/34/1041508734.db2.gz LRPRUKRMVPGWLD-PXNSSMCTSA-N 2 1 330.516 4.170 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2OC2CCCC2)[C@@H](C)C1 ZINC000538738291 1041508742 /nfs/dbraw/zinc/50/87/42/1041508742.db2.gz LRPRUKRMVPGWLD-PXNSSMCTSA-N 2 1 330.516 4.170 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2OC2CCCC2)[C@@H](C)C1 ZINC000538738291 1041508753 /nfs/dbraw/zinc/50/87/53/1041508753.db2.gz LRPRUKRMVPGWLD-PXNSSMCTSA-N 2 1 330.516 4.170 20 0 EIADMP Cc1cccc(COc2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H](C)C3)cc2)c1 ZINC000480753980 1041510071 /nfs/dbraw/zinc/51/00/71/1041510071.db2.gz CPLQXMMXWSEYHZ-WIYYLYMNSA-N 2 1 338.495 4.146 20 0 EIADMP CC[N@H+](Cc1ccc(OC)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538761881 1041537054 /nfs/dbraw/zinc/53/70/54/1041537054.db2.gz IUEOQTNFRBUIQR-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1ccc(OC)cc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000538761881 1041537058 /nfs/dbraw/zinc/53/70/58/1041537058.db2.gz IUEOQTNFRBUIQR-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1ccc(OC)cc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000538761881 1041537064 /nfs/dbraw/zinc/53/70/64/1041537064.db2.gz IUEOQTNFRBUIQR-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP c1csc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000538798678 1041539453 /nfs/dbraw/zinc/53/94/53/1041539453.db2.gz STYLXVGJAHAIQX-ICSRJNTNSA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000538798678 1041539458 /nfs/dbraw/zinc/53/94/58/1041539458.db2.gz STYLXVGJAHAIQX-ICSRJNTNSA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)c1 ZINC000538798678 1041539462 /nfs/dbraw/zinc/53/94/62/1041539462.db2.gz STYLXVGJAHAIQX-ICSRJNTNSA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000538798678 1041539465 /nfs/dbraw/zinc/53/94/65/1041539465.db2.gz STYLXVGJAHAIQX-ICSRJNTNSA-N 2 1 326.509 4.235 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccns1 ZINC000924678303 1041582043 /nfs/dbraw/zinc/58/20/43/1041582043.db2.gz BIYDGQXHOSKPQB-HZPDHXFCSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccns1 ZINC000924678303 1041582047 /nfs/dbraw/zinc/58/20/47/1041582047.db2.gz BIYDGQXHOSKPQB-HZPDHXFCSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1Nc1ccc(C[NH+]2CCCC[C@@H]2C)cc1 ZINC000540699940 1041614979 /nfs/dbraw/zinc/61/49/79/1041614979.db2.gz RRMSCPHOFKVVRT-IIMDRIAPSA-N 2 1 329.532 4.202 20 0 EIADMP C[C@@H]1C[NH+](C)[C@H](C)C[C@@H]1Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000540699940 1041614981 /nfs/dbraw/zinc/61/49/81/1041614981.db2.gz RRMSCPHOFKVVRT-IIMDRIAPSA-N 2 1 329.532 4.202 20 0 EIADMP C[C@@H]1C[NH+](C)[C@H](C)C[C@@H]1Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000540699940 1041614986 /nfs/dbraw/zinc/61/49/86/1041614986.db2.gz RRMSCPHOFKVVRT-IIMDRIAPSA-N 2 1 329.532 4.202 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]C[C@H]3CCCCS3)CC23CC3)cc1 ZINC000516768836 1041745238 /nfs/dbraw/zinc/74/52/38/1041745238.db2.gz ACYRYYNFDMBVDW-RBUKOAKNSA-N 2 1 330.541 4.059 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]C[C@H]3CCCCS3)CC23CC3)cc1 ZINC000516768836 1041745255 /nfs/dbraw/zinc/74/52/55/1041745255.db2.gz ACYRYYNFDMBVDW-RBUKOAKNSA-N 2 1 330.541 4.059 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2ccsc2)CC1 ZINC000437578334 1041845779 /nfs/dbraw/zinc/84/57/79/1041845779.db2.gz JMKBACRMOUVIBG-UHFFFAOYSA-N 2 1 346.544 4.082 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000464069679 1041854344 /nfs/dbraw/zinc/85/43/44/1041854344.db2.gz FGTNTOHZIQVIRM-BHIFYINESA-N 2 1 344.543 4.212 20 0 EIADMP Cn1ccnc1C[C@@H]1CCC[N@H+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000437791853 1041912178 /nfs/dbraw/zinc/91/21/78/1041912178.db2.gz HTYPVOCBVOQNKU-RCZSKKKRSA-N 2 1 337.511 4.185 20 0 EIADMP C[C@@H]([NH2+]C[C@@H](C)CC(F)(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000402757736 1042005619 /nfs/dbraw/zinc/00/56/19/1042005619.db2.gz GDVVHUYJVJMJAI-UXLLHSPISA-N 2 1 328.422 4.075 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCn1c2ccccc2c2ccccc21 ZINC000541571136 1042019181 /nfs/dbraw/zinc/01/91/81/1042019181.db2.gz OSXMEAVDWABZPZ-MBOZVWFJSA-N 2 1 335.495 4.113 20 0 EIADMP C[C@@H](C[NH2+][C@H](c1ccccc1)c1ccc(OC(F)F)cc1)C[NH+](C)C ZINC000425943698 1042033094 /nfs/dbraw/zinc/03/30/94/1042033094.db2.gz JSMKSYOVDWNTEB-HNAYVOBHSA-N 2 1 348.437 4.165 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2cccc(F)c2)s1 ZINC000517574221 1042079189 /nfs/dbraw/zinc/07/91/89/1042079189.db2.gz KMMOKBOFRCEIMX-AWEZNQCLSA-N 2 1 343.471 4.485 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000438201636 1042079587 /nfs/dbraw/zinc/07/95/87/1042079587.db2.gz QIIFDCGFVRMQPE-MDYRTPRTSA-N 2 1 346.515 4.491 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000438201636 1042079595 /nfs/dbraw/zinc/07/95/95/1042079595.db2.gz QIIFDCGFVRMQPE-MDYRTPRTSA-N 2 1 346.515 4.491 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccn(C)n1 ZINC000541734612 1042088098 /nfs/dbraw/zinc/08/80/98/1042088098.db2.gz VZKFQRWUNBKVOL-FQEVSTJZSA-N 2 1 340.515 4.037 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000467372165 1042251869 /nfs/dbraw/zinc/25/18/69/1042251869.db2.gz ZSYFBIGVUZMWDS-UHFFFAOYSA-N 2 1 328.422 4.224 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3cc(N)ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000414937359 1042287394 /nfs/dbraw/zinc/28/73/94/1042287394.db2.gz VMTFYKCDXCIJNY-ODOSVJCGSA-N 2 1 349.522 4.289 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3cc(N)ccc32)CC[N@H+]1Cc1ccccc1 ZINC000414937359 1042287399 /nfs/dbraw/zinc/28/73/99/1042287399.db2.gz VMTFYKCDXCIJNY-ODOSVJCGSA-N 2 1 349.522 4.289 20 0 EIADMP CC(C)c1ccc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000303163336 1042336561 /nfs/dbraw/zinc/33/65/61/1042336561.db2.gz HMOFLKCZQMTPBV-JOCHJYFZSA-N 2 1 336.523 4.464 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCOc2ccc(F)cc2)C1 ZINC000303603354 1042483735 /nfs/dbraw/zinc/48/37/35/1042483735.db2.gz NYEWPCQBRHPXPM-RTBURBONSA-N 2 1 348.506 4.181 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCOc2ccc(F)cc2)C1 ZINC000303603354 1042483736 /nfs/dbraw/zinc/48/37/36/1042483736.db2.gz NYEWPCQBRHPXPM-RTBURBONSA-N 2 1 348.506 4.181 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCOc2ccc(F)cc2)C1 ZINC000303603354 1042483741 /nfs/dbraw/zinc/48/37/41/1042483741.db2.gz NYEWPCQBRHPXPM-RTBURBONSA-N 2 1 348.506 4.181 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCOc2ccccc2)C1 ZINC000303657676 1042492224 /nfs/dbraw/zinc/49/22/24/1042492224.db2.gz VEFNWMSIQKHOGN-VQTJNVASSA-N 2 1 330.516 4.042 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCOc2ccccc2)C1 ZINC000303657676 1042492228 /nfs/dbraw/zinc/49/22/28/1042492228.db2.gz VEFNWMSIQKHOGN-VQTJNVASSA-N 2 1 330.516 4.042 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCOc2ccccc2)C1 ZINC000303657676 1042492231 /nfs/dbraw/zinc/49/22/31/1042492231.db2.gz VEFNWMSIQKHOGN-VQTJNVASSA-N 2 1 330.516 4.042 20 0 EIADMP Cc1cccc2c(CC[NH3+])cn(C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)c21 ZINC001167964464 1042609479 /nfs/dbraw/zinc/60/94/79/1042609479.db2.gz QRLFZHICXAECRO-YOFSQIOKSA-N 2 1 337.511 4.029 20 0 EIADMP C[C@@H](C[NH2+]Cc1ccc(OC(F)F)c(Cl)c1)C[NH+]1CCCCC1 ZINC000518759758 1042677598 /nfs/dbraw/zinc/67/75/98/1042677598.db2.gz HSSHNMPFUOXKNB-ZDUSSCGKSA-N 2 1 346.849 4.153 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)c2ncc(C(C)(C)C)o2)CC1 ZINC000175110397 1042738733 /nfs/dbraw/zinc/73/87/33/1042738733.db2.gz KCEQFIBTYKKVJZ-INIZCTEOSA-N 2 1 335.536 4.477 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2ncc(C(C)(C)C)o2)CC1 ZINC000175110397 1042738745 /nfs/dbraw/zinc/73/87/45/1042738745.db2.gz KCEQFIBTYKKVJZ-INIZCTEOSA-N 2 1 335.536 4.477 20 0 EIADMP Fc1cc(Cl)ccc1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309794758 1042822037 /nfs/dbraw/zinc/82/20/37/1042822037.db2.gz IJTFZXMVFHJUPT-MRXNPFEDSA-N 2 1 332.850 4.091 20 0 EIADMP Fc1cc(Cl)ccc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309794758 1042822040 /nfs/dbraw/zinc/82/20/40/1042822040.db2.gz IJTFZXMVFHJUPT-MRXNPFEDSA-N 2 1 332.850 4.091 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cnc2ccsc2c1 ZINC000309942190 1042824662 /nfs/dbraw/zinc/82/46/62/1042824662.db2.gz ISXWVDAKTBEZMB-INIZCTEOSA-N 2 1 339.508 4.469 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC000177214007 1042830958 /nfs/dbraw/zinc/83/09/58/1042830958.db2.gz PNYGZQWSARBTTG-QGZVFWFLSA-N 2 1 326.484 4.386 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310998835 1042850068 /nfs/dbraw/zinc/85/00/68/1042850068.db2.gz UVEIKUHUHJNACO-BBTUJRGHSA-N 2 1 338.495 4.256 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310998850 1042850319 /nfs/dbraw/zinc/85/03/19/1042850319.db2.gz UVEIKUHUHJNACO-WAOWUJCRSA-N 2 1 338.495 4.256 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311145899 1042853595 /nfs/dbraw/zinc/85/35/95/1042853595.db2.gz ZLARZIMBKPEGNL-DKZVUGQWSA-N 2 1 338.470 4.313 20 0 EIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000178256492 1042862076 /nfs/dbraw/zinc/86/20/76/1042862076.db2.gz YJGCMDUTTMHUTR-ZDUSSCGKSA-N 2 1 335.561 4.274 20 0 EIADMP c1cc(C[NH+]2CCCCC2)ccc1C[N@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000520575620 1042899600 /nfs/dbraw/zinc/89/96/00/1042899600.db2.gz WNIPTQWPYKYQRX-VXKWHMMOSA-N 2 1 342.527 4.064 20 0 EIADMP COC[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(Cl)cc1 ZINC000493882620 1042970844 /nfs/dbraw/zinc/97/08/44/1042970844.db2.gz JOXROKYMEUDERV-LPHOPBHVSA-N 2 1 338.923 4.129 20 0 EIADMP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000493890000 1042971877 /nfs/dbraw/zinc/97/18/77/1042971877.db2.gz ZVJIVCOYSFAYKF-PGRDOPGGSA-N 2 1 338.495 4.017 20 0 EIADMP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000493978305 1042991334 /nfs/dbraw/zinc/99/13/34/1042991334.db2.gz RMCJMPHOFFAYNX-GCJKJVERSA-N 2 1 340.511 4.393 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183183820 1043040044 /nfs/dbraw/zinc/04/00/44/1043040044.db2.gz ADVYFYJMIYLWDU-OKZBNKHCSA-N 2 1 330.516 4.307 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183183820 1043040050 /nfs/dbraw/zinc/04/00/50/1043040050.db2.gz ADVYFYJMIYLWDU-OKZBNKHCSA-N 2 1 330.516 4.307 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000429144363 1043082875 /nfs/dbraw/zinc/08/28/75/1043082875.db2.gz UNBJNPFDKLWYIP-KRWDZBQOSA-N 2 1 335.904 4.102 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000429144363 1043082884 /nfs/dbraw/zinc/08/28/84/1043082884.db2.gz UNBJNPFDKLWYIP-KRWDZBQOSA-N 2 1 335.904 4.102 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C[C@@H]3CCC[C@H](C)C3)CC2)cs1 ZINC000507933412 1043200919 /nfs/dbraw/zinc/20/09/19/1043200919.db2.gz CJBVEYGGORRWEA-FUHWJXTLSA-N 2 1 349.588 4.333 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)F)nc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000657969671 1043232153 /nfs/dbraw/zinc/23/21/53/1043232153.db2.gz SXQAHJCPXGNHDC-LZWOXQAQSA-N 2 1 337.458 4.323 20 0 EIADMP CCSc1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)ccn1 ZINC000427887057 1043250394 /nfs/dbraw/zinc/25/03/94/1043250394.db2.gz RWZQORHETUEZMO-LPHOPBHVSA-N 2 1 347.572 4.326 20 0 EIADMP [NH3+]C1(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CCCC1 ZINC000665249749 1043262456 /nfs/dbraw/zinc/26/24/56/1043262456.db2.gz YMMSKMPEZHFQLK-OAHLLOKOSA-N 2 1 327.497 4.049 20 0 EIADMP Cc1cccnc1[C@H]1CCC[C@@H]([NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)C1 ZINC000665252179 1043284627 /nfs/dbraw/zinc/28/46/27/1043284627.db2.gz JFHHIFQACFFRQY-DXBBTUNJSA-N 2 1 349.522 4.152 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccnn2C(C)C)CC1)CC(C)C ZINC000499600915 1043391885 /nfs/dbraw/zinc/39/18/85/1043391885.db2.gz QYCZDNZKZKWGDK-UHFFFAOYSA-N 2 1 334.552 4.044 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)cc1 ZINC000665269585 1043450119 /nfs/dbraw/zinc/45/01/19/1043450119.db2.gz IZPQQJKBKBMCLQ-SPLOXXLWSA-N 2 1 332.451 4.101 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCc3cc(N)ccc32)CC1 ZINC000665270987 1043459882 /nfs/dbraw/zinc/45/98/82/1043459882.db2.gz DVDQJNOFZCGRAK-BBHUYCHWSA-N 2 1 349.522 4.289 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000674305334 1043571228 /nfs/dbraw/zinc/57/12/28/1043571228.db2.gz HLJLUXFJGCJIAM-YJBOKZPZSA-N 2 1 342.449 4.300 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000674305334 1043571247 /nfs/dbraw/zinc/57/12/47/1043571247.db2.gz HLJLUXFJGCJIAM-YJBOKZPZSA-N 2 1 342.449 4.300 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000674305334 1043571265 /nfs/dbraw/zinc/57/12/65/1043571265.db2.gz HLJLUXFJGCJIAM-YJBOKZPZSA-N 2 1 342.449 4.300 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000674305331 1043574467 /nfs/dbraw/zinc/57/44/67/1043574467.db2.gz HLJLUXFJGCJIAM-CRAIPNDOSA-N 2 1 342.449 4.300 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000674305331 1043574487 /nfs/dbraw/zinc/57/44/87/1043574487.db2.gz HLJLUXFJGCJIAM-CRAIPNDOSA-N 2 1 342.449 4.300 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000674305331 1043574519 /nfs/dbraw/zinc/57/45/19/1043574519.db2.gz HLJLUXFJGCJIAM-CRAIPNDOSA-N 2 1 342.449 4.300 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccnn1-c1ccccc1 ZINC000467364158 1043582436 /nfs/dbraw/zinc/58/24/36/1043582436.db2.gz JIHAYROLHMUBSG-OALUTQOASA-N 2 1 340.515 4.178 20 0 EIADMP CCCCc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000765972581 1043605395 /nfs/dbraw/zinc/60/53/95/1043605395.db2.gz BCXNEPZXYKOBRM-XMSQKQJNSA-N 2 1 344.543 4.323 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000191019059 1043765195 /nfs/dbraw/zinc/76/51/95/1043765195.db2.gz ZMTOUURPIPFELT-NSHGMRRFSA-N 2 1 334.548 4.111 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCC[N@H+](C)Cc2ccccc2)cnn1C(C)(C)C ZINC000191132871 1043786592 /nfs/dbraw/zinc/78/65/92/1043786592.db2.gz JTYGKHUBFRQZHJ-KRWDZBQOSA-N 2 1 342.531 4.119 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)cnn1C(C)(C)C ZINC000191132871 1043786622 /nfs/dbraw/zinc/78/66/22/1043786622.db2.gz JTYGKHUBFRQZHJ-KRWDZBQOSA-N 2 1 342.531 4.119 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)CC1 ZINC000731677669 1043815485 /nfs/dbraw/zinc/81/54/85/1043815485.db2.gz YBAXZAUNBDMERR-UHFFFAOYSA-N 2 1 330.516 4.000 20 0 EIADMP C[NH+](C)[C@H](C[NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1)C1CC1 ZINC000442711331 1043816087 /nfs/dbraw/zinc/81/60/87/1043816087.db2.gz DQVPWBLFJQOHAS-KBAYOESNSA-N 2 1 340.433 4.271 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCCc1ccsc1 ZINC000469757912 1043935878 /nfs/dbraw/zinc/93/58/78/1043935878.db2.gz OHKLDXFUZAWXFS-WGMWDUQUSA-N 2 1 342.552 4.427 20 0 EIADMP CCCC[NH+]1CCC([NH2+]Cc2ccc(C(F)(F)F)cc2C)CC1 ZINC000443015950 1043970456 /nfs/dbraw/zinc/97/04/56/1043970456.db2.gz UUYRTJBDMRTYCY-UHFFFAOYSA-N 2 1 328.422 4.368 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2ccccc2F)s1 ZINC000521855887 1044034065 /nfs/dbraw/zinc/03/40/65/1044034065.db2.gz BJWDVPZBSFDNDY-AWEZNQCLSA-N 2 1 343.471 4.485 20 0 EIADMP CCSc1ccccc1[C@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000765977024 1044243222 /nfs/dbraw/zinc/24/32/22/1044243222.db2.gz PGNTUBWUUPNAID-WMZOPIPTSA-N 2 1 348.556 4.093 20 0 EIADMP CCSc1ccccc1[C@H](C)[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000765977017 1044247910 /nfs/dbraw/zinc/24/79/10/1044247910.db2.gz PGNTUBWUUPNAID-FUHWJXTLSA-N 2 1 348.556 4.093 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000358274944 1044261401 /nfs/dbraw/zinc/26/14/01/1044261401.db2.gz FLAWXESQKMFYAV-NRFANRHFSA-N 2 1 332.451 4.303 20 0 EIADMP Cc1c(C)n(C2CCCC2)c2nc[nH+]c(NCC(C)(C)C[NH+](C)C)c12 ZINC001168766777 1044336977 /nfs/dbraw/zinc/33/69/77/1044336977.db2.gz SVBNDOZLOVGFAQ-UHFFFAOYSA-N 2 1 343.519 4.163 20 0 EIADMP CCC[N@H+](CCCCn1cc[nH+]c1C)[C@@H](C)c1ccccc1OC ZINC000348079072 1044378697 /nfs/dbraw/zinc/37/86/97/1044378697.db2.gz QDJMQIQRSJWXJB-KRWDZBQOSA-N 2 1 329.488 4.454 20 0 EIADMP CCC[N@@H+](CCCCn1cc[nH+]c1C)[C@@H](C)c1ccccc1OC ZINC000348079072 1044378711 /nfs/dbraw/zinc/37/87/11/1044378711.db2.gz QDJMQIQRSJWXJB-KRWDZBQOSA-N 2 1 329.488 4.454 20 0 EIADMP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000542515439 1044394883 /nfs/dbraw/zinc/39/48/83/1044394883.db2.gz YGUPKMUGHAVJQG-SJORKVTESA-N 2 1 345.531 4.024 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)Cc1ccccc1 ZINC000542518734 1044436175 /nfs/dbraw/zinc/43/61/75/1044436175.db2.gz VCUREJMJBCGNKE-ICSRJNTNSA-N 2 1 342.552 4.429 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)Cc1ccccc1 ZINC000542518734 1044436200 /nfs/dbraw/zinc/43/62/00/1044436200.db2.gz VCUREJMJBCGNKE-ICSRJNTNSA-N 2 1 342.552 4.429 20 0 EIADMP CCCN1CCC([NH2+][C@H](C)c2oc3ccc(OC)cc3c2C)CC1 ZINC000675733944 1044452433 /nfs/dbraw/zinc/45/24/33/1044452433.db2.gz RNASQHKHCSICCF-OAHLLOKOSA-N 2 1 330.472 4.275 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2oc3ccc(OC)cc3c2C)CC1 ZINC000675733944 1044452443 /nfs/dbraw/zinc/45/24/43/1044452443.db2.gz RNASQHKHCSICCF-OAHLLOKOSA-N 2 1 330.472 4.275 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H](C[C@H]1CCOC1)c1ccc(F)cc1 ZINC000494880542 1044467298 /nfs/dbraw/zinc/46/72/98/1044467298.db2.gz SNLZLVMODBMLOP-DBXWQHBBSA-N 2 1 348.506 4.148 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccc(F)cc1 ZINC000494880545 1044467417 /nfs/dbraw/zinc/46/74/17/1044467417.db2.gz SNLZLVMODBMLOP-LVCYWYKZSA-N 2 1 348.506 4.148 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCc2c(Cl)cccc2Cl)CC[N@@H+]1C ZINC000428283425 1044475089 /nfs/dbraw/zinc/47/50/89/1044475089.db2.gz HXJKOPJKQAHWEV-KGLIPLIRSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCc2c(Cl)cccc2Cl)CC[N@H+]1C ZINC000428283425 1044475097 /nfs/dbraw/zinc/47/50/97/1044475097.db2.gz HXJKOPJKQAHWEV-KGLIPLIRSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCc2c(Cl)cccc2Cl)CC[NH+]1C ZINC000428283425 1044475102 /nfs/dbraw/zinc/47/51/02/1044475102.db2.gz HXJKOPJKQAHWEV-KGLIPLIRSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCc2c(Cl)cccc2Cl)CC[NH+]1C ZINC000428283425 1044475109 /nfs/dbraw/zinc/47/51/09/1044475109.db2.gz HXJKOPJKQAHWEV-KGLIPLIRSA-N 2 1 329.315 4.341 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000177813940 1044511643 /nfs/dbraw/zinc/51/16/43/1044511643.db2.gz AUJBTEVOZPLMSN-PBHICJAKSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000177813940 1044511659 /nfs/dbraw/zinc/51/16/59/1044511659.db2.gz AUJBTEVOZPLMSN-PBHICJAKSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC[NH+]1C ZINC000177813940 1044511671 /nfs/dbraw/zinc/51/16/71/1044511671.db2.gz AUJBTEVOZPLMSN-PBHICJAKSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC[NH+]1C ZINC000177813940 1044511686 /nfs/dbraw/zinc/51/16/86/1044511686.db2.gz AUJBTEVOZPLMSN-PBHICJAKSA-N 2 1 328.422 4.053 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000675817270 1044515458 /nfs/dbraw/zinc/51/54/58/1044515458.db2.gz ULLDFHUHNVPPDL-MEDUHNTESA-N 2 1 338.282 4.412 20 0 EIADMP CC(C)c1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000675881461 1044551853 /nfs/dbraw/zinc/55/18/53/1044551853.db2.gz LRNOFJIJGBTORW-DYESRHJHSA-N 2 1 330.516 4.104 20 0 EIADMP c1ccc(C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCCC2)cc1 ZINC000480742560 1044579293 /nfs/dbraw/zinc/57/92/93/1044579293.db2.gz CKUDWWFRSXWQEU-VSKRKVRLSA-N 2 1 326.528 4.394 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ncccc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168024270 1044607011 /nfs/dbraw/zinc/60/70/11/1044607011.db2.gz CZYMKNIIAFRCFI-YZIUBNRHSA-N 2 1 335.495 4.100 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3ccc(F)cc32)c1 ZINC000177978440 1044607203 /nfs/dbraw/zinc/60/72/03/1044607203.db2.gz OLVZTOLXHXRKJG-NRFANRHFSA-N 2 1 326.459 4.443 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3csc(-c4cccs4)n3)C2)CC1 ZINC000550573283 1044696649 /nfs/dbraw/zinc/69/66/49/1044696649.db2.gz BNUPBSXUKKYVGQ-HNNXBMFYSA-N 2 1 347.553 4.035 20 0 EIADMP c1ccc([C@H]2CC[N@@H+]2Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000676413569 1044735751 /nfs/dbraw/zinc/73/57/51/1044735751.db2.gz DDUUUPNWQMLPSV-JOCHJYFZSA-N 2 1 336.479 4.108 20 0 EIADMP Cc1nc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c(C)s1 ZINC000676491355 1044756432 /nfs/dbraw/zinc/75/64/32/1044756432.db2.gz ZUZMNYABHOKERP-AWEZNQCLSA-N 2 1 331.529 4.451 20 0 EIADMP Cc1nc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c(C)s1 ZINC000676491355 1044756454 /nfs/dbraw/zinc/75/64/54/1044756454.db2.gz ZUZMNYABHOKERP-AWEZNQCLSA-N 2 1 331.529 4.451 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccn(C)n1 ZINC000543601361 1044892127 /nfs/dbraw/zinc/89/21/27/1044892127.db2.gz FRMDNGDEQXLJHW-HXUWFJFHSA-N 2 1 340.515 4.037 20 0 EIADMP CCC[C@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1cccnc1 ZINC000544570186 1044944331 /nfs/dbraw/zinc/94/43/31/1044944331.db2.gz WPZYJFSKSXZZKF-RXVVDRJESA-N 2 1 325.500 4.423 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCSC3(CCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000922840727 1044984473 /nfs/dbraw/zinc/98/44/73/1044984473.db2.gz RJVWJYMFLONMBP-YZGWKJHDSA-N 2 1 344.568 4.447 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCSC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000922840727 1044984476 /nfs/dbraw/zinc/98/44/76/1044984476.db2.gz RJVWJYMFLONMBP-YZGWKJHDSA-N 2 1 344.568 4.447 20 0 EIADMP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000495420200 1045090127 /nfs/dbraw/zinc/09/01/27/1045090127.db2.gz FZFPDNDAYGPXHJ-ZIFCJYIRSA-N 2 1 326.484 4.403 20 0 EIADMP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000495420200 1045090145 /nfs/dbraw/zinc/09/01/45/1045090145.db2.gz FZFPDNDAYGPXHJ-ZIFCJYIRSA-N 2 1 326.484 4.403 20 0 EIADMP COC1(C[C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000429443340 1045142994 /nfs/dbraw/zinc/14/29/94/1045142994.db2.gz CQKFREACEJJMMX-QKNQBKEWSA-N 2 1 344.543 4.224 20 0 EIADMP Cc1nccn1CCCC[N@H+]1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000429124230 1045255974 /nfs/dbraw/zinc/25/59/74/1045255974.db2.gz ZFVOIVFRMWIZOG-GOSISDBHSA-N 2 1 349.931 4.492 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000429124230 1045255983 /nfs/dbraw/zinc/25/59/83/1045255983.db2.gz ZFVOIVFRMWIZOG-GOSISDBHSA-N 2 1 349.931 4.492 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000429124230 1045255990 /nfs/dbraw/zinc/25/59/90/1045255990.db2.gz ZFVOIVFRMWIZOG-GOSISDBHSA-N 2 1 349.931 4.492 20 0 EIADMP CCCCCOc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC000236786116 1045366718 /nfs/dbraw/zinc/36/67/18/1045366718.db2.gz INEIOCKBDAJECZ-IHWFROFDSA-N 2 1 330.516 4.361 20 0 EIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000236931035 1045370012 /nfs/dbraw/zinc/37/00/12/1045370012.db2.gz DDMDEMCIEMXRGN-AWEZNQCLSA-N 2 1 334.410 4.046 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000236931035 1045370021 /nfs/dbraw/zinc/37/00/21/1045370021.db2.gz DDMDEMCIEMXRGN-AWEZNQCLSA-N 2 1 334.410 4.046 20 0 EIADMP c1csc(CC[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)c1 ZINC000762928016 1045417013 /nfs/dbraw/zinc/41/70/13/1045417013.db2.gz YNYATCFWZZZYMM-UHFFFAOYSA-N 2 1 340.536 4.279 20 0 EIADMP Clc1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)s1 ZINC000915715067 1045455290 /nfs/dbraw/zinc/45/52/90/1045455290.db2.gz VYLDVNJGDPUDAQ-UHFFFAOYSA-N 2 1 326.937 4.490 20 0 EIADMP C[C@H]1CC[C@H]([NH+]2CCC([NH2+]Cc3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170156949 1045781456 /nfs/dbraw/zinc/78/14/56/1045781456.db2.gz IRFWZRNFGWTUSD-KSSFIOAISA-N 2 1 340.433 4.448 20 0 EIADMP C[C@H]1CC[C@@H]([NH+]2CCC([NH2+]Cc3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170158380 1045800280 /nfs/dbraw/zinc/80/02/80/1045800280.db2.gz OFLGZXBIVBNDAO-KBXCAEBGSA-N 2 1 340.433 4.448 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1cncc(F)c1 ZINC000247004115 1045836731 /nfs/dbraw/zinc/83/67/31/1045836731.db2.gz KVWHHRTWTGHHJN-DLBZAZTESA-N 2 1 341.474 4.303 20 0 EIADMP c1ccc2c(c1)cncc2C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000769316283 1045919667 /nfs/dbraw/zinc/91/96/67/1045919667.db2.gz NESNAQDJRCYIHH-LJQANCHMSA-N 2 1 337.511 4.323 20 0 EIADMP c1ccc2c(c1)cncc2C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000769316283 1045919677 /nfs/dbraw/zinc/91/96/77/1045919677.db2.gz NESNAQDJRCYIHH-LJQANCHMSA-N 2 1 337.511 4.323 20 0 EIADMP c1ccc2c(c1)cncc2C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000769316279 1045920196 /nfs/dbraw/zinc/92/01/96/1045920196.db2.gz NESNAQDJRCYIHH-IBGZPJMESA-N 2 1 337.511 4.323 20 0 EIADMP c1ccc2c(c1)cncc2C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000769316279 1045920217 /nfs/dbraw/zinc/92/02/17/1045920217.db2.gz NESNAQDJRCYIHH-IBGZPJMESA-N 2 1 337.511 4.323 20 0 EIADMP c1ccc(N2CCCCC2)c(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000769466601 1045982084 /nfs/dbraw/zinc/98/20/84/1045982084.db2.gz MVOXVKOZZRNBCA-OAQYLSRUSA-N 2 1 341.543 4.127 20 0 EIADMP c1ccc(N2CCCCC2)c(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000769466601 1045982073 /nfs/dbraw/zinc/98/20/73/1045982073.db2.gz MVOXVKOZZRNBCA-OAQYLSRUSA-N 2 1 341.543 4.127 20 0 EIADMP CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000769871866 1046099652 /nfs/dbraw/zinc/09/96/52/1046099652.db2.gz ZWPURAYLBRIHNC-MRXNPFEDSA-N 2 1 341.499 4.382 20 0 EIADMP CCc1noc(C)c1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000769871848 1046100286 /nfs/dbraw/zinc/10/02/86/1046100286.db2.gz ZVRLCWVXZPOYOS-HNNXBMFYSA-N 2 1 329.488 4.236 20 0 EIADMP COc1ccccc1-c1ccc([C@@H](C)[N@@H+](C)CC2CC[NH2+]CC2)cc1 ZINC000261738893 1046139655 /nfs/dbraw/zinc/13/96/55/1046139655.db2.gz MMROLPSXEYMKCW-QGZVFWFLSA-N 2 1 338.495 4.355 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@H](C)C1 ZINC000164467484 1046150370 /nfs/dbraw/zinc/15/03/70/1046150370.db2.gz UPSCYLKKUSDFQV-CJNGLKHVSA-N 2 1 349.569 4.042 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Br)s2)C1 ZINC000125784475 1046345502 /nfs/dbraw/zinc/34/55/02/1046345502.db2.gz FLKUXUWKOIVNGJ-QWHCGFSZSA-N 2 1 345.350 4.282 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c(C)n1 ZINC000771384116 1046384591 /nfs/dbraw/zinc/38/45/91/1046384591.db2.gz OAZMSYJPTRDXBB-SFHVURJKSA-N 2 1 329.532 4.394 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000508762426 1046548935 /nfs/dbraw/zinc/54/89/35/1046548935.db2.gz CJCVUMPVKPUZAE-GRTQGXPSSA-N 2 1 342.527 4.044 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000508762426 1046548956 /nfs/dbraw/zinc/54/89/56/1046548956.db2.gz CJCVUMPVKPUZAE-GRTQGXPSSA-N 2 1 342.527 4.044 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cnc(-c3ccsc3)s2)[C@@H](C)C1 ZINC000536661017 1046628185 /nfs/dbraw/zinc/62/81/85/1046628185.db2.gz VBTAQFGTOSWVRH-BBRMVZONSA-N 2 1 335.542 4.034 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c3ccccc23)[C@H](C)C1 ZINC000536682577 1046646717 /nfs/dbraw/zinc/64/67/17/1046646717.db2.gz YTJIHQCDTSXIMP-OXQOHEQNSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OC)c3ccccc23)[C@H](C)C1 ZINC000536682577 1046646725 /nfs/dbraw/zinc/64/67/25/1046646725.db2.gz YTJIHQCDTSXIMP-OXQOHEQNSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(OC)c3ccccc23)[C@H](C)C1 ZINC000536682577 1046646731 /nfs/dbraw/zinc/64/67/31/1046646731.db2.gz YTJIHQCDTSXIMP-OXQOHEQNSA-N 2 1 326.484 4.011 20 0 EIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536694859 1046690233 /nfs/dbraw/zinc/69/02/33/1046690233.db2.gz AWNYUKBOZJDSLP-QGZVFWFLSA-N 2 1 342.458 4.249 20 0 EIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536694859 1046690246 /nfs/dbraw/zinc/69/02/46/1046690246.db2.gz AWNYUKBOZJDSLP-QGZVFWFLSA-N 2 1 342.458 4.249 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536694859 1046690258 /nfs/dbraw/zinc/69/02/58/1046690258.db2.gz AWNYUKBOZJDSLP-QGZVFWFLSA-N 2 1 342.458 4.249 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536694859 1046690268 /nfs/dbraw/zinc/69/02/68/1046690268.db2.gz AWNYUKBOZJDSLP-QGZVFWFLSA-N 2 1 342.458 4.249 20 0 EIADMP c1cc(-c2ccc(C[NH2+]C3CC[NH+](C4CC4)CC3)cc2)cc2c1OCC2 ZINC000459466026 1046703573 /nfs/dbraw/zinc/70/35/73/1046703573.db2.gz NTIWIOMZVNNNHA-UHFFFAOYSA-N 2 1 348.490 4.005 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379618874 1046708540 /nfs/dbraw/zinc/70/85/40/1046708540.db2.gz AULDSWBTRGOMNB-UWJYYQICSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3cc[nH]c3c2)CC[N@H+]1Cc1ccccc1 ZINC000379618874 1046708553 /nfs/dbraw/zinc/70/85/53/1046708553.db2.gz AULDSWBTRGOMNB-UWJYYQICSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCOc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379624695 1046713941 /nfs/dbraw/zinc/71/39/41/1046713941.db2.gz JRDUVMUTZSYSOT-TZIWHRDSSA-N 2 1 338.495 4.098 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCOc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379624695 1046713956 /nfs/dbraw/zinc/71/39/56/1046713956.db2.gz JRDUVMUTZSYSOT-TZIWHRDSSA-N 2 1 338.495 4.098 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+]C3CC[NH+](C4CC4)CC3)s2)cc1 ZINC000459490605 1046732466 /nfs/dbraw/zinc/73/24/66/1046732466.db2.gz YHROUBXFHMGQQO-UHFFFAOYSA-N 2 1 342.508 4.140 20 0 EIADMP CCOc1ccccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379654651 1046756019 /nfs/dbraw/zinc/75/60/19/1046756019.db2.gz JFZDKHAWMFWDKU-RXVVDRJESA-N 2 1 338.495 4.228 20 0 EIADMP CCOc1ccccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379654651 1046756033 /nfs/dbraw/zinc/75/60/33/1046756033.db2.gz JFZDKHAWMFWDKU-RXVVDRJESA-N 2 1 338.495 4.228 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000536834389 1046810997 /nfs/dbraw/zinc/81/09/97/1046810997.db2.gz USIHMEZJQBFJAG-JQFCIGGWSA-N 2 1 328.422 4.475 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000536834389 1046810999 /nfs/dbraw/zinc/81/09/99/1046810999.db2.gz USIHMEZJQBFJAG-JQFCIGGWSA-N 2 1 328.422 4.475 20 0 EIADMP C[C@@H]1C[N@H+](CCCC[NH2+]C2CCC(c3ccccc3)CC2)C[C@H](C)O1 ZINC000536858420 1046826528 /nfs/dbraw/zinc/82/65/28/1046826528.db2.gz PAMQFKQKVYGUHK-IVCWUUCSSA-N 2 1 344.543 4.192 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1 ZINC000536858176 1046827547 /nfs/dbraw/zinc/82/75/47/1046827547.db2.gz PSWKXBKDNBPPHB-NEPJUHHUSA-N 2 1 326.271 4.485 20 0 EIADMP CC(C)c1nc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cs1 ZINC000556075640 1047433272 /nfs/dbraw/zinc/43/32/72/1047433272.db2.gz DGGBLIQOHPWMPT-IEBWSBKVSA-N 2 1 343.540 4.234 20 0 EIADMP CC(C)c1nc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cs1 ZINC000556075640 1047433277 /nfs/dbraw/zinc/43/32/77/1047433277.db2.gz DGGBLIQOHPWMPT-IEBWSBKVSA-N 2 1 343.540 4.234 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793516 1047482920 /nfs/dbraw/zinc/48/29/20/1047482920.db2.gz NYKKORCOSLZHGD-OALUTQOASA-N 2 1 344.568 4.447 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793516 1047482927 /nfs/dbraw/zinc/48/29/27/1047482927.db2.gz NYKKORCOSLZHGD-OALUTQOASA-N 2 1 344.568 4.447 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2cc(F)c(F)c(F)c2)C[C@@H]1c1ccccc1 ZINC000556167966 1047525807 /nfs/dbraw/zinc/52/58/07/1047525807.db2.gz ZLJOYEUSEKNBJO-VQIMIIECSA-N 2 1 348.412 4.072 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2cc(F)c(F)c(F)c2)C[C@@H]1c1ccccc1 ZINC000556167966 1047525812 /nfs/dbraw/zinc/52/58/12/1047525812.db2.gz ZLJOYEUSEKNBJO-VQIMIIECSA-N 2 1 348.412 4.072 20 0 EIADMP 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 1047604121 /nfs/dbraw/zinc/60/41/21/1047604121.db2.gz IJXZORJHTHZLMA-FXYMYOKYSA-N 2 1 341.326 4.415 20 0 EIADMP C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000898322423 1047616114 /nfs/dbraw/zinc/61/61/14/1047616114.db2.gz KZRGPLZIMLCPAU-MTNREXPMSA-N 2 1 335.495 4.033 20 0 EIADMP C[N@@H+](CCCN[C@@H]1CC[NH+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608678 1047757933 /nfs/dbraw/zinc/75/79/33/1047757933.db2.gz LGJMVKAZCANWIW-IRLDBZIGSA-N 2 1 343.559 4.066 20 0 EIADMP C[NH+](CCCN[C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608678 1047757945 /nfs/dbraw/zinc/75/79/45/1047757945.db2.gz LGJMVKAZCANWIW-IRLDBZIGSA-N 2 1 343.559 4.066 20 0 EIADMP C[NH+](CCCN[C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608678 1047757948 /nfs/dbraw/zinc/75/79/48/1047757948.db2.gz LGJMVKAZCANWIW-IRLDBZIGSA-N 2 1 343.559 4.066 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCOc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000550644325 1047797183 /nfs/dbraw/zinc/79/71/83/1047797183.db2.gz QXWFJWPGUVQKII-CTNGQTDRSA-N 2 1 342.458 4.020 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCOc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000550644325 1047797191 /nfs/dbraw/zinc/79/71/91/1047797191.db2.gz QXWFJWPGUVQKII-CTNGQTDRSA-N 2 1 342.458 4.020 20 0 EIADMP Cc1cccc(O[C@H](C)C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550666093 1047810602 /nfs/dbraw/zinc/81/06/02/1047810602.db2.gz UQPDQSWAOYQUKT-UZKOGDIHSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1cccc(O[C@H](C)C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550666093 1047810604 /nfs/dbraw/zinc/81/06/04/1047810604.db2.gz UQPDQSWAOYQUKT-UZKOGDIHSA-N 2 1 338.495 4.187 20 0 EIADMP CCOc1cc(C)ccc1CN[C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550681081 1047814515 /nfs/dbraw/zinc/81/45/15/1047814515.db2.gz UCEXDJJRBNXPSP-RTWAWAEBSA-N 2 1 338.495 4.319 20 0 EIADMP CCOc1cc(C)ccc1CN[C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550681081 1047814516 /nfs/dbraw/zinc/81/45/16/1047814516.db2.gz UCEXDJJRBNXPSP-RTWAWAEBSA-N 2 1 338.495 4.319 20 0 EIADMP CC(C)[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1cccnc1 ZINC000550678467 1047816352 /nfs/dbraw/zinc/81/63/52/1047816352.db2.gz GVAHBLMKQNWKHW-FDFHNCONSA-N 2 1 337.511 4.246 20 0 EIADMP CC(C)[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1cccnc1 ZINC000550678467 1047816354 /nfs/dbraw/zinc/81/63/54/1047816354.db2.gz GVAHBLMKQNWKHW-FDFHNCONSA-N 2 1 337.511 4.246 20 0 EIADMP CC1(C)[C@@H]2C[C@@H]([N@@H+](Cc3ccc(F)cc3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170736419 1047922633 /nfs/dbraw/zinc/92/26/33/1047922633.db2.gz MFKIEMXTVLUVBN-DHUDUYKCSA-N 2 1 330.491 4.332 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@]2(C)CC2(Cl)Cl)cc1 ZINC000824771220 1047924466 /nfs/dbraw/zinc/92/44/66/1047924466.db2.gz ACHWBVQJXDCZCS-WBMJQRKESA-N 2 1 338.282 4.415 20 0 EIADMP Clc1cc(Cl)c2c(c1)CC[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)C2 ZINC001171066157 1047939678 /nfs/dbraw/zinc/93/96/78/1047939678.db2.gz HPHFFGCGOASQMP-OAHLLOKOSA-N 2 1 339.310 4.067 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CC=C(C)CC3)CC2)cs1 ZINC000556829683 1048043381 /nfs/dbraw/zinc/04/33/81/1048043381.db2.gz QSISGKKZEUYDRR-KRWDZBQOSA-N 2 1 333.545 4.006 20 0 EIADMP C[N@@H+](CC1CC[NH+](C)CC1)[C@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171082941 1048068865 /nfs/dbraw/zinc/06/88/65/1048068865.db2.gz PJFYHSZBFQHLOH-INIZCTEOSA-N 2 1 341.326 4.124 20 0 EIADMP FC1(F)C[C@@]12CCC[NH+](CCCC[N@@H+]1CCC[C@@]3(CC3(F)F)C1)C2 ZINC000844437049 1048334563 /nfs/dbraw/zinc/33/45/63/1048334563.db2.gz KUQCXMLMZFCPOB-HZPDHXFCSA-N 2 1 348.428 4.009 20 0 EIADMP FC1(F)C[C@]12CC[NH+](CCCCCC[N@@H+]1CC[C@]3(CC3(F)F)C1)C2 ZINC000844470872 1048354204 /nfs/dbraw/zinc/35/42/04/1048354204.db2.gz MCXCVOUUDILSJK-HOTGVXAUSA-N 2 1 348.428 4.009 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171139219 1048415563 /nfs/dbraw/zinc/41/55/63/1048415563.db2.gz JWYUFSRSEDCNHS-CZUORRHYSA-N 2 1 341.326 4.172 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171139217 1048416151 /nfs/dbraw/zinc/41/61/51/1048416151.db2.gz JWYUFSRSEDCNHS-BBRMVZONSA-N 2 1 341.326 4.172 20 0 EIADMP CC[C@H](Cc1ccc(C)cc1)[N@H+](CC)Cc1ncc(C[NH+](C)C)s1 ZINC000809582726 1048423568 /nfs/dbraw/zinc/42/35/68/1048423568.db2.gz BPSOGLUZCWKXBO-GOSISDBHSA-N 2 1 345.556 4.356 20 0 EIADMP CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)Cc1ncc(C[NH+](C)C)s1 ZINC000809582726 1048423574 /nfs/dbraw/zinc/42/35/74/1048423574.db2.gz BPSOGLUZCWKXBO-GOSISDBHSA-N 2 1 345.556 4.356 20 0 EIADMP C[N@H+](Cc1ccc(SC(F)(F)F)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000809704836 1048489092 /nfs/dbraw/zinc/48/90/92/1048489092.db2.gz IIJQIPYSUZZBJK-YIONKMFJSA-N 2 1 344.446 4.356 20 0 EIADMP C[N@@H+](Cc1ccc(SC(F)(F)F)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000809704836 1048489107 /nfs/dbraw/zinc/48/91/07/1048489107.db2.gz IIJQIPYSUZZBJK-YIONKMFJSA-N 2 1 344.446 4.356 20 0 EIADMP C[NH+](Cc1ccc(SC(F)(F)F)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000809704836 1048489115 /nfs/dbraw/zinc/48/91/15/1048489115.db2.gz IIJQIPYSUZZBJK-YIONKMFJSA-N 2 1 344.446 4.356 20 0 EIADMP C[NH+](Cc1ccc(SC(F)(F)F)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000809704836 1048489118 /nfs/dbraw/zinc/48/91/18/1048489118.db2.gz IIJQIPYSUZZBJK-YIONKMFJSA-N 2 1 344.446 4.356 20 0 EIADMP Clc1ncccc1CNC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000810178713 1048669274 /nfs/dbraw/zinc/66/92/74/1048669274.db2.gz YUTNICHYVKOBRG-GOSISDBHSA-N 2 1 343.902 4.127 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccncc2Cl)CC1 ZINC000075685585 1048755116 /nfs/dbraw/zinc/75/51/16/1048755116.db2.gz IDDQWGUHTLJPNX-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP Cc1ccc(C[N@@H+]2C[C@@H]3C[NH+](Cc4cccc5cc[nH]c54)C[C@@H]3C2)cc1 ZINC001144712433 1048813405 /nfs/dbraw/zinc/81/34/05/1048813405.db2.gz XLAYIONMLXJDRA-SZPZYZBQSA-N 2 1 345.490 4.040 20 0 EIADMP Cc1ccc(C[NH+]2C[C@@H]3C[N@@H+](Cc4cccc5cc[nH]c54)C[C@@H]3C2)cc1 ZINC001144712433 1048813413 /nfs/dbraw/zinc/81/34/13/1048813413.db2.gz XLAYIONMLXJDRA-SZPZYZBQSA-N 2 1 345.490 4.040 20 0 EIADMP Cc1ccc(C[NH+]2C[C@@H]3C[N@H+](Cc4cccc5cc[nH]c54)C[C@@H]3C2)cc1 ZINC001144712433 1048813415 /nfs/dbraw/zinc/81/34/15/1048813415.db2.gz XLAYIONMLXJDRA-SZPZYZBQSA-N 2 1 345.490 4.040 20 0 EIADMP c1sc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)nc1-c1ccccc1 ZINC000134210284 1048896597 /nfs/dbraw/zinc/89/65/97/1048896597.db2.gz WDFWREWSUMEFNN-UHFFFAOYSA-N 2 1 341.524 4.118 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)[C@H](C)C1 ZINC000081095565 1049623931 /nfs/dbraw/zinc/62/39/31/1049623931.db2.gz LMOVSLVEFVKZSF-KDOFPFPSSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Cl)c3cccnc23)[C@H](C)C1 ZINC000081095565 1049623951 /nfs/dbraw/zinc/62/39/51/1049623951.db2.gz LMOVSLVEFVKZSF-KDOFPFPSSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c3cccnc23)[C@H](C)C1 ZINC000081095565 1049623964 /nfs/dbraw/zinc/62/39/64/1049623964.db2.gz LMOVSLVEFVKZSF-KDOFPFPSSA-N 2 1 331.891 4.050 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)[C@@H]2CCc3c(F)cccc3C2)CC1 ZINC001171414184 1049644948 /nfs/dbraw/zinc/64/49/48/1049644948.db2.gz OGBPCZBZGAZSPS-VAMGGRTRSA-N 2 1 344.518 4.445 20 0 EIADMP Fc1cc(F)c2c(c1)CC[C@@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001170701563 1049736645 /nfs/dbraw/zinc/73/66/45/1049736645.db2.gz PQEJIBXULGSKRW-RBUKOAKNSA-N 2 1 348.481 4.163 20 0 EIADMP Clc1cccc(C[N@@H+]2CCCN(c3cc[nH+]cc3)CC2)c1Cl ZINC001171554901 1049753607 /nfs/dbraw/zinc/75/36/07/1049753607.db2.gz SVWILJLPZYQHIH-UHFFFAOYSA-N 2 1 336.266 4.101 20 0 EIADMP Clc1cccc(C[N@H+]2CCCN(c3cc[nH+]cc3)CC2)c1Cl ZINC001171554901 1049753612 /nfs/dbraw/zinc/75/36/12/1049753612.db2.gz SVWILJLPZYQHIH-UHFFFAOYSA-N 2 1 336.266 4.101 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001171570846 1049757586 /nfs/dbraw/zinc/75/75/86/1049757586.db2.gz PAUANLCZQMZWKG-LEWJYISDSA-N 2 1 326.528 4.193 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000245510983 1049757808 /nfs/dbraw/zinc/75/78/08/1049757808.db2.gz XJQHXCPXLJSKJB-ZQDZILKHSA-N 2 1 328.422 4.270 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000245510983 1049757820 /nfs/dbraw/zinc/75/78/20/1049757820.db2.gz XJQHXCPXLJSKJB-ZQDZILKHSA-N 2 1 328.422 4.270 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CC[N@@H+]1C ZINC000245511792 1049757926 /nfs/dbraw/zinc/75/79/26/1049757926.db2.gz ZDRAUEKUEALHPC-DEICHXMPSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CC[N@H+]1C ZINC000245511792 1049757936 /nfs/dbraw/zinc/75/79/36/1049757936.db2.gz ZDRAUEKUEALHPC-DEICHXMPSA-N 2 1 340.433 4.414 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001171570847 1049758547 /nfs/dbraw/zinc/75/85/47/1049758547.db2.gz PAUANLCZQMZWKG-NHCUHLMSSA-N 2 1 326.528 4.193 20 0 EIADMP Cc1ccc(CC[C@@H](C)[N@@H+](C2CCOCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001171666487 1049773020 /nfs/dbraw/zinc/77/30/20/1049773020.db2.gz YBVCCKNMIKVGNG-HMXCVIKNSA-N 2 1 344.543 4.067 20 0 EIADMP Cc1c(CC[NH3+])c2ccccc2n1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727255 1049784639 /nfs/dbraw/zinc/78/46/39/1049784639.db2.gz TXZBBCIPFWARSQ-YLJYHZDGSA-N 2 1 347.506 4.286 20 0 EIADMP C[C@H]1C[C@H](NC(=[NH2+])c2ccc(F)c(Cl)c2)C[N@@H+]1Cc1ccccc1 ZINC001171740570 1049801550 /nfs/dbraw/zinc/80/15/50/1049801550.db2.gz SKBOCVISIOQFFA-BBRMVZONSA-N 2 1 345.849 4.057 20 0 EIADMP C[C@H]1C[C@H](NC(=[NH2+])c2ccc(F)c(Cl)c2)C[N@H+]1Cc1ccccc1 ZINC001171740570 1049801553 /nfs/dbraw/zinc/80/15/53/1049801553.db2.gz SKBOCVISIOQFFA-BBRMVZONSA-N 2 1 345.849 4.057 20 0 EIADMP CC[N@H+](C)C1CC[NH+]([C@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171966039 1049826916 /nfs/dbraw/zinc/82/69/16/1049826916.db2.gz NPGGXGNQFMHRPY-CQSZACIVSA-N 2 1 328.422 4.053 20 0 EIADMP CC[N@@H+](C)C1CC[NH+]([C@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171966039 1049826921 /nfs/dbraw/zinc/82/69/21/1049826921.db2.gz NPGGXGNQFMHRPY-CQSZACIVSA-N 2 1 328.422 4.053 20 0 EIADMP C[C@H](NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cncs1 ZINC000813881357 1049830670 /nfs/dbraw/zinc/83/06/70/1049830670.db2.gz OXOAUVKFXLQOGL-UXDRXVOSSA-N 2 1 341.524 4.379 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cncs1 ZINC000813881357 1049830679 /nfs/dbraw/zinc/83/06/79/1049830679.db2.gz OXOAUVKFXLQOGL-UXDRXVOSSA-N 2 1 341.524 4.379 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCCc2ccccn2)CC[N@H+]1Cc1ccccc1 ZINC001171971917 1049834884 /nfs/dbraw/zinc/83/48/84/1049834884.db2.gz LEVBAVDLKOXTKC-NRFANRHFSA-N 2 1 337.511 4.047 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccc(O)cc1 ZINC001171971534 1049835129 /nfs/dbraw/zinc/83/51/29/1049835129.db2.gz JDRIVNBEWDAMGT-FXAWDEMLSA-N 2 1 338.495 4.486 20 0 EIADMP CCCCOCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171973320 1049835602 /nfs/dbraw/zinc/83/56/02/1049835602.db2.gz XOFCXGQHVURNQG-HXUWFJFHSA-N 2 1 332.532 4.226 20 0 EIADMP Cc1cc2c(cn1)[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)C(C)(C)C1)CC2 ZINC001171980591 1049838704 /nfs/dbraw/zinc/83/87/04/1049838704.db2.gz RTFVZJFWPPLRQZ-IRLDBZIGSA-N 2 1 349.522 4.410 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CC[C@H](C(F)(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171987847 1049839765 /nfs/dbraw/zinc/83/97/65/1049839765.db2.gz KOOYREGVYRUNKH-IRXDYDNUSA-N 2 1 340.433 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CC[C@H](C(F)(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171987847 1049839766 /nfs/dbraw/zinc/83/97/66/1049839766.db2.gz KOOYREGVYRUNKH-IRXDYDNUSA-N 2 1 340.433 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CC[C@H](C(F)(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171987847 1049839771 /nfs/dbraw/zinc/83/97/71/1049839771.db2.gz KOOYREGVYRUNKH-IRXDYDNUSA-N 2 1 340.433 4.314 20 0 EIADMP CCCO[C@@H]1CC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076488 1049845509 /nfs/dbraw/zinc/84/55/09/1049845509.db2.gz ZOQFPJVFVLRDEC-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP CCCO[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172076488 1049845510 /nfs/dbraw/zinc/84/55/10/1049845510.db2.gz ZOQFPJVFVLRDEC-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP CCCO[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172076488 1049845513 /nfs/dbraw/zinc/84/55/13/1049845513.db2.gz ZOQFPJVFVLRDEC-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]CCCc2ccncc2)C3)cc1 ZINC001172061427 1049849930 /nfs/dbraw/zinc/84/99/30/1049849930.db2.gz HDALGIZFDAQJLB-NUNAXRQHSA-N 2 1 349.522 4.190 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CC2CCSCC2)C3)cc1 ZINC001172066915 1049851297 /nfs/dbraw/zinc/85/12/97/1049851297.db2.gz DFUWDAPQFONQJH-MZADTFQBSA-N 2 1 344.568 4.305 20 0 EIADMP Cc1ncc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC001172067858 1049851556 /nfs/dbraw/zinc/85/15/56/1049851556.db2.gz OEVCUOHGJHPKPO-REPLKXPHSA-N 2 1 341.524 4.127 20 0 EIADMP Cc1ncc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)s1 ZINC001172067858 1049851558 /nfs/dbraw/zinc/85/15/58/1049851558.db2.gz OEVCUOHGJHPKPO-REPLKXPHSA-N 2 1 341.524 4.127 20 0 EIADMP FC1(F)C[C@@H]2C[N@H+]([C@@H]3C[C@H]4CCC[C@@H](C3)[NH+]4Cc3ccccc3)C[C@@H]21 ZINC001172068505 1049852619 /nfs/dbraw/zinc/85/26/19/1049852619.db2.gz JFWVPBFSZWNNEP-OBKDMQGPSA-N 2 1 346.465 4.159 20 0 EIADMP FC1(F)C[C@@H]2C[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4Cc3ccccc3)C[C@@H]21 ZINC001172068505 1049852622 /nfs/dbraw/zinc/85/26/22/1049852622.db2.gz JFWVPBFSZWNNEP-OBKDMQGPSA-N 2 1 346.465 4.159 20 0 EIADMP FC1(F)C[C@@H]2C[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4Cc3ccccc3)C[C@@H]21 ZINC001172068505 1049852623 /nfs/dbraw/zinc/85/26/23/1049852623.db2.gz JFWVPBFSZWNNEP-OBKDMQGPSA-N 2 1 346.465 4.159 20 0 EIADMP C[C@]1(F)CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070162 1049852693 /nfs/dbraw/zinc/85/26/93/1049852693.db2.gz XJQQPBWAQDWCRD-WOZUAGRISA-N 2 1 330.491 4.396 20 0 EIADMP C[C@]1(F)CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070162 1049852696 /nfs/dbraw/zinc/85/26/96/1049852696.db2.gz XJQQPBWAQDWCRD-WOZUAGRISA-N 2 1 330.491 4.396 20 0 EIADMP C[C@]1(F)CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070162 1049852697 /nfs/dbraw/zinc/85/26/97/1049852697.db2.gz XJQQPBWAQDWCRD-WOZUAGRISA-N 2 1 330.491 4.396 20 0 EIADMP C[C@]1(F)CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070162 1049852704 /nfs/dbraw/zinc/85/27/04/1049852704.db2.gz XJQQPBWAQDWCRD-WOZUAGRISA-N 2 1 330.491 4.396 20 0 EIADMP C[N@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127449 1049853089 /nfs/dbraw/zinc/85/30/89/1049853089.db2.gz JNVRSPZBGINYGU-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP C[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127449 1049853091 /nfs/dbraw/zinc/85/30/91/1049853091.db2.gz JNVRSPZBGINYGU-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172127449 1049853094 /nfs/dbraw/zinc/85/30/94/1049853094.db2.gz JNVRSPZBGINYGU-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172127449 1049853096 /nfs/dbraw/zinc/85/30/96/1049853096.db2.gz JNVRSPZBGINYGU-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP CC1(F)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172070155 1049853844 /nfs/dbraw/zinc/85/38/44/1049853844.db2.gz XJEQHRUFXQWENX-PMOLBWCYSA-N 2 1 330.491 4.396 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@]3(CCc4c3cccc4F)C1)C2 ZINC001172133609 1049854334 /nfs/dbraw/zinc/85/43/34/1049854334.db2.gz UACFFLSCCOQYKS-FBAVSBLXSA-N 2 1 342.502 4.121 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@]3(CCc4c3cccc4F)C1)C2 ZINC001172133609 1049854338 /nfs/dbraw/zinc/85/43/38/1049854338.db2.gz UACFFLSCCOQYKS-FBAVSBLXSA-N 2 1 342.502 4.121 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@]3(CCc4c3cccc4F)C1)C2 ZINC001172133609 1049854340 /nfs/dbraw/zinc/85/43/40/1049854340.db2.gz UACFFLSCCOQYKS-FBAVSBLXSA-N 2 1 342.502 4.121 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129292 1049854870 /nfs/dbraw/zinc/85/48/70/1049854870.db2.gz YBJQTXAQHPUBPY-DMUMMCEESA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129292 1049854872 /nfs/dbraw/zinc/85/48/72/1049854872.db2.gz YBJQTXAQHPUBPY-DMUMMCEESA-N 2 1 348.918 4.199 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129292 1049854874 /nfs/dbraw/zinc/85/48/74/1049854874.db2.gz YBJQTXAQHPUBPY-DMUMMCEESA-N 2 1 348.918 4.199 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129292 1049854879 /nfs/dbraw/zinc/85/48/79/1049854879.db2.gz YBJQTXAQHPUBPY-DMUMMCEESA-N 2 1 348.918 4.199 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Cc3ccc(F)cc3)CC1)C2 ZINC001172120972 1049859296 /nfs/dbraw/zinc/85/92/96/1049859296.db2.gz AXNLIHUNCYXIEZ-AERCQKQUSA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Cc3ccc(F)cc3)CC1)C2 ZINC001172120972 1049859300 /nfs/dbraw/zinc/85/93/00/1049859300.db2.gz AXNLIHUNCYXIEZ-AERCQKQUSA-N 2 1 330.491 4.096 20 0 EIADMP CCOc1ccc([C@H]2CCC[N@@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)cc1 ZINC001172124110 1049859760 /nfs/dbraw/zinc/85/97/60/1049859760.db2.gz JMLRWYHYHBEQJV-RCLSDMTESA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@H]2CCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)cc1 ZINC001172124110 1049859761 /nfs/dbraw/zinc/85/97/61/1049859761.db2.gz JMLRWYHYHBEQJV-RCLSDMTESA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@H]2CCC[NH+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172124110 1049859765 /nfs/dbraw/zinc/85/97/65/1049859765.db2.gz JMLRWYHYHBEQJV-RCLSDMTESA-N 2 1 328.500 4.238 20 0 EIADMP CCOc1ccc([C@H]2CCC[NH+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172124110 1049859767 /nfs/dbraw/zinc/85/97/67/1049859767.db2.gz JMLRWYHYHBEQJV-RCLSDMTESA-N 2 1 328.500 4.238 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccnc(Cl)c1F ZINC000823608586 1049862596 /nfs/dbraw/zinc/86/25/96/1049862596.db2.gz KKEOUZWXDBZLJO-UHFFFAOYSA-N 2 1 335.854 4.006 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172317331 1049876500 /nfs/dbraw/zinc/87/65/00/1049876500.db2.gz BLJRQWGABSLJAU-XRYRHKQGSA-N 2 1 344.543 4.365 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172317329 1049876762 /nfs/dbraw/zinc/87/67/62/1049876762.db2.gz BLJRQWGABSLJAU-RXRQOCSWSA-N 2 1 344.543 4.365 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CCC([NH3+])(c2cccc(Cl)c2)CC1 ZINC001172340935 1049888562 /nfs/dbraw/zinc/88/85/62/1049888562.db2.gz YAYCFRPGNUFRJJ-HOTGVXAUSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@H](CC(C)C)[N@@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001172407111 1049899133 /nfs/dbraw/zinc/89/91/33/1049899133.db2.gz NFRKDORYPSIGFB-FKVLARQCSA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001172407111 1049899134 /nfs/dbraw/zinc/89/91/34/1049899134.db2.gz NFRKDORYPSIGFB-FKVLARQCSA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001172407111 1049899140 /nfs/dbraw/zinc/89/91/40/1049899140.db2.gz NFRKDORYPSIGFB-FKVLARQCSA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001172407111 1049899143 /nfs/dbraw/zinc/89/91/43/1049899143.db2.gz NFRKDORYPSIGFB-FKVLARQCSA-N 2 1 343.559 4.439 20 0 EIADMP CC(C)COCC[C@@H](C)[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172475935 1049908327 /nfs/dbraw/zinc/90/83/27/1049908327.db2.gz NQPXAQNTCOGMRU-IFMALSPDSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)COCC[C@@H](C)[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172475935 1049908331 /nfs/dbraw/zinc/90/83/31/1049908331.db2.gz NQPXAQNTCOGMRU-IFMALSPDSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)COCC[C@@H](C)[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172475935 1049908335 /nfs/dbraw/zinc/90/83/35/1049908335.db2.gz NQPXAQNTCOGMRU-IFMALSPDSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172456911 1049915746 /nfs/dbraw/zinc/91/57/46/1049915746.db2.gz JLWADPOVWBJSBC-ZJOUEHCJSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172456911 1049915755 /nfs/dbraw/zinc/91/57/55/1049915755.db2.gz JLWADPOVWBJSBC-ZJOUEHCJSA-N 2 1 332.532 4.080 20 0 EIADMP Cc1cccc(N([C@H]2CC[C@@H](c3ccccc3)C2)C2CC[NH2+]CC2)[nH+]1 ZINC001172566104 1049935998 /nfs/dbraw/zinc/93/59/98/1049935998.db2.gz SCEGGKDXSBBAOX-CTNGQTDRSA-N 2 1 335.495 4.285 20 0 EIADMP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@@H]1CCC[N@H+]1C ZINC001172568175 1049938456 /nfs/dbraw/zinc/93/84/56/1049938456.db2.gz OXUPDLNJZHBXJM-OCCSQVGLSA-N 2 1 330.850 4.013 20 0 EIADMP CC[NH+](CC)CCn1cc(Nc2cc[nH+]c(-c3ccccc3)c2)cn1 ZINC001203251743 1049962077 /nfs/dbraw/zinc/96/20/77/1049962077.db2.gz KZJPKKJGNQEOII-UHFFFAOYSA-N 2 1 335.455 4.031 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2sc(-c3ccccc3)nc2C)C1 ZINC000246999666 1050008805 /nfs/dbraw/zinc/00/88/05/1050008805.db2.gz KPILKJDLKVOZQB-ZBFHGGJFSA-N 2 1 329.513 4.111 20 0 EIADMP CCOc1ccc([C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)C(C)C)cc1OCC ZINC000247893118 1050035952 /nfs/dbraw/zinc/03/59/52/1050035952.db2.gz FZIGHMXKQSJQIS-DJPFJPOOSA-N 2 1 348.531 4.253 20 0 EIADMP CCOc1ccc([C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)C(C)C)cc1OCC ZINC000247893118 1050035960 /nfs/dbraw/zinc/03/59/60/1050035960.db2.gz FZIGHMXKQSJQIS-DJPFJPOOSA-N 2 1 348.531 4.253 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1N(C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248394302 1050052762 /nfs/dbraw/zinc/05/27/62/1050052762.db2.gz FPTWWGJFYBMTKI-IKGGRYGDSA-N 2 1 347.522 4.195 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3occc32)[C@@H]1c1cccs1 ZINC000248879334 1050081865 /nfs/dbraw/zinc/08/18/65/1050081865.db2.gz KHYZQUPVYKTBOW-SIXWZSSISA-N 2 1 330.497 4.391 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3occc32)[C@@H]1c1cccs1 ZINC000248879334 1050081872 /nfs/dbraw/zinc/08/18/72/1050081872.db2.gz KHYZQUPVYKTBOW-SIXWZSSISA-N 2 1 330.497 4.391 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000249163591 1050093295 /nfs/dbraw/zinc/09/32/95/1050093295.db2.gz ZXQGROWEKLXDSQ-RCCFBDPRSA-N 2 1 340.433 4.219 20 0 EIADMP Cc1nccnc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000249173671 1050093425 /nfs/dbraw/zinc/09/34/25/1050093425.db2.gz CZGKPYKMOKCVAN-SJLPKXTDSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1nccnc1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000249173671 1050093431 /nfs/dbraw/zinc/09/34/31/1050093431.db2.gz CZGKPYKMOKCVAN-SJLPKXTDSA-N 2 1 338.499 4.010 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000249188530 1050094476 /nfs/dbraw/zinc/09/44/76/1050094476.db2.gz MGBXCGXGFDUUGO-CAOSSQGBSA-N 2 1 332.454 4.350 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000090046551 1050152331 /nfs/dbraw/zinc/15/23/31/1050152331.db2.gz MALQIVZUPVOWJJ-INMHGKMJSA-N 2 1 335.561 4.052 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc(Cl)nc3)cc2)C1 ZINC001177256642 1050175691 /nfs/dbraw/zinc/17/56/91/1050175691.db2.gz KIPRVWUNWUHNCM-MRXNPFEDSA-N 2 1 343.902 4.257 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CC2(CCCC2)Oc2ccccc21 ZINC000090461158 1050179251 /nfs/dbraw/zinc/17/92/51/1050179251.db2.gz NYCFYHUGMNNSSP-PSBWJHGTSA-N 2 1 328.500 4.141 20 0 EIADMP COc1cc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc2ccccc21 ZINC001177298399 1050180725 /nfs/dbraw/zinc/18/07/25/1050180725.db2.gz BDYKUTIKMTYHOY-GOSISDBHSA-N 2 1 340.511 4.450 20 0 EIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001172849776 1050188312 /nfs/dbraw/zinc/18/83/12/1050188312.db2.gz PNGUXNBKNGAPCJ-GJZGRUSLSA-N 2 1 326.887 4.251 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cccc3cccnc32)C1 ZINC000251600654 1050193364 /nfs/dbraw/zinc/19/33/64/1050193364.db2.gz BRTAYIONMNVZOM-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cccc3cccnc32)C1 ZINC000251600654 1050193371 /nfs/dbraw/zinc/19/33/71/1050193371.db2.gz BRTAYIONMNVZOM-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001172860268 1050199175 /nfs/dbraw/zinc/19/91/75/1050199175.db2.gz ZPTMVAZWJYSWIZ-CQSZACIVSA-N 2 1 338.898 4.394 20 0 EIADMP Cc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c(OC(F)F)cc1C ZINC001177416791 1050209091 /nfs/dbraw/zinc/20/90/91/1050209091.db2.gz WSNOLTKVKJLPCM-CQSZACIVSA-N 2 1 340.458 4.116 20 0 EIADMP C[C@@H](CSc1ccc(Cl)cc1)[NH+]1CCC([NH+]2CCCC2)CC1 ZINC001172878873 1050218868 /nfs/dbraw/zinc/21/88/68/1050218868.db2.gz WFBORYDFWNYNQX-HNNXBMFYSA-N 2 1 338.948 4.381 20 0 EIADMP CCC[NH+]1C[C@@H]2C[N@H+]([C@@H](C)CSc3ccc(Cl)cc3)C[C@@H]2C1 ZINC001172884352 1050226678 /nfs/dbraw/zinc/22/66/78/1050226678.db2.gz BOXRKWBGMOARQJ-HRCADAONSA-N 2 1 338.948 4.094 20 0 EIADMP CCC[NH+]1C[C@@H]2C[N@@H+]([C@@H](C)CSc3ccc(Cl)cc3)C[C@@H]2C1 ZINC001172884352 1050226693 /nfs/dbraw/zinc/22/66/93/1050226693.db2.gz BOXRKWBGMOARQJ-HRCADAONSA-N 2 1 338.948 4.094 20 0 EIADMP CCn1c2ccccc2c2cc(C[N@H+]3CC[C@@H](F)[C@@H]([NH3+])CC3)ccc21 ZINC001206185066 1050263517 /nfs/dbraw/zinc/26/35/17/1050263517.db2.gz LAUDNWNDVZYORO-MOPGFXCFSA-N 2 1 339.458 4.076 20 0 EIADMP CCn1c2ccccc2c2cc(C[N@@H+]3CC[C@@H](F)[C@@H]([NH3+])CC3)ccc21 ZINC001206185066 1050263534 /nfs/dbraw/zinc/26/35/34/1050263534.db2.gz LAUDNWNDVZYORO-MOPGFXCFSA-N 2 1 339.458 4.076 20 0 EIADMP CCCOC1CCC([N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC001173100358 1050302780 /nfs/dbraw/zinc/30/27/80/1050302780.db2.gz ILAYRMMZKLMZLD-HWELCPFYSA-N 2 1 344.543 4.178 20 0 EIADMP CCCOC1CCC([NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC001173100358 1050302789 /nfs/dbraw/zinc/30/27/89/1050302789.db2.gz ILAYRMMZKLMZLD-HWELCPFYSA-N 2 1 344.543 4.178 20 0 EIADMP CCCOC1CCC([NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001173100358 1050302799 /nfs/dbraw/zinc/30/27/99/1050302799.db2.gz ILAYRMMZKLMZLD-HWELCPFYSA-N 2 1 344.543 4.178 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@H](C)CC2CCCCC2)[C@H](C)C1 ZINC001177843947 1050312925 /nfs/dbraw/zinc/31/29/25/1050312925.db2.gz ICRPCABPNQPXQC-SBHAEUEKSA-N 2 1 338.580 4.320 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCC[C@@H](C)CC3)CC2)cs1 ZINC001177855424 1050318091 /nfs/dbraw/zinc/31/80/91/1050318091.db2.gz VTPXUUUDOZSMJC-AEFFLSMTSA-N 2 1 349.588 4.476 20 0 EIADMP CCCCOc1ccccc1C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC001177948642 1050345837 /nfs/dbraw/zinc/34/58/37/1050345837.db2.gz LEHBPAMDHHPWNN-UHFFFAOYSA-N 2 1 330.516 4.362 20 0 EIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCc2[nH+]ccn2CC1 ZINC001173216595 1050351482 /nfs/dbraw/zinc/35/14/82/1050351482.db2.gz MBLHLQRMEXDKSB-LJQANCHMSA-N 2 1 345.490 4.352 20 0 EIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCc2[nH+]ccn2CC1 ZINC001173216595 1050351486 /nfs/dbraw/zinc/35/14/86/1050351486.db2.gz MBLHLQRMEXDKSB-LJQANCHMSA-N 2 1 345.490 4.352 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)CC(c1ccccc1)c1ccccc1 ZINC001173206512 1050365024 /nfs/dbraw/zinc/36/50/24/1050365024.db2.gz WMNRLMZWHYWZLO-GOSISDBHSA-N 2 1 333.479 4.392 20 0 EIADMP Cc1c[nH+]c(CC[NH3+])n1[C@@H](C)CC(c1ccccc1)c1ccccc1 ZINC001173206438 1050365838 /nfs/dbraw/zinc/36/58/38/1050365838.db2.gz VICYCZJFNGKQQL-KRWDZBQOSA-N 2 1 333.479 4.476 20 0 EIADMP CC[C@H]1CC[C@H]([NH2+][C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2[NH3+])C1 ZINC001173270944 1050392340 /nfs/dbraw/zinc/39/23/40/1050392340.db2.gz DKFCHGOVZLZWIE-QKIJFTERSA-N 2 1 332.491 4.142 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+]Cc2cccc(F)c2F)C[N@H+]1Cc1ccccc1 ZINC001178208291 1050406185 /nfs/dbraw/zinc/40/61/85/1050406185.db2.gz KYQLEIDDVKHLAH-WMZOPIPTSA-N 2 1 344.449 4.355 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@H]3CCSc4ccccc43)C2)cc1 ZINC000253355640 1050453943 /nfs/dbraw/zinc/45/39/43/1050453943.db2.gz UIUPMCIFKFYCKM-ICSRJNTNSA-N 2 1 338.520 4.335 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2cc(F)ccc2o1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001178457875 1050473716 /nfs/dbraw/zinc/47/37/16/1050473716.db2.gz FUPRIRFMPMCBMP-CABCVRRESA-N 2 1 330.447 4.315 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2cc(F)ccc2o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001178457875 1050473725 /nfs/dbraw/zinc/47/37/25/1050473725.db2.gz FUPRIRFMPMCBMP-CABCVRRESA-N 2 1 330.447 4.315 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CCC[N@@H+](C)CC1 ZINC001173541804 1050475894 /nfs/dbraw/zinc/47/58/94/1050475894.db2.gz DAOQWMZFJIOVAQ-ZFWWWQNUSA-N 2 1 329.315 4.388 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001173548494 1050486228 /nfs/dbraw/zinc/48/62/28/1050486228.db2.gz CGMKKNLJRZBNCQ-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC001173548494 1050486237 /nfs/dbraw/zinc/48/62/37/1050486237.db2.gz CGMKKNLJRZBNCQ-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001173548494 1050486249 /nfs/dbraw/zinc/48/62/49/1050486249.db2.gz CGMKKNLJRZBNCQ-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2cccc3c[nH]nc32)CC[N@@H+]1Cc1ccccc1 ZINC000093318224 1050558363 /nfs/dbraw/zinc/55/83/63/1050558363.db2.gz HDEIUPFRWFGURN-LAUBAEHRSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2cccc3c[nH]nc32)CC[N@H+]1Cc1ccccc1 ZINC000093318224 1050558369 /nfs/dbraw/zinc/55/83/69/1050558369.db2.gz HDEIUPFRWFGURN-LAUBAEHRSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2cccc3c[nH]nc32)CC[NH+]1Cc1ccccc1 ZINC000093318224 1050558375 /nfs/dbraw/zinc/55/83/75/1050558375.db2.gz HDEIUPFRWFGURN-LAUBAEHRSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cccc3c[nH]nc32)CC[NH+]1Cc1ccccc1 ZINC000093318224 1050558390 /nfs/dbraw/zinc/55/83/90/1050558390.db2.gz HDEIUPFRWFGURN-LAUBAEHRSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H](C[NH2+]Cc1ccc(-c2cccc(C(F)(F)F)c2)o1)C[NH+](C)C ZINC001178811768 1050558973 /nfs/dbraw/zinc/55/89/73/1050558973.db2.gz XTJJEBKIUCPPHJ-CYBMUJFWSA-N 2 1 340.389 4.253 20 0 EIADMP CC(C)[C@H](C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC001179015937 1050613972 /nfs/dbraw/zinc/61/39/72/1050613972.db2.gz RKSWAKXMCWGYHH-VJBWXMMDSA-N 2 1 336.523 4.361 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2([C@H]3CCCCO3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001179429679 1050689240 /nfs/dbraw/zinc/68/92/40/1050689240.db2.gz GIJGPHRLTMCELO-HMXCVIKNSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C2([C@H]3CCCCO3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC001179429679 1050689250 /nfs/dbraw/zinc/68/92/50/1050689250.db2.gz GIJGPHRLTMCELO-HMXCVIKNSA-N 2 1 342.527 4.121 20 0 EIADMP COc1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1C(C)(C)C ZINC001179877579 1050813704 /nfs/dbraw/zinc/81/37/04/1050813704.db2.gz HQRCMDVOPLUTFI-LJQANCHMSA-N 2 1 344.543 4.301 20 0 EIADMP COc1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1C(C)(C)C ZINC001179877579 1050813708 /nfs/dbraw/zinc/81/37/08/1050813708.db2.gz HQRCMDVOPLUTFI-LJQANCHMSA-N 2 1 344.543 4.301 20 0 EIADMP CC(C)(C)c1ccc(CC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001179925500 1050819133 /nfs/dbraw/zinc/81/91/33/1050819133.db2.gz ROCUJSBQWQVIDE-UGKGYDQZSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001179925500 1050819136 /nfs/dbraw/zinc/81/91/36/1050819136.db2.gz ROCUJSBQWQVIDE-UGKGYDQZSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC001179925500 1050819141 /nfs/dbraw/zinc/81/91/41/1050819141.db2.gz ROCUJSBQWQVIDE-UGKGYDQZSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC001179925500 1050819145 /nfs/dbraw/zinc/81/91/45/1050819145.db2.gz ROCUJSBQWQVIDE-UGKGYDQZSA-N 2 1 340.555 4.475 20 0 EIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](CC4CCSCC4)CC[C@@H]32)cc1 ZINC001179918364 1050834781 /nfs/dbraw/zinc/83/47/81/1050834781.db2.gz BOCCNQXXYRCCIC-RTWAWAEBSA-N 2 1 344.568 4.116 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](CC4CCSCC4)CC[C@@H]32)cc1 ZINC001179918364 1050834782 /nfs/dbraw/zinc/83/47/82/1050834782.db2.gz BOCCNQXXYRCCIC-RTWAWAEBSA-N 2 1 344.568 4.116 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](CC4CCSCC4)CC[C@@H]32)cc1 ZINC001179918364 1050834792 /nfs/dbraw/zinc/83/47/92/1050834792.db2.gz BOCCNQXXYRCCIC-RTWAWAEBSA-N 2 1 344.568 4.116 20 0 EIADMP CCOc1ccc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)o1 ZINC001180053531 1050868255 /nfs/dbraw/zinc/86/82/55/1050868255.db2.gz ZFBLHLYYGWCEIQ-UHFFFAOYSA-N 2 1 342.483 4.022 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC2Cc3ccccc3C2)CC1 ZINC001180052354 1050868642 /nfs/dbraw/zinc/86/86/42/1050868642.db2.gz PYIHYCUZVJWVBU-UHFFFAOYSA-N 2 1 348.534 4.245 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc3c(n2)CCC3)CC1 ZINC001180225306 1050921737 /nfs/dbraw/zinc/92/17/37/1050921737.db2.gz QDSYIINWSJOSGH-SFHVURJKSA-N 2 1 341.543 4.047 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000152994955 1050923283 /nfs/dbraw/zinc/92/32/83/1050923283.db2.gz HWNZODOSUZOXCJ-QKPAOTATSA-N 2 1 340.433 4.414 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(SC)o2)CC1)CC1CC1 ZINC001180322596 1050967527 /nfs/dbraw/zinc/96/75/27/1050967527.db2.gz KFKQAVZIZGJVSK-UHFFFAOYSA-N 2 1 336.545 4.336 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001180793780 1051077606 /nfs/dbraw/zinc/07/76/06/1051077606.db2.gz LSICUFGLZVUXTF-KRWDZBQOSA-N 2 1 328.887 4.391 20 0 EIADMP Cc1csc2nc(C)c(C[NH2+]C(C)(C)CC[NH+]3CCCCCC3)n12 ZINC001181042866 1051134022 /nfs/dbraw/zinc/13/40/22/1051134022.db2.gz ILSANEOHBSWGFC-UHFFFAOYSA-N 2 1 348.560 4.147 20 0 EIADMP CC[C@H]([NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1)[C@@H]1CCOC1 ZINC000153853067 1051236947 /nfs/dbraw/zinc/23/69/47/1051236947.db2.gz VISRCJNNNABISC-SXLOBPIMSA-N 2 1 330.516 4.055 20 0 EIADMP COc1ccccc1CCC[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190826522 1051285122 /nfs/dbraw/zinc/28/51/22/1051285122.db2.gz HRIVAMYJLKUNSL-HXUWFJFHSA-N 2 1 344.543 4.216 20 0 EIADMP CC(C)(C)c1cccc(OCCC[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1 ZINC001191122418 1051359181 /nfs/dbraw/zinc/35/91/81/1051359181.db2.gz QMHJYWSMSPJNQC-LJQANCHMSA-N 2 1 344.543 4.171 20 0 EIADMP CS[C@H]1CC[N@@H+](C[C@@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001182063339 1051388673 /nfs/dbraw/zinc/38/86/73/1051388673.db2.gz TXTZABLRTDWYBG-FPOVZHCZSA-N 2 1 346.584 4.362 20 0 EIADMP CS[C@H]1CC[NH+](C[C@@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC001182063339 1051388682 /nfs/dbraw/zinc/38/86/82/1051388682.db2.gz TXTZABLRTDWYBG-FPOVZHCZSA-N 2 1 346.584 4.362 20 0 EIADMP CS[C@H]1CC[NH+](C[C@@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001182063339 1051388696 /nfs/dbraw/zinc/38/86/96/1051388696.db2.gz TXTZABLRTDWYBG-FPOVZHCZSA-N 2 1 346.584 4.362 20 0 EIADMP C/C=C\COc1ccc(CC[C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC001182248547 1051441301 /nfs/dbraw/zinc/44/13/01/1051441301.db2.gz ACTTZACVUAOEKS-GVZHBMFQSA-N 2 1 344.543 4.284 20 0 EIADMP C[C@@H]1C[C@H](C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)C[C@H](C)O1 ZINC001191549590 1051485503 /nfs/dbraw/zinc/48/55/03/1051485503.db2.gz FANKXXQEBVUQQN-CTAFRAEOSA-N 2 1 336.564 4.167 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@@H]2CCCC(C)(C)O2)CC1 ZINC001191549314 1051486885 /nfs/dbraw/zinc/48/68/85/1051486885.db2.gz AVAYVDYVVYEWAD-ICSRJNTNSA-N 2 1 336.564 4.311 20 0 EIADMP C[N@H+]1CCc2ccc(Nc3ccc(C[NH+]4CCCCC4)cc3)cc2C1 ZINC001175365355 1051555274 /nfs/dbraw/zinc/55/52/74/1051555274.db2.gz IXFDUZHXDKRZCG-UHFFFAOYSA-N 2 1 335.495 4.404 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCOCc2ccccc2)cc1 ZINC000156949893 1051583945 /nfs/dbraw/zinc/58/39/45/1051583945.db2.gz JPZRGPCUNDWKHJ-QGZVFWFLSA-N 2 1 335.451 4.048 20 0 EIADMP CC(C)C[N@H+](Cc1cccc(OC(F)F)c1)CC1CC[NH+](C)CC1 ZINC001175601874 1051667695 /nfs/dbraw/zinc/66/76/95/1051667695.db2.gz WBWMEARNHKRDCX-UHFFFAOYSA-N 2 1 340.458 4.088 20 0 EIADMP C[C@@H]1SCC[C@H]1[NH2+]C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001182726494 1051688092 /nfs/dbraw/zinc/68/80/92/1051688092.db2.gz UBWVZDNFWOZPGK-FBBABVLZSA-N 2 1 346.584 4.408 20 0 EIADMP C[C@]1(C[NH3+])CCCC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)C1 ZINC001206541194 1051706895 /nfs/dbraw/zinc/70/68/95/1051706895.db2.gz FUAYOHCHQWJMIK-QGZVFWFLSA-N 2 1 329.315 4.377 20 0 EIADMP C[C@]1(C[NH3+])CCCC[N@@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC001206541394 1051710516 /nfs/dbraw/zinc/71/05/16/1051710516.db2.gz HAVZFMFMTAXHHW-QGZVFWFLSA-N 2 1 328.422 4.089 20 0 EIADMP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@H]3CCC[N@@H+](C)C3)cs2)cs1 ZINC000158173021 1051722840 /nfs/dbraw/zinc/72/28/40/1051722840.db2.gz QRAPHEGZORWBNI-GXTWGEPZSA-N 2 1 335.542 4.172 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC001183281082 1051812090 /nfs/dbraw/zinc/81/20/90/1051812090.db2.gz LQUNGGYLYYEMQN-QTEQDKRBSA-N 2 1 336.523 4.284 20 0 EIADMP CC1(C)CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1cncc(Cl)c1 ZINC000621291503 1051823592 /nfs/dbraw/zinc/82/35/92/1051823592.db2.gz UMTLAJAJBFARIP-LJQANCHMSA-N 2 1 343.902 4.125 20 0 EIADMP C[N@H+](CCCC[NH+]1CCCCC1)Cc1ccsc1Br ZINC001183511430 1051861295 /nfs/dbraw/zinc/86/12/95/1051861295.db2.gz OGCTVTVICRZVGO-UHFFFAOYSA-N 2 1 345.350 4.209 20 0 EIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1ccsc1Br ZINC001183511430 1051861297 /nfs/dbraw/zinc/86/12/97/1051861297.db2.gz OGCTVTVICRZVGO-UHFFFAOYSA-N 2 1 345.350 4.209 20 0 EIADMP C[N@@H+]1CC[C@@H]2CC[C@H](C1)[NH+]2CC/C=C\c1ccc(Br)cc1 ZINC001176069199 1051903142 /nfs/dbraw/zinc/90/31/42/1051903142.db2.gz HNSWPTAKTBOLJJ-IMQXRCJOSA-N 2 1 349.316 4.021 20 0 EIADMP C[N@H+]1CC[C@@H]2CC[C@H](C1)[NH+]2CC/C=C\c1ccc(Br)cc1 ZINC001176069199 1051903157 /nfs/dbraw/zinc/90/31/57/1051903157.db2.gz HNSWPTAKTBOLJJ-IMQXRCJOSA-N 2 1 349.316 4.021 20 0 EIADMP C[NH+]1CC[C@@H]2CC[C@H](C1)[N@@H+]2CC/C=C\c1ccc(Br)cc1 ZINC001176069199 1051903173 /nfs/dbraw/zinc/90/31/73/1051903173.db2.gz HNSWPTAKTBOLJJ-IMQXRCJOSA-N 2 1 349.316 4.021 20 0 EIADMP C[NH+]1CC[C@@H]2CC[C@H](C1)[N@H+]2CC/C=C\c1ccc(Br)cc1 ZINC001176069199 1051903185 /nfs/dbraw/zinc/90/31/85/1051903185.db2.gz HNSWPTAKTBOLJJ-IMQXRCJOSA-N 2 1 349.316 4.021 20 0 EIADMP C[C@@H]1CCCC[C@@H]1C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263195 1051987104 /nfs/dbraw/zinc/98/71/04/1051987104.db2.gz QYJJLQWTRJERCO-NMIHRBCNSA-N 2 1 326.528 4.267 20 0 EIADMP C[C@@H]1CCCC[C@@H]1C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263195 1051987118 /nfs/dbraw/zinc/98/71/18/1051987118.db2.gz QYJJLQWTRJERCO-NMIHRBCNSA-N 2 1 326.528 4.267 20 0 EIADMP C[C@@H]1CCCC[C@@H]1C[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263195 1051987129 /nfs/dbraw/zinc/98/71/29/1051987129.db2.gz QYJJLQWTRJERCO-NMIHRBCNSA-N 2 1 326.528 4.267 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3cc4c(s3)CCC4)CC2)[nH+]c1 ZINC000163495859 1051992069 /nfs/dbraw/zinc/99/20/69/1051992069.db2.gz NKRLTRWBEVYATR-HNNXBMFYSA-N 2 1 341.524 4.260 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C[C@@H]3C[C@@H]3c3ccccc3)CC2)cc1 ZINC000163504343 1051993016 /nfs/dbraw/zinc/99/30/16/1051993016.db2.gz XEYKCBIZUFHGDN-JTHBVZDNSA-N 2 1 334.507 4.087 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3cc4ccccc4o3)CC2)[nH+]c1 ZINC000163534831 1051995907 /nfs/dbraw/zinc/99/59/07/1051995907.db2.gz NWKYBLMVBGUGJL-MRXNPFEDSA-N 2 1 335.451 4.456 20 0 EIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H](CCc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC001184389487 1052001697 /nfs/dbraw/zinc/00/16/97/1052001697.db2.gz XKFWUXZHWNYIKD-XQUALCHDSA-N 2 1 348.534 4.160 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC2(CCO)CCCCC2)cc1 ZINC000165650179 1052072860 /nfs/dbraw/zinc/07/28/60/1052072860.db2.gz MXJPKKCNRVIILR-KRWDZBQOSA-N 2 1 341.499 4.164 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCCc2ccccc2)CC1 ZINC000060377507 1052080008 /nfs/dbraw/zinc/08/00/08/1052080008.db2.gz VWBKLEVELNXIOC-UHFFFAOYSA-N 2 1 336.523 4.463 20 0 EIADMP C[C@@]1(C[NH3+])CCC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC001206295269 1052233651 /nfs/dbraw/zinc/23/36/51/1052233651.db2.gz LURHAFVXERVNIE-QGZVFWFLSA-N 2 1 329.315 4.377 20 0 EIADMP Cc1ccc2cc(C[NH2+]C[C@@H]3CC[N@@H+](Cc4ccccc4)C3)ccc2n1 ZINC000336810983 1052520915 /nfs/dbraw/zinc/52/09/15/1052520915.db2.gz KLCUPSCENCKCKM-NRFANRHFSA-N 2 1 345.490 4.155 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)C1 ZINC000339069036 1052552124 /nfs/dbraw/zinc/55/21/24/1052552124.db2.gz QMTQCNBNPDQVNN-KCZVDYSFSA-N 2 1 344.543 4.256 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000174453410 1052567875 /nfs/dbraw/zinc/56/78/75/1052567875.db2.gz UXQTYGNPRHVZLU-UHFFFAOYSA-N 2 1 349.478 4.437 20 0 EIADMP CC(C)Oc1ccc(CC[C@H](C)[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623363355 1052635715 /nfs/dbraw/zinc/63/57/15/1052635715.db2.gz PTOYWPKJNXCLKN-HKUYNNGSSA-N 2 1 332.532 4.257 20 0 EIADMP COc1cc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)ccc1Cl ZINC000623379857 1052641612 /nfs/dbraw/zinc/64/16/12/1052641612.db2.gz LGEOROSBSNNXSR-UHFFFAOYSA-N 2 1 346.902 4.479 20 0 EIADMP C[C@@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000623447494 1052658036 /nfs/dbraw/zinc/65/80/36/1052658036.db2.gz TUJCJWJLQWLRQQ-PBHICJAKSA-N 2 1 334.479 4.138 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(OCC2CC2)c(F)c1 ZINC000623447494 1052658039 /nfs/dbraw/zinc/65/80/39/1052658039.db2.gz TUJCJWJLQWLRQQ-PBHICJAKSA-N 2 1 334.479 4.138 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000623526035 1052672874 /nfs/dbraw/zinc/67/28/74/1052672874.db2.gz HTSDRMDCLTWKJB-WMZOPIPTSA-N 2 1 339.483 4.397 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000178707807 1052710894 /nfs/dbraw/zinc/71/08/94/1052710894.db2.gz AIQQUUNKCQLZGG-STQMWFEESA-N 2 1 341.377 4.077 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623862531 1052824249 /nfs/dbraw/zinc/82/42/49/1052824249.db2.gz WUCPOQLEUMPYPD-KRWDZBQOSA-N 2 1 329.513 4.151 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623862531 1052824251 /nfs/dbraw/zinc/82/42/51/1052824251.db2.gz WUCPOQLEUMPYPD-KRWDZBQOSA-N 2 1 329.513 4.151 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(F)cc1C(F)(F)F ZINC000623855251 1052826816 /nfs/dbraw/zinc/82/68/16/1052826816.db2.gz UPTWOVSTDOYKCX-LLVKDONJSA-N 2 1 330.369 4.122 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(F)cc1C(F)(F)F ZINC000623855252 1052826961 /nfs/dbraw/zinc/82/69/61/1052826961.db2.gz UPTWOVSTDOYKCX-NSHDSACASA-N 2 1 330.369 4.122 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCCc3scnc32)cc1 ZINC000623853708 1052827022 /nfs/dbraw/zinc/82/70/22/1052827022.db2.gz FEQZYTGDIIZPOB-QGZVFWFLSA-N 2 1 329.513 4.152 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCCC[C@@H]1Sc1ccc(F)cc1 ZINC000623881414 1052829088 /nfs/dbraw/zinc/82/90/88/1052829088.db2.gz NKCMFXGQEKZQSB-MSOLQXFVSA-N 2 1 333.476 4.024 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(F)cc1C(F)(F)F ZINC000623898788 1052831895 /nfs/dbraw/zinc/83/18/95/1052831895.db2.gz QYZRCDPQSBOWRL-LBPRGKRZSA-N 2 1 343.368 4.480 20 0 EIADMP CC[C@H](C)Oc1cc(C[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)ccc1OC ZINC000624019695 1052853877 /nfs/dbraw/zinc/85/38/77/1052853877.db2.gz YIUNLZNOUJRHFS-ROUUACIJSA-N 2 1 348.531 4.227 20 0 EIADMP CC[C@H](C)Oc1cc(C[NH2+]CCC[N@H+]2CCCC[C@@H]2C)ccc1OC ZINC000624019695 1052853881 /nfs/dbraw/zinc/85/38/81/1052853881.db2.gz YIUNLZNOUJRHFS-ROUUACIJSA-N 2 1 348.531 4.227 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]C[C@@H](C)Cn3cc[nH+]c3C)oc21 ZINC000181693026 1052892987 /nfs/dbraw/zinc/89/29/87/1052892987.db2.gz UHRAIYOBJFDPCZ-HUUCEWRRSA-N 2 1 341.455 4.323 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@@H+]1C ZINC000182332260 1052927465 /nfs/dbraw/zinc/92/74/65/1052927465.db2.gz JGYFHJDQNDAZQV-XJKSGUPXSA-N 2 1 326.406 4.157 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@H+]1C ZINC000182332260 1052927469 /nfs/dbraw/zinc/92/74/69/1052927469.db2.gz JGYFHJDQNDAZQV-XJKSGUPXSA-N 2 1 326.406 4.157 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1nccn1C ZINC000182687071 1052946357 /nfs/dbraw/zinc/94/63/57/1052946357.db2.gz GDFIUTAGKPHJJH-HXUWFJFHSA-N 2 1 340.515 4.037 20 0 EIADMP C[NH+](C)C1(C[NH2+][C@H](c2ccccc2)C2CCCCC2)CCOCC1 ZINC000183278611 1052968797 /nfs/dbraw/zinc/96/87/97/1052968797.db2.gz PEBAZDVYIFSUPR-HXUWFJFHSA-N 2 1 330.516 4.008 20 0 EIADMP C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381391040 1053073048 /nfs/dbraw/zinc/07/30/48/1053073048.db2.gz URPXJTRJDKKNLJ-IGGJEDBVSA-N 2 1 338.495 4.403 20 0 EIADMP C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381391040 1053073058 /nfs/dbraw/zinc/07/30/58/1053073058.db2.gz URPXJTRJDKKNLJ-IGGJEDBVSA-N 2 1 338.495 4.403 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC000381796052 1053096431 /nfs/dbraw/zinc/09/64/31/1053096431.db2.gz BNLINQCEQLABKV-UAFMIMERSA-N 2 1 348.481 4.312 20 0 EIADMP Cc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)s1 ZINC000381862491 1053105740 /nfs/dbraw/zinc/10/57/40/1053105740.db2.gz JAUMRKJKSPTQCJ-VQIMIIECSA-N 2 1 328.525 4.365 20 0 EIADMP C[C@@H]([NH2+]Cc1cc(Cl)cs1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382062858 1053136088 /nfs/dbraw/zinc/13/60/88/1053136088.db2.gz PYXCHVBJSWHZOZ-ZBFHGGJFSA-N 2 1 334.916 4.402 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000850432239 1053207948 /nfs/dbraw/zinc/20/79/48/1053207948.db2.gz VGLIMPMFCIXDMP-QGZVFWFLSA-N 2 1 338.495 4.314 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH2+]C1CCN(c3cccc(C)[nH+]3)CC1)CCC2 ZINC000339067104 1053237669 /nfs/dbraw/zinc/23/76/69/1053237669.db2.gz FUGZYYREOQJUCU-OAQYLSRUSA-N 2 1 335.495 4.334 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000383365058 1053329551 /nfs/dbraw/zinc/32/95/51/1053329551.db2.gz UXUUVOAWPQDXLT-WIYYLYMNSA-N 2 1 326.459 4.389 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](Cc2ccc(C)cc2)C(C)C)cn1 ZINC000765239683 1053474064 /nfs/dbraw/zinc/47/40/64/1053474064.db2.gz RFSNPGVNGBYKIS-OAQYLSRUSA-N 2 1 348.494 4.241 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2COc3ccccc3C2)cc1 ZINC000765333871 1053507388 /nfs/dbraw/zinc/50/73/88/1053507388.db2.gz MIIZSKQGEJQHOQ-AEFFLSMTSA-N 2 1 347.462 4.083 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)C[C@H](O)c2ccccc2)cc1 ZINC000120718934 1053578303 /nfs/dbraw/zinc/57/83/03/1053578303.db2.gz NFNMCMJVXLHLRC-JLHGSKIFSA-N 2 1 349.478 4.344 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866248624 1053664119 /nfs/dbraw/zinc/66/41/19/1053664119.db2.gz FPCYQRHBPFCQTN-GFCCVEGCSA-N 2 1 333.863 4.149 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cc2c(ccnc2Cl)o1 ZINC000866272431 1053673478 /nfs/dbraw/zinc/67/34/78/1053673478.db2.gz OCCMETLZZVFYEW-LBPRGKRZSA-N 2 1 332.835 4.117 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1 ZINC000866517078 1053765791 /nfs/dbraw/zinc/76/57/91/1053765791.db2.gz WAROPZHTIJWHND-YLZJTPGZSA-N 3 1 340.515 4.094 20 0 EIADMP C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866705977 1053818179 /nfs/dbraw/zinc/81/81/79/1053818179.db2.gz DIKSJQPYWGWZOK-YWZLYKJASA-N 2 1 327.472 4.100 20 0 EIADMP C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866705977 1053818181 /nfs/dbraw/zinc/81/81/81/1053818181.db2.gz DIKSJQPYWGWZOK-YWZLYKJASA-N 2 1 327.472 4.100 20 0 EIADMP CCC[N@@H+](C[C@H](OC)C1CCC1)C1CCN(Cc2ccccc2)CC1 ZINC001198641156 1054215165 /nfs/dbraw/zinc/21/51/65/1054215165.db2.gz NFVHSENJYDYGAV-QFIPXVFZSA-N 2 1 344.543 4.178 20 0 EIADMP Cc1cccc(OCC[NH2+]CC(C)(C)C[N@H+](C)Cc2ccccc2)c1 ZINC001198992238 1054322859 /nfs/dbraw/zinc/32/28/59/1054322859.db2.gz YMODDPJBNOMQRP-UHFFFAOYSA-N 2 1 340.511 4.122 20 0 EIADMP Cc1cccc(OCC[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)c1 ZINC001198992238 1054322872 /nfs/dbraw/zinc/32/28/72/1054322872.db2.gz YMODDPJBNOMQRP-UHFFFAOYSA-N 2 1 340.511 4.122 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cc(O)ccc1F ZINC000872023826 1054339329 /nfs/dbraw/zinc/33/93/29/1054339329.db2.gz VYWFNOYKCGQLAH-HNNXBMFYSA-N 2 1 330.447 4.222 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cc(O)ccc1F ZINC000872023826 1054339345 /nfs/dbraw/zinc/33/93/45/1054339345.db2.gz VYWFNOYKCGQLAH-HNNXBMFYSA-N 2 1 330.447 4.222 20 0 EIADMP CC(C)[C@H]1CCC[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC001199127297 1054347099 /nfs/dbraw/zinc/34/70/99/1054347099.db2.gz WYNNRUSBORCOQN-UNMCSNQZSA-N 2 1 328.544 4.498 20 0 EIADMP CC[C@H]([NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)[C@@H]1CCCOC1 ZINC000872040806 1054356869 /nfs/dbraw/zinc/35/68/69/1054356869.db2.gz CJAKGHSESZZJMG-ZTNFWEORSA-N 2 1 327.472 4.037 20 0 EIADMP CC[C@H](CCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000872066302 1054374418 /nfs/dbraw/zinc/37/44/18/1054374418.db2.gz GWMCKXHFCUYFPH-IAGOWNOFSA-N 2 1 328.422 4.219 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CCOC(C)(C)C1 ZINC001199267681 1054379407 /nfs/dbraw/zinc/37/94/07/1054379407.db2.gz QJGWWHLOXFOBHG-YLJYHZDGSA-N 2 1 330.516 4.108 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)CC1(C)C ZINC001199309423 1054386684 /nfs/dbraw/zinc/38/66/84/1054386684.db2.gz IJLOAXQYGIJPOP-FQEVSTJZSA-N 2 1 338.495 4.228 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1cccc(OC(F)(F)F)c1 ZINC000858149781 1054424778 /nfs/dbraw/zinc/42/47/78/1054424778.db2.gz UVDUKTQWYMWGNL-JSGCOSHPSA-N 2 1 330.394 4.109 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1cccc(OC(F)(F)F)c1 ZINC000858149781 1054424782 /nfs/dbraw/zinc/42/47/82/1054424782.db2.gz UVDUKTQWYMWGNL-JSGCOSHPSA-N 2 1 330.394 4.109 20 0 EIADMP Cc1nc(C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)sc1C ZINC001199895228 1054483970 /nfs/dbraw/zinc/48/39/70/1054483970.db2.gz AMJXPUPJPLTIFT-UHFFFAOYSA-N 2 1 343.540 4.426 20 0 EIADMP C[C@@]1(CN[C@H]2CCCc3scnc32)CC[N@@H+](Cc2ccccc2)C1 ZINC000858414665 1054485197 /nfs/dbraw/zinc/48/51/97/1054485197.db2.gz FWWSCRMYXDMFKV-PXNSSMCTSA-N 2 1 341.524 4.022 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc(Cl)nc(Cl)c2)cc1 ZINC000859214802 1054645581 /nfs/dbraw/zinc/64/55/81/1054645581.db2.gz OHHDPLCZWUQAKK-UHFFFAOYSA-N 2 1 338.282 4.082 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(Cl)nc(Cl)c2)cc1 ZINC000859214802 1054645590 /nfs/dbraw/zinc/64/55/90/1054645590.db2.gz OHHDPLCZWUQAKK-UHFFFAOYSA-N 2 1 338.282 4.082 20 0 EIADMP CC(C)CC1(C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC001201398699 1054775144 /nfs/dbraw/zinc/77/51/44/1054775144.db2.gz PELHCVVGWDJBTQ-UHFFFAOYSA-N 2 1 332.507 4.249 20 0 EIADMP CC(C)=CCC[C@@H](C)C[N@@H+]1CCn2c(C[NH+](C)C(C)C)cnc2[C@H]1C ZINC001201488110 1054817154 /nfs/dbraw/zinc/81/71/54/1054817154.db2.gz VPFUOXLCCUMVRD-RTBURBONSA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@@H](C)C[N@H+]1CCn2c(C[NH+](C)C(C)C)cnc2[C@H]1C ZINC001201488110 1054817158 /nfs/dbraw/zinc/81/71/58/1054817158.db2.gz VPFUOXLCCUMVRD-RTBURBONSA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@@H](C)C[NH+]1CCn2c(C[N@H+](C)C(C)C)cnc2[C@H]1C ZINC001201488110 1054817160 /nfs/dbraw/zinc/81/71/60/1054817160.db2.gz VPFUOXLCCUMVRD-RTBURBONSA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@@H](C)C[NH+]1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@H]1C ZINC001201488110 1054817162 /nfs/dbraw/zinc/81/71/62/1054817162.db2.gz VPFUOXLCCUMVRD-RTBURBONSA-N 2 1 346.563 4.482 20 0 EIADMP CCC(CC)C[N@@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201528636 1054845263 /nfs/dbraw/zinc/84/52/63/1054845263.db2.gz VFZSXAINRAPSLZ-TYPHKJRUSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201528636 1054845265 /nfs/dbraw/zinc/84/52/65/1054845265.db2.gz VFZSXAINRAPSLZ-TYPHKJRUSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201528636 1054845269 /nfs/dbraw/zinc/84/52/69/1054845269.db2.gz VFZSXAINRAPSLZ-TYPHKJRUSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201528636 1054845278 /nfs/dbraw/zinc/84/52/78/1054845278.db2.gz VFZSXAINRAPSLZ-TYPHKJRUSA-N 2 1 329.532 4.050 20 0 EIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+](CCc3ccccc3)C[C@@H]21 ZINC001201604257 1054862601 /nfs/dbraw/zinc/86/26/01/1054862601.db2.gz NHGPXPDOYXPRRA-VABKMULXSA-N 2 1 334.507 4.340 20 0 EIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+](CCc3ccccc3)C[C@@H]21 ZINC001201604257 1054862604 /nfs/dbraw/zinc/86/26/04/1054862604.db2.gz NHGPXPDOYXPRRA-VABKMULXSA-N 2 1 334.507 4.340 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201609244 1054863343 /nfs/dbraw/zinc/86/33/43/1054863343.db2.gz FEKULCPALOKNJL-GOTSBHOMSA-N 2 1 334.507 4.073 20 0 EIADMP c1ccc(CC[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201609244 1054863345 /nfs/dbraw/zinc/86/33/45/1054863345.db2.gz FEKULCPALOKNJL-GOTSBHOMSA-N 2 1 334.507 4.073 20 0 EIADMP c1ccc(CC[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201609244 1054863346 /nfs/dbraw/zinc/86/33/46/1054863346.db2.gz FEKULCPALOKNJL-GOTSBHOMSA-N 2 1 334.507 4.073 20 0 EIADMP CSCCC[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3cccs3)[C@H]2C1 ZINC001201680824 1054875032 /nfs/dbraw/zinc/87/50/32/1054875032.db2.gz ODLXIDZCYDFOOY-RYQLBKOJSA-N 2 1 338.586 4.034 20 0 EIADMP CSCCC[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201680824 1054875034 /nfs/dbraw/zinc/87/50/34/1054875034.db2.gz ODLXIDZCYDFOOY-RYQLBKOJSA-N 2 1 338.586 4.034 20 0 EIADMP CSCCC[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201680824 1054875036 /nfs/dbraw/zinc/87/50/36/1054875036.db2.gz ODLXIDZCYDFOOY-RYQLBKOJSA-N 2 1 338.586 4.034 20 0 EIADMP CCCCC[NH+]1CCC2(CC[N@@H+](Cc3cccc(OC)c3)C2)CC1 ZINC001201730732 1054887055 /nfs/dbraw/zinc/88/70/55/1054887055.db2.gz LENXSEYCBCICIO-UHFFFAOYSA-N 2 1 330.516 4.173 20 0 EIADMP C[C@@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccncc1 ZINC000671750050 1054962017 /nfs/dbraw/zinc/96/20/17/1054962017.db2.gz OENDJDXHKZOCNO-XTWGIRIWSA-N 2 1 337.511 4.218 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc3ncccc3c2)c1 ZINC000067450066 1055037451 /nfs/dbraw/zinc/03/74/51/1055037451.db2.gz JBNMLTDYPGCSMR-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP Cc1c(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)ccnc1F ZINC000862271370 1055042164 /nfs/dbraw/zinc/04/21/64/1055042164.db2.gz MKXYCSHATAEJIV-MRXNPFEDSA-N 2 1 341.474 4.193 20 0 EIADMP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000877495655 1055065561 /nfs/dbraw/zinc/06/55/61/1055065561.db2.gz GQOIFDCLTZLKMR-CEXJFXJFSA-N 2 1 344.480 4.096 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CCC3SCCS3)CC[N@@H+]2C2CC2)cc1 ZINC000877636971 1055097260 /nfs/dbraw/zinc/09/72/60/1055097260.db2.gz LSQFGIGWIQOQEI-WMZOPIPTSA-N 2 1 348.581 4.140 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CCC3SCCS3)CC[N@H+]2C2CC2)cc1 ZINC000877636971 1055097271 /nfs/dbraw/zinc/09/72/71/1055097271.db2.gz LSQFGIGWIQOQEI-WMZOPIPTSA-N 2 1 348.581 4.140 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]CC[C@@H]3CCSC3)CC[N@@H+]2C2CC2)cc1 ZINC000877661546 1055100922 /nfs/dbraw/zinc/10/09/22/1055100922.db2.gz DTLXRJAVMCMWGO-POAQFYNOSA-N 2 1 330.541 4.087 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]CC[C@@H]3CCSC3)CC[N@H+]2C2CC2)cc1 ZINC000877661546 1055100932 /nfs/dbraw/zinc/10/09/32/1055100932.db2.gz DTLXRJAVMCMWGO-POAQFYNOSA-N 2 1 330.541 4.087 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](CCCC(F)(F)F)CC2 ZINC001202395587 1055171121 /nfs/dbraw/zinc/17/11/21/1055171121.db2.gz NQIVOYYEHSQCMP-MRXNPFEDSA-N 2 1 344.421 4.299 20 0 EIADMP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2cn(C(F)F)c3ccccc23)c2ccccc21 ZINC000863547139 1055226858 /nfs/dbraw/zinc/22/68/58/1055226858.db2.gz PGSVZKBODZIIOY-IAGOWNOFSA-N 2 1 327.378 4.271 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)sc1Br ZINC000623657312 1055531938 /nfs/dbraw/zinc/53/19/38/1055531938.db2.gz NKFOECRTFJJQEL-CHWSQXEVSA-N 2 1 345.350 4.202 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)sc1Br ZINC000623657315 1055532397 /nfs/dbraw/zinc/53/23/97/1055532397.db2.gz NKFOECRTFJJQEL-STQMWFEESA-N 2 1 345.350 4.202 20 0 EIADMP C[C@H](Cc1ccccn1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000655834520 1055702244 /nfs/dbraw/zinc/70/22/44/1055702244.db2.gz PHQMRUPKEOVFJT-YJSIEXFISA-N 2 1 349.522 4.045 20 0 EIADMP COC1CCC(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000542693391 1055835389 /nfs/dbraw/zinc/83/53/89/1055835389.db2.gz WSSPDYOANWSNKT-KCUKBOBISA-N 2 1 344.543 4.224 20 0 EIADMP COC1CCC(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000542693391 1055835391 /nfs/dbraw/zinc/83/53/91/1055835391.db2.gz WSSPDYOANWSNKT-KCUKBOBISA-N 2 1 344.543 4.224 20 0 EIADMP COC1CCC(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000542693392 1055835620 /nfs/dbraw/zinc/83/56/20/1055835620.db2.gz WSSPDYOANWSNKT-UMDHHFKGSA-N 2 1 344.543 4.224 20 0 EIADMP COC1CCC(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000542693392 1055835624 /nfs/dbraw/zinc/83/56/24/1055835624.db2.gz WSSPDYOANWSNKT-UMDHHFKGSA-N 2 1 344.543 4.224 20 0 EIADMP c1ccc(SCC[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000303672507 1056230018 /nfs/dbraw/zinc/23/00/18/1056230018.db2.gz GTIODPRCFZEWFJ-IBGZPJMESA-N 2 1 332.557 4.367 20 0 EIADMP c1ccc(SCC[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000303672507 1056230041 /nfs/dbraw/zinc/23/00/41/1056230041.db2.gz GTIODPRCFZEWFJ-IBGZPJMESA-N 2 1 332.557 4.367 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1OC ZINC000742374726 1058600610 /nfs/dbraw/zinc/60/06/10/1058600610.db2.gz DSSBRCAAPVIIEM-MJGOQNOKSA-N 2 1 348.531 4.227 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1OC ZINC000742374726 1058600625 /nfs/dbraw/zinc/60/06/25/1058600625.db2.gz DSSBRCAAPVIIEM-MJGOQNOKSA-N 2 1 348.531 4.227 20 0 EIADMP Cc1ccc([C@H](C)Nc2ccc3c(c2)[nH+]cn3[C@@H]2CCC[NH2+]CC2)nc1 ZINC001168855022 1060461745 /nfs/dbraw/zinc/46/17/45/1060461745.db2.gz SKPZZGROGCVNNY-FUHWJXTLSA-N 2 1 349.482 4.227 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(Cc3cccc(Cl)c3)CC1)C2 ZINC001169125579 1060651356 /nfs/dbraw/zinc/65/13/56/1060651356.db2.gz JILBOPVWCAUKEM-ACDBMABISA-N 2 1 332.919 4.220 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](n1cc(C3CC[NH2+]CC3)c3cc(F)ccc31)C2 ZINC001169153606 1060669983 /nfs/dbraw/zinc/66/99/83/1060669983.db2.gz KHGWPUQTKRBMRS-BCDXTJNWSA-N 2 1 341.474 4.045 20 0 EIADMP C[C@@H](c1ccc(Br)cc1)[N@@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169160466 1060673050 /nfs/dbraw/zinc/67/30/50/1060673050.db2.gz GHKCVAMGKXBLSQ-KKBVYLPWSA-N 2 1 337.305 4.067 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(Cc3cnc4ccccc4c3)CC1)C2 ZINC001169160034 1060673650 /nfs/dbraw/zinc/67/36/50/1060673650.db2.gz AKXPXKUMCRCEOF-KOUNCHBCSA-N 2 1 349.522 4.115 20 0 EIADMP CC[NH+]1CCC([NH2+]C(C)(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC001169240386 1060714087 /nfs/dbraw/zinc/71/40/87/1060714087.db2.gz GTQSSPMHIMLEQR-UHFFFAOYSA-N 2 1 328.422 4.100 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(c3cccc(F)c3)CCC(F)(F)CC2)CC1 ZINC001169240679 1060715446 /nfs/dbraw/zinc/71/54/46/1060715446.db2.gz BHUBEDACIXOCGU-UHFFFAOYSA-N 2 1 340.433 4.304 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cccc(C(C)(C)C)c2)[C@H](C)C1 ZINC001169555159 1060855176 /nfs/dbraw/zinc/85/51/76/1060855176.db2.gz NQRBEKGDIJDOAC-NQIIRXRSSA-N 2 1 346.559 4.211 20 0 EIADMP C[N@H+]1CCC[C@@H]1CCN1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370734 1061214884 /nfs/dbraw/zinc/21/48/84/1061214884.db2.gz DTVZWJPXPHGDJA-RHSMWYFYSA-N 2 1 326.406 4.327 20 0 EIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370734 1061214905 /nfs/dbraw/zinc/21/49/05/1061214905.db2.gz DTVZWJPXPHGDJA-RHSMWYFYSA-N 2 1 326.406 4.327 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370734 1061214926 /nfs/dbraw/zinc/21/49/26/1061214926.db2.gz DTVZWJPXPHGDJA-RHSMWYFYSA-N 2 1 326.406 4.327 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370734 1061214947 /nfs/dbraw/zinc/21/49/47/1061214947.db2.gz DTVZWJPXPHGDJA-RHSMWYFYSA-N 2 1 326.406 4.327 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370734 1061214966 /nfs/dbraw/zinc/21/49/66/1061214966.db2.gz DTVZWJPXPHGDJA-RHSMWYFYSA-N 2 1 326.406 4.327 20 0 EIADMP CCCC(O)(CCC)C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000532223785 1032104130 /nfs/dbraw/zinc/10/41/30/1032104130.db2.gz PRVVAYUQLONRCD-MRXNPFEDSA-N 2 1 329.488 4.163 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)C1 ZINC000532226713 1032106471 /nfs/dbraw/zinc/10/64/71/1032106471.db2.gz PIFNCDIYBBQZQN-DOMZBBRYSA-N 2 1 343.298 4.139 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)C1 ZINC000532226713 1032106475 /nfs/dbraw/zinc/10/64/75/1032106475.db2.gz PIFNCDIYBBQZQN-DOMZBBRYSA-N 2 1 343.298 4.139 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000532226265 1032107946 /nfs/dbraw/zinc/10/79/46/1032107946.db2.gz RQZGUQQWKHFPKP-OALUTQOASA-N 2 1 328.525 4.272 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCNCc1ccc(Sc2ccccn2)o1 ZINC000509672644 1032259287 /nfs/dbraw/zinc/25/92/87/1032259287.db2.gz KXBOBEIZUUTGKE-INIZCTEOSA-N 2 1 345.512 4.180 20 0 EIADMP C[N@H+](CCCOc1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000533061281 1032466281 /nfs/dbraw/zinc/46/62/81/1032466281.db2.gz RXODMHPJWJDSNH-UHFFFAOYSA-N 2 1 338.495 4.052 20 0 EIADMP C[N@@H+](CCCOc1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000533061281 1032466297 /nfs/dbraw/zinc/46/62/97/1032466297.db2.gz RXODMHPJWJDSNH-UHFFFAOYSA-N 2 1 338.495 4.052 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(Sc3ccccc3)cc2)C1 ZINC000533149452 1032518426 /nfs/dbraw/zinc/51/84/26/1032518426.db2.gz UWSZSPRXBQSVSJ-GOSISDBHSA-N 2 1 326.509 4.269 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H]2CCCCN2C(C)C)CC1)CC1CC1 ZINC000450656844 1032624903 /nfs/dbraw/zinc/62/49/03/1032624903.db2.gz WXKLPKSAXVKNFD-QFIPXVFZSA-N 2 1 349.607 4.083 20 0 EIADMP CC[N@H+](CCC1CCN(C[C@@H]2CCCC[NH+]2C(C)C)CC1)CC1CC1 ZINC000450656844 1032624919 /nfs/dbraw/zinc/62/49/19/1032624919.db2.gz WXKLPKSAXVKNFD-QFIPXVFZSA-N 2 1 349.607 4.083 20 0 EIADMP CC[N@@H+](CCC1CCN(C[C@@H]2CCCC[NH+]2C(C)C)CC1)CC1CC1 ZINC000450656844 1032624926 /nfs/dbraw/zinc/62/49/26/1032624926.db2.gz WXKLPKSAXVKNFD-QFIPXVFZSA-N 2 1 349.607 4.083 20 0 EIADMP CC[NH+](CCC1CCN(C[C@@H]2CCCC[N@@H+]2C(C)C)CC1)CC1CC1 ZINC000450656844 1032624935 /nfs/dbraw/zinc/62/49/35/1032624935.db2.gz WXKLPKSAXVKNFD-QFIPXVFZSA-N 2 1 349.607 4.083 20 0 EIADMP CC[NH+](CCC1CCN(C[C@@H]2CCCC[N@H+]2C(C)C)CC1)CC1CC1 ZINC000450656844 1032624939 /nfs/dbraw/zinc/62/49/39/1032624939.db2.gz WXKLPKSAXVKNFD-QFIPXVFZSA-N 2 1 349.607 4.083 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(Oc2ccccc2)o1 ZINC000180872018 1032627707 /nfs/dbraw/zinc/62/77/07/1032627707.db2.gz ZFKJWDKKXJFBRA-OAHLLOKOSA-N 2 1 325.412 4.003 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1nccn1C ZINC000246063808 1032651168 /nfs/dbraw/zinc/65/11/68/1032651168.db2.gz RORWEVBYPNVFMV-YLJYHZDGSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1nccn1C ZINC000246063808 1032651173 /nfs/dbraw/zinc/65/11/73/1032651173.db2.gz RORWEVBYPNVFMV-YLJYHZDGSA-N 2 1 340.515 4.035 20 0 EIADMP C[N@H+]1CC[C@]2(CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000430148404 1018868060 /nfs/dbraw/zinc/86/80/60/1018868060.db2.gz RTZXWENHQVQJRB-SFHVURJKSA-N 2 1 341.326 4.344 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@H+](CCCCc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000430148404 1018868061 /nfs/dbraw/zinc/86/80/61/1018868061.db2.gz RTZXWENHQVQJRB-SFHVURJKSA-N 2 1 341.326 4.344 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@@H+](CCCCc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000430148404 1018868064 /nfs/dbraw/zinc/86/80/64/1018868064.db2.gz RTZXWENHQVQJRB-SFHVURJKSA-N 2 1 341.326 4.344 20 0 EIADMP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccccc4Cl)o3)C2)C1 ZINC000430150470 1018875876 /nfs/dbraw/zinc/87/58/76/1018875876.db2.gz SEKBTCFOVFCBIY-IBGZPJMESA-N 2 1 330.859 4.128 20 0 EIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccccc4Cl)o3)C2)C1 ZINC000430150470 1018875877 /nfs/dbraw/zinc/87/58/77/1018875877.db2.gz SEKBTCFOVFCBIY-IBGZPJMESA-N 2 1 330.859 4.128 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(-c4ccccc4Cl)o3)C2)C1 ZINC000430150470 1018875879 /nfs/dbraw/zinc/87/58/79/1018875879.db2.gz SEKBTCFOVFCBIY-IBGZPJMESA-N 2 1 330.859 4.128 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(-c4ccccc4Cl)o3)C2)C1 ZINC000430150470 1018875882 /nfs/dbraw/zinc/87/58/82/1018875882.db2.gz SEKBTCFOVFCBIY-IBGZPJMESA-N 2 1 330.859 4.128 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000530460225 1019000324 /nfs/dbraw/zinc/00/03/24/1019000324.db2.gz WUSCCFFUABZEHW-WMLDXEAASA-N 2 1 338.282 4.195 20 0 EIADMP Cc1cnc([C@H](C)C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000274752178 1019189247 /nfs/dbraw/zinc/18/92/47/1019189247.db2.gz HTZQEHKJOKIWON-AYBZRNKSSA-N 2 1 343.540 4.055 20 0 EIADMP Cc1cnc([C@H](C)C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000274752181 1019189879 /nfs/dbraw/zinc/18/98/79/1019189879.db2.gz HTZQEHKJOKIWON-HHXXYDBFSA-N 2 1 343.540 4.055 20 0 EIADMP CC1(C)Cc2cc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)ccc2O1 ZINC000236691829 1032826426 /nfs/dbraw/zinc/82/64/26/1032826426.db2.gz GBUMLZUSNFPWLK-UHFFFAOYSA-N 2 1 342.527 4.287 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000683224605 1019528387 /nfs/dbraw/zinc/52/83/87/1019528387.db2.gz NGMUPNVFSFYNHQ-UHFFFAOYSA-N 2 1 339.405 4.377 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000683224605 1019528401 /nfs/dbraw/zinc/52/84/01/1019528401.db2.gz NGMUPNVFSFYNHQ-UHFFFAOYSA-N 2 1 339.405 4.377 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](CCc2c(F)cccc2Cl)CC1 ZINC001167077778 1019567360 /nfs/dbraw/zinc/56/73/60/1019567360.db2.gz NOTRMROPGMGWDU-UHFFFAOYSA-N 2 1 340.914 4.466 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000179493358 1019747331 /nfs/dbraw/zinc/74/73/31/1019747331.db2.gz CMFZMXJKOFGYFW-ZDUSSCGKSA-N 2 1 341.377 4.173 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000179493358 1019747345 /nfs/dbraw/zinc/74/73/45/1019747345.db2.gz CMFZMXJKOFGYFW-ZDUSSCGKSA-N 2 1 341.377 4.173 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Br)cc1 ZINC000037140848 1019856189 /nfs/dbraw/zinc/85/61/89/1019856189.db2.gz ZJMCDIXNCVEBPJ-QGZVFWFLSA-N 2 1 337.305 4.117 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000180141809 1020066123 /nfs/dbraw/zinc/06/61/23/1020066123.db2.gz RFUHKMZCLCDMOQ-XICAJGIJSA-N 2 1 344.568 4.446 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000398190519 1020528573 /nfs/dbraw/zinc/52/85/73/1020528573.db2.gz ZETGDMONIDYTNF-RDTXWAMCSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000398190519 1020528578 /nfs/dbraw/zinc/52/85/78/1020528578.db2.gz ZETGDMONIDYTNF-RDTXWAMCSA-N 2 1 334.916 4.402 20 0 EIADMP CC(C)(C)[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(F)cc1 ZINC000655703339 1020907892 /nfs/dbraw/zinc/90/78/92/1020907892.db2.gz OJQHVDXPWNBQAW-WOJBJXKFSA-N 2 1 348.506 4.146 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C[C@@H]3CC[N@@H+](C(C)C)C3)s2)cc1C ZINC000655721600 1020915637 /nfs/dbraw/zinc/91/56/37/1020915637.db2.gz QIEKSAPZMLXISR-KRWDZBQOSA-N 2 1 343.540 4.247 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C[C@@H]3CC[N@H+](C(C)C)C3)s2)cc1C ZINC000655721600 1020915641 /nfs/dbraw/zinc/91/56/41/1020915641.db2.gz QIEKSAPZMLXISR-KRWDZBQOSA-N 2 1 343.540 4.247 20 0 EIADMP [NH3+]Cc1cnc2c(ccn2-c2cc[nH+]c3ccc(C(F)(F)F)cc32)c1 ZINC001167314236 1021059333 /nfs/dbraw/zinc/05/93/33/1021059333.db2.gz UWTLEKJVCZYQFB-UHFFFAOYSA-N 2 1 342.324 4.051 20 0 EIADMP CCOc1ccccc1[C@@H](CC(C)C)[NH2+]CCCc1c[nH+]cn1C ZINC000579974386 1021063444 /nfs/dbraw/zinc/06/34/44/1021063444.db2.gz DHLYXSLFIATJSB-LJQANCHMSA-N 2 1 329.488 4.128 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3CCCNc4ccccc43)C2)cc1 ZINC000683690501 1021098641 /nfs/dbraw/zinc/09/86/41/1021098641.db2.gz LXCNRXJQOCVLDR-NZQKXSOJSA-N 2 1 349.522 4.435 20 0 EIADMP C([C@@H]1CCC[N@@H+](CC2([C@@H]3CCCCO3)CCC2)C1)[NH+]1CCCCCC1 ZINC001167326743 1021130305 /nfs/dbraw/zinc/13/03/05/1021130305.db2.gz PZNQJMKXBZEGJD-SFTDATJTSA-N 2 1 348.575 4.314 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C1 ZINC000376132110 1021543948 /nfs/dbraw/zinc/54/39/48/1021543948.db2.gz LGZLNQOQNXFCNN-KGEPEWOVSA-N 2 1 327.516 4.021 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)C1 ZINC000376132110 1021543960 /nfs/dbraw/zinc/54/39/60/1021543960.db2.gz LGZLNQOQNXFCNN-KGEPEWOVSA-N 2 1 327.516 4.021 20 0 EIADMP CC[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1OC(F)F ZINC000414172931 1022029881 /nfs/dbraw/zinc/02/98/81/1022029881.db2.gz FUCDELJDGFKITB-GOEBONIOSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1cccc(O)c1 ZINC000580444285 1022034172 /nfs/dbraw/zinc/03/41/72/1022034172.db2.gz BIUAISIRGMSFDT-PXNSSMCTSA-N 2 1 336.479 4.240 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1cccc(O)c1 ZINC000580444285 1022034191 /nfs/dbraw/zinc/03/41/91/1022034191.db2.gz BIUAISIRGMSFDT-PXNSSMCTSA-N 2 1 336.479 4.240 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+][C@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000340693199 1022040095 /nfs/dbraw/zinc/04/00/95/1022040095.db2.gz ZQQNTRKWFJFMET-JOCHJYFZSA-N 2 1 349.453 4.162 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000398053773 1022053267 /nfs/dbraw/zinc/05/32/67/1022053267.db2.gz YTONRPZHVFJZJR-YWZLYKJASA-N 2 1 346.877 4.479 20 0 EIADMP COc1ccc([C@H]([NH2+]CC[C@@H]2CCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000414199432 1022107370 /nfs/dbraw/zinc/10/73/70/1022107370.db2.gz XAUHQFMPDFKMPA-PGRDOPGGSA-N 2 1 338.495 4.106 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2csc(C(C)(C)C)n2)CC1 ZINC000613491371 1022156865 /nfs/dbraw/zinc/15/68/65/1022156865.db2.gz PLUUYJUTWACDIR-UHFFFAOYSA-N 2 1 337.577 4.385 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2csc(C(C)(C)C)n2)CC1 ZINC000613491371 1022156886 /nfs/dbraw/zinc/15/68/86/1022156886.db2.gz PLUUYJUTWACDIR-UHFFFAOYSA-N 2 1 337.577 4.385 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCOCC1 ZINC000549037994 1022203172 /nfs/dbraw/zinc/20/31/72/1022203172.db2.gz ZBQWMHLBFXJFPM-LEWJYISDSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCOCC1 ZINC000549037994 1022203195 /nfs/dbraw/zinc/20/31/95/1022203195.db2.gz ZBQWMHLBFXJFPM-LEWJYISDSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1ncc([C@H](C)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000245572050 1033037114 /nfs/dbraw/zinc/03/71/14/1033037114.db2.gz CCMFRKIOLJHHHY-KSVNGYGVSA-N 2 1 343.540 4.259 20 0 EIADMP Cc1ncc([C@H](C)[NH2+][C@H]2[C@H](C)CN(Cc3ccccc3)C[C@@H]2C)s1 ZINC000245572050 1033037133 /nfs/dbraw/zinc/03/71/33/1033037133.db2.gz CCMFRKIOLJHHHY-KSVNGYGVSA-N 2 1 343.540 4.259 20 0 EIADMP Cc1ncc([C@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000245572050 1033037158 /nfs/dbraw/zinc/03/71/58/1033037158.db2.gz CCMFRKIOLJHHHY-KSVNGYGVSA-N 2 1 343.540 4.259 20 0 EIADMP Cc1ncc([C@H](C)[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000245572050 1033037180 /nfs/dbraw/zinc/03/71/80/1033037180.db2.gz CCMFRKIOLJHHHY-KSVNGYGVSA-N 2 1 343.540 4.259 20 0 EIADMP Cc1cc(OCCC[C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)ccc1Cl ZINC000549041204 1022247687 /nfs/dbraw/zinc/24/76/87/1022247687.db2.gz FVLSDSUTFTYVOX-IAGOWNOFSA-N 2 1 338.923 4.127 20 0 EIADMP Cc1cc(F)ncc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000892574011 1022253880 /nfs/dbraw/zinc/25/38/80/1022253880.db2.gz HNKVCEKTAQSMQH-MRXNPFEDSA-N 2 1 341.474 4.051 20 0 EIADMP CSc1ccc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)s1 ZINC000580604568 1022292847 /nfs/dbraw/zinc/29/28/47/1022292847.db2.gz XPCYEPKKAHWCOO-QGZVFWFLSA-N 2 1 346.565 4.124 20 0 EIADMP C[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)CC(F)(F)F ZINC000414278994 1022390587 /nfs/dbraw/zinc/39/05/87/1022390587.db2.gz IPGHZFJQVORJMU-DDBAPUKQSA-N 2 1 340.433 4.360 20 0 EIADMP c1nc(C2CCCC2)sc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647544383 1022787927 /nfs/dbraw/zinc/78/79/27/1022787927.db2.gz ZQMGYVMKVYWLFK-IAGOWNOFSA-N 2 1 333.545 4.012 20 0 EIADMP CCCC[C@@H](C)[C@@H](C)[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000367998652 1022969232 /nfs/dbraw/zinc/96/92/32/1022969232.db2.gz QZMVWBLHTVPJFB-HZPDHXFCSA-N 2 1 335.536 4.308 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H]4CCC[C@H]43)cc2)cs1 ZINC000581326325 1023024118 /nfs/dbraw/zinc/02/41/18/1023024118.db2.gz TWKUHOPVVGUNGE-NSHGMRRFSA-N 2 1 341.524 4.081 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2nc3ccccc3[nH]2)CC1)CC(C)C ZINC000548160769 1023076986 /nfs/dbraw/zinc/07/69/86/1023076986.db2.gz BTBIKFBWJLDOQG-UHFFFAOYSA-N 2 1 342.531 4.143 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2nc3ccccc3[nH]2)CC1)CC(C)C ZINC000548160769 1023077005 /nfs/dbraw/zinc/07/70/05/1023077005.db2.gz BTBIKFBWJLDOQG-UHFFFAOYSA-N 2 1 342.531 4.143 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)ccc1SC ZINC000376594369 1023148200 /nfs/dbraw/zinc/14/82/00/1023148200.db2.gz DRNPIKKWHDSJLU-ODIFPOPNSA-N 2 1 334.529 4.085 20 0 EIADMP C[C@]1(C[NH2+]Cc2ccc3ncccc3c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000311410431 1023155890 /nfs/dbraw/zinc/15/58/90/1023155890.db2.gz BUIIHIBKCVSXQC-HSZRJFAPSA-N 2 1 345.490 4.237 20 0 EIADMP C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccc(O)c1 ZINC000178802291 1023176055 /nfs/dbraw/zinc/17/60/55/1023176055.db2.gz YRSNWUJNXAVPCB-BRIRTLKKSA-N 2 1 336.479 4.238 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccc(O)c1 ZINC000178802291 1023176062 /nfs/dbraw/zinc/17/60/62/1023176062.db2.gz YRSNWUJNXAVPCB-BRIRTLKKSA-N 2 1 336.479 4.238 20 0 EIADMP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)[C@@H]1CC1(C)C ZINC000417300620 1023249181 /nfs/dbraw/zinc/24/91/81/1023249181.db2.gz APGZBZMGTMJZCR-RBUKOAKNSA-N 2 1 347.547 4.308 20 0 EIADMP CCC[C@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)[C@H]1CC1(C)C ZINC000417300612 1023249223 /nfs/dbraw/zinc/24/92/23/1023249223.db2.gz APGZBZMGTMJZCR-MOPGFXCFSA-N 2 1 347.547 4.308 20 0 EIADMP c1csc([C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000090015596 1023264766 /nfs/dbraw/zinc/26/47/66/1023264766.db2.gz XZKIXSHNOMYCNU-OTWHNJEPSA-N 2 1 326.509 4.248 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417347041 1023274301 /nfs/dbraw/zinc/27/43/01/1023274301.db2.gz VOFFRVCFZYDUPB-MQOOWTBDSA-N 2 1 332.557 4.483 20 0 EIADMP Cc1ncncc1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000581558630 1023361495 /nfs/dbraw/zinc/36/14/95/1023361495.db2.gz VVWOPFYSNCOKKZ-QGZVFWFLSA-N 2 1 338.499 4.012 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]C2C[C@H]3CC[C@@H](C2)S3)C[N@H+]1Cc1ccccc1 ZINC000925617567 1023410953 /nfs/dbraw/zinc/41/09/53/1023410953.db2.gz XGNRCHOAPCEBGI-VZHSDHNVSA-N 2 1 344.568 4.303 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1F ZINC000415078608 1023430595 /nfs/dbraw/zinc/43/05/95/1023430595.db2.gz IZJNASHAPFCDBA-XLIONFOSSA-N 2 1 326.459 4.186 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]Cc3ccccc3OC3CCC3)CC[NH2+]2)cc1 ZINC000415090442 1023432973 /nfs/dbraw/zinc/43/29/73/1023432973.db2.gz OUKHZILLHDSRJB-CTNGQTDRSA-N 2 1 336.479 4.201 20 0 EIADMP CSc1cc(C)ccc1C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415085916 1023435960 /nfs/dbraw/zinc/43/59/60/1023435960.db2.gz RABQSZALTJMZBW-RBUKOAKNSA-N 2 1 326.509 4.300 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]C[C@@H]3C[C@H]3c3ccccc3)C2)c1 ZINC000417883337 1023444336 /nfs/dbraw/zinc/44/43/36/1023444336.db2.gz SMMJDHSDZHQSOO-CUWPLCDZSA-N 2 1 340.536 4.353 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]C[C@@H]3C[C@H]3c3ccccc3)C2)c1 ZINC000417883337 1023444340 /nfs/dbraw/zinc/44/43/40/1023444340.db2.gz SMMJDHSDZHQSOO-CUWPLCDZSA-N 2 1 340.536 4.353 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000893327501 1023465225 /nfs/dbraw/zinc/46/52/25/1023465225.db2.gz KHNJXJCETGNDEP-UHFFFAOYSA-N 2 1 341.499 4.067 20 0 EIADMP C[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccccc1OC(F)F ZINC000545519477 1023470541 /nfs/dbraw/zinc/47/05/41/1023470541.db2.gz MGWLLLPIHPIBQY-CQSZACIVSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@H](C[N@@H+](C)C[C@@H]1CCC[NH+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078112 1023490760 /nfs/dbraw/zinc/49/07/60/1023490760.db2.gz ZUTLUDNOUHBORZ-HUUCEWRRSA-N 2 1 328.422 4.083 20 0 EIADMP C[C@H](C[NH+](C)C[C@@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078112 1023490767 /nfs/dbraw/zinc/49/07/67/1023490767.db2.gz ZUTLUDNOUHBORZ-HUUCEWRRSA-N 2 1 328.422 4.083 20 0 EIADMP C[C@H](C[NH+](C)C[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078112 1023490775 /nfs/dbraw/zinc/49/07/75/1023490775.db2.gz ZUTLUDNOUHBORZ-HUUCEWRRSA-N 2 1 328.422 4.083 20 0 EIADMP C[C@H](C[N@@H+](C)[C@@H]1CCN(C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097670 1023499966 /nfs/dbraw/zinc/49/99/66/1023499966.db2.gz MWQQZHXQQMZTDO-JKIFEVAISA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[N@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097670 1023499971 /nfs/dbraw/zinc/49/99/71/1023499971.db2.gz MWQQZHXQQMZTDO-JKIFEVAISA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[N@@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097670 1023499975 /nfs/dbraw/zinc/49/99/75/1023499975.db2.gz MWQQZHXQQMZTDO-JKIFEVAISA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[NH+](C)[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097670 1023499978 /nfs/dbraw/zinc/49/99/78/1023499978.db2.gz MWQQZHXQQMZTDO-JKIFEVAISA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[NH+](C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097670 1023499981 /nfs/dbraw/zinc/49/99/81/1023499981.db2.gz MWQQZHXQQMZTDO-JKIFEVAISA-N 2 1 328.422 4.223 20 0 EIADMP Clc1cc2cccnc2c(C[N@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c1 ZINC000656784451 1023530278 /nfs/dbraw/zinc/53/02/78/1023530278.db2.gz DFWAMTQJEURUNL-QGZVFWFLSA-N 2 1 343.902 4.100 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2[nH]ccc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311138179 1023584389 /nfs/dbraw/zinc/58/43/89/1023584389.db2.gz YESBTBOHVFOTRS-LAUBAEHRSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000377629038 1023643520 /nfs/dbraw/zinc/64/35/20/1023643520.db2.gz PBABHVVHQHQAEG-JKXDFHQYSA-N 2 1 326.406 4.323 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000377629038 1023643526 /nfs/dbraw/zinc/64/35/26/1023643526.db2.gz PBABHVVHQHQAEG-JKXDFHQYSA-N 2 1 326.406 4.323 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000377629038 1023643529 /nfs/dbraw/zinc/64/35/29/1023643529.db2.gz PBABHVVHQHQAEG-JKXDFHQYSA-N 2 1 326.406 4.323 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2cnccc2c1 ZINC000398135718 1023700451 /nfs/dbraw/zinc/70/04/51/1023700451.db2.gz KYXLTWZHIKTRGV-FDDCHVKYSA-N 2 1 345.490 4.235 20 0 EIADMP Fc1cc(Cl)c(C[NH+]2CCC3(CCC[NH2+]C3)CC2)c(Cl)c1 ZINC001222460740 1023779454 /nfs/dbraw/zinc/77/94/54/1023779454.db2.gz CBIBCQPQFZPGAQ-UHFFFAOYSA-N 2 1 331.262 4.098 20 0 EIADMP CSc1cccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000660435091 1023787054 /nfs/dbraw/zinc/78/70/54/1023787054.db2.gz KQIWJHUIBVALDS-UHFFFAOYSA-N 2 1 341.524 4.321 20 0 EIADMP CC(C)C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1cccc(C(F)(F)F)c1 ZINC000471781778 1023840051 /nfs/dbraw/zinc/84/00/51/1023840051.db2.gz RFGPUHPPCZBARL-QGZVFWFLSA-N 2 1 339.405 4.358 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+]C2CCC(F)(F)CC2)C[N@H+]1Cc1ccccc1 ZINC000647196191 1023851498 /nfs/dbraw/zinc/85/14/98/1023851498.db2.gz RSAXFDRKKHQWMB-WMZOPIPTSA-N 2 1 336.470 4.455 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccc(F)cc2Cl)[C@@H](C)C1 ZINC000468804212 1023876514 /nfs/dbraw/zinc/87/65/14/1023876514.db2.gz CJUPQWHIIUQGDY-GUYCJALGSA-N 2 1 326.887 4.077 20 0 EIADMP Fc1ccc(/C=C\C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000511784736 1023882015 /nfs/dbraw/zinc/88/20/15/1023882015.db2.gz HTRSVHHRMMMBJK-OCTSTCLRSA-N 2 1 342.433 4.090 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]CCC[C@@H]3CCCCO3)CC23CC3)cc1 ZINC000647201802 1023885360 /nfs/dbraw/zinc/88/53/60/1023885360.db2.gz ANVBJSKPENWUDH-RTWAWAEBSA-N 2 1 342.527 4.123 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]CCC[C@@H]3CCCCO3)CC23CC3)cc1 ZINC000647201802 1023885363 /nfs/dbraw/zinc/88/53/63/1023885363.db2.gz ANVBJSKPENWUDH-RTWAWAEBSA-N 2 1 342.527 4.123 20 0 EIADMP CC[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccccc1OC(F)F ZINC000341626508 1023963662 /nfs/dbraw/zinc/96/36/62/1023963662.db2.gz MRFQITXWHDRONF-ZBFHGGJFSA-N 2 1 326.431 4.203 20 0 EIADMP CC[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccccc1OC(F)F ZINC000341626508 1023963672 /nfs/dbraw/zinc/96/36/72/1023963672.db2.gz MRFQITXWHDRONF-ZBFHGGJFSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000301216789 1033192118 /nfs/dbraw/zinc/19/21/18/1033192118.db2.gz ZGYBRBIMGYDIHW-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP CC(C)C[C@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)c1ccc(F)cc1 ZINC000652150001 1024331500 /nfs/dbraw/zinc/33/15/00/1024331500.db2.gz IIGDHXFIZVGJQD-FQEVSTJZSA-N 2 1 348.506 4.148 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cc(O)cc(F)c2)CC1 ZINC000473130218 1024336694 /nfs/dbraw/zinc/33/66/94/1024336694.db2.gz ASEWDGVCSKIOGU-MRXNPFEDSA-N 2 1 334.479 4.008 20 0 EIADMP Cc1[nH+]ccn1CCCN1C[C@@H](c2cccc(Cl)c2)OCC1(C)C ZINC000661740760 1024428876 /nfs/dbraw/zinc/42/88/76/1024428876.db2.gz RVLCAHAPUTXEEE-SFHVURJKSA-N 2 1 347.890 4.087 20 0 EIADMP Clc1ccc2c(c1)OCCC[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000341758603 1024617116 /nfs/dbraw/zinc/61/71/16/1024617116.db2.gz BQQXREDGYBKZCX-SFHVURJKSA-N 2 1 334.891 4.018 20 0 EIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347473 1024696978 /nfs/dbraw/zinc/69/69/78/1024696978.db2.gz BLQMXDKCZYWXMM-ONZODILHSA-N 2 1 338.495 4.119 20 0 EIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347474 1024697366 /nfs/dbraw/zinc/69/73/66/1024697366.db2.gz BLQMXDKCZYWXMM-PGVBMLAISA-N 2 1 338.495 4.119 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)C[C@H]2CCC[NH+](C)C2)cc1 ZINC000092253698 1024762024 /nfs/dbraw/zinc/76/20/24/1024762024.db2.gz MUHOICKYTPWBRQ-IBGZPJMESA-N 2 1 338.495 4.136 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000092253698 1024762044 /nfs/dbraw/zinc/76/20/44/1024762044.db2.gz MUHOICKYTPWBRQ-IBGZPJMESA-N 2 1 338.495 4.136 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000092253698 1024762067 /nfs/dbraw/zinc/76/20/67/1024762067.db2.gz MUHOICKYTPWBRQ-IBGZPJMESA-N 2 1 338.495 4.136 20 0 EIADMP Fc1cccc(F)c1C[NH+]1C[C@@H]2CC[N@@H+](C3CCCC3)CC[C@@H]2C1 ZINC001279210393 1024790800 /nfs/dbraw/zinc/79/08/00/1024790800.db2.gz ILBANQPDLVRHJZ-IYBDPMFKSA-N 2 1 334.454 4.051 20 0 EIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(OC(F)F)cc1 ZINC000164687697 1024801208 /nfs/dbraw/zinc/80/12/08/1024801208.db2.gz DPOMZSHYKHTADR-QGZVFWFLSA-N 2 1 337.414 4.314 20 0 EIADMP COc1cc2c(cc1F)CC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000510930544 1024841782 /nfs/dbraw/zinc/84/17/82/1024841782.db2.gz SOHMJVNNADLPIP-HXUWFJFHSA-N 2 1 346.490 4.208 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc2cc(Cl)ccc2o1 ZINC000278858983 1024946106 /nfs/dbraw/zinc/94/61/06/1024946106.db2.gz AWZQZOOOSQJIOM-QWHCGFSZSA-N 2 1 329.831 4.196 20 0 EIADMP c1sc(C2CCCC2)nc1C[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662293743 1025044811 /nfs/dbraw/zinc/04/48/11/1025044811.db2.gz MURINDYQGGDRFJ-QGZVFWFLSA-N 2 1 333.545 4.012 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3F)s2)C1 ZINC000062426933 1025056366 /nfs/dbraw/zinc/05/63/66/1025056366.db2.gz GLFQYZUUDZNAHB-HNNXBMFYSA-N 2 1 332.488 4.374 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1nc2ccccc2s1 ZINC000162679945 1025385438 /nfs/dbraw/zinc/38/54/38/1025385438.db2.gz HGEKBFRFFJBUKL-QGZVFWFLSA-N 2 1 340.496 4.419 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1nc2ccccc2s1 ZINC000162679945 1025385447 /nfs/dbraw/zinc/38/54/47/1025385447.db2.gz HGEKBFRFFJBUKL-QGZVFWFLSA-N 2 1 340.496 4.419 20 0 EIADMP c1ccc2c(c1)[nH]c1c2CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663466123 1025391573 /nfs/dbraw/zinc/39/15/73/1025391573.db2.gz OGPKONRAAXYPMH-UWJYYQICSA-N 2 1 337.511 4.257 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC000663466307 1025393465 /nfs/dbraw/zinc/39/34/65/1025393465.db2.gz QWSPOIUYEAHDQO-NJDAHSKKSA-N 2 1 341.543 4.128 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2occc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511985599 1025396094 /nfs/dbraw/zinc/39/60/94/1025396094.db2.gz AQDRCOCJWSSLRC-DYESRHJHSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2ncc(Cl)s2)C[N@H+]1Cc1ccccc1 ZINC000472037150 1025461239 /nfs/dbraw/zinc/46/12/39/1025461239.db2.gz HQRSXQKRRPEMEJ-GOEBONIOSA-N 2 1 349.931 4.187 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@@H](c2ccc(C)cc2)C[C@H]1C ZINC000426539584 1025490800 /nfs/dbraw/zinc/49/08/00/1025490800.db2.gz NEHVQJLHHAYKKK-XLIONFOSSA-N 2 1 346.478 4.262 20 0 EIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CCc3[nH+]ccn3C2)c2ccccc2)cc1 ZINC000278923982 1025618663 /nfs/dbraw/zinc/61/86/63/1025618663.db2.gz IEVAPRNHCBEXHZ-AVRDEDQJSA-N 2 1 331.463 4.133 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H](Oc2ccccc2OC)C1 ZINC001167827188 1025634115 /nfs/dbraw/zinc/63/41/15/1025634115.db2.gz UMYFNHCHSMEUCU-RTBURBONSA-N 2 1 348.531 4.049 20 0 EIADMP COc1cccc(C[C@@H]([NH2+]CCCn2cc[nH+]c2C)c2ccccc2)c1 ZINC000511037570 1025786344 /nfs/dbraw/zinc/78/63/44/1025786344.db2.gz YZXBLAIOTWOWDG-JOCHJYFZSA-N 2 1 349.478 4.164 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCO[C@](C)(c2ccc(C)cc2)C1 ZINC001167837433 1025848762 /nfs/dbraw/zinc/84/87/62/1025848762.db2.gz KBKWXNQPJWVJCD-CTNGQTDRSA-N 2 1 332.532 4.053 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H](OCc2ccccc2)C1 ZINC001167837910 1025849791 /nfs/dbraw/zinc/84/97/91/1025849791.db2.gz NSONGBWXQUSDOW-PZJWPPBQSA-N 2 1 332.532 4.178 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000432409159 1025877976 /nfs/dbraw/zinc/87/79/76/1025877976.db2.gz FGQFWCAWVCEDBS-QZTJIDSGSA-N 2 1 348.531 4.015 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(Cl)cc1 ZINC000432412232 1025882947 /nfs/dbraw/zinc/88/29/47/1025882947.db2.gz FSAQSRXSGVXEEL-APWZRJJASA-N 2 1 338.923 4.128 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)sc1Br ZINC000375660399 1025903898 /nfs/dbraw/zinc/90/38/98/1025903898.db2.gz MWZQNBKVLIKFDE-AVGNSLFASA-N 2 1 343.334 4.096 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)sc1Br ZINC000375660399 1025903916 /nfs/dbraw/zinc/90/39/16/1025903916.db2.gz MWZQNBKVLIKFDE-AVGNSLFASA-N 2 1 343.334 4.096 20 0 EIADMP c1ccc(-c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)cc2)nc1 ZINC001167968181 1025894825 /nfs/dbraw/zinc/89/48/25/1025894825.db2.gz NSMBGCQTQGLMKI-FRIKZZABSA-N 2 1 347.506 4.244 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cncs1 ZINC000157660603 1025911872 /nfs/dbraw/zinc/91/18/72/1025911872.db2.gz KDUIFGQGKPJALF-CVEARBPZSA-N 2 1 329.513 4.368 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1cncs1 ZINC000157660603 1025911900 /nfs/dbraw/zinc/91/19/00/1025911900.db2.gz KDUIFGQGKPJALF-CVEARBPZSA-N 2 1 329.513 4.368 20 0 EIADMP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000582032427 1025997817 /nfs/dbraw/zinc/99/78/17/1025997817.db2.gz HPIUCIVEQPOBRU-ZNLUXHQJSA-N 2 1 338.495 4.051 20 0 EIADMP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000582032427 1025997826 /nfs/dbraw/zinc/99/78/26/1025997826.db2.gz HPIUCIVEQPOBRU-ZNLUXHQJSA-N 2 1 338.495 4.051 20 0 EIADMP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000582032424 1025998851 /nfs/dbraw/zinc/99/88/51/1025998851.db2.gz HPIUCIVEQPOBRU-AGHHOFFYSA-N 2 1 338.495 4.051 20 0 EIADMP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000582032424 1025998871 /nfs/dbraw/zinc/99/88/71/1025998871.db2.gz HPIUCIVEQPOBRU-AGHHOFFYSA-N 2 1 338.495 4.051 20 0 EIADMP OCCCCCCCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167970978 1026049638 /nfs/dbraw/zinc/04/96/38/1026049638.db2.gz RGGOSVQXVQDRAS-SEJPIABJSA-N 2 1 336.564 4.095 20 0 EIADMP Cc1nc(-c2cc([C@@H](C)[NH2+]C3CC[NH+](C4CC4)CC3)cs2)cs1 ZINC000119681443 1026075863 /nfs/dbraw/zinc/07/58/63/1026075863.db2.gz YIAPCZZJLFJBCW-GFCCVEGCSA-N 2 1 347.553 4.457 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1cc(F)cc(Br)c1 ZINC000344175751 1026094789 /nfs/dbraw/zinc/09/47/89/1026094789.db2.gz SSSQEXPQHGNLOW-RLCCDNCMSA-N 2 1 343.284 4.112 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1cc(F)cc(Br)c1 ZINC000344175751 1026094809 /nfs/dbraw/zinc/09/48/09/1026094809.db2.gz SSSQEXPQHGNLOW-RLCCDNCMSA-N 2 1 343.284 4.112 20 0 EIADMP FC1(F)CCC(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001167972766 1026131153 /nfs/dbraw/zinc/13/11/53/1026131153.db2.gz BHPRXEOGTBXACO-AYHJJNSGSA-N 2 1 326.475 4.197 20 0 EIADMP CC(C)SCC[N@@H+](C)[C@@H]1CCC[NH+](CCSC(C)C)CC1 ZINC000514096019 1026133843 /nfs/dbraw/zinc/13/38/43/1026133843.db2.gz RDIIMZRSETXYSV-QGZVFWFLSA-N 2 1 332.623 4.056 20 0 EIADMP CC(C)SCC[NH+](C)[C@@H]1CCC[N@H+](CCSC(C)C)CC1 ZINC000514096019 1026133860 /nfs/dbraw/zinc/13/38/60/1026133860.db2.gz RDIIMZRSETXYSV-QGZVFWFLSA-N 2 1 332.623 4.056 20 0 EIADMP CC(C)SCC[NH+](C)[C@@H]1CCC[N@@H+](CCSC(C)C)CC1 ZINC000514096019 1026133875 /nfs/dbraw/zinc/13/38/75/1026133875.db2.gz RDIIMZRSETXYSV-QGZVFWFLSA-N 2 1 332.623 4.056 20 0 EIADMP CC(C)(C)Oc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167974278 1026173098 /nfs/dbraw/zinc/17/30/98/1026173098.db2.gz UCGNUXZDNDDDKH-IHWFROFDSA-N 2 1 342.527 4.359 20 0 EIADMP COc1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CCC2)cc1 ZINC001167975799 1026295147 /nfs/dbraw/zinc/29/51/47/1026295147.db2.gz WFUWPMAATANJGL-IHWFROFDSA-N 2 1 340.511 4.069 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]([C@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000342443086 1026298969 /nfs/dbraw/zinc/29/89/69/1026298969.db2.gz BJZNREBDONXISR-CYBMUJFWSA-N 2 1 337.389 4.436 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]([C@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000342443086 1026298991 /nfs/dbraw/zinc/29/89/91/1026298991.db2.gz BJZNREBDONXISR-CYBMUJFWSA-N 2 1 337.389 4.436 20 0 EIADMP CCC[C@H](C)[C@@H](CC)[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000162759507 1026299058 /nfs/dbraw/zinc/29/90/58/1026299058.db2.gz LERHUGIPMOODAB-HNAYVOBHSA-N 2 1 335.536 4.308 20 0 EIADMP CC1(C)CC([NH2+]Cc2cc(Cl)ccc2OC(F)F)CC(C)(C)[NH2+]1 ZINC000319990819 1026328143 /nfs/dbraw/zinc/32/81/43/1026328143.db2.gz KTOOKEIKLBSIJX-UHFFFAOYSA-N 2 1 346.849 4.340 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)c1 ZINC000657367578 1026333352 /nfs/dbraw/zinc/33/33/52/1026333352.db2.gz QWGJNAUVYPIZOI-MRXNPFEDSA-N 2 1 344.524 4.210 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC000657377242 1026372463 /nfs/dbraw/zinc/37/24/63/1026372463.db2.gz NVICYYZGFMVBGW-YQQQUEKLSA-N 2 1 341.524 4.223 20 0 EIADMP C[C@@H](Cc1ccc(O)cc1)[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000511095821 1026390208 /nfs/dbraw/zinc/39/02/08/1026390208.db2.gz XHRJHKSRFHVXPO-ROUUACIJSA-N 2 1 338.495 4.138 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccc(Br)s1 ZINC000548733896 1026548677 /nfs/dbraw/zinc/54/86/77/1026548677.db2.gz XWPKZRUHKOAVLO-RYUDHWBXSA-N 2 1 331.323 4.036 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(Br)s1 ZINC000548733896 1026548683 /nfs/dbraw/zinc/54/86/83/1026548683.db2.gz XWPKZRUHKOAVLO-RYUDHWBXSA-N 2 1 331.323 4.036 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2cc(F)cc(F)c2)CCN1Cc1ccccc1 ZINC001167573599 1026621321 /nfs/dbraw/zinc/62/13/21/1026621321.db2.gz WFFQYOZDPOICQI-HRAATJIYSA-N 2 1 344.449 4.450 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cc(F)cc(F)c2)CCN1Cc1ccccc1 ZINC001167573599 1026621330 /nfs/dbraw/zinc/62/13/30/1026621330.db2.gz WFFQYOZDPOICQI-HRAATJIYSA-N 2 1 344.449 4.450 20 0 EIADMP C[C@H](N[C@H]1CCc2c1c(F)ccc2F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512312362 1026681234 /nfs/dbraw/zinc/68/12/34/1026681234.db2.gz DOONYDLLOFPKEA-KSMMKXTCSA-N 2 1 334.454 4.195 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2c1c(F)ccc2F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512312362 1026681243 /nfs/dbraw/zinc/68/12/43/1026681243.db2.gz DOONYDLLOFPKEA-KSMMKXTCSA-N 2 1 334.454 4.195 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2c1c(F)ccc2F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512312362 1026681249 /nfs/dbraw/zinc/68/12/49/1026681249.db2.gz DOONYDLLOFPKEA-KSMMKXTCSA-N 2 1 334.454 4.195 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc(Br)cs1 ZINC000279819494 1026711690 /nfs/dbraw/zinc/71/16/90/1026711690.db2.gz XZUNVIJJFRRGQA-NSHDSACASA-N 2 1 343.334 4.178 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc(Br)cs1 ZINC000279819493 1026711990 /nfs/dbraw/zinc/71/19/90/1026711990.db2.gz XZUNVIJJFRRGQA-LLVKDONJSA-N 2 1 343.334 4.178 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)CCSc2ccc(Cl)cc2)CC1 ZINC000507339922 1026751472 /nfs/dbraw/zinc/75/14/72/1026751472.db2.gz JYPOFSITGQXXKL-UHFFFAOYSA-N 2 1 326.937 4.237 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCSc2ccc(Cl)cc2)CC1 ZINC000507339922 1026751482 /nfs/dbraw/zinc/75/14/82/1026751482.db2.gz JYPOFSITGQXXKL-UHFFFAOYSA-N 2 1 326.937 4.237 20 0 EIADMP C[C@@H]([NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1)[C@@H]1CCCOC1 ZINC000507533215 1026830966 /nfs/dbraw/zinc/83/09/66/1026830966.db2.gz NPUBOLSZZXUYTE-WSTZPKSXSA-N 2 1 330.516 4.055 20 0 EIADMP CC[NH+](CC)CCO[C@H]1CC[N@H+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC001167603779 1026994217 /nfs/dbraw/zinc/99/42/17/1026994217.db2.gz ZQDGHSMBHIROQW-UXHICEINSA-N 2 1 332.532 4.106 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000474484970 1027122656 /nfs/dbraw/zinc/12/26/56/1027122656.db2.gz BWUCKXSDKXVMCA-OAHLLOKOSA-N 2 1 329.315 4.248 20 0 EIADMP Cc1cc(N2CCC[N@@H+](Cc3ccc(C(F)(F)F)cc3)CC2)cc[nH+]1 ZINC000302221426 1027267025 /nfs/dbraw/zinc/26/70/25/1027267025.db2.gz NRTZASMZHMXKHH-UHFFFAOYSA-N 2 1 349.400 4.121 20 0 EIADMP CC[N@H+](Cc1ccncc1)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168038909 1027315097 /nfs/dbraw/zinc/31/50/97/1027315097.db2.gz AAYHCVIKXITOFS-RTBURBONSA-N 2 1 337.511 4.345 20 0 EIADMP CC[N@@H+](Cc1ccncc1)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168038909 1027315116 /nfs/dbraw/zinc/31/51/16/1027315116.db2.gz AAYHCVIKXITOFS-RTBURBONSA-N 2 1 337.511 4.345 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(OC(F)F)c(Cl)c1 ZINC000520208412 1027317044 /nfs/dbraw/zinc/31/70/44/1027317044.db2.gz SOOMTRJJBFMDPG-ZDUSSCGKSA-N 2 1 346.849 4.296 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc(OC(F)F)c(Cl)c1 ZINC000520208412 1027317069 /nfs/dbraw/zinc/31/70/69/1027317069.db2.gz SOOMTRJJBFMDPG-ZDUSSCGKSA-N 2 1 346.849 4.296 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000342858323 1027330096 /nfs/dbraw/zinc/33/00/96/1027330096.db2.gz DBHCNPUGOHLUJQ-ZDUSSCGKSA-N 2 1 325.378 4.293 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000342858323 1027330120 /nfs/dbraw/zinc/33/01/20/1027330120.db2.gz DBHCNPUGOHLUJQ-ZDUSSCGKSA-N 2 1 325.378 4.293 20 0 EIADMP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c(F)c1 ZINC000520238419 1027342970 /nfs/dbraw/zinc/34/29/70/1027342970.db2.gz IONOEQAHQIQFGQ-HNAYVOBHSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c(F)c1 ZINC000520238419 1027342989 /nfs/dbraw/zinc/34/29/89/1027342989.db2.gz IONOEQAHQIQFGQ-HNAYVOBHSA-N 2 1 348.487 4.069 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000342863100 1027347755 /nfs/dbraw/zinc/34/77/55/1027347755.db2.gz GCTJMVVXDKHLRP-QFIPXVFZSA-N 2 1 331.463 4.381 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000342863100 1027347775 /nfs/dbraw/zinc/34/77/75/1027347775.db2.gz GCTJMVVXDKHLRP-QFIPXVFZSA-N 2 1 331.463 4.381 20 0 EIADMP C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ccnc3cc(C(F)(F)F)ccc32)C1 ZINC000302709301 1027366166 /nfs/dbraw/zinc/36/61/66/1027366166.db2.gz DEQSBXCXEQAZNW-CXAGYDPISA-N 2 1 349.400 4.174 20 0 EIADMP C[N@@H+]1CC[C@@H]2[C@H](CCCN2c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000302709301 1027366179 /nfs/dbraw/zinc/36/61/79/1027366179.db2.gz DEQSBXCXEQAZNW-CXAGYDPISA-N 2 1 349.400 4.174 20 0 EIADMP C[N@H+]1CC[C@@H]2[C@H](CCCN2c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000302709301 1027366193 /nfs/dbraw/zinc/36/61/93/1027366193.db2.gz DEQSBXCXEQAZNW-CXAGYDPISA-N 2 1 349.400 4.174 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CCC(F)(F)[C@@H](C)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168041207 1027433392 /nfs/dbraw/zinc/43/33/92/1027433392.db2.gz QZIAUKFOONSEBV-BMFAXAFESA-N 2 1 336.470 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC(F)(F)[C@@H](C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168041207 1027433404 /nfs/dbraw/zinc/43/34/04/1027433404.db2.gz QZIAUKFOONSEBV-BMFAXAFESA-N 2 1 336.470 4.405 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CCC(F)(F)[C@@H](C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168041207 1027433411 /nfs/dbraw/zinc/43/34/11/1027433411.db2.gz QZIAUKFOONSEBV-BMFAXAFESA-N 2 1 336.470 4.405 20 0 EIADMP CC(C)C[C@H](C[NH2+]C1CC[NH+](CCOC(C)C)CC1)c1ccccc1 ZINC000474796816 1027505980 /nfs/dbraw/zinc/50/59/80/1027505980.db2.gz WLISYJKEHCADCY-OAQYLSRUSA-N 2 1 346.559 4.295 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)C1CCSCC1 ZINC000474803257 1027522531 /nfs/dbraw/zinc/52/25/31/1027522531.db2.gz ZGLUKMGNTQCIDV-FUHIMQAGSA-N 2 1 332.557 4.018 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)C1CCSCC1 ZINC000474803257 1027522534 /nfs/dbraw/zinc/52/25/34/1027522534.db2.gz ZGLUKMGNTQCIDV-FUHIMQAGSA-N 2 1 332.557 4.018 20 0 EIADMP Oc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)C3(CC3)C1)CC2 ZINC000657695097 1027614557 /nfs/dbraw/zinc/61/45/57/1027614557.db2.gz ZIBDHOMYADSHSV-SIKLNZKXSA-N 2 1 348.490 4.166 20 0 EIADMP Oc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)C3(CC3)C1)CC2 ZINC000657695097 1027614576 /nfs/dbraw/zinc/61/45/76/1027614576.db2.gz ZIBDHOMYADSHSV-SIKLNZKXSA-N 2 1 348.490 4.166 20 0 EIADMP C[N@@H+]1CC[C@@H]2CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000474924701 1027805155 /nfs/dbraw/zinc/80/51/55/1027805155.db2.gz IRVJRCALAQBJGG-QAPCUYQASA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@@H]2CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000474924701 1027805160 /nfs/dbraw/zinc/80/51/60/1027805160.db2.gz IRVJRCALAQBJGG-QAPCUYQASA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@H+](CCCCc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000474924701 1027805167 /nfs/dbraw/zinc/80/51/67/1027805167.db2.gz IRVJRCALAQBJGG-QAPCUYQASA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@@H+](CCCCc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000474924701 1027805177 /nfs/dbraw/zinc/80/51/77/1027805177.db2.gz IRVJRCALAQBJGG-QAPCUYQASA-N 2 1 341.326 4.342 20 0 EIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](CCCc4cccnc4)CC[C@@H]32)cc1 ZINC001167646333 1027828762 /nfs/dbraw/zinc/82/87/62/1027828762.db2.gz AUFPPRKHFPYAQU-GOTSBHOMSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](CCCc4cccnc4)CC[C@@H]32)cc1 ZINC001167646333 1027828764 /nfs/dbraw/zinc/82/87/64/1027828764.db2.gz AUFPPRKHFPYAQU-GOTSBHOMSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](CCCc4cccnc4)CC[C@@H]32)cc1 ZINC001167646333 1027828777 /nfs/dbraw/zinc/82/87/77/1027828777.db2.gz AUFPPRKHFPYAQU-GOTSBHOMSA-N 2 1 349.522 4.001 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccc(F)cc2)cc1F ZINC000153726496 1027893040 /nfs/dbraw/zinc/89/30/40/1027893040.db2.gz IVNVEQPLPPZYCR-CYBMUJFWSA-N 2 1 327.378 4.310 20 0 EIADMP c1csc(-c2ccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCC4)C3)cc2)c1 ZINC000444651471 1027920524 /nfs/dbraw/zinc/92/05/24/1027920524.db2.gz GQRUOJNZVHHCIR-SFHVURJKSA-N 2 1 326.509 4.333 20 0 EIADMP C(=C/C[N@H+]1CCC[C@@H]1c1ccncc1)\C[NH+]1CCC[C@@H]1c1ccncc1 ZINC000153968069 1028069553 /nfs/dbraw/zinc/06/95/53/1028069553.db2.gz MMSJPTZXSMTSFJ-HSMZSTHASA-N 2 1 348.494 4.007 20 0 EIADMP Fc1cc(Cl)ccc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000189242033 1028109516 /nfs/dbraw/zinc/10/95/16/1028109516.db2.gz MAVSDSVKZOFIPN-UHFFFAOYSA-N 2 1 332.850 4.365 20 0 EIADMP Cc1ccc2cc(C[NH2+][C@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)ccc2n1 ZINC000189427153 1028136045 /nfs/dbraw/zinc/13/60/45/1028136045.db2.gz CAJGRTOOAQKREW-YLJYHZDGSA-N 2 1 337.511 4.286 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCSC(F)(F)F)CC1 ZINC001167658854 1028224602 /nfs/dbraw/zinc/22/46/02/1028224602.db2.gz LKTRRRWTRJOXHM-CQSZACIVSA-N 2 1 338.483 4.216 20 0 EIADMP C[N@@H+](CCCCC(F)(F)F)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000154724895 1028275385 /nfs/dbraw/zinc/27/53/85/1028275385.db2.gz MCLNJUGGFQEWCA-KRWDZBQOSA-N 2 1 328.422 4.173 20 0 EIADMP C[NH+](CCCCC(F)(F)F)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000154724895 1028275405 /nfs/dbraw/zinc/27/54/05/1028275405.db2.gz MCLNJUGGFQEWCA-KRWDZBQOSA-N 2 1 328.422 4.173 20 0 EIADMP C[NH+](CCCCC(F)(F)F)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000154724895 1028275426 /nfs/dbraw/zinc/27/54/26/1028275426.db2.gz MCLNJUGGFQEWCA-KRWDZBQOSA-N 2 1 328.422 4.173 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000346138783 1028276670 /nfs/dbraw/zinc/27/66/70/1028276670.db2.gz TZMHDYNLLVZOCU-OAQYLSRUSA-N 2 1 332.451 4.221 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000346225040 1028331480 /nfs/dbraw/zinc/33/14/80/1028331480.db2.gz VNBFPQDQCMTRRJ-GOSISDBHSA-N 2 1 346.478 4.376 20 0 EIADMP COCc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)o1 ZINC000125542882 1028423794 /nfs/dbraw/zinc/42/37/94/1028423794.db2.gz SXQBWCJXHLDYGP-KRWDZBQOSA-N 2 1 342.483 4.090 20 0 EIADMP COCc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)o1 ZINC000125542882 1028423806 /nfs/dbraw/zinc/42/38/06/1028423806.db2.gz SXQBWCJXHLDYGP-KRWDZBQOSA-N 2 1 342.483 4.090 20 0 EIADMP CCCCCOc1cc(CN(C)C[C@@H]2CCC[N@@H+](C)C2)ccc1OC ZINC000508526229 1028446610 /nfs/dbraw/zinc/44/66/10/1028446610.db2.gz BAIDDANHCWAHFZ-LJQANCHMSA-N 2 1 348.531 4.038 20 0 EIADMP CCCCCOc1cc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)ccc1OC ZINC000508526229 1028446619 /nfs/dbraw/zinc/44/66/19/1028446619.db2.gz BAIDDANHCWAHFZ-LJQANCHMSA-N 2 1 348.531 4.038 20 0 EIADMP CCCCCOc1cc(C[N@@H+](C)C[C@@H]2CCC[NH+](C)C2)ccc1OC ZINC000508526229 1028446624 /nfs/dbraw/zinc/44/66/24/1028446624.db2.gz BAIDDANHCWAHFZ-LJQANCHMSA-N 2 1 348.531 4.038 20 0 EIADMP CCCCCOc1cc(C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)ccc1OC ZINC000508526229 1028446632 /nfs/dbraw/zinc/44/66/32/1028446632.db2.gz BAIDDANHCWAHFZ-LJQANCHMSA-N 2 1 348.531 4.038 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cn1 ZINC000156224969 1028677974 /nfs/dbraw/zinc/67/79/74/1028677974.db2.gz OCGRJJPCOSEXHQ-ROUUACIJSA-N 2 1 328.504 4.025 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)cn1 ZINC000156224969 1028677997 /nfs/dbraw/zinc/67/79/97/1028677997.db2.gz OCGRJJPCOSEXHQ-ROUUACIJSA-N 2 1 328.504 4.025 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC[C@@H]2CCO[C@H](C)C2)cc1 ZINC000346858962 1028797671 /nfs/dbraw/zinc/79/76/71/1028797671.db2.gz HLGJXNJQTZCOJU-SOLBZPMBSA-N 2 1 327.472 4.037 20 0 EIADMP Clc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1Cl ZINC000281643337 1028821022 /nfs/dbraw/zinc/82/10/22/1028821022.db2.gz PEJBTUTTXLYPJY-FPCVCCKLSA-N 2 1 339.310 4.456 20 0 EIADMP C[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccc(-c4ccccc4F)o3)C2)C1 ZINC000583505309 1028825172 /nfs/dbraw/zinc/82/51/72/1028825172.db2.gz ADAPQEXDWAFGJO-FQEVSTJZSA-N 2 1 328.431 4.003 20 0 EIADMP C[N@H+]1CCC[C@]2(CC[NH+](Cc3ccc(-c4ccccc4F)o3)C2)C1 ZINC000583505309 1028825175 /nfs/dbraw/zinc/82/51/75/1028825175.db2.gz ADAPQEXDWAFGJO-FQEVSTJZSA-N 2 1 328.431 4.003 20 0 EIADMP C[NH+]1CCC[C@]2(CC[N@H+](Cc3ccc(-c4ccccc4F)o3)C2)C1 ZINC000583505309 1028825179 /nfs/dbraw/zinc/82/51/79/1028825179.db2.gz ADAPQEXDWAFGJO-FQEVSTJZSA-N 2 1 328.431 4.003 20 0 EIADMP C[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccc(-c4ccccc4F)o3)C2)C1 ZINC000583505309 1028825186 /nfs/dbraw/zinc/82/51/86/1028825186.db2.gz ADAPQEXDWAFGJO-FQEVSTJZSA-N 2 1 328.431 4.003 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+]CC[C@@H]3CCc4ccccc4N3)CC2)cc1 ZINC000650720443 1028881584 /nfs/dbraw/zinc/88/15/84/1028881584.db2.gz PNGFXMBTMDSBBN-QFIPXVFZSA-N 2 1 349.522 4.058 20 0 EIADMP CCCC[NH+]1CCC([N@H+](C)Cc2c(C)onc2-c2ccccc2)CC1 ZINC001141992078 1029334216 /nfs/dbraw/zinc/33/42/16/1029334216.db2.gz AJLLVIYHBBQKRE-UHFFFAOYSA-N 2 1 341.499 4.346 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c(C)onc2-c2ccccc2)CC1 ZINC001141992078 1029334231 /nfs/dbraw/zinc/33/42/31/1029334231.db2.gz AJLLVIYHBBQKRE-UHFFFAOYSA-N 2 1 341.499 4.346 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)CCS2 ZINC000343494395 1029369088 /nfs/dbraw/zinc/36/90/88/1029369088.db2.gz FIHMCEFVRORSJR-QFBILLFUSA-N 2 1 348.556 4.334 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000508567469 1029420789 /nfs/dbraw/zinc/42/07/89/1029420789.db2.gz YNKVAAUBOVAKQB-GOSISDBHSA-N 2 1 340.511 4.401 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000508567469 1029420795 /nfs/dbraw/zinc/42/07/95/1029420795.db2.gz YNKVAAUBOVAKQB-GOSISDBHSA-N 2 1 340.511 4.401 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000508567469 1029420802 /nfs/dbraw/zinc/42/08/02/1029420802.db2.gz YNKVAAUBOVAKQB-GOSISDBHSA-N 2 1 340.511 4.401 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000508567469 1029420808 /nfs/dbraw/zinc/42/08/08/1029420808.db2.gz YNKVAAUBOVAKQB-GOSISDBHSA-N 2 1 340.511 4.401 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC000475276621 1029482926 /nfs/dbraw/zinc/48/29/26/1029482926.db2.gz PHGFMRLCTISBTC-YMPZKCBVSA-N 2 1 334.507 4.434 20 0 EIADMP CC(C)[N@H+](CCCCCO)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060698 1029493957 /nfs/dbraw/zinc/49/39/57/1029493957.db2.gz XSYIYRAVDYZUOI-VTYHHJSWSA-N 2 1 346.559 4.301 20 0 EIADMP CC(C)[N@@H+](CCCCCO)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060698 1029493961 /nfs/dbraw/zinc/49/39/61/1029493961.db2.gz XSYIYRAVDYZUOI-VTYHHJSWSA-N 2 1 346.559 4.301 20 0 EIADMP CC(C)[NH+](CCCCCO)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060698 1029493969 /nfs/dbraw/zinc/49/39/69/1029493969.db2.gz XSYIYRAVDYZUOI-VTYHHJSWSA-N 2 1 346.559 4.301 20 0 EIADMP CC(C)[NH+](CCCCCO)[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060698 1029493979 /nfs/dbraw/zinc/49/39/79/1029493979.db2.gz XSYIYRAVDYZUOI-VTYHHJSWSA-N 2 1 346.559 4.301 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2c(OC(F)F)ccc3ccccc32)CC[N@@H+]1C ZINC000525195097 1029517898 /nfs/dbraw/zinc/51/78/98/1029517898.db2.gz PBLMXMVQPXKHGJ-HIFRSBDPSA-N 2 1 334.410 4.014 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2c(OC(F)F)ccc3ccccc32)CC[N@H+]1C ZINC000525195097 1029517910 /nfs/dbraw/zinc/51/79/10/1029517910.db2.gz PBLMXMVQPXKHGJ-HIFRSBDPSA-N 2 1 334.410 4.014 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccn1 ZINC000158893743 1029610316 /nfs/dbraw/zinc/61/03/16/1029610316.db2.gz JCPZEZCTUFCBCQ-HKUYNNGSSA-N 2 1 343.540 4.486 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccn1 ZINC000158893743 1029610321 /nfs/dbraw/zinc/61/03/21/1029610321.db2.gz JCPZEZCTUFCBCQ-HKUYNNGSSA-N 2 1 343.540 4.486 20 0 EIADMP Cc1nc(-c2ccc(CN[C@@H]3CC[N@H+](C)C(C)(C)C3)cc2)cs1 ZINC000623379223 1029622477 /nfs/dbraw/zinc/62/24/77/1029622477.db2.gz DPULMEAXKYTTPC-QGZVFWFLSA-N 2 1 329.513 4.081 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)cc2)cs1 ZINC000623379223 1029622489 /nfs/dbraw/zinc/62/24/89/1029622489.db2.gz DPULMEAXKYTTPC-QGZVFWFLSA-N 2 1 329.513 4.081 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C2CC(CF)(CF)C2)cc1 ZINC000657836351 1029684093 /nfs/dbraw/zinc/68/40/93/1029684093.db2.gz KOTZOCDZRNHMSB-INIZCTEOSA-N 2 1 336.470 4.238 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838576 1029721169 /nfs/dbraw/zinc/72/11/69/1029721169.db2.gz DAGRBKJCXZRYSB-QLFBSQMISA-N 2 1 325.447 4.038 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838576 1029721174 /nfs/dbraw/zinc/72/11/74/1029721174.db2.gz DAGRBKJCXZRYSB-QLFBSQMISA-N 2 1 325.447 4.038 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(Br)c(Cl)c2)C1 ZINC000657840428 1029748238 /nfs/dbraw/zinc/74/82/38/1029748238.db2.gz GHSFFXIHYYXJAN-NWDGAFQWSA-N 2 1 345.712 4.095 20 0 EIADMP C[C@H]([NH2+]C1(CNc2cc[nH+]cc2Cl)CCOCC1)c1ccccc1 ZINC000080984163 1029769428 /nfs/dbraw/zinc/76/94/28/1029769428.db2.gz QNUUIAIDWVOFKP-HNNXBMFYSA-N 2 1 345.874 4.047 20 0 EIADMP FC(F)Oc1ccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc1Cl ZINC000092073917 1029898529 /nfs/dbraw/zinc/89/85/29/1029898529.db2.gz NMLJQVHCWHLZHB-GFCCVEGCSA-N 2 1 341.789 4.044 20 0 EIADMP c1c[nH]c([C@@H]2CCC[N@H+](Cc3cccc(OC4CCCC4)c3)C2)n1 ZINC000092071786 1029898734 /nfs/dbraw/zinc/89/87/34/1029898734.db2.gz BCQXMTYGFARYCR-QGZVFWFLSA-N 2 1 325.456 4.111 20 0 EIADMP CC[NH+](CC)CCCC1CCN(C[C@H]2CCCC[N@@H+]2C(C)C)CC1 ZINC000450722133 1029914616 /nfs/dbraw/zinc/91/46/16/1029914616.db2.gz ZGLGKRSIXXCLBP-OAQYLSRUSA-N 2 1 337.596 4.083 20 0 EIADMP CC[NH+](CC)CCCC1CCN(C[C@H]2CCCC[N@H+]2C(C)C)CC1 ZINC000450722133 1029914629 /nfs/dbraw/zinc/91/46/29/1029914629.db2.gz ZGLGKRSIXXCLBP-OAQYLSRUSA-N 2 1 337.596 4.083 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1ccc(F)cn1 ZINC000092739140 1029929323 /nfs/dbraw/zinc/92/93/23/1029929323.db2.gz FAVFYQFERZQTQI-IRXDYDNUSA-N 2 1 341.474 4.303 20 0 EIADMP COc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1Cl ZINC000450728073 1029933494 /nfs/dbraw/zinc/93/34/94/1029933494.db2.gz NYJVSADYNSVNNL-GOEBONIOSA-N 2 1 336.907 4.091 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657867191 1029948048 /nfs/dbraw/zinc/94/80/48/1029948048.db2.gz KJUJATXCGMCYMJ-IEBWSBKVSA-N 2 1 349.478 4.043 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657867191 1029948074 /nfs/dbraw/zinc/94/80/74/1029948074.db2.gz KJUJATXCGMCYMJ-IEBWSBKVSA-N 2 1 349.478 4.043 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCCSCC1 ZINC000657886231 1030195919 /nfs/dbraw/zinc/19/59/19/1030195919.db2.gz DAPARUZNSYJASG-LJQANCHMSA-N 2 1 344.524 4.287 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cc3cccc(OCC)c3o2)CC1 ZINC000102557562 1030199015 /nfs/dbraw/zinc/19/90/15/1030199015.db2.gz YFKCZEKPLDZMER-OAHLLOKOSA-N 2 1 330.472 4.357 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc3cccc(OCC)c3o2)CC1 ZINC000102557559 1030200047 /nfs/dbraw/zinc/20/00/47/1030200047.db2.gz YFKCZEKPLDZMER-HNNXBMFYSA-N 2 1 330.472 4.357 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1 ZINC000647344347 1030224964 /nfs/dbraw/zinc/22/49/64/1030224964.db2.gz ORNJGPBDNFQWMI-ZNLUXHQJSA-N 2 1 338.495 4.081 20 0 EIADMP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C[C@H]2CC[N@H+](C(C)C)C2)cc1 ZINC000685455688 1030340551 /nfs/dbraw/zinc/34/05/51/1030340551.db2.gz LFXUHYOGVFTFRB-FZUCFXCGSA-N 2 1 344.543 4.283 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1 ZINC000447812551 1030355054 /nfs/dbraw/zinc/35/50/54/1030355054.db2.gz MPZJJEGKZASVRN-MSOLQXFVSA-N 2 1 328.525 4.353 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1 ZINC000447812551 1030355084 /nfs/dbraw/zinc/35/50/84/1030355084.db2.gz MPZJJEGKZASVRN-MSOLQXFVSA-N 2 1 328.525 4.353 20 0 EIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1 ZINC000447812583 1030355198 /nfs/dbraw/zinc/35/51/98/1030355198.db2.gz MPZJJEGKZASVRN-ZWKOTPCHSA-N 2 1 328.525 4.353 20 0 EIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1 ZINC000447812583 1030355216 /nfs/dbraw/zinc/35/52/16/1030355216.db2.gz MPZJJEGKZASVRN-ZWKOTPCHSA-N 2 1 328.525 4.353 20 0 EIADMP CSc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000685614101 1030565076 /nfs/dbraw/zinc/56/50/76/1030565076.db2.gz HAHMKBMUZGRERF-QGZVFWFLSA-N 2 1 346.565 4.472 20 0 EIADMP COc1ccc([C@@H]([NH2+]C[C@@H](C)C[NH+]2CCCC2)c2ccccc2)cc1 ZINC000392937740 1030585801 /nfs/dbraw/zinc/58/58/01/1030585801.db2.gz JGRDGRRDEPJOMU-GCJKJVERSA-N 2 1 338.495 4.106 20 0 EIADMP COc1ccc([C@H]([NH2+]C[C@H](C)C[NH+]2CCCC2)c2ccccc2)cc1 ZINC000392937743 1030586533 /nfs/dbraw/zinc/58/65/33/1030586533.db2.gz JGRDGRRDEPJOMU-PGRDOPGGSA-N 2 1 338.495 4.106 20 0 EIADMP COC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccc(Cl)c1 ZINC000685645167 1030613539 /nfs/dbraw/zinc/61/35/39/1030613539.db2.gz KLIOHYXLUTZTLB-VQIMIIECSA-N 2 1 338.923 4.129 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)CCCOc2cccc3ccccc32)CCN1C ZINC000530666369 1030618002 /nfs/dbraw/zinc/61/80/02/1030618002.db2.gz UVVGMLFIWSWFHE-PKOBYXMFSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCOc2cccc3ccccc32)CC[N@@H+]1C ZINC000530666369 1030618021 /nfs/dbraw/zinc/61/80/21/1030618021.db2.gz UVVGMLFIWSWFHE-PKOBYXMFSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCOc2cccc3ccccc32)CC[N@H+]1C ZINC000530666369 1030618043 /nfs/dbraw/zinc/61/80/43/1030618043.db2.gz UVVGMLFIWSWFHE-PKOBYXMFSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)CCCOc2cccc3ccccc32)CC[NH+]1C ZINC000530666369 1030618060 /nfs/dbraw/zinc/61/80/60/1030618060.db2.gz UVVGMLFIWSWFHE-PKOBYXMFSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)CCCOc2cccc3ccccc32)CC[NH+]1C ZINC000530666369 1030618068 /nfs/dbraw/zinc/61/80/68/1030618068.db2.gz UVVGMLFIWSWFHE-PKOBYXMFSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(OCc3ccccc3)cc2)CC[N@@H+]1C ZINC000530666081 1030622891 /nfs/dbraw/zinc/62/28/91/1030622891.db2.gz SANQCXAFOLTDLP-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(OCc3ccccc3)cc2)CC[N@H+]1C ZINC000530666081 1030622905 /nfs/dbraw/zinc/62/29/05/1030622905.db2.gz SANQCXAFOLTDLP-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(OCc3ccccc3)cc2)CC[NH+]1C ZINC000530666081 1030622919 /nfs/dbraw/zinc/62/29/19/1030622919.db2.gz SANQCXAFOLTDLP-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(OCc3ccccc3)cc2)CC[NH+]1C ZINC000530666081 1030622929 /nfs/dbraw/zinc/62/29/29/1030622929.db2.gz SANQCXAFOLTDLP-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP CCOC1CCC([NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000657933748 1030630308 /nfs/dbraw/zinc/63/03/08/1030630308.db2.gz VFCDYNUWTHIUGV-UBHSMVFVSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCCSCC2)C[N@H+]1Cc1ccccc1 ZINC000657934217 1030634242 /nfs/dbraw/zinc/63/42/42/1030634242.db2.gz ZZRLTWMYIHHYPQ-YZGWKJHDSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1cc[n+](C[C@@H]2CCC3(CCCCC3)O2)cc1 ZINC000191699569 1030653505 /nfs/dbraw/zinc/65/35/05/1030653505.db2.gz UEPZIYZFRQBTPZ-FPOVZHCZSA-N 2 1 343.535 4.230 20 0 EIADMP COCC1(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCCCC1 ZINC000685665273 1030665137 /nfs/dbraw/zinc/66/51/37/1030665137.db2.gz QERVGKLNGHBMDL-FPOVZHCZSA-N 2 1 344.543 4.084 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@H]1c1cccs1 ZINC000527669032 1030807123 /nfs/dbraw/zinc/80/71/23/1030807123.db2.gz WSPZSNIJISZGCE-XLIONFOSSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@H]1c1cccs1 ZINC000527669032 1030807124 /nfs/dbraw/zinc/80/71/24/1030807124.db2.gz WSPZSNIJISZGCE-XLIONFOSSA-N 2 1 339.508 4.402 20 0 EIADMP COCCC1(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCCC1 ZINC000122380190 1030811902 /nfs/dbraw/zinc/81/19/02/1030811902.db2.gz HNNCOVDTBZZKMB-KRWDZBQOSA-N 2 1 341.499 4.428 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21)c1ccccn1 ZINC000658066538 1030813874 /nfs/dbraw/zinc/81/38/74/1030813874.db2.gz MJXQFIANKRHLSJ-URHOCTSQSA-N 2 1 349.522 4.218 20 0 EIADMP CC[C@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000658090003 1030819650 /nfs/dbraw/zinc/81/96/50/1030819650.db2.gz DKRBQKAOCCYZII-HNAYVOBHSA-N 2 1 327.472 4.037 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000658265852 1030917500 /nfs/dbraw/zinc/91/75/00/1030917500.db2.gz VJQIMJFKXNFMLG-VHBXLISGSA-N 2 1 348.481 4.455 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000658265852 1030917507 /nfs/dbraw/zinc/91/75/07/1030917507.db2.gz VJQIMJFKXNFMLG-VHBXLISGSA-N 2 1 348.481 4.455 20 0 EIADMP C[C@H]([NH2+]C1CCC2(CC2(F)F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000658265790 1030922054 /nfs/dbraw/zinc/92/20/54/1030922054.db2.gz PXOAUMDXURDDIG-FVPXHTFXSA-N 2 1 348.481 4.455 20 0 EIADMP C[C@H](Cc1ccoc1)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658317266 1030980735 /nfs/dbraw/zinc/98/07/35/1030980735.db2.gz KBPMAQSBOBACFD-NQIIRXRSSA-N 2 1 338.495 4.103 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cccnc1 ZINC000658320505 1030983924 /nfs/dbraw/zinc/98/39/24/1030983924.db2.gz YWLGNKGGFLMZFN-GHTZIAJQSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527964486 1031006818 /nfs/dbraw/zinc/00/68/18/1031006818.db2.gz KSCRHKLTRJXPFS-QTGUNEKASA-N 2 1 349.522 4.423 20 0 EIADMP CC(C)c1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@@H](C)c1nc2ccccc2o1 ZINC000375825401 1031311041 /nfs/dbraw/zinc/31/10/41/1031311041.db2.gz RMIXFEJOHQUTMQ-HOTGVXAUSA-N 2 1 338.455 4.373 20 0 EIADMP CC(C)c1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@@H](C)c1nc2ccccc2o1 ZINC000375825401 1031311065 /nfs/dbraw/zinc/31/10/65/1031311065.db2.gz RMIXFEJOHQUTMQ-HOTGVXAUSA-N 2 1 338.455 4.373 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCOC3(CCC3)C2)C1 ZINC000449082167 1031437811 /nfs/dbraw/zinc/43/78/11/1031437811.db2.gz LFFHJTMAZISQNL-GHTZIAJQSA-N 2 1 342.527 4.110 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2cc3cccnc3o2)C1 ZINC000449081957 1031438653 /nfs/dbraw/zinc/43/86/53/1031438653.db2.gz JEHKNPJIMDAVFH-QGZVFWFLSA-N 2 1 349.478 4.350 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)c1 ZINC000531688259 1031459578 /nfs/dbraw/zinc/45/95/78/1031459578.db2.gz DYWYNDRKGQJQSL-HNNXBMFYSA-N 2 1 340.458 4.367 20 0 EIADMP CC[C@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C1CCCC1 ZINC000449123770 1031461653 /nfs/dbraw/zinc/46/16/53/1031461653.db2.gz NQSAWBFRTSTFBP-IBGZPJMESA-N 2 1 333.520 4.062 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)C1CCOCC1 ZINC000531682143 1031475093 /nfs/dbraw/zinc/47/50/93/1031475093.db2.gz HNOMNZUCSCQWCA-XMSQKQJNSA-N 2 1 344.543 4.356 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1ccncn1 ZINC000453075528 1031561591 /nfs/dbraw/zinc/56/15/91/1031561591.db2.gz WGZHCFGAEMXGAA-QGZVFWFLSA-N 2 1 338.499 4.092 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)c1ccncn1 ZINC000453075528 1031561604 /nfs/dbraw/zinc/56/16/04/1031561604.db2.gz WGZHCFGAEMXGAA-QGZVFWFLSA-N 2 1 338.499 4.092 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccncc1 ZINC000453079043 1031566569 /nfs/dbraw/zinc/56/65/69/1031566569.db2.gz CIZXMCBSNUAAKK-VQIMIIECSA-N 2 1 329.513 4.096 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccncc1 ZINC000453079043 1031566577 /nfs/dbraw/zinc/56/65/77/1031566577.db2.gz CIZXMCBSNUAAKK-VQIMIIECSA-N 2 1 329.513 4.096 20 0 EIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cc(-c2ccccc2)nn1C ZINC000453101498 1031593330 /nfs/dbraw/zinc/59/33/30/1031593330.db2.gz YIJLNXWNAZDIBR-OAHLLOKOSA-N 2 1 340.515 4.047 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H](C3CC3)C3CCC3)CC2)cs1 ZINC000453104038 1031595695 /nfs/dbraw/zinc/59/56/95/1031595695.db2.gz CBCCDRBIDAAMSF-HXUWFJFHSA-N 2 1 347.572 4.086 20 0 EIADMP COCC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000449307340 1031614195 /nfs/dbraw/zinc/61/41/95/1031614195.db2.gz OVWKZTLCBXVKBG-XVAXZDLZSA-N 2 1 344.543 4.082 20 0 EIADMP COCC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000449307340 1031614208 /nfs/dbraw/zinc/61/42/08/1031614208.db2.gz OVWKZTLCBXVKBG-XVAXZDLZSA-N 2 1 344.543 4.082 20 0 EIADMP FC(F)C1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)CC1 ZINC000453228678 1031747746 /nfs/dbraw/zinc/74/77/46/1031747746.db2.gz UTBGRQFFYXVERG-KURKYZTESA-N 2 1 334.454 4.065 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)CC1 ZINC000531943172 1031824432 /nfs/dbraw/zinc/82/44/32/1031824432.db2.gz VRILKBVOKHWYQC-AWEZNQCLSA-N 2 1 344.421 4.356 20 0 EIADMP Cc1cccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cccc(F)c2)c1 ZINC000453376692 1031926676 /nfs/dbraw/zinc/92/66/76/1031926676.db2.gz YRFNHFSVELKRSZ-KBRMVUAJSA-N 2 1 338.470 4.438 20 0 EIADMP CCN(c1ccccc1)c1ccc(C[NH2+][C@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000531980181 1031928609 /nfs/dbraw/zinc/92/86/09/1031928609.db2.gz AOEPSNZGRMTPHM-AVRDEDQJSA-N 2 1 337.511 4.274 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Br)c(F)c1 ZINC000453401359 1031935948 /nfs/dbraw/zinc/93/59/48/1031935948.db2.gz MSIRZNWMLDXLNR-LBPRGKRZSA-N 2 1 343.284 4.113 20 0 EIADMP Cc1cc([N@H+]2CCCC[C@H]2C)ccc1NC1CC[NH+](C2CC2)CC1 ZINC000459363938 1031947946 /nfs/dbraw/zinc/94/79/46/1031947946.db2.gz RUUZVNYZIDOYJF-QGZVFWFLSA-N 2 1 327.516 4.413 20 0 EIADMP Cc1cc([N@@H+]2CCCC[C@H]2C)ccc1NC1CC[NH+](C2CC2)CC1 ZINC000459363938 1031947961 /nfs/dbraw/zinc/94/79/61/1031947961.db2.gz RUUZVNYZIDOYJF-QGZVFWFLSA-N 2 1 327.516 4.413 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)c1 ZINC000453397433 1031964496 /nfs/dbraw/zinc/96/44/96/1031964496.db2.gz JLUHOZONFVCWPQ-AWEZNQCLSA-N 2 1 326.431 4.121 20 0 EIADMP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000152482700 1031985080 /nfs/dbraw/zinc/98/50/80/1031985080.db2.gz VEJXYTHYOAXBBJ-BZNIZROVSA-N 2 1 325.283 4.055 20 0 EIADMP C[C@@H](CCN[C@@H](C)c1ccc(Cl)nc1)[N@@H+](C)Cc1ccccc1 ZINC000179135341 1032015435 /nfs/dbraw/zinc/01/54/35/1032015435.db2.gz ZMHJBOORUBZAJO-HOTGVXAUSA-N 2 1 331.891 4.296 20 0 EIADMP C[C@@H](CC[NH2+][C@@H](C)c1ccc(Cl)nc1)[N@@H+](C)Cc1ccccc1 ZINC000179135341 1032015471 /nfs/dbraw/zinc/01/54/71/1032015471.db2.gz ZMHJBOORUBZAJO-HOTGVXAUSA-N 2 1 331.891 4.296 20 0 EIADMP Cc1ccc2[nH+]ccc(N3CCC(c4[nH+]cc5n4CCCC5)CC3)c2c1 ZINC000432929031 1033433795 /nfs/dbraw/zinc/43/37/95/1033433795.db2.gz VJDQBBUTNNWJHB-UHFFFAOYSA-N 2 1 346.478 4.460 20 0 EIADMP Cc1ncc(C[N@@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)s1 ZINC000411173992 1033716982 /nfs/dbraw/zinc/71/69/82/1033716982.db2.gz RKWYEFBBTKGAEY-UHFFFAOYSA-N 2 1 329.513 4.069 20 0 EIADMP Cc1ncc(C[N@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)s1 ZINC000411173992 1033717000 /nfs/dbraw/zinc/71/70/00/1033717000.db2.gz RKWYEFBBTKGAEY-UHFFFAOYSA-N 2 1 329.513 4.069 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[N@H+](C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000576438252 1034562075 /nfs/dbraw/zinc/56/20/75/1034562075.db2.gz LPHROHNRFAPWES-UCGSKFKCSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[NH+](C)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000576438252 1034562088 /nfs/dbraw/zinc/56/20/88/1034562088.db2.gz LPHROHNRFAPWES-UCGSKFKCSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000576438252 1034562112 /nfs/dbraw/zinc/56/21/12/1034562112.db2.gz LPHROHNRFAPWES-UCGSKFKCSA-N 2 1 338.442 4.106 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC000576438252 1034562132 /nfs/dbraw/zinc/56/21/32/1034562132.db2.gz LPHROHNRFAPWES-UCGSKFKCSA-N 2 1 338.442 4.106 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000513216688 1034833171 /nfs/dbraw/zinc/83/31/71/1034833171.db2.gz GWTBOYIXNDELRX-GSEOLPGOSA-N 2 1 332.557 4.303 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000513216688 1034833174 /nfs/dbraw/zinc/83/31/74/1034833174.db2.gz GWTBOYIXNDELRX-GSEOLPGOSA-N 2 1 332.557 4.303 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CSc4ccccc43)CC2)C1 ZINC000513207723 1034836433 /nfs/dbraw/zinc/83/64/33/1034836433.db2.gz FEGAYTNUNOSWSB-SUMDDJOVSA-N 2 1 330.541 4.466 20 0 EIADMP C[N@H+](C[C@H]1C[C@H]1c1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513483524 1034974430 /nfs/dbraw/zinc/97/44/30/1034974430.db2.gz DURJWSGWPOHJAZ-GGAORHGYSA-N 2 1 334.507 4.387 20 0 EIADMP C[N@@H+](C[C@H]1C[C@H]1c1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513483524 1034974442 /nfs/dbraw/zinc/97/44/42/1034974442.db2.gz DURJWSGWPOHJAZ-GGAORHGYSA-N 2 1 334.507 4.387 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cc(C(F)(F)F)ccc1Cl ZINC000513500742 1034999137 /nfs/dbraw/zinc/99/91/37/1034999137.db2.gz OBYQTYHKPAOLMH-NSHDSACASA-N 2 1 345.796 4.290 20 0 EIADMP Cc1ccnc([C@@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000513667989 1035088637 /nfs/dbraw/zinc/08/86/37/1035088637.db2.gz UXDGOHLJMJDWTC-MOXWOTFGSA-N 2 1 337.511 4.197 20 0 EIADMP Cc1ccnc([C@@H](C)[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000513667989 1035088646 /nfs/dbraw/zinc/08/86/46/1035088646.db2.gz UXDGOHLJMJDWTC-MOXWOTFGSA-N 2 1 337.511 4.197 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2cc3ccnc(Cl)c3s2)C1 ZINC000894242021 1035307898 /nfs/dbraw/zinc/30/78/98/1035307898.db2.gz QSHBQICFSUEPQO-CYBMUJFWSA-N 2 1 337.920 4.160 20 0 EIADMP C[C@H](c1ccc(F)cc1F)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501025552 1035353305 /nfs/dbraw/zinc/35/33/05/1035353305.db2.gz ZCJNWSGJTFBVJI-OAHLLOKOSA-N 2 1 345.437 4.269 20 0 EIADMP CCC[N@@H+](CCCN1CC[NH+](C(C)C)CC1)[C@@H](CC)c1ccccc1 ZINC000501103161 1035378196 /nfs/dbraw/zinc/37/81/96/1035378196.db2.gz FXSMZVADRBDRNR-QFIPXVFZSA-N 2 1 345.575 4.266 20 0 EIADMP C[NH+](C)[C@H](C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1)C1CCCCC1 ZINC000501427560 1035443083 /nfs/dbraw/zinc/44/30/83/1035443083.db2.gz WOTRMPPSCZGNBT-HLAWJBBLSA-N 2 1 329.532 4.208 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000501427109 1035443476 /nfs/dbraw/zinc/44/34/76/1035443476.db2.gz VSRGTVVKGNWPIA-INIZCTEOSA-N 2 1 344.449 4.028 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@H+]1C ZINC000501465713 1035449258 /nfs/dbraw/zinc/44/92/58/1035449258.db2.gz GLQWXKQJLVHTFW-YWZLYKJASA-N 2 1 344.449 4.169 20 0 EIADMP COc1ccccc1-c1ccc([C@H](C)[N@@H+](C)CC[C@@H]2CC[NH2+]C2)cc1 ZINC000420294553 1035492625 /nfs/dbraw/zinc/49/26/25/1035492625.db2.gz BBEGUNNBGNMCFG-ROUUACIJSA-N 2 1 338.495 4.355 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CC[C@H]([C@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420302789 1035506073 /nfs/dbraw/zinc/50/60/73/1035506073.db2.gz GOBOQPVHVMSESW-WHOFXGATSA-N 2 1 333.863 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@H]([C@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420302789 1035506080 /nfs/dbraw/zinc/50/60/80/1035506080.db2.gz GOBOQPVHVMSESW-WHOFXGATSA-N 2 1 333.863 4.034 20 0 EIADMP Cc1cc(C)c(C[N@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)c(C)c1 ZINC000420315546 1035508368 /nfs/dbraw/zinc/50/83/68/1035508368.db2.gz RXONFSSLNVFCKM-NRFANRHFSA-N 2 1 337.511 4.151 20 0 EIADMP Cc1cc(C)c(C[N@@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)c(C)c1 ZINC000420315546 1035508376 /nfs/dbraw/zinc/50/83/76/1035508376.db2.gz RXONFSSLNVFCKM-NRFANRHFSA-N 2 1 337.511 4.151 20 0 EIADMP CSCC1(CC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000595064445 1035543050 /nfs/dbraw/zinc/54/30/50/1035543050.db2.gz BBSPGTWTCAAAJT-HNNXBMFYSA-N 2 1 329.513 4.365 20 0 EIADMP CCSC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000595100648 1035587876 /nfs/dbraw/zinc/58/78/76/1035587876.db2.gz TZVMMMIWIGCNDQ-LDLYASANSA-N 2 1 330.541 4.057 20 0 EIADMP c1[nH+]c(C2CC[NH+](CCSC3CCCCC3)CC2)n2c1CCCC2 ZINC000501868265 1035703991 /nfs/dbraw/zinc/70/39/91/1035703991.db2.gz DNEMVHODGWLTND-UHFFFAOYSA-N 2 1 347.572 4.465 20 0 EIADMP Fc1cc(Cl)cc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000485728825 1036215015 /nfs/dbraw/zinc/21/50/15/1036215015.db2.gz CJULUNJAYQXPAE-UHFFFAOYSA-N 2 1 346.877 4.276 20 0 EIADMP COC1CC[NH+](C2(C[NH2+]C3CC4(C3)CCCCC4)CCCC2)CC1 ZINC000421369583 1036315013 /nfs/dbraw/zinc/31/50/13/1036315013.db2.gz WFRUEXMQAGGBGT-UHFFFAOYSA-N 2 1 334.548 4.113 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2ccc(F)cc2F)CCCC1 ZINC000486079827 1036465072 /nfs/dbraw/zinc/46/50/72/1036465072.db2.gz QGLMYQLUFRVJFR-SPYBWZPUSA-N 2 1 336.470 4.095 20 0 EIADMP CCc1cccc2c(C3CC[NH+](CC[C@@H]4CCC[N@H+]4C)CC3)c[nH]c21 ZINC000502690547 1036488124 /nfs/dbraw/zinc/48/81/24/1036488124.db2.gz VCMZQHYAALZGDH-IBGZPJMESA-N 2 1 339.527 4.394 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1Cc1c(F)cccc1Cl ZINC000502694927 1036510038 /nfs/dbraw/zinc/51/00/38/1036510038.db2.gz ULOHSPLLUSPAPW-MRXNPFEDSA-N 2 1 349.881 4.471 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1Cc1c(F)cccc1Cl ZINC000502694927 1036510057 /nfs/dbraw/zinc/51/00/57/1036510057.db2.gz ULOHSPLLUSPAPW-MRXNPFEDSA-N 2 1 349.881 4.471 20 0 EIADMP C[C@@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526519 1036786735 /nfs/dbraw/zinc/78/67/35/1036786735.db2.gz HHOKKCMPDOCUNR-KDOFPFPSSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526519 1036786757 /nfs/dbraw/zinc/78/67/57/1036786757.db2.gz HHOKKCMPDOCUNR-KDOFPFPSSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526519 1036786775 /nfs/dbraw/zinc/78/67/75/1036786775.db2.gz HHOKKCMPDOCUNR-KDOFPFPSSA-N 2 1 332.488 4.326 20 0 EIADMP COC1([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CCCC1 ZINC000421835582 1036798361 /nfs/dbraw/zinc/79/83/61/1036798361.db2.gz PZMVNCQKLWIDBS-JZXOWHBKSA-N 2 1 336.545 4.068 20 0 EIADMP COC1([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CCCC1 ZINC000421835582 1036798389 /nfs/dbraw/zinc/79/83/89/1036798389.db2.gz PZMVNCQKLWIDBS-JZXOWHBKSA-N 2 1 336.545 4.068 20 0 EIADMP CC[C@H](C[NH2+]CC1([NH+]2CCC(OC)CC2)CCCC1)c1ccccc1 ZINC000502985807 1036851666 /nfs/dbraw/zinc/85/16/66/1036851666.db2.gz FGJUDLAVSADRLW-LJQANCHMSA-N 2 1 344.543 4.193 20 0 EIADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(c2ccon2)CC1 ZINC000668714418 1036899722 /nfs/dbraw/zinc/89/97/22/1036899722.db2.gz WMMVUQBEHPZOSP-UHFFFAOYSA-N 2 1 341.499 4.012 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(c2ccon2)CC1 ZINC000668714418 1036899725 /nfs/dbraw/zinc/89/97/25/1036899725.db2.gz WMMVUQBEHPZOSP-UHFFFAOYSA-N 2 1 341.499 4.012 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cccc3[nH]ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000503123232 1036923014 /nfs/dbraw/zinc/92/30/14/1036923014.db2.gz RMWSXKGBFUCZLY-RXVVDRJESA-N 2 1 347.506 4.353 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cccc3[nH]ccc32)CC[N@H+]1Cc1ccccc1 ZINC000503123232 1036923032 /nfs/dbraw/zinc/92/30/32/1036923032.db2.gz RMWSXKGBFUCZLY-RXVVDRJESA-N 2 1 347.506 4.353 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(C[NH2+]C/C=C\c3ccncc3)cc2)C1 ZINC000486989683 1036937745 /nfs/dbraw/zinc/93/77/45/1036937745.db2.gz UUVHQLXZIUMBGJ-PYSGZSLQSA-N 2 1 349.522 4.363 20 0 EIADMP Cc1cnc([C@H](C)C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000273508582 1037487685 /nfs/dbraw/zinc/48/76/85/1037487685.db2.gz ZZDNCGACKAIKLA-JTDSTZFVSA-N 2 1 343.540 4.055 20 0 EIADMP [NH3+]C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)C1 ZINC000414652227 1037673982 /nfs/dbraw/zinc/67/39/82/1037673982.db2.gz GRXVTSFACPKPTG-GFCCVEGCSA-N 2 1 340.414 4.215 20 0 EIADMP COCCSc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422709440 1037804046 /nfs/dbraw/zinc/80/40/46/1037804046.db2.gz DISJIJVJKZJDCL-PNHOKKKMSA-N 2 1 342.508 4.221 20 0 EIADMP Clc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc2)cc1 ZINC000422769791 1037829119 /nfs/dbraw/zinc/82/91/19/1037829119.db2.gz TYWYWSMPFFBLAL-XNMUZJSGSA-N 2 1 326.871 4.302 20 0 EIADMP CC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3C[C@@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000422800321 1037836197 /nfs/dbraw/zinc/83/61/97/1037836197.db2.gz BGIKWOZIMUEWGY-DHIUTWEWSA-N 3 1 349.522 4.153 20 0 EIADMP Clc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2cccs2)cc1 ZINC000422946098 1037883435 /nfs/dbraw/zinc/88/34/35/1037883435.db2.gz OLGMAQSKPOHJPA-IXEWLPCDSA-N 2 1 332.900 4.364 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)o2)cs1 ZINC000422950915 1037887908 /nfs/dbraw/zinc/88/79/08/1037887908.db2.gz XAVXEMHNQHAYOL-GVDBMIGSSA-N 2 1 345.512 4.112 20 0 EIADMP CC(C)N(C)c1ccccc1C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000423056737 1037924994 /nfs/dbraw/zinc/92/49/94/1037924994.db2.gz GDKCNPSHJOLKFX-RTWAWAEBSA-N 2 1 337.511 4.114 20 0 EIADMP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423092385 1037954940 /nfs/dbraw/zinc/95/49/40/1037954940.db2.gz BSJSMMMOWHZOFQ-JRJVTICQSA-N 2 1 328.887 4.134 20 0 EIADMP [NH3+][C@@H]1CCC[C@@H]1[NH2+]C[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423125916 1037972110 /nfs/dbraw/zinc/97/21/10/1037972110.db2.gz IMMHZPPTEPZQCR-AABGKKOBSA-N 2 1 344.886 4.067 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423178709 1038034762 /nfs/dbraw/zinc/03/47/62/1038034762.db2.gz GLDNXTMEHBAVJH-SECBINFHSA-N 2 1 340.311 4.127 20 0 EIADMP CC[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cccc(Cl)c1F ZINC000423182522 1038035156 /nfs/dbraw/zinc/03/51/56/1038035156.db2.gz FEBGFHSTGQZXMQ-QGZVFWFLSA-N 2 1 335.854 4.095 20 0 EIADMP Cc1ccsc1C[N@@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000414725637 1038058596 /nfs/dbraw/zinc/05/85/96/1038058596.db2.gz WPOBZUZQWCXBEP-KRWDZBQOSA-N 2 1 332.538 4.262 20 0 EIADMP Fc1ccc([C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423215517 1038059832 /nfs/dbraw/zinc/05/98/32/1038059832.db2.gz QRUTTYFPUAPALP-OPAMFIHVSA-N 2 1 349.453 4.053 20 0 EIADMP c1ccc2cc(OCC[N@@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000606447873 1038070817 /nfs/dbraw/zinc/07/08/17/1038070817.db2.gz KFHVMIOGGHWQRH-OAQYLSRUSA-N 2 1 338.495 4.169 20 0 EIADMP c1ccc2cc(OCC[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000606447873 1038070836 /nfs/dbraw/zinc/07/08/36/1038070836.db2.gz KFHVMIOGGHWQRH-OAQYLSRUSA-N 2 1 338.495 4.169 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)[NH3+])c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423288860 1038090722 /nfs/dbraw/zinc/09/07/22/1038090722.db2.gz VLENDCJHXGKVOX-QMMMGPOBSA-N 2 1 328.300 4.112 20 0 EIADMP CCC([NH3+])(CC)C[NH2+][C@H](C)c1sc(-c2ccc(OC)cc2)nc1C ZINC000423287889 1038092498 /nfs/dbraw/zinc/09/24/98/1038092498.db2.gz PBSNNVCLLSEUTP-CYBMUJFWSA-N 2 1 347.528 4.295 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@@H]3C1)CCCO2 ZINC000489557419 1038113002 /nfs/dbraw/zinc/11/30/02/1038113002.db2.gz YMMGWIIWAFEFKI-IIDMSEBBSA-N 2 1 334.891 4.079 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCCO2 ZINC000489557419 1038113021 /nfs/dbraw/zinc/11/30/21/1038113021.db2.gz YMMGWIIWAFEFKI-IIDMSEBBSA-N 2 1 334.891 4.079 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCCOc3ccc(C(C)C)cc32)CC1 ZINC000489554659 1038116217 /nfs/dbraw/zinc/11/62/17/1038116217.db2.gz GWNKLKDZPBMIIB-HXUWFJFHSA-N 2 1 330.516 4.488 20 0 EIADMP CCCC[C@@H](C[NH3+])[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000423303546 1038131238 /nfs/dbraw/zinc/13/12/38/1038131238.db2.gz XFUABXYSXCBAMF-OALUTQOASA-N 2 1 331.891 4.126 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCCc3cc(N)ccc32)cc1 ZINC000423344727 1038136069 /nfs/dbraw/zinc/13/60/69/1038136069.db2.gz FMNZFCLQCZPLAZ-QRQCRPRQSA-N 2 1 346.478 4.491 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@@H]3C1)CCCO2 ZINC000489630264 1038178008 /nfs/dbraw/zinc/17/80/08/1038178008.db2.gz LHSSCYAGOJDHFR-NLWGTHIKSA-N 2 1 328.500 4.240 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CCCO2 ZINC000489630264 1038178023 /nfs/dbraw/zinc/17/80/23/1038178023.db2.gz LHSSCYAGOJDHFR-NLWGTHIKSA-N 2 1 328.500 4.240 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423512028 1038272321 /nfs/dbraw/zinc/27/23/21/1038272321.db2.gz UFQIKIJLTMIGEE-VGOFRKELSA-N 3 1 348.494 4.312 20 0 EIADMP C[C@H]([NH2+]CC1([NH3+])C2CC3CC(C2)CC1C3)c1ccc2ccccc2n1 ZINC000423524672 1038278410 /nfs/dbraw/zinc/27/84/10/1038278410.db2.gz JTSZSYIEVIEDNL-WTHLRWBASA-N 2 1 335.495 4.039 20 0 EIADMP C[C@H](O)[C@@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1ccccc1 ZINC000658355909 1038341487 /nfs/dbraw/zinc/34/14/87/1038341487.db2.gz IQKQUUZYOVBTMP-FXAWDEMLSA-N 2 1 346.559 4.377 20 0 EIADMP C[C@@H]1C[C@@H](C[N@H+]2CCC[C@@H]2c2ccc(Br)s2)CC[NH2+]1 ZINC000414760290 1038349475 /nfs/dbraw/zinc/34/94/75/1038349475.db2.gz QHDJGKJAWFSZHV-FRRDWIJNSA-N 2 1 343.334 4.036 20 0 EIADMP c1cc2[nH+]ccc(N3CCC(C[NH+]4CCCCCC4)CC3)c2s1 ZINC000608079518 1038497906 /nfs/dbraw/zinc/49/79/06/1038497906.db2.gz NBGCZWUVFLWLOU-UHFFFAOYSA-N 2 1 329.513 4.389 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](Cc1ccncc1)c1cccs1 ZINC000424321622 1038803566 /nfs/dbraw/zinc/80/35/66/1038803566.db2.gz UWHIGUZTCMDPSS-GOSISDBHSA-N 2 1 340.496 4.002 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CC4(C[C@H]3C)CC[NH2+]CC4)s2)cc1 ZINC000424376286 1038837471 /nfs/dbraw/zinc/83/74/71/1038837471.db2.gz KWHWQZQYLXJXQR-MRXNPFEDSA-N 2 1 341.524 4.083 20 0 EIADMP C[N@@H+](CCCCc1ccccc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000480851272 1038843883 /nfs/dbraw/zinc/84/38/83/1038843883.db2.gz JKPJRUGGZYXUAB-UHFFFAOYSA-N 2 1 337.511 4.253 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(C)cc2C)[C@@H](C)C1 ZINC000480887607 1038853209 /nfs/dbraw/zinc/85/32/09/1038853209.db2.gz FMIFRNMICOYHPG-ZVDOUQERSA-N 2 1 332.532 4.091 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000539163212 1038865485 /nfs/dbraw/zinc/86/54/85/1038865485.db2.gz ONUNWJJIMVWOOT-KDOFPFPSSA-N 2 1 340.433 4.476 20 0 EIADMP COc1cccc(C2(N[C@@H]3CC[N@H+](C)[C@H](c4ccccc4)C3)CC2)c1 ZINC000550754221 1038899712 /nfs/dbraw/zinc/89/97/12/1038899712.db2.gz RISJLTJIYDIYOO-CTNGQTDRSA-N 2 1 336.479 4.109 20 0 EIADMP COc1cccc(C2(N[C@@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)CC2)c1 ZINC000550754221 1038899722 /nfs/dbraw/zinc/89/97/22/1038899722.db2.gz RISJLTJIYDIYOO-CTNGQTDRSA-N 2 1 336.479 4.109 20 0 EIADMP C[NH+]1CCC([NH2+][C@@H]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000462122744 1038943067 /nfs/dbraw/zinc/94/30/67/1038943067.db2.gz UCEDIHGBYAPWMH-QZTJIDSGSA-N 2 1 340.433 4.415 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CCSCc1ccc(Cl)cc1Cl ZINC000539296779 1038947074 /nfs/dbraw/zinc/94/70/74/1038947074.db2.gz LCWGAQDDCUDUBA-MLGOLLRUSA-N 2 1 347.355 4.156 20 0 EIADMP FC(F)(F)Oc1cccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000537623373 1039003930 /nfs/dbraw/zinc/00/39/30/1039003930.db2.gz DJKXWUIQOYLNBE-MRXNPFEDSA-N 2 1 342.405 4.036 20 0 EIADMP FC(F)(F)Oc1cccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000537623373 1039003949 /nfs/dbraw/zinc/00/39/49/1039003949.db2.gz DJKXWUIQOYLNBE-MRXNPFEDSA-N 2 1 342.405 4.036 20 0 EIADMP C[C@H](C[NH+]1CCC[C@H]([N@@H+](C)C[C@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333628 1039065265 /nfs/dbraw/zinc/06/52/65/1039065265.db2.gz TZEKGJJZFHRWMC-XQQFMLRXSA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[NH+]1CCC[C@H]([N@H+](C)C[C@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333628 1039065288 /nfs/dbraw/zinc/06/52/88/1039065288.db2.gz TZEKGJJZFHRWMC-XQQFMLRXSA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[N@H+]1CCC[C@H]([NH+](C)C[C@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333628 1039065307 /nfs/dbraw/zinc/06/53/07/1039065307.db2.gz TZEKGJJZFHRWMC-XQQFMLRXSA-N 2 1 348.375 4.170 20 0 EIADMP C[C@H](C[N@@H+]1CCC[C@H]([NH+](C)C[C@H](C)C(F)(F)F)CC1)C(F)(F)F ZINC000555333628 1039065327 /nfs/dbraw/zinc/06/53/27/1039065327.db2.gz TZEKGJJZFHRWMC-XQQFMLRXSA-N 2 1 348.375 4.170 20 0 EIADMP CCC(CC)(CC)C[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000667836559 1039113041 /nfs/dbraw/zinc/11/30/41/1039113041.db2.gz ULZPUIYBUOKUTO-UHFFFAOYSA-N 2 1 335.536 4.309 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2(c3cccc(Cl)c3F)CCCC2)CC[N@H+]1C ZINC000477864125 1039143779 /nfs/dbraw/zinc/14/37/79/1039143779.db2.gz ZUZJOOCGZVMZSM-LSDHHAIUSA-N 2 1 338.898 4.363 20 0 EIADMP c1csc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)c1 ZINC000537628809 1039145509 /nfs/dbraw/zinc/14/55/09/1039145509.db2.gz CFFHLQYUDVPCHB-HXUWFJFHSA-N 2 1 326.509 4.236 20 0 EIADMP c1csc(C[N@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)c1 ZINC000537628809 1039145513 /nfs/dbraw/zinc/14/55/13/1039145513.db2.gz CFFHLQYUDVPCHB-HXUWFJFHSA-N 2 1 326.509 4.236 20 0 EIADMP c1csc(C[NH+]2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)c1 ZINC000537628809 1039145520 /nfs/dbraw/zinc/14/55/20/1039145520.db2.gz CFFHLQYUDVPCHB-HXUWFJFHSA-N 2 1 326.509 4.236 20 0 EIADMP c1csc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)c1 ZINC000537628809 1039145532 /nfs/dbraw/zinc/14/55/32/1039145532.db2.gz CFFHLQYUDVPCHB-HXUWFJFHSA-N 2 1 326.509 4.236 20 0 EIADMP Cc1c(Br)cccc1C[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000534135270 1039152764 /nfs/dbraw/zinc/15/27/64/1039152764.db2.gz RESKSFQSFXEKDB-UHFFFAOYSA-N 2 1 339.321 4.062 20 0 EIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1 ZINC000552098925 1039152832 /nfs/dbraw/zinc/15/28/32/1039152832.db2.gz SSORXKIDCRARDS-JYJNAYRXSA-N 2 1 331.529 4.252 20 0 EIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1 ZINC000552098925 1039152840 /nfs/dbraw/zinc/15/28/40/1039152840.db2.gz SSORXKIDCRARDS-JYJNAYRXSA-N 2 1 331.529 4.252 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc2n[nH]cc2c1 ZINC000552099420 1039157280 /nfs/dbraw/zinc/15/72/80/1039157280.db2.gz IEMODLIUSFRSPC-FIKGOQFSSA-N 2 1 348.494 4.267 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc2n[nH]cc2c1 ZINC000552099420 1039157289 /nfs/dbraw/zinc/15/72/89/1039157289.db2.gz IEMODLIUSFRSPC-FIKGOQFSSA-N 2 1 348.494 4.267 20 0 EIADMP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccccc1OC(F)F ZINC000477917855 1039230269 /nfs/dbraw/zinc/23/02/69/1039230269.db2.gz UQQDHJSUPSPBJT-CQSZACIVSA-N 2 1 326.431 4.061 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)C1 ZINC000481324776 1039298300 /nfs/dbraw/zinc/29/83/00/1039298300.db2.gz RXLGEGRTTKDYGV-GOTSBHOMSA-N 2 1 336.523 4.162 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(F)cc2C(F)(F)F)C[C@H]1C ZINC000552290461 1039344215 /nfs/dbraw/zinc/34/42/15/1039344215.db2.gz JSZPCAZOOMYOTK-IUODEOHRSA-N 2 1 332.385 4.149 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@H]1C ZINC000552290461 1039344231 /nfs/dbraw/zinc/34/42/31/1039344231.db2.gz JSZPCAZOOMYOTK-IUODEOHRSA-N 2 1 332.385 4.149 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@H]1C ZINC000552290461 1039344245 /nfs/dbraw/zinc/34/42/45/1039344245.db2.gz JSZPCAZOOMYOTK-IUODEOHRSA-N 2 1 332.385 4.149 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@H]1C ZINC000552290461 1039344255 /nfs/dbraw/zinc/34/42/55/1039344255.db2.gz JSZPCAZOOMYOTK-IUODEOHRSA-N 2 1 332.385 4.149 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@H]1C ZINC000552290461 1039344265 /nfs/dbraw/zinc/34/42/65/1039344265.db2.gz JSZPCAZOOMYOTK-IUODEOHRSA-N 2 1 332.385 4.149 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](c2ccc(C)cc2)C2CC2)cn1 ZINC000091288577 1039357740 /nfs/dbraw/zinc/35/77/40/1039357740.db2.gz KSTGWVMFHXGJSC-NRFANRHFSA-N 2 1 332.451 4.125 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000514097964 1039632660 /nfs/dbraw/zinc/63/26/60/1039632660.db2.gz CHLSOGABQDBQPF-DNVJHFABSA-N 2 1 349.522 4.170 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000537649554 1039815098 /nfs/dbraw/zinc/81/50/98/1039815098.db2.gz NDGHXGBTYUYITF-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000537649554 1039815101 /nfs/dbraw/zinc/81/51/01/1039815101.db2.gz NDGHXGBTYUYITF-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000537649554 1039815103 /nfs/dbraw/zinc/81/51/03/1039815103.db2.gz NDGHXGBTYUYITF-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000537649554 1039815112 /nfs/dbraw/zinc/81/51/12/1039815112.db2.gz NDGHXGBTYUYITF-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000537649554 1039815115 /nfs/dbraw/zinc/81/51/15/1039815115.db2.gz NDGHXGBTYUYITF-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CCc1oc2ccccc2c1C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000537649741 1039824440 /nfs/dbraw/zinc/82/44/40/1039824440.db2.gz ZFNJIMPSULKWNR-QGZVFWFLSA-N 2 1 326.484 4.159 20 0 EIADMP CCc1oc2ccccc2c1C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000537649741 1039824442 /nfs/dbraw/zinc/82/44/42/1039824442.db2.gz ZFNJIMPSULKWNR-QGZVFWFLSA-N 2 1 326.484 4.159 20 0 EIADMP CCc1oc2ccccc2c1C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000537649741 1039824446 /nfs/dbraw/zinc/82/44/46/1039824446.db2.gz ZFNJIMPSULKWNR-QGZVFWFLSA-N 2 1 326.484 4.159 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+]C[C@H]3CCC[C@@H](C)[C@@H]3C)sc2C1 ZINC000481823506 1039849927 /nfs/dbraw/zinc/84/99/27/1039849927.db2.gz KJKHGCHOQCKQPY-OWCLPIDISA-N 2 1 335.561 4.072 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+]C[C@H]3CCC[C@@H](C)[C@@H]3C)sc2C1 ZINC000481823506 1039849931 /nfs/dbraw/zinc/84/99/31/1039849931.db2.gz KJKHGCHOQCKQPY-OWCLPIDISA-N 2 1 335.561 4.072 20 0 EIADMP CSc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551007501 1039860573 /nfs/dbraw/zinc/86/05/73/1039860573.db2.gz PDDBFXQQLZHQQE-ICSRJNTNSA-N 2 1 326.509 4.334 20 0 EIADMP CSc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551007501 1039860577 /nfs/dbraw/zinc/86/05/77/1039860577.db2.gz PDDBFXQQLZHQQE-ICSRJNTNSA-N 2 1 326.509 4.334 20 0 EIADMP c1cc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)cs1 ZINC000537695352 1040004706 /nfs/dbraw/zinc/00/47/06/1040004706.db2.gz LZEZVVGXAVJMKS-PMACEKPBSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)cs1 ZINC000537695352 1040004722 /nfs/dbraw/zinc/00/47/22/1040004722.db2.gz LZEZVVGXAVJMKS-PMACEKPBSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)cs1 ZINC000537695352 1040004739 /nfs/dbraw/zinc/00/47/39/1040004739.db2.gz LZEZVVGXAVJMKS-PMACEKPBSA-N 2 1 326.509 4.235 20 0 EIADMP c1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)cs1 ZINC000537695352 1040004757 /nfs/dbraw/zinc/00/47/57/1040004757.db2.gz LZEZVVGXAVJMKS-PMACEKPBSA-N 2 1 326.509 4.235 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)C[C@H]1c1ccccc1 ZINC000551176645 1040022519 /nfs/dbraw/zinc/02/25/19/1040022519.db2.gz YRWVBNJCMUQONC-YXTQBTIXSA-N 2 1 338.470 4.497 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)C[C@H]1c1ccccc1 ZINC000551176645 1040022537 /nfs/dbraw/zinc/02/25/37/1040022537.db2.gz YRWVBNJCMUQONC-YXTQBTIXSA-N 2 1 338.470 4.497 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000482137199 1040027965 /nfs/dbraw/zinc/02/79/65/1040027965.db2.gz ILYPSMHDXFWQAX-BLLLJJGKSA-N 2 1 329.315 4.201 20 0 EIADMP C[C@@H](C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)c1ccc(F)cc1 ZINC000435058109 1040035575 /nfs/dbraw/zinc/03/55/75/1040035575.db2.gz DGERAZPVAYONGM-INIZCTEOSA-N 2 1 341.474 4.342 20 0 EIADMP Clc1ccc(-c2ncc(C[NH2+]CCC[NH+]3CCCCC3)s2)cc1 ZINC000551200864 1040056607 /nfs/dbraw/zinc/05/66/07/1040056607.db2.gz XWQCVQOADAHJTF-UHFFFAOYSA-N 2 1 349.931 4.429 20 0 EIADMP C[C@@H](C[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)C[NH+]1CCCC1 ZINC000551205970 1040059766 /nfs/dbraw/zinc/05/97/66/1040059766.db2.gz SXGNSYWAIFLHKA-AWEZNQCLSA-N 2 1 349.931 4.285 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3F)s2)C1 ZINC000551207990 1040060412 /nfs/dbraw/zinc/06/04/12/1040060412.db2.gz GLFQYZUUDZNAHB-OAHLLOKOSA-N 2 1 332.488 4.374 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC[C@H](c2ccccc2)C(F)(F)F)[C@H](C)C1 ZINC000551238869 1040085796 /nfs/dbraw/zinc/08/57/96/1040085796.db2.gz FENIDPXKWAYUGS-OIISXLGYSA-N 2 1 328.422 4.043 20 0 EIADMP c1cc2[nH+]ccc(N3CC[C@]4(CC[N@@H+](Cc5ccccc5)C4)C3)c2s1 ZINC000553334951 1040142066 /nfs/dbraw/zinc/14/20/66/1040142066.db2.gz JXJAJZQISDEOFU-NRFANRHFSA-N 2 1 349.503 4.399 20 0 EIADMP c1cc2[nH+]ccc(N3CC[C@]4(CC[N@H+](Cc5ccccc5)C4)C3)c2s1 ZINC000553334951 1040142081 /nfs/dbraw/zinc/14/20/81/1040142081.db2.gz JXJAJZQISDEOFU-NRFANRHFSA-N 2 1 349.503 4.399 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccccc2OC(F)(F)F)C1 ZINC000482341205 1040189240 /nfs/dbraw/zinc/18/92/40/1040189240.db2.gz CWSYSTDUTCLBEU-GJZGRUSLSA-N 2 1 344.421 4.356 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccccc2OC(F)(F)F)C1 ZINC000482341205 1040189246 /nfs/dbraw/zinc/18/92/46/1040189246.db2.gz CWSYSTDUTCLBEU-GJZGRUSLSA-N 2 1 344.421 4.356 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)c1 ZINC000482353533 1040199520 /nfs/dbraw/zinc/19/95/20/1040199520.db2.gz DABIGEQNDKCVMQ-JKSUJKDBSA-N 2 1 340.458 4.367 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000482353533 1040199539 /nfs/dbraw/zinc/19/95/39/1040199539.db2.gz DABIGEQNDKCVMQ-JKSUJKDBSA-N 2 1 340.458 4.367 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000482360659 1040201913 /nfs/dbraw/zinc/20/19/13/1040201913.db2.gz PWNPKNDLFDULPH-GJZGRUSLSA-N 2 1 344.421 4.356 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000482434329 1040242836 /nfs/dbraw/zinc/24/28/36/1040242836.db2.gz FNKLMMJLDYXELO-PKOBYXMFSA-N 2 1 326.459 4.041 20 0 EIADMP Cc1ccc([C@@H]([NH2+]CC2([NH+](C)C)CCOCC2)C2CCCCC2)cc1 ZINC000479297496 1040257115 /nfs/dbraw/zinc/25/71/15/1040257115.db2.gz WCLADDAOERYMAA-NRFANRHFSA-N 2 1 344.543 4.317 20 0 EIADMP Cc1cc2[nH]c(C[NH2+]C3CCN(c4cccc(C)[nH+]4)CC3)cc2c(C)c1 ZINC000479393278 1040311687 /nfs/dbraw/zinc/31/16/87/1040311687.db2.gz KVAZNVQMGUHIGV-UHFFFAOYSA-N 2 1 348.494 4.247 20 0 EIADMP C[C@H](Cc1ccccc1)C[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000482518169 1040313728 /nfs/dbraw/zinc/31/37/28/1040313728.db2.gz KQGOFIBNDRRBHS-LJQANCHMSA-N 2 1 337.511 4.109 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC3(CCCC3)O2)CC[N@@H+]1Cc1ccccc1 ZINC000379655499 1040317157 /nfs/dbraw/zinc/31/71/57/1040317157.db2.gz MBXNYHLZRZDSLD-HLAWJBBLSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC3(CCCC3)O2)CC[N@H+]1Cc1ccccc1 ZINC000379655499 1040317169 /nfs/dbraw/zinc/31/71/69/1040317169.db2.gz MBXNYHLZRZDSLD-HLAWJBBLSA-N 2 1 342.527 4.121 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(OC)c1 ZINC000479461728 1040367077 /nfs/dbraw/zinc/36/70/77/1040367077.db2.gz DLJDMMGEBSUECV-DENIHFKCSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1Sc1ccccc1 ZINC000482644970 1040404669 /nfs/dbraw/zinc/40/46/69/1040404669.db2.gz VIZZZKYHZZISFR-APWZRJJASA-N 2 1 326.509 4.268 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1Sc1ccccc1 ZINC000482644970 1040404680 /nfs/dbraw/zinc/40/46/80/1040404680.db2.gz VIZZZKYHZZISFR-APWZRJJASA-N 2 1 326.509 4.268 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccccc1Sc1ccccc1 ZINC000482644972 1040406193 /nfs/dbraw/zinc/40/61/93/1040406193.db2.gz VIZZZKYHZZISFR-QFBILLFUSA-N 2 1 326.509 4.268 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccccc1Sc1ccccc1 ZINC000482644972 1040406196 /nfs/dbraw/zinc/40/61/96/1040406196.db2.gz VIZZZKYHZZISFR-QFBILLFUSA-N 2 1 326.509 4.268 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2ccccc2OC(F)F)C1 ZINC000515020057 1040420767 /nfs/dbraw/zinc/42/07/67/1040420767.db2.gz MSXKPCDSPVCMGH-SFKKXYGYSA-N 2 1 338.442 4.013 20 0 EIADMP CC(C)COc1ccc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000479539181 1040443306 /nfs/dbraw/zinc/44/33/06/1040443306.db2.gz DFKHYWFEPNQMSR-QHGAOEGBSA-N 2 1 330.516 4.389 20 0 EIADMP CC(C)[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000539509579 1040504209 /nfs/dbraw/zinc/50/42/09/1040504209.db2.gz HFUSDOHKLFOCMF-KRWDZBQOSA-N 2 1 326.406 4.254 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3[C@H](C)CCC[C@@H]3C)CC2)cs1 ZINC000482874302 1040533527 /nfs/dbraw/zinc/53/35/27/1040533527.db2.gz NQLNOQIZGVASGL-IGOJGBNBSA-N 2 1 349.588 4.332 20 0 EIADMP COc1ccc(C2([NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)cc1 ZINC000553846124 1040583308 /nfs/dbraw/zinc/58/33/08/1040583308.db2.gz MRUMDLUMRILTRF-UHFFFAOYSA-N 2 1 328.500 4.071 20 0 EIADMP CN(C)c1cc[nH+]cc1C[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000435746952 1040602238 /nfs/dbraw/zinc/60/22/38/1040602238.db2.gz CFRIOTMKCRUOMH-CZIWCDLHSA-N 2 1 349.400 4.202 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(c2ccc(F)cc2C)CC1 ZINC000428718879 1040716877 /nfs/dbraw/zinc/71/68/77/1040716877.db2.gz OATJPPSCCBQGHE-UHFFFAOYSA-N 2 1 329.463 4.299 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C)cnn1-c1cccc(Cl)c1 ZINC000479871025 1040731941 /nfs/dbraw/zinc/73/19/41/1040731941.db2.gz FFGPKYFEGYFEQM-CQSZACIVSA-N 2 1 348.922 4.073 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)ccc1SC ZINC000479898542 1040756638 /nfs/dbraw/zinc/75/66/38/1040756638.db2.gz DKBTUCXQLORHEH-HZPDHXFCSA-N 2 1 336.545 4.332 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)ccc1SC ZINC000479898542 1040756656 /nfs/dbraw/zinc/75/66/56/1040756656.db2.gz DKBTUCXQLORHEH-HZPDHXFCSA-N 2 1 336.545 4.332 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cc(Cl)cc(Cl)c2OC)C[C@H]1C ZINC000539816804 1040809922 /nfs/dbraw/zinc/80/99/22/1040809922.db2.gz DIRFXEZYNUPJKL-DOMZBBRYSA-N 2 1 345.314 4.307 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]CCC3CCCCC3)CC2)cs1 ZINC000483313847 1040816346 /nfs/dbraw/zinc/81/63/46/1040816346.db2.gz KJFYGGSGWTXHCM-UHFFFAOYSA-N 2 1 349.588 4.478 20 0 EIADMP Cc1cc(F)ccc1C[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000539828134 1040823990 /nfs/dbraw/zinc/82/39/90/1040823990.db2.gz BMCMMDSPXVUQRA-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)ccc1C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000539828134 1040823998 /nfs/dbraw/zinc/82/39/98/1040823998.db2.gz BMCMMDSPXVUQRA-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)ccc1C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539828134 1040823999 /nfs/dbraw/zinc/82/39/99/1040823999.db2.gz BMCMMDSPXVUQRA-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)ccc1C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539828134 1040824001 /nfs/dbraw/zinc/82/40/01/1040824001.db2.gz BMCMMDSPXVUQRA-LJQANCHMSA-N 2 1 326.459 4.088 20 0 EIADMP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000669846972 1040851072 /nfs/dbraw/zinc/85/10/72/1040851072.db2.gz UIKYOLMWUFUGSM-ACRUOGEOSA-N 2 1 332.507 4.407 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC000537967957 1040973835 /nfs/dbraw/zinc/97/38/35/1040973835.db2.gz JBVNGAMMIQMOEF-KJNZLNQQSA-N 2 1 325.500 4.390 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)c2cccc(Br)c21 ZINC000483734454 1040987743 /nfs/dbraw/zinc/98/77/43/1040987743.db2.gz XDQFQMGZLSZLQF-DVZHBHJUSA-N 2 1 337.305 4.070 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)c2cccc(Br)c21 ZINC000483734454 1040987770 /nfs/dbraw/zinc/98/77/70/1040987770.db2.gz XDQFQMGZLSZLQF-DVZHBHJUSA-N 2 1 337.305 4.070 20 0 EIADMP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]CCC[NH+]2CCCCC2)c1 ZINC000480164489 1041019802 /nfs/dbraw/zinc/01/98/02/1041019802.db2.gz XNXUPPYVERARGU-OAHLLOKOSA-N 2 1 326.431 4.123 20 0 EIADMP C[C@H]([NH2+]CCCN(C)Cc1ccccc1)c1ccc2ccccc2n1 ZINC000480171298 1041029719 /nfs/dbraw/zinc/02/97/19/1041029719.db2.gz QIBFEPPDRODURB-SFHVURJKSA-N 2 1 333.479 4.408 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000480208926 1041081965 /nfs/dbraw/zinc/08/19/65/1041081965.db2.gz LDRZBTVZHNGRJS-DENIHFKCSA-N 2 1 334.507 4.218 20 0 EIADMP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000480241712 1041102608 /nfs/dbraw/zinc/10/26/08/1041102608.db2.gz PYWLRKBNRDQIST-GOSISDBHSA-N 2 1 326.509 4.495 20 0 EIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000480253195 1041135109 /nfs/dbraw/zinc/13/51/09/1041135109.db2.gz WOSGGUXKBRVXJV-FUHWJXTLSA-N 2 1 342.449 4.262 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000540148274 1041194128 /nfs/dbraw/zinc/19/41/28/1041194128.db2.gz YKEWNEZPRJDYCY-JXFKEZNVSA-N 2 1 326.509 4.268 20 0 EIADMP Cc1ccc(SC2(C[NH2+][C@H]3CC[N@@H+](C)[C@@H](C)C3)CCCC2)cc1 ZINC000484287868 1041194667 /nfs/dbraw/zinc/19/46/67/1041194667.db2.gz CYHWAVGHHIMLBB-ROUUACIJSA-N 2 1 332.557 4.472 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000540150166 1041198692 /nfs/dbraw/zinc/19/86/92/1041198692.db2.gz CBIUQHJIFFEVLH-HZPDHXFCSA-N 2 1 340.458 4.307 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2cccc(F)c2F)cc1 ZINC000540178136 1041223472 /nfs/dbraw/zinc/22/34/72/1041223472.db2.gz SHZNMAYIPJNHOC-AWEZNQCLSA-N 2 1 341.405 4.352 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)C[C@@H]1C ZINC000667664404 1041232943 /nfs/dbraw/zinc/23/29/43/1041232943.db2.gz KDPCUOVIJUOZTH-KXBFYZLASA-N 2 1 343.540 4.423 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)C[C@@H]1C ZINC000667664404 1041232958 /nfs/dbraw/zinc/23/29/58/1041232958.db2.gz KDPCUOVIJUOZTH-KXBFYZLASA-N 2 1 343.540 4.423 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3scnc3C)cc2)C[C@@H]1C ZINC000667664404 1041232971 /nfs/dbraw/zinc/23/29/71/1041232971.db2.gz KDPCUOVIJUOZTH-KXBFYZLASA-N 2 1 343.540 4.423 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(-c3scnc3C)cc2)C[C@@H]1C ZINC000667664404 1041232988 /nfs/dbraw/zinc/23/29/88/1041232988.db2.gz KDPCUOVIJUOZTH-KXBFYZLASA-N 2 1 343.540 4.423 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000540199436 1041258786 /nfs/dbraw/zinc/25/87/86/1041258786.db2.gz VIFGBWPMPRMFLN-GOSISDBHSA-N 2 1 340.433 4.369 20 0 EIADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc[nH+]c2ccccc21 ZINC000463063517 1041299490 /nfs/dbraw/zinc/29/94/90/1041299490.db2.gz HKFFKWKMAXEEHE-IBGZPJMESA-N 2 1 331.463 4.193 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000538406155 1041302632 /nfs/dbraw/zinc/30/26/32/1041302632.db2.gz REOVHNPVSRTUFC-GOSISDBHSA-N 2 1 336.479 4.178 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463076174 1041320392 /nfs/dbraw/zinc/32/03/92/1041320392.db2.gz HNCNQRGJISZVDS-GOSISDBHSA-N 2 1 340.486 4.053 20 0 EIADMP COc1cccc2c(N3CCC(C[N@H+](C)C(C)C)CC3)cc(C)[nH+]c12 ZINC000540285513 1041342716 /nfs/dbraw/zinc/34/27/16/1041342716.db2.gz PIPSUFKSAQNWQK-UHFFFAOYSA-N 2 1 341.499 4.108 20 0 EIADMP COc1cccc2c(N3CCC(C[N@@H+](C)C(C)C)CC3)cc(C)[nH+]c12 ZINC000540285513 1041342728 /nfs/dbraw/zinc/34/27/28/1041342728.db2.gz PIPSUFKSAQNWQK-UHFFFAOYSA-N 2 1 341.499 4.108 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cc(F)cc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463114933 1041344037 /nfs/dbraw/zinc/34/40/37/1041344037.db2.gz IBNORDXGCPXBPM-IIBYNOLFSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cc(F)cc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463114933 1041344049 /nfs/dbraw/zinc/34/40/49/1041344049.db2.gz IBNORDXGCPXBPM-IIBYNOLFSA-N 2 1 344.449 4.150 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+]C/C=C/c3ccccc3)CC2)cc1 ZINC000463128415 1041350647 /nfs/dbraw/zinc/35/06/47/1041350647.db2.gz QPXNSRVPUVXMGF-QPJJXVBHSA-N 2 1 338.470 4.136 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000540302935 1041354891 /nfs/dbraw/zinc/35/48/91/1041354891.db2.gz WMRLMJXLVNKPBE-RHSMWYFYSA-N 2 1 328.422 4.334 20 0 EIADMP CCCCn1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)c(C)n1 ZINC000540317771 1041363655 /nfs/dbraw/zinc/36/36/55/1041363655.db2.gz FMTUXAMLDOYUGC-DYESRHJHSA-N 2 1 346.563 4.124 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463139936 1041375557 /nfs/dbraw/zinc/37/55/57/1041375557.db2.gz USFGGKNAHWYJMF-UGKGYDQZSA-N 2 1 334.507 4.361 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3ccccc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463139936 1041375562 /nfs/dbraw/zinc/37/55/62/1041375562.db2.gz USFGGKNAHWYJMF-UGKGYDQZSA-N 2 1 334.507 4.361 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1C[C@@H]1c1ccccc1 ZINC000463162025 1041378985 /nfs/dbraw/zinc/37/89/85/1041378985.db2.gz JZSOVVDYWQIKTR-YADHBBJMSA-N 2 1 335.495 4.176 20 0 EIADMP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463152750 1041385586 /nfs/dbraw/zinc/38/55/86/1041385586.db2.gz SWUVDJHJEMRNKB-JPYJTQIMSA-N 2 1 334.507 4.217 20 0 EIADMP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463189774 1041406867 /nfs/dbraw/zinc/40/68/67/1041406867.db2.gz KYZRVALLUCBWLO-NMIHRBCNSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1OCCC[C@@H]1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463189774 1041406876 /nfs/dbraw/zinc/40/68/76/1041406876.db2.gz KYZRVALLUCBWLO-NMIHRBCNSA-N 2 1 344.543 4.080 20 0 EIADMP Cc1cccc([C@H](C)C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000463191784 1041408037 /nfs/dbraw/zinc/40/80/37/1041408037.db2.gz QCPYYDADTHBNSC-HXUWFJFHSA-N 2 1 336.523 4.395 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC000667706283 1041421856 /nfs/dbraw/zinc/42/18/56/1041421856.db2.gz WBQTYGYDSJMMNF-MOPGFXCFSA-N 2 1 341.524 4.035 20 0 EIADMP COc1cc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1OC ZINC000480615273 1041425994 /nfs/dbraw/zinc/42/59/94/1041425994.db2.gz RJIVUKVWIWPNBP-ROUUACIJSA-N 2 1 348.531 4.317 20 0 EIADMP Clc1ccc([C@@H]2CCC[C@H]2[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000414889622 1041432955 /nfs/dbraw/zinc/43/29/55/1041432955.db2.gz YWPSAXDATSBGET-VQTJNVASSA-N 2 1 343.902 4.141 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OCCC(C)C)c(OC)c2)CC1 ZINC000540409800 1041438267 /nfs/dbraw/zinc/43/82/67/1041438267.db2.gz MTKGCUBADVXYJF-KRWDZBQOSA-N 2 1 348.531 4.255 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCc2ccccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463248224 1041452860 /nfs/dbraw/zinc/45/28/60/1041452860.db2.gz RQHUKUACBXWZJK-NQIIRXRSSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCc2ccccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463248224 1041452862 /nfs/dbraw/zinc/45/28/62/1041452862.db2.gz RQHUKUACBXWZJK-NQIIRXRSSA-N 2 1 340.486 4.401 20 0 EIADMP C[N@@H+]1CC[C@@H]2CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC000516221094 1041457243 /nfs/dbraw/zinc/45/72/43/1041457243.db2.gz OGIBKTARSPUBIY-RPWUZVMVSA-N 2 1 348.534 4.114 20 0 EIADMP C[N@H+]1CC[C@@H]2CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC000516221094 1041457251 /nfs/dbraw/zinc/45/72/51/1041457251.db2.gz OGIBKTARSPUBIY-RPWUZVMVSA-N 2 1 348.534 4.114 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@H+](CC(Cc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC000516221094 1041457260 /nfs/dbraw/zinc/45/72/60/1041457260.db2.gz OGIBKTARSPUBIY-RPWUZVMVSA-N 2 1 348.534 4.114 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@@H+](CC(Cc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC000516221094 1041457264 /nfs/dbraw/zinc/45/72/64/1041457264.db2.gz OGIBKTARSPUBIY-RPWUZVMVSA-N 2 1 348.534 4.114 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)C(F)(F)F ZINC000480669411 1041461725 /nfs/dbraw/zinc/46/17/25/1041461725.db2.gz WOZCBRVWDMKCSV-VDHUWJSZSA-N 2 1 340.433 4.075 20 0 EIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000480692422 1041476539 /nfs/dbraw/zinc/47/65/39/1041476539.db2.gz IGUSJXWGIZQOAW-ZVDOUQERSA-N 2 1 330.516 4.389 20 0 EIADMP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1ccccc1F ZINC000480696121 1041485026 /nfs/dbraw/zinc/48/50/26/1041485026.db2.gz VSTVFWWZTLPGPD-QGZVFWFLSA-N 2 1 344.474 4.397 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)C[C@H]1C ZINC000538718697 1041488302 /nfs/dbraw/zinc/48/83/02/1041488302.db2.gz IGLRUKDKEUFGHL-UZLBHIALSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc3cc(OC)ccc3c2)C[C@H]1C ZINC000538718697 1041488304 /nfs/dbraw/zinc/48/83/04/1041488304.db2.gz IGLRUKDKEUFGHL-UZLBHIALSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc3cc(OC)ccc3c2)C[C@H]1C ZINC000538718697 1041488308 /nfs/dbraw/zinc/48/83/08/1041488308.db2.gz IGLRUKDKEUFGHL-UZLBHIALSA-N 2 1 326.484 4.153 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@@H]([C@@H](C)[NH3+])C3)s2)cc1 ZINC000484903380 1041504174 /nfs/dbraw/zinc/50/41/74/1041504174.db2.gz FXFRZKDZJFSEKY-RHSMWYFYSA-N 2 1 329.513 4.103 20 0 EIADMP C[C@@H]1C[NH+](CCCCC[N@H+]2CCC(F)(F)[C@H](C)C2)CCC1(F)F ZINC000554946423 1041507800 /nfs/dbraw/zinc/50/78/00/1041507800.db2.gz SPUVNLAKEKBEGA-HUUCEWRRSA-N 2 1 338.433 4.111 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@@H](C)C1 ZINC000538738192 1041512383 /nfs/dbraw/zinc/51/23/83/1041512383.db2.gz FCFHPPVUSHNYAC-HNAYVOBHSA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@@H](C)C1 ZINC000538738192 1041512396 /nfs/dbraw/zinc/51/23/96/1041512396.db2.gz FCFHPPVUSHNYAC-HNAYVOBHSA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@@H](C)C1 ZINC000538738192 1041512408 /nfs/dbraw/zinc/51/24/08/1041512408.db2.gz FCFHPPVUSHNYAC-HNAYVOBHSA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@@H](C)C1 ZINC000538738192 1041512419 /nfs/dbraw/zinc/51/24/19/1041512419.db2.gz FCFHPPVUSHNYAC-HNAYVOBHSA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@@H](C)C1 ZINC000538738083 1041513461 /nfs/dbraw/zinc/51/34/61/1041513461.db2.gz XIQIWUQQKYQSQO-RDJZCZTQSA-N 2 1 340.458 4.067 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@@H](C)C1 ZINC000538738083 1041513470 /nfs/dbraw/zinc/51/34/70/1041513470.db2.gz XIQIWUQQKYQSQO-RDJZCZTQSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@@H](C)C1 ZINC000538738083 1041513478 /nfs/dbraw/zinc/51/34/78/1041513478.db2.gz XIQIWUQQKYQSQO-RDJZCZTQSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(C)c(C)cc2OC(F)F)[C@@H](C)C1 ZINC000538738083 1041513495 /nfs/dbraw/zinc/51/34/95/1041513495.db2.gz XIQIWUQQKYQSQO-RDJZCZTQSA-N 2 1 340.458 4.067 20 0 EIADMP COc1ccc2ccccc2c1C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000538749409 1041521405 /nfs/dbraw/zinc/52/14/05/1041521405.db2.gz LLSWZVGXVLBDRP-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc2ccccc2c1C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000538749409 1041521412 /nfs/dbraw/zinc/52/14/12/1041521412.db2.gz LLSWZVGXVLBDRP-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc2ccccc2c1C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000538749409 1041521417 /nfs/dbraw/zinc/52/14/17/1041521417.db2.gz LLSWZVGXVLBDRP-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3cccc(OCC)c3o2)C1 ZINC000540596483 1041552172 /nfs/dbraw/zinc/55/21/72/1041552172.db2.gz BBVPPGDGWVAGES-JKSUJKDBSA-N 2 1 330.472 4.214 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3cccc(OCC)c3o2)C1 ZINC000540596483 1041552178 /nfs/dbraw/zinc/55/21/78/1041552178.db2.gz BBVPPGDGWVAGES-JKSUJKDBSA-N 2 1 330.472 4.214 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cc(C)ccc1OC ZINC000538984302 1041600480 /nfs/dbraw/zinc/60/04/80/1041600480.db2.gz GDXSYYYVDBRRDH-FQEVSTJZSA-N 2 1 330.516 4.451 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000540915736 1041737191 /nfs/dbraw/zinc/73/71/91/1041737191.db2.gz LHCSUNFIYOXKKS-OXQOHEQNSA-N 2 1 328.887 4.361 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000540915736 1041737193 /nfs/dbraw/zinc/73/71/93/1041737193.db2.gz LHCSUNFIYOXKKS-OXQOHEQNSA-N 2 1 328.887 4.361 20 0 EIADMP C[C@@H](c1ccc(CN2[C@@H]3CC[C@H]2CC[N@@H+](C)C3)cc1)C(F)(F)F ZINC000517387881 1042000497 /nfs/dbraw/zinc/00/04/97/1042000497.db2.gz OULRQPKAOIGLST-RRQGHBQHSA-N 2 1 326.406 4.021 20 0 EIADMP C[C@@H](c1ccc(CN2[C@@H]3CC[C@H]2CC[N@H+](C)C3)cc1)C(F)(F)F ZINC000517387881 1042000505 /nfs/dbraw/zinc/00/05/05/1042000505.db2.gz OULRQPKAOIGLST-RRQGHBQHSA-N 2 1 326.406 4.021 20 0 EIADMP C[N@H+](Cc1ccc(Cl)cc1F)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000437992282 1042007474 /nfs/dbraw/zinc/00/74/74/1042007474.db2.gz ZOVQWPZWQQMYGX-UHFFFAOYSA-N 2 1 347.865 4.223 20 0 EIADMP FC1(F)CC(C[NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000425940697 1042017845 /nfs/dbraw/zinc/01/78/45/1042017845.db2.gz XNIPNMOUVJKIMA-VAMGGRTRSA-N 2 1 348.481 4.312 20 0 EIADMP c1ccc(OCCCCC[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000438132263 1042059684 /nfs/dbraw/zinc/05/96/84/1042059684.db2.gz YJQWRVYEXPEWEX-FQEVSTJZSA-N 2 1 330.516 4.044 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccn(C)n1 ZINC000541734613 1042087297 /nfs/dbraw/zinc/08/72/97/1042087297.db2.gz VZKFQRWUNBKVOL-HXUWFJFHSA-N 2 1 340.515 4.037 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccn(C)n1 ZINC000541734499 1042087766 /nfs/dbraw/zinc/08/77/66/1042087766.db2.gz LNYMHALGEZCIAP-FQEVSTJZSA-N 2 1 340.515 4.037 20 0 EIADMP C[C@@H](c1ccc(F)cc1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464832153 1042189242 /nfs/dbraw/zinc/18/92/42/1042189242.db2.gz BVJFWQIOWBYLJM-PKOBYXMFSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@@H](c1ccc(F)cc1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464832153 1042189247 /nfs/dbraw/zinc/18/92/47/1042189247.db2.gz BVJFWQIOWBYLJM-PKOBYXMFSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@@H](c1ccc(F)cc1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464832153 1042189255 /nfs/dbraw/zinc/18/92/55/1042189255.db2.gz BVJFWQIOWBYLJM-PKOBYXMFSA-N 2 1 326.459 4.341 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000509568717 1042378293 /nfs/dbraw/zinc/37/82/93/1042378293.db2.gz AQPAWXZSSNCHOF-HNNXBMFYSA-N 2 1 332.488 4.376 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000509568719 1042378761 /nfs/dbraw/zinc/37/87/61/1042378761.db2.gz AQPAWXZSSNCHOF-OAHLLOKOSA-N 2 1 332.488 4.376 20 0 EIADMP CC(C)(C)c1cccc(OCCC[NH+]2CCC([NH+]3CCCC3)CC2)c1 ZINC000303584592 1042479796 /nfs/dbraw/zinc/47/97/96/1042479796.db2.gz QAAMHTAPGUJVNB-UHFFFAOYSA-N 2 1 344.543 4.313 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)[C@@H](C)C1 ZINC000492335644 1042611972 /nfs/dbraw/zinc/61/19/72/1042611972.db2.gz SQMUEZOROOSWCW-MAUKXSAKSA-N 2 1 338.923 4.289 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1cccc(-c2ccncc2)c1)C1CCCCC1 ZINC000439466124 1042639195 /nfs/dbraw/zinc/63/91/95/1042639195.db2.gz GTLREUNRQYNNAM-UHFFFAOYSA-N 2 1 337.511 4.493 20 0 EIADMP CC[C@H](NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccc(F)cn1 ZINC000493278729 1042891808 /nfs/dbraw/zinc/89/18/08/1042891808.db2.gz VKLLLNWGLQMDIF-QOKNQOGYSA-N 2 1 347.503 4.406 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCCN(C)[C@@H]1c1cccs1)c1ccc(F)cn1 ZINC000493278729 1042891810 /nfs/dbraw/zinc/89/18/10/1042891810.db2.gz VKLLLNWGLQMDIF-QOKNQOGYSA-N 2 1 347.503 4.406 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@@H]1C ZINC000493282724 1042892413 /nfs/dbraw/zinc/89/24/13/1042892413.db2.gz TZGWWDYVRCVDTC-RDJZCZTQSA-N 2 1 338.923 4.432 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@@H]1C ZINC000493282724 1042892414 /nfs/dbraw/zinc/89/24/14/1042892414.db2.gz TZGWWDYVRCVDTC-RDJZCZTQSA-N 2 1 338.923 4.432 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@@H]1C ZINC000493282724 1042892418 /nfs/dbraw/zinc/89/24/18/1042892418.db2.gz TZGWWDYVRCVDTC-RDJZCZTQSA-N 2 1 338.923 4.432 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@@H]1C ZINC000493282724 1042892419 /nfs/dbraw/zinc/89/24/19/1042892419.db2.gz TZGWWDYVRCVDTC-RDJZCZTQSA-N 2 1 338.923 4.432 20 0 EIADMP c1cc(C[NH+]2CCCCC2)ccc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000520575619 1042899450 /nfs/dbraw/zinc/89/94/50/1042899450.db2.gz WNIPTQWPYKYQRX-FGZHOGPDSA-N 2 1 342.527 4.064 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)c1ccccc1 ZINC000089553125 1042957972 /nfs/dbraw/zinc/95/79/72/1042957972.db2.gz VLGCOSWJZFWEBE-QGZVFWFLSA-N 2 1 326.459 4.183 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)[C@H](OC)c2ccccc2)c1 ZINC000493905183 1042973525 /nfs/dbraw/zinc/97/35/25/1042973525.db2.gz HBVMIRPPKPMYKF-UTKZUKDTSA-N 2 1 326.484 4.004 20 0 EIADMP CCCC[N@@H+](CC)CCNC1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168008112 1043031381 /nfs/dbraw/zinc/03/13/81/1043031381.db2.gz CNYGBKDWAUXVMB-PMACEKPBSA-N 2 1 345.575 4.140 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183190822 1043039518 /nfs/dbraw/zinc/03/95/18/1043039518.db2.gz LYKCUHYJZVJLPS-HZSPNIEDSA-N 2 1 340.433 4.408 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183190822 1043039523 /nfs/dbraw/zinc/03/95/23/1043039523.db2.gz LYKCUHYJZVJLPS-HZSPNIEDSA-N 2 1 340.433 4.408 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(-n3cccn3)cc2)c1 ZINC000067450037 1043041665 /nfs/dbraw/zinc/04/16/65/1043041665.db2.gz ZHXSYLAVYGVLQO-UHFFFAOYSA-N 2 1 348.494 4.002 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168008299 1043044741 /nfs/dbraw/zinc/04/47/41/1043044741.db2.gz XFBLKTQKRAJEJF-UKBAYJJMSA-N 2 1 336.470 4.453 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310365543 1043132370 /nfs/dbraw/zinc/13/23/70/1043132370.db2.gz LZGXTHWSAHMIFR-PKOBYXMFSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310365543 1043132372 /nfs/dbraw/zinc/13/23/72/1043132372.db2.gz LZGXTHWSAHMIFR-PKOBYXMFSA-N 2 1 326.459 4.389 20 0 EIADMP Cc1cccc2c1[nH+]cc(C)c2N1CCC(Cc2[nH+]ccn2C)CC1 ZINC000185299112 1043171490 /nfs/dbraw/zinc/17/14/90/1043171490.db2.gz SYQRIVFYPRAVDU-UHFFFAOYSA-N 2 1 334.467 4.044 20 0 EIADMP Cc1cccc2c1[nH+]cc(C)c2N1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000185352470 1043175889 /nfs/dbraw/zinc/17/58/89/1043175889.db2.gz NGKAUNUREWFNJO-QGZVFWFLSA-N 2 1 334.467 4.044 20 0 EIADMP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2cc(O)cc(F)c2)CC1 ZINC000185467857 1043187351 /nfs/dbraw/zinc/18/73/51/1043187351.db2.gz SNWVPEVXUJZXDP-UHFFFAOYSA-N 2 1 342.458 4.053 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH+]3CCC([NH+](C)C)CC3)ccc21 ZINC000507995483 1043231154 /nfs/dbraw/zinc/23/11/54/1043231154.db2.gz SSMVJBRCQQWLLB-UHFFFAOYSA-N 2 1 335.495 4.340 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(F)cc2Cl)CCCC1 ZINC000427886277 1043249715 /nfs/dbraw/zinc/24/97/15/1043249715.db2.gz LOSFNZAAYVTJSF-KSSFIOAISA-N 2 1 338.898 4.221 20 0 EIADMP COc1cccc2cc(C[NH2+]CCCC[N@H+]3CCC[C@@H](C)C3)oc21 ZINC000727644195 1043254992 /nfs/dbraw/zinc/25/49/92/1043254992.db2.gz RTIPUKLCAKBDPG-MRXNPFEDSA-N 2 1 330.472 4.043 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000674005781 1043271603 /nfs/dbraw/zinc/27/16/03/1043271603.db2.gz OKTPLRBLDJJRIR-QAPCUYQASA-N 2 1 342.449 4.443 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000674005781 1043271613 /nfs/dbraw/zinc/27/16/13/1043271613.db2.gz OKTPLRBLDJJRIR-QAPCUYQASA-N 2 1 342.449 4.443 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000674005781 1043271622 /nfs/dbraw/zinc/27/16/22/1043271622.db2.gz OKTPLRBLDJJRIR-QAPCUYQASA-N 2 1 342.449 4.443 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(C(F)F)nc1 ZINC000631084663 1043283659 /nfs/dbraw/zinc/28/36/59/1043283659.db2.gz WRTGDHWRAZVEMM-MAUKXSAKSA-N 2 1 345.437 4.019 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(C(F)F)nc1 ZINC000631084663 1043283664 /nfs/dbraw/zinc/28/36/64/1043283664.db2.gz WRTGDHWRAZVEMM-MAUKXSAKSA-N 2 1 345.437 4.019 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCSCC1 ZINC000187191548 1043334241 /nfs/dbraw/zinc/33/42/41/1043334241.db2.gz WQNYIXPVFPSBAI-ZNDGOPKYSA-N 2 1 344.568 4.303 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657998973 1043419406 /nfs/dbraw/zinc/41/94/06/1043419406.db2.gz QHTMWQXWFPMAPL-AEFFLSMTSA-N 2 1 335.451 4.001 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657998973 1043419416 /nfs/dbraw/zinc/41/94/16/1043419416.db2.gz QHTMWQXWFPMAPL-AEFFLSMTSA-N 2 1 335.451 4.001 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000174992596 1043425518 /nfs/dbraw/zinc/42/55/18/1043425518.db2.gz RXWVFEUKJYKOPX-OAQYLSRUSA-N 2 1 326.459 4.443 20 0 EIADMP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000474033791 1043692748 /nfs/dbraw/zinc/69/27/48/1043692748.db2.gz LUTFVOUQTQHRJI-OXQOHEQNSA-N 2 1 330.516 4.128 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cnn1C(C)(C)C ZINC000191178247 1043787570 /nfs/dbraw/zinc/78/75/70/1043787570.db2.gz QVAHCMPZCNMFOT-IRXDYDNUSA-N 2 1 334.552 4.252 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000442789839 1043840498 /nfs/dbraw/zinc/84/04/98/1043840498.db2.gz HUQZYOFYFXAZQF-RXQRSOPUSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(C(F)F)CC1 ZINC000442789839 1043840499 /nfs/dbraw/zinc/84/04/99/1043840499.db2.gz HUQZYOFYFXAZQF-RXQRSOPUSA-N 2 1 336.470 4.311 20 0 EIADMP CC(C)(C)C[N@@H+]([C@@H]1Cc2cccc(Cl)c2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168707185 1043895581 /nfs/dbraw/zinc/89/55/81/1043895581.db2.gz KIVDCCYJOAYXGJ-BRWVUGGUSA-N 2 1 334.935 4.425 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCOC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000674910094 1043934300 /nfs/dbraw/zinc/93/43/00/1043934300.db2.gz ZVYMRMPLJIOGFN-ICSRJNTNSA-N 2 1 332.532 4.177 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)CCCOC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC000674910094 1043934327 /nfs/dbraw/zinc/93/43/27/1043934327.db2.gz ZVYMRMPLJIOGFN-ICSRJNTNSA-N 2 1 332.532 4.177 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)CCCOC(C)(C)C)CC[NH+]1Cc1ccccc1 ZINC000674910094 1043934342 /nfs/dbraw/zinc/93/43/42/1043934342.db2.gz ZVYMRMPLJIOGFN-ICSRJNTNSA-N 2 1 332.532 4.177 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCOC(C)(C)C)CC[NH+]1Cc1ccccc1 ZINC000674910094 1043934380 /nfs/dbraw/zinc/93/43/80/1043934380.db2.gz ZVYMRMPLJIOGFN-ICSRJNTNSA-N 2 1 332.532 4.177 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000193083078 1043997830 /nfs/dbraw/zinc/99/78/30/1043997830.db2.gz ONVNUEPEPHLNIJ-MRXNPFEDSA-N 2 1 334.916 4.056 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000193083078 1043997843 /nfs/dbraw/zinc/99/78/43/1043997843.db2.gz ONVNUEPEPHLNIJ-MRXNPFEDSA-N 2 1 334.916 4.056 20 0 EIADMP COc1ccc(C[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1OCC(C)C ZINC000521820853 1044010611 /nfs/dbraw/zinc/01/06/11/1044010611.db2.gz JEPIBFIRUMADOT-GOSISDBHSA-N 2 1 348.531 4.084 20 0 EIADMP COc1ccc(C[NH2+]CCC[N@H+]2CCCC[C@H]2C)cc1OCC(C)C ZINC000521820853 1044010622 /nfs/dbraw/zinc/01/06/22/1044010622.db2.gz JEPIBFIRUMADOT-GOSISDBHSA-N 2 1 348.531 4.084 20 0 EIADMP CCc1nc(C)c([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000195137264 1044027115 /nfs/dbraw/zinc/02/71/15/1044027115.db2.gz IPPMCUBVLGIEKT-CRAIPNDOSA-N 2 1 343.540 4.187 20 0 EIADMP Clc1cccc(Cl)c1CCC[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000193266997 1044029422 /nfs/dbraw/zinc/02/94/22/1044029422.db2.gz UNCJHBOGFRSGQT-UHFFFAOYSA-N 2 1 327.299 4.142 20 0 EIADMP CCSc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000765977014 1044248676 /nfs/dbraw/zinc/24/86/76/1044248676.db2.gz PGNTUBWUUPNAID-AEFFLSMTSA-N 2 1 348.556 4.093 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)cc1 ZINC000348035230 1044367786 /nfs/dbraw/zinc/36/77/86/1044367786.db2.gz DDJCSKIUEKJMJN-JXFKEZNVSA-N 2 1 329.488 4.019 20 0 EIADMP CCOc1ccc([C@@H](CC)N[C@@H]2CC[N@H+](CC3CC3)C2)cc1OCC ZINC000675833492 1044520860 /nfs/dbraw/zinc/52/08/60/1044520860.db2.gz KRUMSXBYLNEQSN-RTBURBONSA-N 2 1 346.515 4.009 20 0 EIADMP CCOc1ccc([C@@H](CC)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc1OCC ZINC000675833492 1044520874 /nfs/dbraw/zinc/52/08/74/1044520874.db2.gz KRUMSXBYLNEQSN-RTBURBONSA-N 2 1 346.515 4.009 20 0 EIADMP C[N@@H+](Cc1cc(Cl)cs1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000494925068 1044524094 /nfs/dbraw/zinc/52/40/94/1044524094.db2.gz PUXRRVGWJFKSKU-MRXNPFEDSA-N 2 1 334.916 4.355 20 0 EIADMP C[N@H+](Cc1cc(Cl)cs1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000494925068 1044524112 /nfs/dbraw/zinc/52/41/12/1044524112.db2.gz PUXRRVGWJFKSKU-MRXNPFEDSA-N 2 1 334.916 4.355 20 0 EIADMP C[NH+](Cc1cc(Cl)cs1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000494925068 1044524124 /nfs/dbraw/zinc/52/41/24/1044524124.db2.gz PUXRRVGWJFKSKU-MRXNPFEDSA-N 2 1 334.916 4.355 20 0 EIADMP C[NH+](Cc1cc(Cl)cs1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000494925068 1044524137 /nfs/dbraw/zinc/52/41/37/1044524137.db2.gz PUXRRVGWJFKSKU-MRXNPFEDSA-N 2 1 334.916 4.355 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCc3ccc(C(F)(F)F)cc3)CC[C@@H]21 ZINC000675897596 1044544090 /nfs/dbraw/zinc/54/40/90/1044544090.db2.gz HEQAPAHQZUHIOA-AEFFLSMTSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCc3ccc(C(F)(F)F)cc3)CC[C@@H]21 ZINC000675897596 1044544103 /nfs/dbraw/zinc/54/41/03/1044544103.db2.gz HEQAPAHQZUHIOA-AEFFLSMTSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCc3ccc(C(F)(F)F)cc3)CC[C@@H]21 ZINC000675897596 1044544116 /nfs/dbraw/zinc/54/41/16/1044544116.db2.gz HEQAPAHQZUHIOA-AEFFLSMTSA-N 2 1 340.433 4.054 20 0 EIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1cccs1 ZINC000675880283 1044552046 /nfs/dbraw/zinc/55/20/46/1044552046.db2.gz CUNAOOCJXCXTIH-QZTJIDSGSA-N 2 1 336.545 4.068 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(Cl)s1 ZINC000675880108 1044553007 /nfs/dbraw/zinc/55/30/07/1044553007.db2.gz BFKIJGVEYVYTMH-LSDHHAIUSA-N 2 1 342.936 4.086 20 0 EIADMP CC(C)Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000675882953 1044555077 /nfs/dbraw/zinc/55/50/77/1044555077.db2.gz VUICZTCSZLWQLP-GCJKJVERSA-N 2 1 344.543 4.179 20 0 EIADMP c1ccc(C[C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000480753800 1044582475 /nfs/dbraw/zinc/58/24/75/1044582475.db2.gz BUMSKTPRWUPYRM-DENIHFKCSA-N 2 1 326.528 4.252 20 0 EIADMP C[C@H]1CC([NH2+]C(C)(C)c2ccccn2)C[C@H](C)N1Cc1ccccc1 ZINC001168025315 1044645816 /nfs/dbraw/zinc/64/58/16/1044645816.db2.gz JIYBNMRSBPWCMS-ROUUACIJSA-N 2 1 337.511 4.348 20 0 EIADMP C[C@@H](C[NH2+]Cc1ccc(-c2c(F)cccc2F)o1)C[NH+]1CCCC1 ZINC000522378759 1044672430 /nfs/dbraw/zinc/67/24/30/1044672430.db2.gz KJQXSSWPGPVPKO-AWEZNQCLSA-N 2 1 334.410 4.046 20 0 EIADMP FC(F)(F)c1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000676712965 1044827875 /nfs/dbraw/zinc/82/78/75/1044827875.db2.gz VLCNDTOISKYXAR-CRAIPNDOSA-N 2 1 338.417 4.154 20 0 EIADMP FC(F)(F)c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000676712965 1044827879 /nfs/dbraw/zinc/82/78/79/1044827879.db2.gz VLCNDTOISKYXAR-CRAIPNDOSA-N 2 1 338.417 4.154 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CCC[C@]34CCCO4)CC[N@H+]2C2CC2)cc1 ZINC000895681779 1044850952 /nfs/dbraw/zinc/85/09/52/1044850952.db2.gz WNNRSOKNCYIFEI-ZDFPQIBNSA-N 2 1 340.511 4.046 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CCC[C@]34CCCO4)CC[N@@H+]2C2CC2)cc1 ZINC000895681779 1044850954 /nfs/dbraw/zinc/85/09/54/1044850954.db2.gz WNNRSOKNCYIFEI-ZDFPQIBNSA-N 2 1 340.511 4.046 20 0 EIADMP CCc1ccc([C@@H](CC(C)C)[NH2+]C2CC[NH+](CCOC)CC2)cc1 ZINC000671658796 1044891206 /nfs/dbraw/zinc/89/12/06/1044891206.db2.gz VTAPRZAOZWASOC-OAQYLSRUSA-N 2 1 332.532 4.037 20 0 EIADMP CCCCCOc1ccc(C[NH2+]C2CC[NH+](CC(C)C)CC2)cc1 ZINC000302928631 1044921231 /nfs/dbraw/zinc/92/12/31/1044921231.db2.gz FLKDAGLFZYYNGC-UHFFFAOYSA-N 2 1 332.532 4.466 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836941 1044982914 /nfs/dbraw/zinc/98/29/14/1044982914.db2.gz FIBCOBMCMXYNCX-QRQLOZEOSA-N 2 1 330.541 4.057 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836941 1044982932 /nfs/dbraw/zinc/98/29/32/1044982932.db2.gz FIBCOBMCMXYNCX-QRQLOZEOSA-N 2 1 330.541 4.057 20 0 EIADMP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000347913514 1044998533 /nfs/dbraw/zinc/99/85/33/1044998533.db2.gz AEMWYYDXMLOGKU-ROUUACIJSA-N 2 1 340.515 4.096 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cn2ccc(-c3cccs3)n2)CC1 ZINC000738067666 1045033000 /nfs/dbraw/zinc/03/30/00/1045033000.db2.gz NKDNYQLLTIGAQU-UHFFFAOYSA-N 2 1 346.544 4.013 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cn2ccc(-c3cccs3)n2)CC1 ZINC000738067666 1045033015 /nfs/dbraw/zinc/03/30/15/1045033015.db2.gz NKDNYQLLTIGAQU-UHFFFAOYSA-N 2 1 346.544 4.013 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CC(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000509069627 1045054626 /nfs/dbraw/zinc/05/46/26/1045054626.db2.gz LDCIJLFNCAIJGV-JTHBVZDNSA-N 2 1 334.507 4.235 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CC(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000509069627 1045054652 /nfs/dbraw/zinc/05/46/52/1045054652.db2.gz LDCIJLFNCAIJGV-JTHBVZDNSA-N 2 1 334.507 4.235 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CC(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000509069627 1045054666 /nfs/dbraw/zinc/05/46/66/1045054666.db2.gz LDCIJLFNCAIJGV-JTHBVZDNSA-N 2 1 334.507 4.235 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2Cc3ccccc32)CC1 ZINC000671746653 1045179372 /nfs/dbraw/zinc/17/93/72/1045179372.db2.gz QJQZRYNZIPPSIU-HWELCPFYSA-N 2 1 334.507 4.359 20 0 EIADMP C[C@@H](CC[NH2+]Cc1scnc1C1CC1)[N@H+](C)Cc1ccccc1 ZINC000487306718 1045226326 /nfs/dbraw/zinc/22/63/26/1045226326.db2.gz HPGSUWALRGYUPB-HNNXBMFYSA-N 2 1 329.513 4.021 20 0 EIADMP C[C@@H](CC[NH2+]Cc1scnc1C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000487306718 1045226333 /nfs/dbraw/zinc/22/63/33/1045226333.db2.gz HPGSUWALRGYUPB-HNNXBMFYSA-N 2 1 329.513 4.021 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3ccc(C)cc3)cc2)C1 ZINC000236823222 1045367615 /nfs/dbraw/zinc/36/76/15/1045367615.db2.gz SISYZVMZWKMAIR-NRFANRHFSA-N 2 1 338.495 4.005 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc3c2OC(C)(C)C3)c1 ZINC000236880879 1045369574 /nfs/dbraw/zinc/36/95/74/1045369574.db2.gz CDKQCJGQHPFSAA-UHFFFAOYSA-N 2 1 338.495 4.142 20 0 EIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(c2nc(C(C)(C)C)cs2)CC1 ZINC000762916607 1045413797 /nfs/dbraw/zinc/41/37/97/1045413797.db2.gz HWQGDZUPHFBGPS-UHFFFAOYSA-N 2 1 346.544 4.215 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccnc(Cl)c2)cc1F ZINC000153718044 1045460589 /nfs/dbraw/zinc/46/05/89/1045460589.db2.gz UPWXHAJWVUQRGA-LBPRGKRZSA-N 2 1 344.821 4.219 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000398025058 1045823718 /nfs/dbraw/zinc/82/37/18/1045823718.db2.gz CATARXGKWSWIJB-NPPFBWRTSA-N 2 1 338.495 4.256 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000398025058 1045823719 /nfs/dbraw/zinc/82/37/19/1045823719.db2.gz CATARXGKWSWIJB-NPPFBWRTSA-N 2 1 338.495 4.256 20 0 EIADMP Cc1ccc(C[N@@H+](C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(C)n1 ZINC000248557745 1045869807 /nfs/dbraw/zinc/86/98/07/1045869807.db2.gz LQHVYDXNLADJGO-AVRDEDQJSA-N 2 1 337.511 4.183 20 0 EIADMP Cc1ccc(C[N@H+](C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(C)n1 ZINC000248557745 1045869809 /nfs/dbraw/zinc/86/98/09/1045869809.db2.gz LQHVYDXNLADJGO-AVRDEDQJSA-N 2 1 337.511 4.183 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cncc3ccccc32)C1 ZINC000769148843 1045883489 /nfs/dbraw/zinc/88/34/89/1045883489.db2.gz TZMAOXHUIXPEAV-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cncc3ccccc32)C1 ZINC000769148843 1045883496 /nfs/dbraw/zinc/88/34/96/1045883496.db2.gz TZMAOXHUIXPEAV-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cncc3ccccc32)C1 ZINC000769148843 1045883493 /nfs/dbraw/zinc/88/34/93/1045883493.db2.gz TZMAOXHUIXPEAV-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cncc3ccccc32)C1 ZINC000769148843 1045883503 /nfs/dbraw/zinc/88/35/03/1045883503.db2.gz TZMAOXHUIXPEAV-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP CCC[N@@H+]1CCc2c(N)sc(Nc3ccc4[nH]c(C)[nH+]c4c3)c2C1 ZINC001213073421 1045959988 /nfs/dbraw/zinc/95/99/88/1045959988.db2.gz ORSWUZDKENCRGG-UHFFFAOYSA-N 2 1 341.484 4.027 20 0 EIADMP CCC[N@H+]1CCc2c(N)sc(Nc3ccc4[nH]c(C)[nH+]c4c3)c2C1 ZINC001213073421 1045959997 /nfs/dbraw/zinc/95/99/97/1045959997.db2.gz ORSWUZDKENCRGG-UHFFFAOYSA-N 2 1 341.484 4.027 20 0 EIADMP Cn1cccc1C[NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000161747753 1046030826 /nfs/dbraw/zinc/03/08/26/1046030826.db2.gz JQDYPHHKPYDOSX-UHFFFAOYSA-N 2 1 325.500 4.079 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@H](C)c3ccc(C)c(C)c3)CC2)nc(C)[nH+]1 ZINC000162259306 1046153512 /nfs/dbraw/zinc/15/35/12/1046153512.db2.gz MGWWQIZQKJPJHS-QGZVFWFLSA-N 2 1 338.499 4.030 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000125437970 1046309319 /nfs/dbraw/zinc/30/93/19/1046309319.db2.gz IYTNHHAOABRGCQ-UHFFFAOYSA-N 2 1 325.378 4.123 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1ccccc1C(F)(F)F ZINC000125437970 1046309335 /nfs/dbraw/zinc/30/93/35/1046309335.db2.gz IYTNHHAOABRGCQ-UHFFFAOYSA-N 2 1 325.378 4.123 20 0 EIADMP c1csc([C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C2CC2)c1 ZINC000125869117 1046360695 /nfs/dbraw/zinc/36/06/95/1046360695.db2.gz LJUXKGFQTQWQLM-HXUWFJFHSA-N 2 1 326.509 4.453 20 0 EIADMP C[C@H]([NH2+]CCc1cc(F)ccc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710417 1046363106 /nfs/dbraw/zinc/36/31/06/1046363106.db2.gz MXRSPFQFWTUGES-QFBILLFUSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@@H](NC1(c2ccccc2F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508717798 1046374190 /nfs/dbraw/zinc/37/41/90/1046374190.db2.gz IBOBXUSGNOHDRE-IEBWSBKVSA-N 2 1 338.470 4.315 20 0 EIADMP C[C@@H]([NH2+]C1(c2ccccc2F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508717798 1046374207 /nfs/dbraw/zinc/37/42/07/1046374207.db2.gz IBOBXUSGNOHDRE-IEBWSBKVSA-N 2 1 338.470 4.315 20 0 EIADMP C[C@@H]([NH2+]C1(c2ccccc2F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508717798 1046374227 /nfs/dbraw/zinc/37/42/27/1046374227.db2.gz IBOBXUSGNOHDRE-IEBWSBKVSA-N 2 1 338.470 4.315 20 0 EIADMP CC(C)=CCC[C@@H](C)CC[NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1 ZINC000916839990 1046384728 /nfs/dbraw/zinc/38/47/28/1046384728.db2.gz VIWPYABZPOVNNG-QGZVFWFLSA-N 2 1 326.488 4.438 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508722731 1046426226 /nfs/dbraw/zinc/42/62/26/1046426226.db2.gz UGQANSABYXSSDN-HKUYNNGSSA-N 2 1 328.525 4.099 20 0 EIADMP Cc1[nH+]ccc(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1Cl ZINC000497251757 1046517918 /nfs/dbraw/zinc/51/79/18/1046517918.db2.gz ZWHMYUZBWDUWEV-DYVFJYSZSA-N 2 1 335.904 4.022 20 0 EIADMP C[C@@H](C[NH2+]C1CC[NH+](C2CC2)CC1)c1c(Cl)cccc1Cl ZINC000459400555 1046597575 /nfs/dbraw/zinc/59/75/75/1046597575.db2.gz MPOZQEPELXBVRC-LBPRGKRZSA-N 2 1 327.299 4.313 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cc(C)c(C)cc2OC(F)F)C[C@@H]1C ZINC000536662082 1046632317 /nfs/dbraw/zinc/63/23/17/1046632317.db2.gz NSCXMZUIAFZNCO-RDJZCZTQSA-N 2 1 340.458 4.209 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CCN(Cc2ccccc2OC2CCCC2)C1 ZINC000536664512 1046635086 /nfs/dbraw/zinc/63/50/86/1046635086.db2.gz OSWBFBCINSPOKI-GOSISDBHSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2OC2CCCC2)C1 ZINC000536664512 1046635098 /nfs/dbraw/zinc/63/50/98/1046635098.db2.gz OSWBFBCINSPOKI-GOSISDBHSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2OC2CCCC2)C1 ZINC000536664512 1046635106 /nfs/dbraw/zinc/63/51/06/1046635106.db2.gz OSWBFBCINSPOKI-GOSISDBHSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2OC2CCCC2)C1 ZINC000536664512 1046635116 /nfs/dbraw/zinc/63/51/16/1046635116.db2.gz OSWBFBCINSPOKI-GOSISDBHSA-N 2 1 330.516 4.172 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2OC2CCCC2)C1 ZINC000536664512 1046635126 /nfs/dbraw/zinc/63/51/26/1046635126.db2.gz OSWBFBCINSPOKI-GOSISDBHSA-N 2 1 330.516 4.172 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1cccc(Br)c1 ZINC000127322057 1046649076 /nfs/dbraw/zinc/64/90/76/1046649076.db2.gz ZDRIGNCSAIXETF-CYBMUJFWSA-N 2 1 336.277 4.037 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1cccc(Br)c1 ZINC000127322057 1046649085 /nfs/dbraw/zinc/64/90/85/1046649085.db2.gz ZDRIGNCSAIXETF-CYBMUJFWSA-N 2 1 336.277 4.037 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)CC2)[nH+]c1 ZINC000127365626 1046657037 /nfs/dbraw/zinc/65/70/37/1046657037.db2.gz GBJCZTRKKSVJRG-TZIWHRDSSA-N 2 1 335.495 4.285 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+]C/C=C\c2ccc(OCc3ccccc3)cc2)CC1 ZINC000459459376 1046697125 /nfs/dbraw/zinc/69/71/25/1046697125.db2.gz HKMIXVYQPAXEBN-YVMONPNESA-N 2 1 348.490 4.130 20 0 EIADMP C[C@H]1C[C@H](NCc2ccc(F)cc2F)CC[N@H+]1Cc1ccccc1 ZINC000379622201 1046715479 /nfs/dbraw/zinc/71/54/79/1046715479.db2.gz GEOHMLPKQHEPCZ-HNAYVOBHSA-N 2 1 330.422 4.108 20 0 EIADMP C[N@H+](C/C=C\c1ccccc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000536729687 1046726699 /nfs/dbraw/zinc/72/66/99/1046726699.db2.gz MQOLZXHQMDDQOX-YVMONPNESA-N 2 1 335.495 4.333 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(C)nc2ccccc12 ZINC000191485111 1046733791 /nfs/dbraw/zinc/73/37/91/1046733791.db2.gz QPLWKVGYGIZGCX-UHFFFAOYSA-N 2 1 336.483 4.214 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(C)nc2ccccc12 ZINC000191485111 1046733808 /nfs/dbraw/zinc/73/38/08/1046733808.db2.gz QPLWKVGYGIZGCX-UHFFFAOYSA-N 2 1 336.483 4.214 20 0 EIADMP CCOc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379643034 1046738210 /nfs/dbraw/zinc/73/82/10/1046738210.db2.gz ASJQLZYYGUZDMV-NQIIRXRSSA-N 2 1 338.495 4.228 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3cc(F)ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000379644787 1046738864 /nfs/dbraw/zinc/73/88/64/1046738864.db2.gz CPYLNOWWZTYXQS-BSLALVQMSA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3cc(F)ccc32)CC[N@H+]1Cc1ccccc1 ZINC000379644787 1046738877 /nfs/dbraw/zinc/73/88/77/1046738877.db2.gz CPYLNOWWZTYXQS-BSLALVQMSA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCCC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000379651227 1046744219 /nfs/dbraw/zinc/74/42/19/1046744219.db2.gz UJEQNTIMWVEJHV-QRQLOZEOSA-N 2 1 336.470 4.455 20 0 EIADMP Clc1ccc([C@H](C[NH2+]C2CC[NH+](C3CC3)CC2)OCC2CC2)cc1 ZINC000459543280 1046765950 /nfs/dbraw/zinc/76/59/50/1046765950.db2.gz LJCQJKQQVLPRNI-FQEVSTJZSA-N 2 1 348.918 4.024 20 0 EIADMP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000536855973 1046826183 /nfs/dbraw/zinc/82/61/83/1046826183.db2.gz CVIQTDCLMNLHJN-MXNKGDRCSA-N 2 1 344.543 4.110 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(Br)c(F)c2)CC1 ZINC000536866122 1046832968 /nfs/dbraw/zinc/83/29/68/1046832968.db2.gz ZQPXQKGCPKULLH-GFCCVEGCSA-N 2 1 343.284 4.112 20 0 EIADMP CC(C)[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000536961940 1046870597 /nfs/dbraw/zinc/87/05/97/1046870597.db2.gz VMVPKWCRSKGGDB-BEFAXECRSA-N 2 1 345.487 4.085 20 0 EIADMP COc1ccc([C@H]([NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)C2CC2)cc1 ZINC000536946954 1046877792 /nfs/dbraw/zinc/87/77/92/1046877792.db2.gz BRUZMNDYWFAMTK-DYESRHJHSA-N 2 1 330.516 4.248 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459796844 1046893623 /nfs/dbraw/zinc/89/36/23/1046893623.db2.gz WLKVQCLGSLPSTE-ASNKMWSDSA-N 2 1 338.442 4.013 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H](CCc2ccccc2)Cc2ccccc2)CC1 ZINC000537303055 1047084909 /nfs/dbraw/zinc/08/49/09/1047084909.db2.gz AYRWSNIBIVMHFT-HSZRJFAPSA-N 2 1 334.507 4.082 20 0 EIADMP CC[NH+](CC)CCC[N@H+]1CCCCC[C@@H]1C[C@H](O)c1cccs1 ZINC000788482681 1047214895 /nfs/dbraw/zinc/21/48/95/1047214895.db2.gz QLFJBWRDWADLMA-MSOLQXFVSA-N 2 1 338.561 4.148 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCSC(F)(F)F)CC1 ZINC000788556961 1047221948 /nfs/dbraw/zinc/22/19/48/1047221948.db2.gz IHGATWPWKTUVRJ-UHFFFAOYSA-N 2 1 346.462 4.272 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2OCc2ccccc2)[C@H](C)C1 ZINC000536853815 1047390190 /nfs/dbraw/zinc/39/01/90/1047390190.db2.gz VKXIFJNBZJUDMT-NQIIRXRSSA-N 2 1 338.495 4.086 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccccc2OCc2ccccc2)[C@H](C)C1 ZINC000536853815 1047390200 /nfs/dbraw/zinc/39/02/00/1047390200.db2.gz VKXIFJNBZJUDMT-NQIIRXRSSA-N 2 1 338.495 4.086 20 0 EIADMP Cn1ccnc1[C@H]1CCCN(Cc2nc(C3CCCCC3)cs2)C1 ZINC000444799589 1047422738 /nfs/dbraw/zinc/42/27/38/1047422738.db2.gz SROYVBJTBJQQQM-INIZCTEOSA-N 2 1 344.528 4.304 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c(C)o1 ZINC000556064121 1047429260 /nfs/dbraw/zinc/42/92/60/1047429260.db2.gz UCCNHDDYVMBLGJ-YLJYHZDGSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)c(C)o1 ZINC000556064121 1047429266 /nfs/dbraw/zinc/42/92/66/1047429266.db2.gz UCCNHDDYVMBLGJ-YLJYHZDGSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](Cc1ccccc1Cl)C1CC1 ZINC000556077240 1047434747 /nfs/dbraw/zinc/43/47/47/1047434747.db2.gz VDCNXXPBFVAICB-IFXJQAMLSA-N 2 1 331.891 4.092 20 0 EIADMP CCOc1cccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000556117625 1047471433 /nfs/dbraw/zinc/47/14/33/1047471433.db2.gz FDVVGCMEOKRENS-IFMALSPDSA-N 2 1 338.495 4.053 20 0 EIADMP CCOc1cccc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000556117625 1047471435 /nfs/dbraw/zinc/47/14/35/1047471435.db2.gz FDVVGCMEOKRENS-IFMALSPDSA-N 2 1 338.495 4.053 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCNc2ccccc2F)C[C@H]1c1ccccc1 ZINC000556172914 1047537757 /nfs/dbraw/zinc/53/77/57/1047537757.db2.gz CQLNYDPZCBFJIV-NQIIRXRSSA-N 2 1 341.474 4.053 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCNc2ccccc2F)C[C@H]1c1ccccc1 ZINC000556172914 1047537767 /nfs/dbraw/zinc/53/77/67/1047537767.db2.gz CQLNYDPZCBFJIV-NQIIRXRSSA-N 2 1 341.474 4.053 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C1(C)C ZINC000556179634 1047542852 /nfs/dbraw/zinc/54/28/52/1047542852.db2.gz URIJMELPMOVCGE-YSTOQKLRSA-N 2 1 330.516 4.004 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C1(C)C ZINC000556179634 1047542855 /nfs/dbraw/zinc/54/28/55/1047542855.db2.gz URIJMELPMOVCGE-YSTOQKLRSA-N 2 1 330.516 4.004 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccncc1F ZINC000556235915 1047601264 /nfs/dbraw/zinc/60/12/64/1047601264.db2.gz IXFBLOYHXLPPMN-QGZVFWFLSA-N 2 1 341.474 4.448 20 0 EIADMP 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 1047604194 /nfs/dbraw/zinc/60/41/94/1047604194.db2.gz IJXZORJHTHZLMA-DSXGEBMQSA-N 2 1 341.326 4.415 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](c2ccncc2)C2CC2)cc1 ZINC000898319482 1047610797 /nfs/dbraw/zinc/61/07/97/1047610797.db2.gz GLOODLNQEZTNMK-BTYIYWSLSA-N 2 1 332.451 4.378 20 0 EIADMP CC(C)C[C@H](CCO)C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000556261901 1047633383 /nfs/dbraw/zinc/63/33/83/1047633383.db2.gz OWMBPSSFUJPHOU-HWELCPFYSA-N 2 1 346.559 4.064 20 0 EIADMP C[C@@H](Nc1cccc2cc[nH+]cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000537526049 1047668186 /nfs/dbraw/zinc/66/81/86/1047668186.db2.gz PCZLUUXOBRCZKJ-MRXNPFEDSA-N 2 1 335.451 4.348 20 0 EIADMP CC(C)[NH+]1CCC([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000556407444 1047740120 /nfs/dbraw/zinc/74/01/20/1047740120.db2.gz RPOFSMZOEARNHC-UHFFFAOYSA-N 2 1 349.931 4.426 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCOC2CCCCC2)C[C@H]1c1ccccc1 ZINC000550606701 1047758123 /nfs/dbraw/zinc/75/81/23/1047758123.db2.gz JGPMDDKYJJKDPV-CTNGQTDRSA-N 2 1 330.516 4.151 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCOC2CCCCC2)C[C@H]1c1ccccc1 ZINC000550606701 1047758129 /nfs/dbraw/zinc/75/81/29/1047758129.db2.gz JGPMDDKYJJKDPV-CTNGQTDRSA-N 2 1 330.516 4.151 20 0 EIADMP Cc1ccccc1[C@H](O)C[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000763435122 1047791311 /nfs/dbraw/zinc/79/13/11/1047791311.db2.gz ZJBLMAGGRXMRJD-SIKLNZKXSA-N 2 1 344.543 4.005 20 0 EIADMP CC(C)[NH2+]C1CC[NH+](CCCOc2ccc3ccccc3c2)CC1 ZINC000108369787 1047800056 /nfs/dbraw/zinc/80/00/56/1047800056.db2.gz MQYOUPGRHLWHOQ-UHFFFAOYSA-N 2 1 326.484 4.071 20 0 EIADMP C[C@H]1C[C@H](N(C)Cc2cnc(-c3ccc(Cl)cc3)s2)CC[N@H+]1C ZINC000556598244 1047834166 /nfs/dbraw/zinc/83/41/66/1047834166.db2.gz IWCZBWCXMXAXIZ-XJKSGUPXSA-N 2 1 349.931 4.378 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2cnc(-c3ccc(Cl)cc3)s2)CCN1C ZINC000556598244 1047834168 /nfs/dbraw/zinc/83/41/68/1047834168.db2.gz IWCZBWCXMXAXIZ-XJKSGUPXSA-N 2 1 349.931 4.378 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cnc(-c3ccc(Cl)cc3)s2)CCN1C ZINC000556598244 1047834170 /nfs/dbraw/zinc/83/41/70/1047834170.db2.gz IWCZBWCXMXAXIZ-XJKSGUPXSA-N 2 1 349.931 4.378 20 0 EIADMP Cc1ccc2c(C[N@H+]3C[C@H]4C[NH+](Cc5ccccc5)C[C@H]4C3)c[nH]c2c1 ZINC001136974646 1048005712 /nfs/dbraw/zinc/00/57/12/1048005712.db2.gz HGKGXOOEZPEDRP-OYRHEFFESA-N 2 1 345.490 4.040 20 0 EIADMP Cc1ccc2c(C[NH+]3C[C@H]4C[N@H+](Cc5ccccc5)C[C@H]4C3)c[nH]c2c1 ZINC001136974646 1048005728 /nfs/dbraw/zinc/00/57/28/1048005728.db2.gz HGKGXOOEZPEDRP-OYRHEFFESA-N 2 1 345.490 4.040 20 0 EIADMP Cc1ccc2c(C[NH+]3C[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]4C3)c[nH]c2c1 ZINC001136974646 1048005745 /nfs/dbraw/zinc/00/57/45/1048005745.db2.gz HGKGXOOEZPEDRP-OYRHEFFESA-N 2 1 345.490 4.040 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@H]3CCC[C@@H]4C[C@@H]43)cc2)CC1 ZINC000825033143 1048021191 /nfs/dbraw/zinc/02/11/91/1048021191.db2.gz IERATDXUQFARJL-QMMLZNLJSA-N 2 1 327.516 4.065 20 0 EIADMP FC1(F)CC([NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000556887848 1048100795 /nfs/dbraw/zinc/10/07/95/1048100795.db2.gz MGQXTUWWPAZQGA-BHIYHBOVSA-N 2 1 334.454 4.065 20 0 EIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170755457 1048109138 /nfs/dbraw/zinc/10/91/38/1048109138.db2.gz BSVCCCSJIMCBAZ-MZADTFQBSA-N 2 1 326.528 4.408 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCc2ccccc2[C@@H](c2ccccc2)[C@H]1C ZINC000499052835 1048129047 /nfs/dbraw/zinc/12/90/47/1048129047.db2.gz DKRBEDBZSYQVIC-WZONZLPQSA-N 2 1 345.490 4.270 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCc2ccccc2[C@@H](c2ccccc2)[C@H]1C ZINC000499052835 1048129055 /nfs/dbraw/zinc/12/90/55/1048129055.db2.gz DKRBEDBZSYQVIC-WZONZLPQSA-N 2 1 345.490 4.270 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCc2ccccc2[C@@H](c2ccccc2)[C@@H]1C ZINC000499052832 1048129106 /nfs/dbraw/zinc/12/91/06/1048129106.db2.gz DKRBEDBZSYQVIC-FDDCHVKYSA-N 2 1 345.490 4.270 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCc2ccccc2[C@@H](c2ccccc2)[C@@H]1C ZINC000499052832 1048129113 /nfs/dbraw/zinc/12/91/13/1048129113.db2.gz DKRBEDBZSYQVIC-FDDCHVKYSA-N 2 1 345.490 4.270 20 0 EIADMP Fc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1F ZINC000499140734 1048341998 /nfs/dbraw/zinc/34/19/98/1048341998.db2.gz XMKONWYVMFFMKN-LDLYASANSA-N 2 1 342.433 4.250 20 0 EIADMP Fc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1F ZINC000499140734 1048342008 /nfs/dbraw/zinc/34/20/08/1048342008.db2.gz XMKONWYVMFFMKN-LDLYASANSA-N 2 1 342.433 4.250 20 0 EIADMP CCc1nc(C(C)C)ccc1C[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000815106919 1048346734 /nfs/dbraw/zinc/34/67/34/1048346734.db2.gz GFXCMGDGRKRYNO-UHFFFAOYSA-N 2 1 329.532 4.075 20 0 EIADMP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000815622219 1048547568 /nfs/dbraw/zinc/54/75/68/1048547568.db2.gz PRERQPXJGDLASI-HKUYNNGSSA-N 2 1 326.459 4.307 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3ccccc3)C2)[C@H](C)C1 ZINC000133313413 1048703065 /nfs/dbraw/zinc/70/30/65/1048703065.db2.gz REHZEMRASDYTNT-ZDFPQIBNSA-N 2 1 344.543 4.049 20 0 EIADMP c1ccc2c(c1)OCCC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000133462967 1048726781 /nfs/dbraw/zinc/72/67/81/1048726781.db2.gz WVASOQBMDQUOSJ-HXUWFJFHSA-N 2 1 328.500 4.287 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)c(F)c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001137654282 1048762715 /nfs/dbraw/zinc/76/27/15/1048762715.db2.gz IMZXLXNTBFQEJR-SFHVURJKSA-N 2 1 346.877 4.433 20 0 EIADMP C[N@H+](Cc1ccc(Cl)c(F)c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001137654282 1048762729 /nfs/dbraw/zinc/76/27/29/1048762729.db2.gz IMZXLXNTBFQEJR-SFHVURJKSA-N 2 1 346.877 4.433 20 0 EIADMP C[NH+](Cc1ccc(Cl)c(F)c1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001137654282 1048762744 /nfs/dbraw/zinc/76/27/44/1048762744.db2.gz IMZXLXNTBFQEJR-SFHVURJKSA-N 2 1 346.877 4.433 20 0 EIADMP C[NH+](Cc1ccc(Cl)c(F)c1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001137654282 1048762761 /nfs/dbraw/zinc/76/27/61/1048762761.db2.gz IMZXLXNTBFQEJR-SFHVURJKSA-N 2 1 346.877 4.433 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC[C@@]1(C)C[C@@]1(F)Cl ZINC000846188815 1048838676 /nfs/dbraw/zinc/83/86/76/1048838676.db2.gz JTERVABTEPDIAM-BVBHFADKSA-N 2 1 338.898 4.191 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000816598703 1048840136 /nfs/dbraw/zinc/84/01/36/1048840136.db2.gz MUNIRBODMVBASH-XDJHFCHBSA-N 2 1 342.527 4.044 20 0 EIADMP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@@H+](CCCCCC[NH3+])C1 ZINC000846220941 1048843812 /nfs/dbraw/zinc/84/38/12/1048843812.db2.gz ZXBIOLDGFXECJA-SFHVURJKSA-N 2 1 342.531 4.316 20 0 EIADMP CC(C)CC1(C)CC[NH+](Cc2ccc(C[NH+]3CCOCC3)cc2)CC1 ZINC001170837123 1048849644 /nfs/dbraw/zinc/84/96/44/1048849644.db2.gz VJTQGWIEDBKREL-UHFFFAOYSA-N 2 1 344.543 4.167 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1csc(-c2ccccc2)n1 ZINC000817948198 1049064533 /nfs/dbraw/zinc/06/45/33/1049064533.db2.gz GCFTXEBQSAHTEL-OAHLLOKOSA-N 2 1 337.492 4.162 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Cl)sc1Cl ZINC000817947672 1049064871 /nfs/dbraw/zinc/06/48/71/1049064871.db2.gz FLCWIDRZALDPPL-JTQLQIEISA-N 2 1 329.296 4.407 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H](C[NH3+])CC(C)C)ccc1SC(F)F ZINC000817958193 1049065708 /nfs/dbraw/zinc/06/57/08/1049065708.db2.gz INHRBFAXTGRZCA-WCQYABFASA-N 2 1 332.460 4.034 20 0 EIADMP CCCC[C@@H](C[NH3+])[NH2+][C@H](C)c1ccc(SC(F)F)c(OC)c1 ZINC000817963093 1049068155 /nfs/dbraw/zinc/06/81/55/1049068155.db2.gz MXWQOLUDUIVXQQ-YPMHNXCESA-N 2 1 332.460 4.178 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911483 1049186682 /nfs/dbraw/zinc/18/66/82/1049186682.db2.gz XVGNEPOUFJKNKL-KBAYOESNSA-N 2 1 332.919 4.322 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000818962629 1049217097 /nfs/dbraw/zinc/21/70/97/1049217097.db2.gz UZRNXIHUAMGQNO-FQEVSTJZSA-N 2 1 346.902 4.003 20 0 EIADMP Fc1ccc2c(NC[C@@H]3CC[N@@H+](CCc4ccccc4)C3)cc[nH+]c2c1 ZINC000078695525 1049272355 /nfs/dbraw/zinc/27/23/55/1049272355.db2.gz RQLZTUKQILXIOB-SFHVURJKSA-N 2 1 349.453 4.350 20 0 EIADMP CCO[C@@H](CC[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C(C)C ZINC000348095192 1049414053 /nfs/dbraw/zinc/41/40/53/1049414053.db2.gz JREUFDBLXRZNML-JXFKEZNVSA-N 2 1 329.488 4.283 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H](c2ccccc2)N(C)C)cc1 ZINC000348130217 1049438810 /nfs/dbraw/zinc/43/88/10/1049438810.db2.gz KFVCIDKKHZTKJJ-VGSWGCGISA-N 2 1 348.494 4.134 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc3[nH]ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000080338884 1049579999 /nfs/dbraw/zinc/57/99/99/1049579999.db2.gz XORJODDTUXQPOY-YLJYHZDGSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cccc3[nH]ccc32)CC[N@H+]1Cc1ccccc1 ZINC000080338884 1049580014 /nfs/dbraw/zinc/58/00/14/1049580014.db2.gz XORJODDTUXQPOY-YLJYHZDGSA-N 2 1 333.479 4.311 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccccc2Oc2cccnc2)[C@H](C)C1 ZINC000081096781 1049624451 /nfs/dbraw/zinc/62/44/51/1049624451.db2.gz AWSHODHLRMKYBK-YLJYHZDGSA-N 2 1 339.483 4.036 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2Oc2cccnc2)[C@H](C)C1 ZINC000081096781 1049624457 /nfs/dbraw/zinc/62/44/57/1049624457.db2.gz AWSHODHLRMKYBK-YLJYHZDGSA-N 2 1 339.483 4.036 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2Oc2cccnc2)[C@H](C)C1 ZINC000081096781 1049624464 /nfs/dbraw/zinc/62/44/64/1049624464.db2.gz AWSHODHLRMKYBK-YLJYHZDGSA-N 2 1 339.483 4.036 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2Oc2cccnc2)[C@H](C)C1 ZINC000081096781 1049624480 /nfs/dbraw/zinc/62/44/80/1049624480.db2.gz AWSHODHLRMKYBK-YLJYHZDGSA-N 2 1 339.483 4.036 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccccc2Oc2cccnc2)[C@@H](C)C1 ZINC000245412718 1049710342 /nfs/dbraw/zinc/71/03/42/1049710342.db2.gz AWSHODHLRMKYBK-PXNSSMCTSA-N 2 1 339.483 4.036 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccccc2Oc2cccnc2)[C@@H](C)C1 ZINC000245412718 1049710359 /nfs/dbraw/zinc/71/03/59/1049710359.db2.gz AWSHODHLRMKYBK-PXNSSMCTSA-N 2 1 339.483 4.036 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2Oc2cccnc2)[C@@H](C)C1 ZINC000245412718 1049710375 /nfs/dbraw/zinc/71/03/75/1049710375.db2.gz AWSHODHLRMKYBK-PXNSSMCTSA-N 2 1 339.483 4.036 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706774 1049775774 /nfs/dbraw/zinc/77/57/74/1049775774.db2.gz MACDXJRERGAPMZ-GBESFXJTSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706774 1049775779 /nfs/dbraw/zinc/77/57/79/1049775779.db2.gz MACDXJRERGAPMZ-GBESFXJTSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706774 1049775786 /nfs/dbraw/zinc/77/57/86/1049775786.db2.gz MACDXJRERGAPMZ-GBESFXJTSA-N 2 1 348.481 4.161 20 0 EIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@H](C)CCc2ccc(C)cc2)CC1 ZINC001171672946 1049776188 /nfs/dbraw/zinc/77/61/88/1049776188.db2.gz UWRPQAYPTGHTSG-GOSISDBHSA-N 2 1 337.511 4.259 20 0 EIADMP Cc1ccc2c(CC[NH3+])cn([C@@H]3C[C@H](C)[N@H+](Cc4ccccc4)C3)c2c1 ZINC001171724860 1049784656 /nfs/dbraw/zinc/78/46/56/1049784656.db2.gz DBGBJUKWAUSABI-GHTZIAJQSA-N 2 1 347.506 4.286 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+]([C@@H]2Cc3cccc(F)c3C2)C2CCCCC2)CC1 ZINC001171786024 1049804689 /nfs/dbraw/zinc/80/46/89/1049804689.db2.gz WNEXOCXEPJGJGN-BHIYHBOVSA-N 2 1 330.491 4.198 20 0 EIADMP C[N@@H+]([C@H]1Cc2cccc(F)c2C1)C1CC[NH+](C2CCCCC2)CC1 ZINC001171812147 1049809483 /nfs/dbraw/zinc/80/94/83/1049809483.db2.gz LIXFTXGDHWSXSL-IBGZPJMESA-N 2 1 330.491 4.022 20 0 EIADMP Cc1ncccc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000813790225 1049816295 /nfs/dbraw/zinc/81/62/95/1049816295.db2.gz KQSLYPZDXVNEIY-FRIKZZABSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ncccc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813790225 1049816299 /nfs/dbraw/zinc/81/62/99/1049816299.db2.gz KQSLYPZDXVNEIY-FRIKZZABSA-N 2 1 335.495 4.065 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001171960693 1049824064 /nfs/dbraw/zinc/82/40/64/1049824064.db2.gz GIPFZLBHSJRLMR-PILAGYSTSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001171960693 1049824066 /nfs/dbraw/zinc/82/40/66/1049824066.db2.gz GIPFZLBHSJRLMR-PILAGYSTSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+](CC2CCC2)C1 ZINC001171963551 1049825503 /nfs/dbraw/zinc/82/55/03/1049825503.db2.gz IFQYZULHJHIAIP-KSSFIOAISA-N 2 1 340.433 4.100 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001171963551 1049825509 /nfs/dbraw/zinc/82/55/09/1049825509.db2.gz IFQYZULHJHIAIP-KSSFIOAISA-N 2 1 340.433 4.100 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2ccc(F)cc2)CC[N@H+]1Cc1ccccc1 ZINC001171966221 1049826475 /nfs/dbraw/zinc/82/64/75/1049826475.db2.gz UGHPQZJAGMRFAY-HXUWFJFHSA-N 2 1 326.459 4.359 20 0 EIADMP CC(C)([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171965726 1049826820 /nfs/dbraw/zinc/82/68/20/1049826820.db2.gz QSTXATSDXWUEGV-HXUWFJFHSA-N 2 1 337.511 4.350 20 0 EIADMP CC[NH+](CC)C1CC[NH+]([C@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171974382 1049835648 /nfs/dbraw/zinc/83/56/48/1049835648.db2.gz SZJDWRFETSTYIW-OAHLLOKOSA-N 2 1 342.449 4.443 20 0 EIADMP CC[NH+]1CCC([N@H+](C)[C@@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171973612 1049836335 /nfs/dbraw/zinc/83/63/35/1049836335.db2.gz LKACSWTUIXMCCV-AWEZNQCLSA-N 2 1 328.422 4.053 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)[C@@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171973612 1049836336 /nfs/dbraw/zinc/83/63/36/1049836336.db2.gz LKACSWTUIXMCCV-AWEZNQCLSA-N 2 1 328.422 4.053 20 0 EIADMP CC1(C)C[C@@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CCO1 ZINC001171978674 1049838418 /nfs/dbraw/zinc/83/84/18/1049838418.db2.gz IJPMVEBTECYQFG-VQTJNVASSA-N 2 1 344.543 4.224 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CC[C@]3(C2)CCCCO3)CC[N@H+]1Cc1ccccc1 ZINC001171981734 1049838630 /nfs/dbraw/zinc/83/86/30/1049838630.db2.gz NGCUDPYJFMHABE-UNMCSNQZSA-N 2 1 342.527 4.075 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CC[C@]3(C2)CCCCO3)CC[NH+]1Cc1ccccc1 ZINC001171981734 1049838634 /nfs/dbraw/zinc/83/86/34/1049838634.db2.gz NGCUDPYJFMHABE-UNMCSNQZSA-N 2 1 342.527 4.075 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CC[C@]3(C2)CCCCO3)CC[NH+]1Cc1ccccc1 ZINC001171981734 1049838636 /nfs/dbraw/zinc/83/86/36/1049838636.db2.gz NGCUDPYJFMHABE-UNMCSNQZSA-N 2 1 342.527 4.075 20 0 EIADMP COCC[C@@H]1CCCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984113 1049840330 /nfs/dbraw/zinc/84/03/30/1049840330.db2.gz ICURRNLFHPMSIM-LEWJYISDSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@@H]1CCCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984113 1049840332 /nfs/dbraw/zinc/84/03/32/1049840332.db2.gz ICURRNLFHPMSIM-LEWJYISDSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@@H]1CCCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984113 1049840335 /nfs/dbraw/zinc/84/03/35/1049840335.db2.gz ICURRNLFHPMSIM-LEWJYISDSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@@H]1CCCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984113 1049840338 /nfs/dbraw/zinc/84/03/38/1049840338.db2.gz ICURRNLFHPMSIM-LEWJYISDSA-N 2 1 344.543 4.321 20 0 EIADMP C[N@@H+](C[C@@H]1CCCCO1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076438 1049843853 /nfs/dbraw/zinc/84/38/53/1049843853.db2.gz YOKNTWVFPLFCQJ-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP C[NH+](C[C@@H]1CCCCO1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076438 1049843859 /nfs/dbraw/zinc/84/38/59/1049843859.db2.gz YOKNTWVFPLFCQJ-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP C[NH+](C[C@@H]1CCCCO1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076438 1049843861 /nfs/dbraw/zinc/84/38/61/1049843861.db2.gz YOKNTWVFPLFCQJ-CBPXPLCBSA-N 2 1 342.527 4.073 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@@H]2CCc4ncccc42)C3)cc1 ZINC001172077021 1049845638 /nfs/dbraw/zinc/84/56/38/1049845638.db2.gz OGECTQHXZGKJCB-ISHFTEKXSA-N 2 1 347.506 4.244 20 0 EIADMP CC(C)O[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172082432 1049847890 /nfs/dbraw/zinc/84/78/90/1049847890.db2.gz JWBQXKNRWMHQCY-CLAROIROSA-N 2 1 342.527 4.071 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@H](Sc3ccc(F)cc3)C1)C2 ZINC001172127695 1049852441 /nfs/dbraw/zinc/85/24/41/1049852441.db2.gz JKAXFLHWPPWBSE-ZMMAXQRCSA-N 2 1 334.504 4.007 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@H](Sc3ccc(F)cc3)C1)C2 ZINC001172127695 1049852442 /nfs/dbraw/zinc/85/24/42/1049852442.db2.gz JKAXFLHWPPWBSE-ZMMAXQRCSA-N 2 1 334.504 4.007 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CC[C@H](Sc3ccc(F)cc3)C1)C2 ZINC001172127695 1049852445 /nfs/dbraw/zinc/85/24/45/1049852445.db2.gz JKAXFLHWPPWBSE-ZMMAXQRCSA-N 2 1 334.504 4.007 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CC[C@H](Sc3ccc(F)cc3)C1)C2 ZINC001172127695 1049852449 /nfs/dbraw/zinc/85/24/49/1049852449.db2.gz JKAXFLHWPPWBSE-ZMMAXQRCSA-N 2 1 334.504 4.007 20 0 EIADMP COC[C@H]1CCCC[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069317 1049852467 /nfs/dbraw/zinc/85/24/67/1049852467.db2.gz PAQSLIMHGKMSRJ-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@H]1CCCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069317 1049852468 /nfs/dbraw/zinc/85/24/68/1049852468.db2.gz PAQSLIMHGKMSRJ-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@H]1CCCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069317 1049852471 /nfs/dbraw/zinc/85/24/71/1049852471.db2.gz PAQSLIMHGKMSRJ-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP COC[C@H]1CCCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069317 1049852474 /nfs/dbraw/zinc/85/24/74/1049852474.db2.gz PAQSLIMHGKMSRJ-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Sc3ccccc3)CC1)C2 ZINC001172127430 1049852519 /nfs/dbraw/zinc/85/25/19/1049852519.db2.gz JHGLIQHVIOQLES-BCDXTJNWSA-N 2 1 330.541 4.258 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Sc3ccccc3)CC1)C2 ZINC001172127430 1049852520 /nfs/dbraw/zinc/85/25/20/1049852520.db2.gz JHGLIQHVIOQLES-BCDXTJNWSA-N 2 1 330.541 4.258 20 0 EIADMP C[C@H]1C[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)CC[C@@]1(C)c1cccc(O)c1 ZINC001172125390 1049852584 /nfs/dbraw/zinc/85/25/84/1049852584.db2.gz QIEHTUBWBPJDJW-ZTPQHHQPSA-N 2 1 342.527 4.007 20 0 EIADMP C[C@H]1C[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)CC[C@@]1(C)c1cccc(O)c1 ZINC001172125390 1049852585 /nfs/dbraw/zinc/85/25/85/1049852585.db2.gz QIEHTUBWBPJDJW-ZTPQHHQPSA-N 2 1 342.527 4.007 20 0 EIADMP C[C@H]1C[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)CC[C@@]1(C)c1cccc(O)c1 ZINC001172125390 1049852587 /nfs/dbraw/zinc/85/25/87/1049852587.db2.gz QIEHTUBWBPJDJW-ZTPQHHQPSA-N 2 1 342.527 4.007 20 0 EIADMP C[C@H]1C[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CC[C@@]1(C)c1cccc(O)c1 ZINC001172125390 1049852590 /nfs/dbraw/zinc/85/25/90/1049852590.db2.gz QIEHTUBWBPJDJW-ZTPQHHQPSA-N 2 1 342.527 4.007 20 0 EIADMP C[C@]1(F)CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070159 1049853262 /nfs/dbraw/zinc/85/32/62/1049853262.db2.gz XJQQPBWAQDWCRD-BQJUDKOJSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@]1(F)CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070159 1049853265 /nfs/dbraw/zinc/85/32/65/1049853265.db2.gz XJQQPBWAQDWCRD-BQJUDKOJSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@]1(F)CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070159 1049853266 /nfs/dbraw/zinc/85/32/66/1049853266.db2.gz XJQQPBWAQDWCRD-BQJUDKOJSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@]1(F)CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070159 1049853269 /nfs/dbraw/zinc/85/32/69/1049853269.db2.gz XJQQPBWAQDWCRD-BQJUDKOJSA-N 2 1 330.491 4.396 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129290 1049854559 /nfs/dbraw/zinc/85/45/59/1049854559.db2.gz YBJQTXAQHPUBPY-AJYBTWMASA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129290 1049854563 /nfs/dbraw/zinc/85/45/63/1049854563.db2.gz YBJQTXAQHPUBPY-AJYBTWMASA-N 2 1 348.918 4.199 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129290 1049854565 /nfs/dbraw/zinc/85/45/65/1049854565.db2.gz YBJQTXAQHPUBPY-AJYBTWMASA-N 2 1 348.918 4.199 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@H](Oc3ccc(Cl)cc3)C1)C2 ZINC001172129290 1049854569 /nfs/dbraw/zinc/85/45/69/1049854569.db2.gz YBJQTXAQHPUBPY-AJYBTWMASA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@]3(CCc4c3cccc4F)C1)C2 ZINC001172133615 1049855126 /nfs/dbraw/zinc/85/51/26/1049855126.db2.gz UACFFLSCCOQYKS-WYADAEROSA-N 2 1 342.502 4.121 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@]3(CCc4c3cccc4F)C1)C2 ZINC001172133615 1049855129 /nfs/dbraw/zinc/85/51/29/1049855129.db2.gz UACFFLSCCOQYKS-WYADAEROSA-N 2 1 342.502 4.121 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@]3(CCc4c3cccc4F)C1)C2 ZINC001172133615 1049855132 /nfs/dbraw/zinc/85/51/32/1049855132.db2.gz UACFFLSCCOQYKS-WYADAEROSA-N 2 1 342.502 4.121 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H](CCc3ccccc3)C1)C2 ZINC001172134696 1049855148 /nfs/dbraw/zinc/85/51/48/1049855148.db2.gz YPGCDIDIDBVSNK-KJJMTIBFSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H](CCc3ccccc3)C1)C2 ZINC001172134696 1049855150 /nfs/dbraw/zinc/85/51/50/1049855150.db2.gz YPGCDIDIDBVSNK-KJJMTIBFSA-N 2 1 326.528 4.347 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H](CCc3ccccc3)C1)C2 ZINC001172134696 1049855152 /nfs/dbraw/zinc/85/51/52/1049855152.db2.gz YPGCDIDIDBVSNK-KJJMTIBFSA-N 2 1 326.528 4.347 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@H](CCc3ccccc3)C1)C2 ZINC001172134696 1049855153 /nfs/dbraw/zinc/85/51/53/1049855153.db2.gz YPGCDIDIDBVSNK-KJJMTIBFSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108401 1049856324 /nfs/dbraw/zinc/85/63/24/1049856324.db2.gz AAORPMLCJSBXIZ-CIAFKFPVSA-N 2 1 342.527 4.149 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108401 1049856329 /nfs/dbraw/zinc/85/63/29/1049856329.db2.gz AAORPMLCJSBXIZ-CIAFKFPVSA-N 2 1 342.527 4.149 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC3(CCCc4ccccc43)CC1)C2 ZINC001172120678 1049858253 /nfs/dbraw/zinc/85/82/53/1049858253.db2.gz LMJOYVGRJXWKGW-AERCQKQUSA-N 2 1 338.539 4.372 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1c3ccccc3-c3ccccc31)C2 ZINC001172112053 1049858606 /nfs/dbraw/zinc/85/86/06/1049858606.db2.gz ZUUZKOADQZRZLS-BCDXTJNWSA-N 2 1 332.491 4.404 20 0 EIADMP Cc1ccc2c(C[C@@H](C)[NH3+])cn([C@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)c2c1 ZINC001172113283 1049858858 /nfs/dbraw/zinc/85/88/58/1049858858.db2.gz BTLIXCVKTDMHAZ-YSHGAJCASA-N 2 1 325.500 4.027 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](N[C@H](c1ccccc1)[C@@H]([NH3+])c1ccccc1)C2 ZINC001172119426 1049859032 /nfs/dbraw/zinc/85/90/32/1049859032.db2.gz ZQJMJDQJRVPUSB-MFKCLSPESA-N 2 1 349.522 4.033 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1cc(C(C)(C)C[NH3+])c3ccccc31)C2 ZINC001172114069 1049859042 /nfs/dbraw/zinc/85/90/42/1049859042.db2.gz LSIOAIAKBMDSFN-FVQHAEBGSA-N 2 1 325.500 4.065 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCc3ccc(C(F)(F)F)cc3C1)C2 ZINC001172124217 1049859949 /nfs/dbraw/zinc/85/99/49/1049859949.db2.gz JNQPZJLAOGCIAF-PIIMJCKOSA-N 2 1 338.417 4.079 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCc3ccc(C(F)(F)F)cc3C1)C2 ZINC001172124217 1049859951 /nfs/dbraw/zinc/85/99/51/1049859951.db2.gz JNQPZJLAOGCIAF-PIIMJCKOSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCc3ccc(C(F)(F)F)cc3C1)C2 ZINC001172124217 1049859955 /nfs/dbraw/zinc/85/99/55/1049859955.db2.gz JNQPZJLAOGCIAF-PIIMJCKOSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCc3ccc(C(F)(F)F)cc3C1)C2 ZINC001172124217 1049859958 /nfs/dbraw/zinc/85/99/58/1049859958.db2.gz JNQPZJLAOGCIAF-PIIMJCKOSA-N 2 1 338.417 4.079 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)O3)CC1 ZINC001172222424 1049867596 /nfs/dbraw/zinc/86/75/96/1049867596.db2.gz GYVYKSLWZMVFOA-LJRDSGNISA-N 2 1 348.918 4.122 20 0 EIADMP COCCC[NH+]1CCC([NH2+][C@@H](CC2CCC2)c2ccccc2F)CC1 ZINC001172248480 1049872421 /nfs/dbraw/zinc/87/24/21/1049872421.db2.gz KATJZQZVAKKDON-NRFANRHFSA-N 2 1 348.506 4.148 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C[C@@H]1C ZINC001172375051 1049884538 /nfs/dbraw/zinc/88/45/38/1049884538.db2.gz BSPJXIGMVIFUHO-FGSXEWAUSA-N 2 1 326.528 4.334 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C[C@@H]1C ZINC001172375051 1049884542 /nfs/dbraw/zinc/88/45/42/1049884542.db2.gz BSPJXIGMVIFUHO-FGSXEWAUSA-N 2 1 326.528 4.334 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001172340450 1049888519 /nfs/dbraw/zinc/88/85/19/1049888519.db2.gz KBARCGNPTXHPAJ-MOPGFXCFSA-N 2 1 332.532 4.177 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC001172347911 1049891366 /nfs/dbraw/zinc/89/13/66/1049891366.db2.gz GGMBHGFWEAHNSE-JKBKZWBZSA-N 2 1 332.532 4.080 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC001172347911 1049891368 /nfs/dbraw/zinc/89/13/68/1049891368.db2.gz GGMBHGFWEAHNSE-JKBKZWBZSA-N 2 1 332.532 4.080 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C ZINC001172353461 1049893216 /nfs/dbraw/zinc/89/32/16/1049893216.db2.gz XAHPKWRBVBHRPK-JBPLPALLSA-N 2 1 346.559 4.328 20 0 EIADMP CCOCC[C@H](C)[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001172427388 1049900837 /nfs/dbraw/zinc/90/08/37/1049900837.db2.gz OVETZYOVSGKTGP-FQEVSTJZSA-N 2 1 344.543 4.180 20 0 EIADMP CC(C)COCC[C@@H](C)[NH+]1CCC([NH3+])(c2cccc(Cl)c2)CC1 ZINC001172469200 1049909345 /nfs/dbraw/zinc/90/93/45/1049909345.db2.gz SQSVQTJUOHUYFC-MRXNPFEDSA-N 2 1 338.923 4.041 20 0 EIADMP CC[N@H+](Cc1ccccc1)C1CC[NH+]([C@H](C)CCOC(C)C)CC1 ZINC001172447084 1049915153 /nfs/dbraw/zinc/91/51/53/1049915153.db2.gz AMKFOBVDLXRFCK-LJQANCHMSA-N 2 1 332.532 4.177 20 0 EIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H](C)CCOC(C)C)CC1 ZINC001172447084 1049915155 /nfs/dbraw/zinc/91/51/55/1049915155.db2.gz AMKFOBVDLXRFCK-LJQANCHMSA-N 2 1 332.532 4.177 20 0 EIADMP CC(C)COCC[C@@H](C)[NH+]1CCC([NH3+])(c2ccc(Cl)cc2)CC1 ZINC001172466810 1049919449 /nfs/dbraw/zinc/91/94/49/1049919449.db2.gz GAGPUIVQQGXIGC-MRXNPFEDSA-N 2 1 338.923 4.041 20 0 EIADMP Cc1ccc[nH+]c1N([C@H]1CC[C@@H](c2ccccc2)C1)C1CC[NH2+]CC1 ZINC001172564484 1049934380 /nfs/dbraw/zinc/93/43/80/1049934380.db2.gz HEQLUMFJDBCEKQ-CTNGQTDRSA-N 2 1 335.495 4.285 20 0 EIADMP CC(C)([NH3+])CC[NH2+]CCC(C)(C)[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172535809 1049942746 /nfs/dbraw/zinc/94/27/46/1049942746.db2.gz JKIORAYWSZSHDZ-UXHICEINSA-N 3 1 345.575 4.188 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc3ccccc3n2)C1 ZINC000246359613 1049959936 /nfs/dbraw/zinc/95/99/36/1049959936.db2.gz IKJYYYGWWKPGAV-MSOLQXFVSA-N 2 1 325.500 4.253 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc3ccccc3n2)C1 ZINC000246359613 1049959942 /nfs/dbraw/zinc/95/99/42/1049959942.db2.gz IKJYYYGWWKPGAV-MSOLQXFVSA-N 2 1 325.500 4.253 20 0 EIADMP Cc1nccnc1[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000249208292 1050094450 /nfs/dbraw/zinc/09/44/50/1050094450.db2.gz WXTIOXPRGQORKZ-SJLPKXTDSA-N 2 1 338.499 4.010 20 0 EIADMP Clc1cc2c(c(Cl)c1)CC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000089695999 1050128704 /nfs/dbraw/zinc/12/87/04/1050128704.db2.gz PRPLALUPGOEJQE-GTNSWQLSSA-N 2 1 325.283 4.055 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc3ccccc3)C1)CC2 ZINC001172825422 1050166626 /nfs/dbraw/zinc/16/66/26/1050166626.db2.gz GXKYYGRURNLFIJ-URXFXBBRSA-N 2 1 348.534 4.354 20 0 EIADMP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2cccc(C(F)(F)F)c2)C1 ZINC001177294002 1050176861 /nfs/dbraw/zinc/17/68/61/1050176861.db2.gz CCZLGWZCTAJBAP-GJZGRUSLSA-N 2 1 328.422 4.163 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1csc(Br)c1 ZINC001177299146 1050180615 /nfs/dbraw/zinc/18/06/15/1050180615.db2.gz LAFJZRFRBSIZTR-CYBMUJFWSA-N 2 1 345.350 4.255 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C/C=C\c1cccc(F)c1 ZINC001177277631 1050186204 /nfs/dbraw/zinc/18/62/04/1050186204.db2.gz MMMMAQVIWXRCNU-CLFYSBASSA-N 2 1 326.459 4.469 20 0 EIADMP C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001172849777 1050189087 /nfs/dbraw/zinc/18/90/87/1050189087.db2.gz PNGUXNBKNGAPCJ-HUUCEWRRSA-N 2 1 326.887 4.251 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCc3ccccc3CC2)cc1F ZINC001177454366 1050212457 /nfs/dbraw/zinc/21/24/57/1050212457.db2.gz PHVMKNQKSLWYCL-UHFFFAOYSA-N 2 1 349.453 4.357 20 0 EIADMP C[C@H](CSc1ccc(Cl)cc1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC001172876082 1050216468 /nfs/dbraw/zinc/21/64/68/1050216468.db2.gz VZSSATJYUCOIDV-HUUCEWRRSA-N 2 1 326.937 4.142 20 0 EIADMP C[C@H](CSc1ccc(Cl)cc1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC001172879497 1050220166 /nfs/dbraw/zinc/22/01/66/1050220166.db2.gz NVXATUXQJVMKDJ-CQSZACIVSA-N 2 1 326.937 4.094 20 0 EIADMP C[C@@H](CSc1ccc(Cl)cc1)n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001172881815 1050223832 /nfs/dbraw/zinc/22/38/32/1050223832.db2.gz KXMNSFMRQINSHR-ZDUSSCGKSA-N 2 1 335.904 4.357 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+]CC(C)(C)[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC001177483483 1050225994 /nfs/dbraw/zinc/22/59/94/1050225994.db2.gz UIWLSEXDLPHBAY-MSOLQXFVSA-N 2 1 332.532 4.116 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+]CC(C)(C)[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001177483483 1050226008 /nfs/dbraw/zinc/22/60/08/1050226008.db2.gz UIWLSEXDLPHBAY-MSOLQXFVSA-N 2 1 332.532 4.116 20 0 EIADMP CO[C@H]1CCC[C@H]([N@@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)C1 ZINC001172943936 1050243476 /nfs/dbraw/zinc/24/34/76/1050243476.db2.gz VGVRMMORFWDIIV-NXQKYAITSA-N 2 1 342.527 4.055 20 0 EIADMP CO[C@H]1CCC[C@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@H+](C)C(C)C)[C@H]3C2)C1 ZINC001172943936 1050243493 /nfs/dbraw/zinc/24/34/93/1050243493.db2.gz VGVRMMORFWDIIV-NXQKYAITSA-N 2 1 342.527 4.055 20 0 EIADMP CO[C@H]1CCC[C@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@@H+](C)C(C)C)[C@H]3C2)C1 ZINC001172943936 1050243507 /nfs/dbraw/zinc/24/35/07/1050243507.db2.gz VGVRMMORFWDIIV-NXQKYAITSA-N 2 1 342.527 4.055 20 0 EIADMP CC(C)[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)c1ccccc1 ZINC000091265859 1050244195 /nfs/dbraw/zinc/24/41/95/1050244195.db2.gz SCLNWOKDKGKXOA-JOCHJYFZSA-N 2 1 338.495 4.006 20 0 EIADMP CCCOC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC001173096504 1050287488 /nfs/dbraw/zinc/28/74/88/1050287488.db2.gz QAOCHVRUGAUAAI-DZVQBONVSA-N 2 1 344.543 4.224 20 0 EIADMP CCCOC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC001173096504 1050287504 /nfs/dbraw/zinc/28/75/04/1050287504.db2.gz QAOCHVRUGAUAAI-DZVQBONVSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCOC2CCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001177875314 1050310544 /nfs/dbraw/zinc/31/05/44/1050310544.db2.gz JBRIEZCOVIHZLR-FPOVZHCZSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCOC2CCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001177875314 1050310559 /nfs/dbraw/zinc/31/05/59/1050310559.db2.gz JBRIEZCOVIHZLR-FPOVZHCZSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCOC2CCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001177875310 1050311279 /nfs/dbraw/zinc/31/12/79/1050311279.db2.gz JBRIEZCOVIHZLR-CTNGQTDRSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCOC2CCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001177875310 1050311283 /nfs/dbraw/zinc/31/12/83/1050311283.db2.gz JBRIEZCOVIHZLR-CTNGQTDRSA-N 2 1 344.543 4.369 20 0 EIADMP C[C@H]1CCCC[C@H]1CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001177860132 1050317400 /nfs/dbraw/zinc/31/74/00/1050317400.db2.gz RMLREGNFDYWCCW-FPOVZHCZSA-N 2 1 328.544 4.500 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2CC[C@@H](C)SC2)C[N@H+]1Cc1ccccc1 ZINC001178207160 1050404444 /nfs/dbraw/zinc/40/44/44/1050404444.db2.gz APOXJDJCPXDXKK-JYBIWHBTSA-N 2 1 332.557 4.161 20 0 EIADMP CCSC[C@@H](C)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001173306367 1050404647 /nfs/dbraw/zinc/40/46/47/1050404647.db2.gz TYUONFRNQPHAMP-GOSISDBHSA-N 2 1 332.557 4.116 20 0 EIADMP CC(C)([NH3+])CC[NH2+]CCC(C)(C)[NH2+][C@@H]1CCCC2(CCCCC2)C1 ZINC001173338636 1050428470 /nfs/dbraw/zinc/42/84/70/1050428470.db2.gz BODDESKZZWOBDK-GOSISDBHSA-N 3 1 337.596 4.355 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC001178284841 1050428950 /nfs/dbraw/zinc/42/89/50/1050428950.db2.gz CTZVDLJPZFNAEF-RJGXRXQPSA-N 2 1 334.507 4.385 20 0 EIADMP CCSC[C@H](C)[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001173316897 1050439272 /nfs/dbraw/zinc/43/92/72/1050439272.db2.gz ZXJXFAKGJBTVDR-ICSRJNTNSA-N 2 1 332.557 4.116 20 0 EIADMP CCSC[C@H](C)[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001173316897 1050439279 /nfs/dbraw/zinc/43/92/79/1050439279.db2.gz ZXJXFAKGJBTVDR-ICSRJNTNSA-N 2 1 332.557 4.116 20 0 EIADMP CCSC[C@H](C)[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001173316897 1050439287 /nfs/dbraw/zinc/43/92/87/1050439287.db2.gz ZXJXFAKGJBTVDR-ICSRJNTNSA-N 2 1 332.557 4.116 20 0 EIADMP CCSC[C@@H](C)[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001173316899 1050440062 /nfs/dbraw/zinc/44/00/62/1050440062.db2.gz ZXJXFAKGJBTVDR-UYAOXDASSA-N 2 1 332.557 4.116 20 0 EIADMP CCSC[C@@H](C)[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001173316899 1050440064 /nfs/dbraw/zinc/44/00/64/1050440064.db2.gz ZXJXFAKGJBTVDR-UYAOXDASSA-N 2 1 332.557 4.116 20 0 EIADMP CCSC[C@@H](C)[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001173316899 1050440068 /nfs/dbraw/zinc/44/00/68/1050440068.db2.gz ZXJXFAKGJBTVDR-UYAOXDASSA-N 2 1 332.557 4.116 20 0 EIADMP Cc1ccccc1N(C)c1ccc(C[N@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)cc1 ZINC001206200336 1050455436 /nfs/dbraw/zinc/45/54/36/1050455436.db2.gz RDIFAKHMJAFRJT-PMACEKPBSA-N 2 1 341.474 4.024 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC[C@H]1CCC[N@H+]1C ZINC001173540377 1050475998 /nfs/dbraw/zinc/47/59/98/1050475998.db2.gz WMLPRIWYNPAOML-DZGCQCFKSA-N 2 1 329.315 4.388 20 0 EIADMP CN(C)c1cc[nH+]cc1C[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC001178478448 1050480808 /nfs/dbraw/zinc/48/08/08/1050480808.db2.gz ZBJBNXQWIAFXLI-UHFFFAOYSA-N 2 1 345.437 4.027 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001173553721 1050481615 /nfs/dbraw/zinc/48/16/15/1050481615.db2.gz XZAUYNIFUIXASL-BMFZPTHFSA-N 2 1 341.326 4.198 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1C[C@H]2CC[N@H+](C)C[C@H]2C1 ZINC001173553721 1050481619 /nfs/dbraw/zinc/48/16/19/1050481619.db2.gz XZAUYNIFUIXASL-BMFZPTHFSA-N 2 1 341.326 4.198 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1C[C@H]2CC[N@@H+](C)C[C@H]2C1 ZINC001173553721 1050481624 /nfs/dbraw/zinc/48/16/24/1050481624.db2.gz XZAUYNIFUIXASL-BMFZPTHFSA-N 2 1 341.326 4.198 20 0 EIADMP CC[C@H]1CCC[C@@H]1C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001178748941 1050542727 /nfs/dbraw/zinc/54/27/27/1050542727.db2.gz XLBDKKXEAVXVIK-RBUKOAKNSA-N 2 1 332.507 4.249 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CCN(C/C(Cl)=C\Cl)CC1 ZINC000763521800 1050619449 /nfs/dbraw/zinc/61/94/49/1050619449.db2.gz WBZYVDCEIRWLHZ-GZTJUZNOSA-N 2 1 327.299 4.149 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000763521800 1050619453 /nfs/dbraw/zinc/61/94/53/1050619453.db2.gz WBZYVDCEIRWLHZ-GZTJUZNOSA-N 2 1 327.299 4.149 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000763521800 1050619457 /nfs/dbraw/zinc/61/94/57/1050619457.db2.gz WBZYVDCEIRWLHZ-GZTJUZNOSA-N 2 1 327.299 4.149 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccccc2N(C)C)c1 ZINC000093943470 1050724599 /nfs/dbraw/zinc/72/45/99/1050724599.db2.gz HTUKOQPYQCKDGL-GOSISDBHSA-N 2 1 339.527 4.444 20 0 EIADMP CCO[C@H](C[NH2+]Cc1ccccc1-c1ccc(C)cc1C)C[NH+](C)C ZINC001179559356 1050725018 /nfs/dbraw/zinc/72/50/18/1050725018.db2.gz GOHYIMIKYFHBDS-HXUWFJFHSA-N 2 1 340.511 4.027 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CCC(C)(C)CO2)CC[N@@H+]1Cc1ccccc1 ZINC001179686363 1050747918 /nfs/dbraw/zinc/74/79/18/1050747918.db2.gz WMJLIOHKNRRLEQ-GIVPXCGWSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CCC(C)(C)CO2)CC[N@H+]1Cc1ccccc1 ZINC001179686363 1050747933 /nfs/dbraw/zinc/74/79/33/1050747933.db2.gz WMJLIOHKNRRLEQ-GIVPXCGWSA-N 2 1 344.543 4.224 20 0 EIADMP CCc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)o1 ZINC001179771409 1050767283 /nfs/dbraw/zinc/76/72/83/1050767283.db2.gz CNEBXRAPLJGOCQ-HSALFYBXSA-N 2 1 338.495 4.232 20 0 EIADMP COc1ccc(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1C(C)(C)C ZINC001180081956 1050877473 /nfs/dbraw/zinc/87/74/73/1050877473.db2.gz OUESVORYAKDYRS-LJQANCHMSA-N 2 1 344.543 4.156 20 0 EIADMP COc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1C(C)(C)C ZINC001180081956 1050877481 /nfs/dbraw/zinc/87/74/81/1050877481.db2.gz OUESVORYAKDYRS-LJQANCHMSA-N 2 1 344.543 4.156 20 0 EIADMP COc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1C(C)(C)C ZINC001180081956 1050877486 /nfs/dbraw/zinc/87/74/86/1050877486.db2.gz OUESVORYAKDYRS-LJQANCHMSA-N 2 1 344.543 4.156 20 0 EIADMP COc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1C(C)(C)C ZINC001180081956 1050877491 /nfs/dbraw/zinc/87/74/91/1050877491.db2.gz OUESVORYAKDYRS-LJQANCHMSA-N 2 1 344.543 4.156 20 0 EIADMP COc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1C(C)(C)C ZINC001180081956 1050877497 /nfs/dbraw/zinc/87/74/97/1050877497.db2.gz OUESVORYAKDYRS-LJQANCHMSA-N 2 1 344.543 4.156 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC001180097711 1050886742 /nfs/dbraw/zinc/88/67/42/1050886742.db2.gz GQUOPMRGVOSDNQ-QGZVFWFLSA-N 2 1 328.422 4.320 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC001180097711 1050886755 /nfs/dbraw/zinc/88/67/55/1050886755.db2.gz GQUOPMRGVOSDNQ-QGZVFWFLSA-N 2 1 328.422 4.320 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC001180097711 1050886760 /nfs/dbraw/zinc/88/67/60/1050886760.db2.gz GQUOPMRGVOSDNQ-QGZVFWFLSA-N 2 1 328.422 4.320 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC001180097711 1050886761 /nfs/dbraw/zinc/88/67/61/1050886761.db2.gz GQUOPMRGVOSDNQ-QGZVFWFLSA-N 2 1 328.422 4.320 20 0 EIADMP Cc1c[nH+]ccc1Nc1cccc2c1C[N@@H+](C)C[C@@H]2c1ccccc1 ZINC001174539261 1051031791 /nfs/dbraw/zinc/03/17/91/1051031791.db2.gz ZYAMRGYSWWXDOW-LJQANCHMSA-N 2 1 329.447 4.133 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000414155137 1051144307 /nfs/dbraw/zinc/14/43/07/1051144307.db2.gz MNQPZASKSYZUIG-QIJUGHKUSA-N 2 1 337.511 4.218 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000414155137 1051144311 /nfs/dbraw/zinc/14/43/11/1051144311.db2.gz MNQPZASKSYZUIG-QIJUGHKUSA-N 2 1 337.511 4.218 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCSCc3ccccc3)C2)CC1 ZINC001190651732 1051245812 /nfs/dbraw/zinc/24/58/12/1051245812.db2.gz QAIQXZSSBHNJNF-OAQYLSRUSA-N 2 1 346.584 4.364 20 0 EIADMP CO[C@H](C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccc(F)cc1 ZINC001190826213 1051286833 /nfs/dbraw/zinc/28/68/33/1051286833.db2.gz GEWHQWKAVGQNOG-WIYYLYMNSA-N 2 1 348.506 4.101 20 0 EIADMP CO[C@H](C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccc(F)cc1 ZINC001190826213 1051286836 /nfs/dbraw/zinc/28/68/36/1051286836.db2.gz GEWHQWKAVGQNOG-WIYYLYMNSA-N 2 1 348.506 4.101 20 0 EIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC001205546420 1051320113 /nfs/dbraw/zinc/32/01/13/1051320113.db2.gz VDLCWKLLDXLGEG-MRXNPFEDSA-N 2 1 333.278 4.079 20 0 EIADMP C([C@H]1CCC2(CCCCCC2)O1)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001191069969 1051339054 /nfs/dbraw/zinc/33/90/54/1051339054.db2.gz JDXLWRBGTDZLKN-VQTJNVASSA-N 2 1 334.548 4.066 20 0 EIADMP C=Cc1ccc(CC[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001181945461 1051359086 /nfs/dbraw/zinc/35/90/86/1051359086.db2.gz MFCASKALIGYAED-WMZHIEFXSA-N 2 1 334.507 4.372 20 0 EIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+]CCCCc1cccc(C(F)(F)F)c1 ZINC001182174420 1051400656 /nfs/dbraw/zinc/40/06/56/1051400656.db2.gz QCMCFHLTJSKIOG-HNNXBMFYSA-N 2 1 330.438 4.346 20 0 EIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+]CCCCc1cccc(C(F)(F)F)c1 ZINC001182174420 1051400661 /nfs/dbraw/zinc/40/06/61/1051400661.db2.gz QCMCFHLTJSKIOG-HNNXBMFYSA-N 2 1 330.438 4.346 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2coc(-c3ccccc3)n2)c1 ZINC000155681465 1051445166 /nfs/dbraw/zinc/44/51/66/1051445166.db2.gz TWMOLDYECSKHEB-UHFFFAOYSA-N 2 1 349.478 4.472 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2coc(-c3ccccc3)n2)c1 ZINC000155681465 1051445172 /nfs/dbraw/zinc/44/51/72/1051445172.db2.gz TWMOLDYECSKHEB-UHFFFAOYSA-N 2 1 349.478 4.472 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCc2c(Cl)cccc2Cl)C[C@H]1C ZINC001191417640 1051453063 /nfs/dbraw/zinc/45/30/63/1051453063.db2.gz PZSKEHNRLJOPMB-ZIAGYGMSSA-N 2 1 329.315 4.341 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCc2c(Cl)cccc2Cl)C[C@H]1C ZINC001191417640 1051453065 /nfs/dbraw/zinc/45/30/65/1051453065.db2.gz PZSKEHNRLJOPMB-ZIAGYGMSSA-N 2 1 329.315 4.341 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@@H]1C ZINC001191417131 1051452982 /nfs/dbraw/zinc/45/29/82/1051452982.db2.gz NMPYNGKWAVSPED-KBXCAEBGSA-N 2 1 331.891 4.193 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@@H]1C ZINC001191417131 1051452985 /nfs/dbraw/zinc/45/29/85/1051452985.db2.gz NMPYNGKWAVSPED-KBXCAEBGSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@@H]1C ZINC001191417131 1051452990 /nfs/dbraw/zinc/45/29/90/1051452990.db2.gz NMPYNGKWAVSPED-KBXCAEBGSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@@H]1C ZINC001191417131 1051452995 /nfs/dbraw/zinc/45/29/95/1051452995.db2.gz NMPYNGKWAVSPED-KBXCAEBGSA-N 2 1 331.891 4.193 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCc2c(Cl)cccc2Cl)C[C@H]1C ZINC001191417640 1051453059 /nfs/dbraw/zinc/45/30/59/1051453059.db2.gz PZSKEHNRLJOPMB-ZIAGYGMSSA-N 2 1 329.315 4.341 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)C(C)C ZINC000155819963 1051464564 /nfs/dbraw/zinc/46/45/64/1051464564.db2.gz VRMBSYHSQZJUPN-INIZCTEOSA-N 2 1 345.531 4.076 20 0 EIADMP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311188774 1051468997 /nfs/dbraw/zinc/46/89/97/1051468997.db2.gz DJWVWNJTRNVTPU-UYAOXDASSA-N 2 1 338.495 4.176 20 0 EIADMP C[C@H](CC[NH2+][C@H]1CC[N@@H+](C)C[C@H]1C)c1cccc(C(F)(F)F)c1 ZINC000155868302 1051469098 /nfs/dbraw/zinc/46/90/98/1051469098.db2.gz KTWOGAWJMHEAIV-CPUCHLNUSA-N 2 1 328.422 4.129 20 0 EIADMP C/C=C\COc1ccc(CC[C@@H](C)[NH2+]CC[N@@H+]2CCCC2(C)C)cc1 ZINC001182307445 1051486209 /nfs/dbraw/zinc/48/62/09/1051486209.db2.gz BAEAYVBGZQOTND-SFFCAUCYSA-N 2 1 344.543 4.427 20 0 EIADMP C/C=C\COc1ccc(CC[C@@H](C)[NH2+]CC[N@H+]2CCCC2(C)C)cc1 ZINC001182307445 1051486214 /nfs/dbraw/zinc/48/62/14/1051486214.db2.gz BAEAYVBGZQOTND-SFFCAUCYSA-N 2 1 344.543 4.427 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(NC2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000774272129 1051541370 /nfs/dbraw/zinc/54/13/70/1051541370.db2.gz NJPRFZIJDVZKJF-ZNDGOPKYSA-N 2 1 327.516 4.098 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000774272129 1051541376 /nfs/dbraw/zinc/54/13/76/1051541376.db2.gz NJPRFZIJDVZKJF-ZNDGOPKYSA-N 2 1 327.516 4.098 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000774272129 1051541382 /nfs/dbraw/zinc/54/13/82/1051541382.db2.gz NJPRFZIJDVZKJF-ZNDGOPKYSA-N 2 1 327.516 4.098 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000774402557 1051579432 /nfs/dbraw/zinc/57/94/32/1051579432.db2.gz CDWXCHVDDQPNFT-NSHDSACASA-N 2 1 342.314 4.243 20 0 EIADMP C[N@H+]1C[C@@H](C[NH2+][C@@H]2CC[C@@](C)(c3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC001182542187 1051636374 /nfs/dbraw/zinc/63/63/74/1051636374.db2.gz CKLFNZKYPJBNHJ-CAUSLRQDSA-N 2 1 348.534 4.432 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)c(C(F)(F)F)c1 ZINC000157679642 1051664785 /nfs/dbraw/zinc/66/47/85/1051664785.db2.gz DXFIXBGARPDTJK-ZFWWWQNUSA-N 2 1 344.421 4.065 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)c(C(F)(F)F)c1 ZINC000157679642 1051664795 /nfs/dbraw/zinc/66/47/95/1051664795.db2.gz DXFIXBGARPDTJK-ZFWWWQNUSA-N 2 1 344.421 4.065 20 0 EIADMP C[C@@H]1[C@H](c2ccccc2)c2ccccc2CC[N@H+]1CCCn1ccnc1 ZINC001192334055 1051692099 /nfs/dbraw/zinc/69/20/99/1051692099.db2.gz GKCQQYDYDSECCJ-AUSIDOKSSA-N 2 1 345.490 4.352 20 0 EIADMP Cc1ccc(CC[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)cc1C ZINC001182817343 1051719308 /nfs/dbraw/zinc/71/93/08/1051719308.db2.gz SKGSCOPHILUZSF-VXNXHJTFSA-N 2 1 348.534 4.489 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H](O)c2ccc(C)cc2)CC1)CC(C)C ZINC001192491049 1051745562 /nfs/dbraw/zinc/74/55/62/1051745562.db2.gz ZEAMAVZMBAOGCP-JOCHJYFZSA-N 2 1 346.559 4.108 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2c(C)nsc2C)CC1)CC1CC1 ZINC001192499435 1051746337 /nfs/dbraw/zinc/74/63/37/1051746337.db2.gz CASVYWRPLDYCMC-UHFFFAOYSA-N 2 1 335.561 4.094 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CCSc2ccncc2)CC1)CC1CC1 ZINC001192502158 1051747399 /nfs/dbraw/zinc/74/73/99/1051747399.db2.gz SUKXXMBWAUSLBV-UHFFFAOYSA-N 2 1 347.572 4.008 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC(NC[C@H]2CC[N@H+]2C2CCCCC2)CC1 ZINC001182918239 1051747455 /nfs/dbraw/zinc/74/74/55/1051747455.db2.gz KMLSZNISQLRKIH-STZQEDGTSA-N 2 1 347.591 4.026 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)C(C)(C)C1 ZINC001175758304 1051770622 /nfs/dbraw/zinc/77/06/22/1051770622.db2.gz LYVRIKXKJOFTSK-IBGZPJMESA-N 2 1 328.544 4.452 20 0 EIADMP CC(C)C[N@@H+](C/C=C\c1ccc(F)c(F)c1)CC1CC[NH+](C)CC1 ZINC001183463218 1051846170 /nfs/dbraw/zinc/84/61/70/1051846170.db2.gz CKQLGNKNVBCZRV-PLNGDYQASA-N 2 1 336.470 4.278 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC001193092253 1051875083 /nfs/dbraw/zinc/87/50/83/1051875083.db2.gz CHHHBLITYURQBB-JYRKZWEQSA-N 2 1 344.543 4.080 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001193249481 1051889956 /nfs/dbraw/zinc/88/99/56/1051889956.db2.gz NAPLJYBWCOVLHG-GDBMZVCRSA-N 2 1 338.442 4.031 20 0 EIADMP CCCn1ccnc1CCC[N@@H+](C)Cc1nc(C)c(C(C)(C)C)s1 ZINC001193354752 1051906893 /nfs/dbraw/zinc/90/68/93/1051906893.db2.gz HBFUIAFOFRQIOU-UHFFFAOYSA-N 2 1 348.560 4.420 20 0 EIADMP C[NH+](C)[C@@H]1CC[C@H]2C[N@@H+](Cc3cc(F)cc(C(F)(F)F)c3)C[C@H]2C1 ZINC001184303254 1051982382 /nfs/dbraw/zinc/98/23/82/1051982382.db2.gz NZSBTSAGSRRTRN-JJRVBVJISA-N 2 1 344.396 4.007 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCc4cc(Cl)ccc43)CC2)[nH+]c1 ZINC000163527947 1051993529 /nfs/dbraw/zinc/99/35/29/1051993529.db2.gz GUKQLQNYYLCIBN-IBGZPJMESA-N 2 1 341.886 4.289 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000163688356 1052002042 /nfs/dbraw/zinc/00/20/42/1052002042.db2.gz NVZATDNANJKPHD-UHFFFAOYSA-N 2 1 326.271 4.411 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000163688356 1052002056 /nfs/dbraw/zinc/00/20/56/1052002056.db2.gz NVZATDNANJKPHD-UHFFFAOYSA-N 2 1 326.271 4.411 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000166011369 1052081999 /nfs/dbraw/zinc/08/19/99/1052081999.db2.gz QJXPYHUQLBFOPO-DYXWJJEUSA-N 2 1 330.516 4.008 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)Cc3ccccc3CF)C2)s1 ZINC001194153711 1052089320 /nfs/dbraw/zinc/08/93/20/1052089320.db2.gz QRCAJGXSCGYJAW-KRWDZBQOSA-N 2 1 346.515 4.480 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)Cc3ccccc3CF)C2)s1 ZINC001194153711 1052089333 /nfs/dbraw/zinc/08/93/33/1052089333.db2.gz QRCAJGXSCGYJAW-KRWDZBQOSA-N 2 1 346.515 4.480 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)Cc3ccccc3CF)C2)s1 ZINC001194153711 1052089345 /nfs/dbraw/zinc/08/93/45/1052089345.db2.gz QRCAJGXSCGYJAW-KRWDZBQOSA-N 2 1 346.515 4.480 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cc(C)cc(Br)c2)C[C@H]1C ZINC000774903338 1052269385 /nfs/dbraw/zinc/26/93/85/1052269385.db2.gz MKSNUMMUCOJKBU-PBHICJAKSA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)cc(Br)c2)C[C@H]1C ZINC000774903338 1052269388 /nfs/dbraw/zinc/26/93/88/1052269388.db2.gz MKSNUMMUCOJKBU-PBHICJAKSA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C)cc(Br)c2)C[C@H]1C ZINC000774903338 1052269392 /nfs/dbraw/zinc/26/93/92/1052269392.db2.gz MKSNUMMUCOJKBU-PBHICJAKSA-N 2 1 339.321 4.062 20 0 EIADMP c1cc2c(s1)CCC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000336707956 1052512753 /nfs/dbraw/zinc/51/27/53/1052512753.db2.gz JFXYQAFAHHBICT-PKOBYXMFSA-N 2 1 326.509 4.237 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CC2)CC1(C)C ZINC000623398802 1052646651 /nfs/dbraw/zinc/64/66/51/1052646651.db2.gz PDMKDUOIPRTQNN-INIZCTEOSA-N 2 1 340.433 4.199 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1(C)C ZINC000623512323 1052667143 /nfs/dbraw/zinc/66/71/43/1052667143.db2.gz BLZPDGQSFNLLQK-DJIMGWMZSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(F)c(Br)c1 ZINC000623533197 1052669246 /nfs/dbraw/zinc/66/92/46/1052669246.db2.gz WLFVJZLMRKNZCD-AAEUAGOBSA-N 2 1 343.284 4.112 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(F)c(Br)c1 ZINC000623533197 1052669248 /nfs/dbraw/zinc/66/92/48/1052669248.db2.gz WLFVJZLMRKNZCD-AAEUAGOBSA-N 2 1 343.284 4.112 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)c2ccccc12 ZINC000178698657 1052711407 /nfs/dbraw/zinc/71/14/07/1052711407.db2.gz VSZYMPOIUZTXHU-HZPDHXFCSA-N 2 1 337.467 4.340 20 0 EIADMP CC(C)c1nccn1Cc1cccc(N[C@@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000623932404 1052837616 /nfs/dbraw/zinc/83/76/16/1052837616.db2.gz MOKWKEHRIMXZHF-LJQANCHMSA-N 2 1 340.515 4.340 20 0 EIADMP CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H]2CC[N@H+](C)C(C)(C)C2)c1 ZINC000623932404 1052837618 /nfs/dbraw/zinc/83/76/18/1052837618.db2.gz MOKWKEHRIMXZHF-LJQANCHMSA-N 2 1 340.515 4.340 20 0 EIADMP CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000623932404 1052837623 /nfs/dbraw/zinc/83/76/23/1052837623.db2.gz MOKWKEHRIMXZHF-LJQANCHMSA-N 2 1 340.515 4.340 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c2ccccc12 ZINC000624119587 1052867884 /nfs/dbraw/zinc/86/78/84/1052867884.db2.gz FNMQOZKBFSLDEJ-IAGOWNOFSA-N 2 1 326.484 4.231 20 0 EIADMP CC[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)[C@H]1CCOC(C)(C)C1 ZINC001194781833 1053090966 /nfs/dbraw/zinc/09/09/66/1053090966.db2.gz INGGEAXNQHOVSE-NRFANRHFSA-N 2 1 344.543 4.452 20 0 EIADMP CSC1(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000381904870 1053110963 /nfs/dbraw/zinc/11/09/63/1053110963.db2.gz IKVUGFDBUZUMNF-LJQANCHMSA-N 2 1 332.557 4.164 20 0 EIADMP C[C@H]([NH2+]Cc1sccc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381895141 1053111831 /nfs/dbraw/zinc/11/18/31/1053111831.db2.gz UEJAWGRKOWHVIO-HOCLYGCPSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@H]([NH2+]Cc1sccc1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381895141 1053111842 /nfs/dbraw/zinc/11/18/42/1053111842.db2.gz UEJAWGRKOWHVIO-HOCLYGCPSA-N 2 1 334.916 4.402 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)o1 ZINC000383543029 1053352809 /nfs/dbraw/zinc/35/28/09/1053352809.db2.gz UXPFVLFNVNGUBZ-ZWOKBUDYSA-N 2 1 326.484 4.458 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12)c1ccc(SC(F)F)cc1 ZINC000764967857 1053403363 /nfs/dbraw/zinc/40/33/63/1053403363.db2.gz XXJRDNBPDPGNII-APHBMKBZSA-N 2 1 326.456 4.279 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(SC(F)F)cc1 ZINC000764967857 1053403372 /nfs/dbraw/zinc/40/33/72/1053403372.db2.gz XXJRDNBPDPGNII-APHBMKBZSA-N 2 1 326.456 4.279 20 0 EIADMP Clc1cccc(SCC[N@H+]2CCCN(c3cc[nH+]cc3)CC2)c1 ZINC001195536235 1053428450 /nfs/dbraw/zinc/42/84/50/1053428450.db2.gz PJGVALYOYGPLTH-UHFFFAOYSA-N 2 1 347.915 4.039 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCc3cc(C)ccc32)cc1F ZINC000765322260 1053508386 /nfs/dbraw/zinc/50/83/86/1053508386.db2.gz DYNKHQSAALWYDF-HXUWFJFHSA-N 2 1 335.426 4.405 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)COc2ccccc2)cc1 ZINC000765435645 1053544982 /nfs/dbraw/zinc/54/49/82/1053544982.db2.gz CLOUPGVXRJAIEY-IRXDYDNUSA-N 2 1 335.451 4.299 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccnc(Cl)c1 ZINC000765449398 1053550525 /nfs/dbraw/zinc/55/05/25/1053550525.db2.gz JJJAPKMQMWUBKW-WMZOPIPTSA-N 2 1 343.902 4.298 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@@H]2CCCO2)[C@H]1c1cccs1 ZINC000866271588 1053671506 /nfs/dbraw/zinc/67/15/06/1053671506.db2.gz ANQJYFWZSCWSIL-BWPNAZKDSA-N 2 1 348.556 4.068 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@@H]2CCCO2)[C@H]1c1cccs1 ZINC000866271588 1053671508 /nfs/dbraw/zinc/67/15/08/1053671508.db2.gz ANQJYFWZSCWSIL-BWPNAZKDSA-N 2 1 348.556 4.068 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](CCc1ccccc1)c1ccccn1 ZINC000866272954 1053673453 /nfs/dbraw/zinc/67/34/53/1053673453.db2.gz ZIJXGDBILVASPT-JOCHJYFZSA-N 2 1 348.494 4.330 20 0 EIADMP CCOc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000386416515 1053712344 /nfs/dbraw/zinc/71/23/44/1053712344.db2.gz YTOLFOWGZUAATJ-NQIIRXRSSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc2c(ccnc2Cl)o1 ZINC000866392353 1053712893 /nfs/dbraw/zinc/71/28/93/1053712893.db2.gz AQFMHBJZWQCBQR-HIFRSBDPSA-N 2 1 347.890 4.254 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc2c(ccnc2Cl)o1 ZINC000866392353 1053712907 /nfs/dbraw/zinc/71/29/07/1053712907.db2.gz AQFMHBJZWQCBQR-HIFRSBDPSA-N 2 1 347.890 4.254 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2c1cccc2F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386578560 1053782335 /nfs/dbraw/zinc/78/23/35/1053782335.db2.gz ZGJCZCGMRKYEEG-ZJBJCVSYSA-N 2 1 338.470 4.313 20 0 EIADMP Cc1oc(-c2ccsc2)nc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000338987448 1054026895 /nfs/dbraw/zinc/02/68/95/1054026895.db2.gz ZRIOFEBRBGBQHM-UHFFFAOYSA-N 2 1 345.512 4.019 20 0 EIADMP CC(C)C[C@H](C)C[N@H+]1CC[C@@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856559695 1054084667 /nfs/dbraw/zinc/08/46/67/1054084667.db2.gz SMUOPAJPWAIMNW-GHTZIAJQSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)C[C@H](C)C[NH+]1CC[C@@H](Oc2ccnc(C[N@H+](C)C(C)C)c2)C1 ZINC000856559695 1054084677 /nfs/dbraw/zinc/08/46/77/1054084677.db2.gz SMUOPAJPWAIMNW-GHTZIAJQSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)C[C@H](C)C[NH+]1CC[C@@H](Oc2ccnc(C[N@@H+](C)C(C)C)c2)C1 ZINC000856559695 1054084690 /nfs/dbraw/zinc/08/46/90/1054084690.db2.gz SMUOPAJPWAIMNW-GHTZIAJQSA-N 2 1 347.547 4.057 20 0 EIADMP Cc1cc(C)nc(C[N@H+]2CCC[C@@H](c3cncn3C(C)(C)C)C2)c1 ZINC001198791710 1054268852 /nfs/dbraw/zinc/26/88/52/1054268852.db2.gz YEPJETMVXHJGCA-QGZVFWFLSA-N 2 1 326.488 4.030 20 0 EIADMP CC[C@H](CCC(F)(F)F)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000872016709 1054331101 /nfs/dbraw/zinc/33/11/01/1054331101.db2.gz NNTJOSSMNDYVPM-MRXNPFEDSA-N 2 1 328.422 4.362 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCOC3(CCCC3)C2)[C@H]1c1cccs1 ZINC000872038081 1054352876 /nfs/dbraw/zinc/35/28/76/1054352876.db2.gz HTYMGSNOBVFSGI-AOIWGVFYSA-N 2 1 348.556 4.212 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCOC3(CCCC3)C2)[C@H]1c1cccs1 ZINC000872038081 1054352900 /nfs/dbraw/zinc/35/29/00/1054352900.db2.gz HTYMGSNOBVFSGI-AOIWGVFYSA-N 2 1 348.556 4.212 20 0 EIADMP CC[C@H]([NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)[C@H]1CCCOC1 ZINC000872040800 1054355502 /nfs/dbraw/zinc/35/55/02/1054355502.db2.gz CJAKGHSESZZJMG-BPAFIMBUSA-N 2 1 327.472 4.037 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001199403059 1054405873 /nfs/dbraw/zinc/40/58/73/1054405873.db2.gz DFTXVBYIKGJKBB-QGZVFWFLSA-N 2 1 327.516 4.348 20 0 EIADMP [NH3+][C@@H](C[C@@H]1CCC[N@@H+](Cc2csc(C3CC3)n2)C1)C1CCCC1 ZINC000872156697 1054412305 /nfs/dbraw/zinc/41/23/05/1054412305.db2.gz LFYVEBYXQZGNLJ-KSSFIOAISA-N 2 1 333.545 4.140 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc(Oc3ccc(F)cc3)c2)C1 ZINC001199844443 1054478754 /nfs/dbraw/zinc/47/87/54/1054478754.db2.gz ZGMOWSCXFPTGCV-SFHVURJKSA-N 2 1 342.458 4.440 20 0 EIADMP [NH3+][C@@H](C[C@H]1CCC[N@@H+](Cc2scnc2C2CC2)C1)C1CCCC1 ZINC000873232491 1054509655 /nfs/dbraw/zinc/50/96/55/1054509655.db2.gz RPIAAMVDYVWVOG-PBHICJAKSA-N 2 1 333.545 4.140 20 0 EIADMP CCNc1ccccc1C[NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC001200941774 1054596680 /nfs/dbraw/zinc/59/66/80/1054596680.db2.gz JMUKRTWXLCCPLB-SFHVURJKSA-N 2 1 325.500 4.119 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(NC[C@H]3CC=CCC3)cc2)CC1 ZINC000125585105 1054820467 /nfs/dbraw/zinc/82/04/67/1054820467.db2.gz YLXNDDLBIBWZRB-SFHVURJKSA-N 2 1 327.516 4.233 20 0 EIADMP CCC[C@@H](C)C[NH+]1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201544395 1054837680 /nfs/dbraw/zinc/83/76/80/1054837680.db2.gz PNPPYTVQIIHOSQ-TZIWHRDSSA-N 2 1 344.543 4.178 20 0 EIADMP CCC[C@H](C)C[NH+]1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001201543842 1054837935 /nfs/dbraw/zinc/83/79/35/1054837935.db2.gz LBXRLFACSMYEEQ-SFHVURJKSA-N 2 1 329.532 4.194 20 0 EIADMP c1ccc(CCC[N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201681703 1054875362 /nfs/dbraw/zinc/87/53/62/1054875362.db2.gz CIZQLBIMNVMSIZ-RPWUZVMVSA-N 2 1 348.534 4.463 20 0 EIADMP c1ccc(CCC[NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201681703 1054875364 /nfs/dbraw/zinc/87/53/64/1054875364.db2.gz CIZQLBIMNVMSIZ-RPWUZVMVSA-N 2 1 348.534 4.463 20 0 EIADMP c1ccc(CCC[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201681703 1054875366 /nfs/dbraw/zinc/87/53/66/1054875366.db2.gz CIZQLBIMNVMSIZ-RPWUZVMVSA-N 2 1 348.534 4.463 20 0 EIADMP CC(C)=CCC[C@H](C)CC[N@@H+]1CCn2c(C[NH+](C)C(C)C)cnc2C1 ZINC001201974676 1054953811 /nfs/dbraw/zinc/95/38/11/1054953811.db2.gz ZBSSRKARUUHFSH-IBGZPJMESA-N 2 1 346.563 4.312 20 0 EIADMP CC(C)=CCC[C@H](C)CC[N@H+]1CCn2c(C[NH+](C)C(C)C)cnc2C1 ZINC001201974676 1054953819 /nfs/dbraw/zinc/95/38/19/1054953819.db2.gz ZBSSRKARUUHFSH-IBGZPJMESA-N 2 1 346.563 4.312 20 0 EIADMP CC(C)=CCC[C@H](C)CC[NH+]1CCn2c(C[N@H+](C)C(C)C)cnc2C1 ZINC001201974676 1054953830 /nfs/dbraw/zinc/95/38/30/1054953830.db2.gz ZBSSRKARUUHFSH-IBGZPJMESA-N 2 1 346.563 4.312 20 0 EIADMP CC(C)=CCC[C@H](C)CC[NH+]1CCn2c(C[N@@H+](C)C(C)C)cnc2C1 ZINC001201974676 1054953839 /nfs/dbraw/zinc/95/38/39/1054953839.db2.gz ZBSSRKARUUHFSH-IBGZPJMESA-N 2 1 346.563 4.312 20 0 EIADMP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+](CC[C@@H](C)CCC=C(C)C)CC1 ZINC001201981665 1054958469 /nfs/dbraw/zinc/95/84/69/1054958469.db2.gz QLDWCFNTVMZDNC-PZJWPPBQSA-N 2 1 336.564 4.334 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc(Cl)c2N)c1 ZINC000876982114 1054992996 /nfs/dbraw/zinc/99/29/96/1054992996.db2.gz VRJPDOYADWVASW-UHFFFAOYSA-N 2 1 331.891 4.052 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cccc(Cl)c2N)CC1 ZINC000877037965 1055006142 /nfs/dbraw/zinc/00/61/42/1055006142.db2.gz FDOMLYYUQLGTIX-HNNXBMFYSA-N 2 1 343.902 4.237 20 0 EIADMP Clc1ccc([C@H](C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)OCC2CC2)cc1 ZINC000671764596 1055058240 /nfs/dbraw/zinc/05/82/40/1055058240.db2.gz GLEVDHRNUDVPAP-AABGKKOBSA-N 2 1 348.918 4.024 20 0 EIADMP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC000877733347 1055110941 /nfs/dbraw/zinc/11/09/41/1055110941.db2.gz RYCIXAVCMBNNNL-CEXJFXJFSA-N 2 1 344.480 4.096 20 0 EIADMP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC000877733347 1055110949 /nfs/dbraw/zinc/11/09/49/1055110949.db2.gz RYCIXAVCMBNNNL-CEXJFXJFSA-N 2 1 344.480 4.096 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccnc(Cl)c1 ZINC000126844342 1055176636 /nfs/dbraw/zinc/17/66/36/1055176636.db2.gz PPVULDUTGGKNCS-CABCVRRESA-N 2 1 349.931 4.359 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccnc(Cl)c1 ZINC000126844342 1055176643 /nfs/dbraw/zinc/17/66/43/1055176643.db2.gz PPVULDUTGGKNCS-CABCVRRESA-N 2 1 349.931 4.359 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[C@@H](c2ccccc2)O1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000878412321 1055299466 /nfs/dbraw/zinc/29/94/66/1055299466.db2.gz VTUBIBLKFRGRRY-TZEULACYSA-N 2 1 342.527 4.149 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[C@H](c2ccccc2)O1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000878412320 1055300611 /nfs/dbraw/zinc/30/06/11/1055300611.db2.gz VTUBIBLKFRGRRY-OZROYSPXSA-N 2 1 342.527 4.149 20 0 EIADMP CC[NH+](CC)CCCC1CC[NH+](Cc2ccn(C3CCCC3)n2)CC1 ZINC000542941963 1056822681 /nfs/dbraw/zinc/82/26/81/1056822681.db2.gz HOVQTYNGOLTSFH-UHFFFAOYSA-N 2 1 346.563 4.332 20 0 EIADMP Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000180137923 1058369897 /nfs/dbraw/zinc/36/98/97/1058369897.db2.gz LZOGSTFYARKRAZ-IXDOHACOSA-N 2 1 340.515 4.047 20 0 EIADMP CC[NH+]1CCN(CCCC[NH2+][C@H](CC(C)(C)C)c2ccccc2)CC1 ZINC000181493908 1059464478 /nfs/dbraw/zinc/46/44/78/1059464478.db2.gz OMIOOJPGTGJECC-OAQYLSRUSA-N 2 1 345.575 4.171 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000386483114 1060267813 /nfs/dbraw/zinc/26/78/13/1060267813.db2.gz WLRQDPIDGSNHHW-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(F)F)cc2)[C@@H](C)C1 ZINC000746469522 1060369919 /nfs/dbraw/zinc/36/99/19/1060369919.db2.gz COFBAFZSOXPIOW-XJKSGUPXSA-N 2 1 328.472 4.163 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(SC(F)F)cc2)[C@@H](C)C1 ZINC000746469522 1060369937 /nfs/dbraw/zinc/36/99/37/1060369937.db2.gz COFBAFZSOXPIOW-XJKSGUPXSA-N 2 1 328.472 4.163 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(SC(F)F)cc2)[C@@H](C)C1 ZINC000746469522 1060369954 /nfs/dbraw/zinc/36/99/54/1060369954.db2.gz COFBAFZSOXPIOW-XJKSGUPXSA-N 2 1 328.472 4.163 20 0 EIADMP CC(C)C[C@H](Cc1ccccc1)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001169062319 1060618781 /nfs/dbraw/zinc/61/87/81/1060618781.db2.gz SMSSXYMLCSGZJE-HXUWFJFHSA-N 3 1 347.591 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)Cc1ccc(C(F)(F)F)cc1)C2 ZINC001169118328 1060646854 /nfs/dbraw/zinc/64/68/54/1060646854.db2.gz HNYZGPHUNWKEKH-OSYLJGHBSA-N 2 1 340.433 4.241 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCc1ccc(CCc3ccccc3)cc1)C2 ZINC001169124003 1060649285 /nfs/dbraw/zinc/64/92/85/1060649285.db2.gz OZRFIQSMOIIFSG-JOZNFPNDSA-N 2 1 348.534 4.229 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(CCCc3ccccc3)CC1)C2 ZINC001169126745 1060651511 /nfs/dbraw/zinc/65/15/11/1060651511.db2.gz XEPJKAOEGWTFOW-KOUNCHBCSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCc3ccccc3[C@@H]1c1ccccc1)C2 ZINC001169143232 1060662475 /nfs/dbraw/zinc/66/24/75/1060662475.db2.gz ZCLCIAGQCXTXRG-GNXKAVGDSA-N 2 1 332.491 4.259 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCc3ccccc3[C@@H]1c1ccccc1)C2 ZINC001169143232 1060662480 /nfs/dbraw/zinc/66/24/80/1060662480.db2.gz ZCLCIAGQCXTXRG-GNXKAVGDSA-N 2 1 332.491 4.259 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCc3ccccc3[C@@H]1c1ccccc1)C2 ZINC001169143232 1060662488 /nfs/dbraw/zinc/66/24/88/1060662488.db2.gz ZCLCIAGQCXTXRG-GNXKAVGDSA-N 2 1 332.491 4.259 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](n1cc(C3CC[NH2+]CC3)c3cccc(F)c31)C2 ZINC001169155158 1060670113 /nfs/dbraw/zinc/67/01/13/1060670113.db2.gz YTWVTIBMNRDQBY-BJWYYQGGSA-N 2 1 341.474 4.045 20 0 EIADMP FC1(F)CCC[C@H](Nc2ccc3c(c2)[nH+]cn3[C@@H]2CCC[NH2+]CC2)C1 ZINC001169213868 1060694904 /nfs/dbraw/zinc/69/49/04/1060694904.db2.gz QCMQDAODUHYJMS-JKSUJKDBSA-N 2 1 348.441 4.341 20 0 EIADMP Cc1ccc(CNc2ccc3c(C4C[NH2+]C4)[nH+]cn3c2)c2ccccc12 ZINC001169419606 1060809905 /nfs/dbraw/zinc/80/99/05/1060809905.db2.gz UMVINUZTYSWEPI-UHFFFAOYSA-N 2 1 342.446 4.095 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c(C)o1 ZINC000767363773 1061212178 /nfs/dbraw/zinc/21/21/78/1061212178.db2.gz WYKIAYUJHDXIEN-INIZCTEOSA-N 2 1 326.484 4.418 20 0 EIADMP C[N@H+]1CCC[C@H]1CCN1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370736 1061213589 /nfs/dbraw/zinc/21/35/89/1061213589.db2.gz DTVZWJPXPHGDJA-WMLDXEAASA-N 2 1 326.406 4.327 20 0 EIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370736 1061213609 /nfs/dbraw/zinc/21/36/09/1061213609.db2.gz DTVZWJPXPHGDJA-WMLDXEAASA-N 2 1 326.406 4.327 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370736 1061213628 /nfs/dbraw/zinc/21/36/28/1061213628.db2.gz DTVZWJPXPHGDJA-WMLDXEAASA-N 2 1 326.406 4.327 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370736 1061213649 /nfs/dbraw/zinc/21/36/49/1061213649.db2.gz DTVZWJPXPHGDJA-WMLDXEAASA-N 2 1 326.406 4.327 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370736 1061213670 /nfs/dbraw/zinc/21/36/70/1061213670.db2.gz DTVZWJPXPHGDJA-WMLDXEAASA-N 2 1 326.406 4.327 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1ccc(Br)s1)C1CCCCC1 ZINC000037901127 213172242 /nfs/dbraw/zinc/17/22/42/213172242.db2.gz XPEPVZVHOQILJX-UHFFFAOYSA-N 2 1 345.350 4.255 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1ccc(Br)s1)C1CCCCC1 ZINC000037901127 213172246 /nfs/dbraw/zinc/17/22/46/213172246.db2.gz XPEPVZVHOQILJX-UHFFFAOYSA-N 2 1 345.350 4.255 20 0 EIADMP CC[NH+](CC)C1CCN(c2cc(C)c3ccc(C)c(C)c3[nH+]2)CC1 ZINC001165054563 722006001 /nfs/dbraw/zinc/00/60/01/722006001.db2.gz RCESWRXNUSOCRQ-UHFFFAOYSA-N 2 1 325.500 4.471 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)C1CCOCC1 ZINC000532192757 1032078824 /nfs/dbraw/zinc/07/88/24/1032078824.db2.gz KTJZSDOJBXNXNT-AVRDEDQJSA-N 2 1 344.543 4.356 20 0 EIADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@@H]1c1ccccn1 ZINC000536629700 1032082572 /nfs/dbraw/zinc/08/25/72/1032082572.db2.gz HDAKSFJVZSDTBU-OAQYLSRUSA-N 2 1 337.511 4.377 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@@H]1c1ccccn1 ZINC000536629700 1032082589 /nfs/dbraw/zinc/08/25/89/1032082589.db2.gz HDAKSFJVZSDTBU-OAQYLSRUSA-N 2 1 337.511 4.377 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000536629700 1032082606 /nfs/dbraw/zinc/08/26/06/1032082606.db2.gz HDAKSFJVZSDTBU-OAQYLSRUSA-N 2 1 337.511 4.377 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000536629700 1032082609 /nfs/dbraw/zinc/08/26/09/1032082609.db2.gz HDAKSFJVZSDTBU-OAQYLSRUSA-N 2 1 337.511 4.377 20 0 EIADMP C[N@@H+](Cc1ccccc1NC1CC[NH+](C2CC2)CC1)C1CCCCC1 ZINC000459374358 1032092232 /nfs/dbraw/zinc/09/22/32/1032092232.db2.gz ULRXVSXRQGVQFI-UHFFFAOYSA-N 2 1 341.543 4.490 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccc(F)cc1 ZINC000532213621 1032094338 /nfs/dbraw/zinc/09/43/38/1032094338.db2.gz LBCAWQNVVCOLAV-JBYIUTFZSA-N 2 1 340.486 4.429 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccc(F)cc1 ZINC000532213621 1032094342 /nfs/dbraw/zinc/09/43/42/1032094342.db2.gz LBCAWQNVVCOLAV-JBYIUTFZSA-N 2 1 340.486 4.429 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Br)cc2)C1 ZINC000532214759 1032095974 /nfs/dbraw/zinc/09/59/74/1032095974.db2.gz LCFFWJGJKWZARJ-GJZGRUSLSA-N 2 1 339.321 4.220 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccc(F)cc1 ZINC000532213620 1032096200 /nfs/dbraw/zinc/09/62/00/1032096200.db2.gz LBCAWQNVVCOLAV-HMFYCAOWSA-N 2 1 340.486 4.429 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccc(F)cc1 ZINC000532213620 1032096216 /nfs/dbraw/zinc/09/62/16/1032096216.db2.gz LBCAWQNVVCOLAV-HMFYCAOWSA-N 2 1 340.486 4.429 20 0 EIADMP Cc1nc(-c2ccc([C@@H](C)[NH2+]C3CC[NH+](C4CC4)CC3)cc2)cs1 ZINC000459381795 1032165794 /nfs/dbraw/zinc/16/57/94/1032165794.db2.gz DUMKMZUVWMSQGX-CQSZACIVSA-N 2 1 341.524 4.396 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000532802083 1032320488 /nfs/dbraw/zinc/32/04/88/1032320488.db2.gz JFBNDSCQYMFGND-MJGOQNOKSA-N 2 1 328.500 4.145 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000532802082 1032321547 /nfs/dbraw/zinc/32/15/47/1032321547.db2.gz JFBNDSCQYMFGND-IEBWSBKVSA-N 2 1 328.500 4.145 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000532802075 1032321738 /nfs/dbraw/zinc/32/17/38/1032321738.db2.gz JFBNDSCQYMFGND-HKUYNNGSSA-N 2 1 328.500 4.145 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)s1 ZINC000245594487 1032337410 /nfs/dbraw/zinc/33/74/10/1032337410.db2.gz RGCXYAPLSABFQA-RVSPLBMKSA-N 2 1 335.542 4.247 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)s1 ZINC000245594487 1032337423 /nfs/dbraw/zinc/33/74/23/1032337423.db2.gz RGCXYAPLSABFQA-RVSPLBMKSA-N 2 1 335.542 4.247 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccsc2C(F)(F)F)CC1 ZINC000529526995 1032429019 /nfs/dbraw/zinc/42/90/19/1032429019.db2.gz OWWIFKAUTXPETH-UHFFFAOYSA-N 2 1 334.451 4.319 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CC(F)(F)C1 ZINC000529543592 1032435181 /nfs/dbraw/zinc/43/51/81/1032435181.db2.gz BHJSBXRGCIBYFW-FMJMRLDVSA-N 2 1 334.454 4.205 20 0 EIADMP CCC(CC)[C@H](CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1)OC ZINC000533008861 1032439614 /nfs/dbraw/zinc/43/96/14/1032439614.db2.gz DSSFIGMGUKZLFD-NRFANRHFSA-N 2 1 332.532 4.082 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccsc1C(F)(F)F ZINC000529566825 1032459438 /nfs/dbraw/zinc/45/94/38/1032459438.db2.gz HLKAXKWSJQXOAC-UHFFFAOYSA-N 2 1 345.434 4.438 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccsc1C(F)(F)F ZINC000529566825 1032459440 /nfs/dbraw/zinc/45/94/40/1032459440.db2.gz HLKAXKWSJQXOAC-UHFFFAOYSA-N 2 1 345.434 4.438 20 0 EIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccncc1 ZINC000245750720 1032459876 /nfs/dbraw/zinc/45/98/76/1032459876.db2.gz TZBIKJDSJZDLTG-CIAFKFPVSA-N 2 1 335.495 4.318 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCO3)cc1 ZINC000177791442 1032505297 /nfs/dbraw/zinc/50/52/97/1032505297.db2.gz MNRCULXXEGHYJM-CABCVRRESA-N 2 1 349.434 4.321 20 0 EIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C[C@H]1CCCCC1(F)F ZINC000450455632 1032510835 /nfs/dbraw/zinc/51/08/35/1032510835.db2.gz OFYUOHGZROAWRC-RTBURBONSA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)C[C@H]1CCCCC1(F)F ZINC000450455632 1032510847 /nfs/dbraw/zinc/51/08/47/1032510847.db2.gz OFYUOHGZROAWRC-RTBURBONSA-N 2 1 336.470 4.266 20 0 EIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C[C@H]1CCCCC1(F)F ZINC000450455632 1032510863 /nfs/dbraw/zinc/51/08/63/1032510863.db2.gz OFYUOHGZROAWRC-RTBURBONSA-N 2 1 336.470 4.266 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000178451624 1032530296 /nfs/dbraw/zinc/53/02/96/1032530296.db2.gz WYCGSUKCIHBLJE-GOSISDBHSA-N 2 1 328.500 4.285 20 0 EIADMP CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(OC(F)F)cc1 ZINC000178705720 1032544059 /nfs/dbraw/zinc/54/40/59/1032544059.db2.gz YLYBCDIAWBCDMB-GUYCJALGSA-N 2 1 337.414 4.170 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccccc1OC(F)F ZINC000178704001 1032544502 /nfs/dbraw/zinc/54/45/02/1032544502.db2.gz MMFIPKGASXCVPN-CZUORRHYSA-N 2 1 337.414 4.170 20 0 EIADMP Cc1csc([C@H](C)C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000274735587 1019086103 /nfs/dbraw/zinc/08/61/03/1019086103.db2.gz DAOHAAWPIFJESE-AYBZRNKSSA-N 2 1 343.540 4.055 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000432793000 1032812288 /nfs/dbraw/zinc/81/22/88/1032812288.db2.gz NAJVQQBFOINWFJ-HNNXBMFYSA-N 2 1 332.488 4.470 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000432793000 1032812291 /nfs/dbraw/zinc/81/22/91/1032812291.db2.gz NAJVQQBFOINWFJ-HNNXBMFYSA-N 2 1 332.488 4.470 20 0 EIADMP Cc1cnc([C@H](C)C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000274752184 1019187811 /nfs/dbraw/zinc/18/78/11/1019187811.db2.gz HTZQEHKJOKIWON-SUMDDJOVSA-N 2 1 343.540 4.055 20 0 EIADMP COc1cc(-c2ccccc2)ccc1CN[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000512454020 1032820302 /nfs/dbraw/zinc/82/03/02/1032820302.db2.gz NKIGCFLPSIFGOR-LEWJYISDSA-N 2 1 336.479 4.079 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000512454020 1032820306 /nfs/dbraw/zinc/82/03/06/1032820306.db2.gz NKIGCFLPSIFGOR-LEWJYISDSA-N 2 1 336.479 4.079 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000512454020 1032820307 /nfs/dbraw/zinc/82/03/07/1032820307.db2.gz NKIGCFLPSIFGOR-LEWJYISDSA-N 2 1 336.479 4.079 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH+]2CCC[C@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614628 1019485748 /nfs/dbraw/zinc/48/57/48/1019485748.db2.gz FCDSIUBPQNLEHT-PBHICJAKSA-N 2 1 342.405 4.064 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH+]2CCC[C@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614628 1019485756 /nfs/dbraw/zinc/48/57/56/1019485756.db2.gz FCDSIUBPQNLEHT-PBHICJAKSA-N 2 1 342.405 4.064 20 0 EIADMP C[NH+]1CCC[C@@H](C[N@@H+]2CCC[C@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614628 1019485780 /nfs/dbraw/zinc/48/57/80/1019485780.db2.gz FCDSIUBPQNLEHT-PBHICJAKSA-N 2 1 342.405 4.064 20 0 EIADMP C[NH+]1CCC[C@@H](C[N@H+]2CCC[C@H]2c2ccc(OC(F)(F)F)cc2)C1 ZINC001208614628 1019485797 /nfs/dbraw/zinc/48/57/97/1019485797.db2.gz FCDSIUBPQNLEHT-PBHICJAKSA-N 2 1 342.405 4.064 20 0 EIADMP CCc1nc(C(C)C)ccc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000579846677 1019591664 /nfs/dbraw/zinc/59/16/64/1019591664.db2.gz BWVDVLIZMVOSAD-LJQANCHMSA-N 2 1 329.532 4.218 20 0 EIADMP CCc1nc(C(C)C)ccc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000579846677 1019591679 /nfs/dbraw/zinc/59/16/79/1019591679.db2.gz BWVDVLIZMVOSAD-LJQANCHMSA-N 2 1 329.532 4.218 20 0 EIADMP CC(C)n1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)cn1 ZINC000154877026 1020083645 /nfs/dbraw/zinc/08/36/45/1020083645.db2.gz GLCJEZNFXZTBCU-QGZVFWFLSA-N 2 1 328.504 4.155 20 0 EIADMP FC(F)(F)c1ccc2c(c1)[nH+]ccc2N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000443672891 1020207516 /nfs/dbraw/zinc/20/75/16/1020207516.db2.gz HEBRVEHDKYQMQP-OAHLLOKOSA-N 2 1 349.400 4.318 20 0 EIADMP Cc1cnc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c(C)c1 ZINC000655806752 1020976575 /nfs/dbraw/zinc/97/65/75/1020976575.db2.gz AAQZEEVMRMLKTD-NRFANRHFSA-N 2 1 349.522 4.028 20 0 EIADMP Cc1cnc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c(C)c1 ZINC000655806752 1020976581 /nfs/dbraw/zinc/97/65/81/1020976581.db2.gz AAQZEEVMRMLKTD-NRFANRHFSA-N 2 1 349.522 4.028 20 0 EIADMP COc1ccc2cc([C@H](C)[NH2+]C[C@@H](C)Cn3cc[nH+]c3C)ccc2c1 ZINC000121519725 1020998988 /nfs/dbraw/zinc/99/89/88/1020998988.db2.gz OFWHVGGCMSMGMI-CVEARBPZSA-N 2 1 337.467 4.340 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(-c2c(F)cccc2F)cc1 ZINC000564424296 1021065627 /nfs/dbraw/zinc/06/56/27/1021065627.db2.gz RSNZRVHUKJMYIG-AWEZNQCLSA-N 2 1 341.405 4.488 20 0 EIADMP Cc1cc(C)c(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c(C)n1 ZINC001167326761 1021130183 /nfs/dbraw/zinc/13/01/83/1021130183.db2.gz QGKZBCNRPCDZRP-HXUWFJFHSA-N 2 1 329.532 4.095 20 0 EIADMP Cc1cc(C)c(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c(C)n1 ZINC001167326761 1021130185 /nfs/dbraw/zinc/13/01/85/1021130185.db2.gz QGKZBCNRPCDZRP-HXUWFJFHSA-N 2 1 329.532 4.095 20 0 EIADMP Brc1cccc(C2=CC[N@H+](CCC[NH+]3CCCC3)CC2)c1 ZINC000580018252 1021142325 /nfs/dbraw/zinc/14/23/25/1021142325.db2.gz AVDCQQRCMGRJOL-UHFFFAOYSA-N 2 1 349.316 4.024 20 0 EIADMP Brc1cccc(C2=CC[N@@H+](CCC[NH+]3CCCC3)CC2)c1 ZINC000580018252 1021142335 /nfs/dbraw/zinc/14/23/35/1021142335.db2.gz AVDCQQRCMGRJOL-UHFFFAOYSA-N 2 1 349.316 4.024 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000472468664 1021388058 /nfs/dbraw/zinc/38/80/58/1021388058.db2.gz UFXMFZNGXWYSNS-ZBFHGGJFSA-N 2 1 340.433 4.430 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2ccccc2)cc1F ZINC000580059980 1021585718 /nfs/dbraw/zinc/58/57/18/1021585718.db2.gz JSXSFOISMNNZTG-IERDGZPVSA-N 2 1 326.459 4.265 20 0 EIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cccc(Br)c2Cl)CC1 ZINC000706460794 1021684086 /nfs/dbraw/zinc/68/40/86/1021684086.db2.gz MLCNSNOFQQPEPT-UHFFFAOYSA-N 2 1 345.712 4.065 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398028280 1021950604 /nfs/dbraw/zinc/95/06/04/1021950604.db2.gz DEHRFTWRIWFEMI-SVMVAKDDSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398028280 1021950620 /nfs/dbraw/zinc/95/06/20/1021950620.db2.gz DEHRFTWRIWFEMI-SVMVAKDDSA-N 2 1 340.486 4.257 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000570926868 1021998244 /nfs/dbraw/zinc/99/82/44/1021998244.db2.gz JGYAQUKZTHMYOQ-LJQANCHMSA-N 2 1 340.536 4.386 20 0 EIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000570926868 1021998251 /nfs/dbraw/zinc/99/82/51/1021998251.db2.gz JGYAQUKZTHMYOQ-LJQANCHMSA-N 2 1 340.536 4.386 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000414170378 1022022081 /nfs/dbraw/zinc/02/20/81/1022022081.db2.gz BYYWSLMPMFOGJZ-HTAPYJJXSA-N 2 1 349.478 4.239 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)c2ccccc12 ZINC000414173962 1022032922 /nfs/dbraw/zinc/03/29/22/1022032922.db2.gz HEMSHFWOHXDMIF-IRXDYDNUSA-N 2 1 326.484 4.231 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1nc(-c2ccccc2)cs1 ZINC000414184740 1022062190 /nfs/dbraw/zinc/06/21/90/1022062190.db2.gz OGHHKRXIAGNJHC-CVEARBPZSA-N 2 1 329.513 4.193 20 0 EIADMP CO[C@@](C)([C@H](C)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C1CC1 ZINC000414235537 1022248119 /nfs/dbraw/zinc/24/81/19/1022248119.db2.gz JXHFFDNDYIKHNP-AVYPCKFXSA-N 2 1 327.472 4.035 20 0 EIADMP CO[C@@](C)([C@@H](C)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C1CC1 ZINC000414235545 1022248908 /nfs/dbraw/zinc/24/89/08/1022248908.db2.gz JXHFFDNDYIKHNP-SXGZJXTBSA-N 2 1 327.472 4.035 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000471602660 1022310135 /nfs/dbraw/zinc/31/01/35/1022310135.db2.gz CTHLLGUDIXOTHK-RYRKJORJSA-N 2 1 344.524 4.318 20 0 EIADMP COc1ccc(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c2ccccc12 ZINC000580677397 1022367482 /nfs/dbraw/zinc/36/74/82/1022367482.db2.gz NOFOVXGSBUJXHQ-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP C[N@@H+](Cc1cc2ccccc2[nH]1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000684023172 1022372568 /nfs/dbraw/zinc/37/25/68/1022372568.db2.gz ULCYRCDVCDMFLT-LJQANCHMSA-N 2 1 333.479 4.122 20 0 EIADMP C[N@H+](Cc1cc2ccccc2[nH]1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000684023172 1022372585 /nfs/dbraw/zinc/37/25/85/1022372585.db2.gz ULCYRCDVCDMFLT-LJQANCHMSA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1cc2ccccc2[nH]1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000684023172 1022372605 /nfs/dbraw/zinc/37/26/05/1022372605.db2.gz ULCYRCDVCDMFLT-LJQANCHMSA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1cc2ccccc2[nH]1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000684023172 1022372624 /nfs/dbraw/zinc/37/26/24/1022372624.db2.gz ULCYRCDVCDMFLT-LJQANCHMSA-N 2 1 333.479 4.122 20 0 EIADMP COCC1CCC([NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000414315131 1022511686 /nfs/dbraw/zinc/51/16/86/1022511686.db2.gz RLXCVVWHBBPHCZ-UHFFFAOYSA-N 2 1 344.543 4.224 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310858203 1022521072 /nfs/dbraw/zinc/52/10/72/1022521072.db2.gz BYMOXHZFKZYYNU-GCJKJVERSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2nc3ccccc3[nH]2)CC1 ZINC000548157624 1022929197 /nfs/dbraw/zinc/92/91/97/1022929197.db2.gz CRSKPGJNUYBPQF-QGZVFWFLSA-N 2 1 340.515 4.039 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2nc3ccccc3[nH]2)CC1 ZINC000548157624 1022929212 /nfs/dbraw/zinc/92/92/12/1022929212.db2.gz CRSKPGJNUYBPQF-QGZVFWFLSA-N 2 1 340.515 4.039 20 0 EIADMP C[NH+](C)CC1CC[NH+](Cc2ccc(Cl)cc2C(F)(F)F)CC1 ZINC001143505829 1022963863 /nfs/dbraw/zinc/96/38/63/1022963863.db2.gz OZEQOXKZVJQOKZ-UHFFFAOYSA-N 2 1 334.813 4.132 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)[C@H]3C[C@@H]3c3cccs3)CC2)[nH+]c1 ZINC000367437840 1023032372 /nfs/dbraw/zinc/03/23/72/1023032372.db2.gz JVZSUWXYELHATF-NXHRZFHOSA-N 2 1 341.524 4.202 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)s1 ZINC000178224698 1023072741 /nfs/dbraw/zinc/07/27/41/1023072741.db2.gz XWMRDFNXFLRCEQ-CABCVRRESA-N 2 1 331.529 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)s1 ZINC000178224698 1023072748 /nfs/dbraw/zinc/07/27/48/1023072748.db2.gz XWMRDFNXFLRCEQ-CABCVRRESA-N 2 1 331.529 4.321 20 0 EIADMP C[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccc(O)c1 ZINC000178802298 1023176501 /nfs/dbraw/zinc/17/65/01/1023176501.db2.gz YRSNWUJNXAVPCB-ZNDGOPKYSA-N 2 1 336.479 4.238 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccc(O)c1 ZINC000178802298 1023176509 /nfs/dbraw/zinc/17/65/09/1023176509.db2.gz YRSNWUJNXAVPCB-ZNDGOPKYSA-N 2 1 336.479 4.238 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C[C@H](C)O1 ZINC000581501312 1023310583 /nfs/dbraw/zinc/31/05/83/1023310583.db2.gz QXPKIEPNPLZKIS-WJJPVSRMSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C[C@H](C)O1 ZINC000581501312 1023310595 /nfs/dbraw/zinc/31/05/95/1023310595.db2.gz QXPKIEPNPLZKIS-WJJPVSRMSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]([NH3+])[C@@H]1CC[N@@H+](Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000414663837 1023311969 /nfs/dbraw/zinc/31/19/69/1023311969.db2.gz RWETVPMXQOHTNH-NVXWUHKLSA-N 2 1 344.886 4.088 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](C(c2ccccc2)c2ccccc2)C1 ZINC000549140103 1023369068 /nfs/dbraw/zinc/36/90/68/1023369068.db2.gz ZFSBLKWZJDUZFA-FQEVSTJZSA-N 2 1 334.507 4.440 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000549140103 1023369073 /nfs/dbraw/zinc/36/90/73/1023369073.db2.gz ZFSBLKWZJDUZFA-FQEVSTJZSA-N 2 1 334.507 4.440 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000549140103 1023369083 /nfs/dbraw/zinc/36/90/83/1023369083.db2.gz ZFSBLKWZJDUZFA-FQEVSTJZSA-N 2 1 334.507 4.440 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CCCC[C@@H]3[C@H]3CC[NH2+]C3)s2)cc1 ZINC000415038598 1023403864 /nfs/dbraw/zinc/40/38/64/1023403864.db2.gz IABAIWHEXITKRM-PKOBYXMFSA-N 2 1 341.524 4.083 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000415078507 1023423165 /nfs/dbraw/zinc/42/31/65/1023423165.db2.gz GMVOBEPCFYCGHG-UCNVEGJOSA-N 2 1 346.478 4.016 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415083353 1023433420 /nfs/dbraw/zinc/43/34/20/1023433420.db2.gz NCWXBOMBWCRSTK-YSSFQJQWSA-N 2 1 326.871 4.410 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)CCCC1 ZINC000415094465 1023439711 /nfs/dbraw/zinc/43/97/11/1023439711.db2.gz XPJQTGISCNYBGH-PMACEKPBSA-N 2 1 330.516 4.056 20 0 EIADMP C[C@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccccc1OC(F)F ZINC000545519476 1023471132 /nfs/dbraw/zinc/47/11/32/1023471132.db2.gz MGWLLLPIHPIBQY-AWEZNQCLSA-N 2 1 326.431 4.061 20 0 EIADMP CC[C@H](c1ccc(Br)cc1)[N@@H+](C)C[C@@H]1CCCN(C)C1 ZINC000472737616 1023475732 /nfs/dbraw/zinc/47/57/32/1023475732.db2.gz KLPBVDSFEFTOMX-RHSMWYFYSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@H](c1ccc(Br)cc1)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000472737616 1023475737 /nfs/dbraw/zinc/47/57/37/1023475737.db2.gz KLPBVDSFEFTOMX-RHSMWYFYSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@H](c1ccc(Br)cc1)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000472737616 1023475742 /nfs/dbraw/zinc/47/57/42/1023475742.db2.gz KLPBVDSFEFTOMX-RHSMWYFYSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@H](c1ccc(Br)cc1)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000472737616 1023475750 /nfs/dbraw/zinc/47/57/50/1023475750.db2.gz KLPBVDSFEFTOMX-RHSMWYFYSA-N 2 1 339.321 4.174 20 0 EIADMP CC[C@H](c1ccc(Br)cc1)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000472737616 1023475754 /nfs/dbraw/zinc/47/57/54/1023475754.db2.gz KLPBVDSFEFTOMX-RHSMWYFYSA-N 2 1 339.321 4.174 20 0 EIADMP C[C@@H](C[N@@H+](C)CC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000500065105 1023480128 /nfs/dbraw/zinc/48/01/28/1023480128.db2.gz AVRPXSZPKJFLEA-AWEZNQCLSA-N 2 1 328.422 4.083 20 0 EIADMP Clc1ccc2cccnc2c1C[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656784132 1023529935 /nfs/dbraw/zinc/52/99/35/1023529935.db2.gz YWPQMKMRWWNJGL-KRWDZBQOSA-N 2 1 343.902 4.100 20 0 EIADMP CSc1ccc(C[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310079814 1023543952 /nfs/dbraw/zinc/54/39/52/1023543952.db2.gz IKJJDLZYSPYWFB-OAQYLSRUSA-N 2 1 340.536 4.410 20 0 EIADMP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)C1 ZINC000684370477 1023544853 /nfs/dbraw/zinc/54/48/53/1023544853.db2.gz VLQINWURUKZIDY-DUXKGJEZSA-N 2 1 330.516 4.108 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(SC)c(OC)c1 ZINC000191474608 1023550607 /nfs/dbraw/zinc/55/06/07/1023550607.db2.gz FTOALQVVTURELY-UHFFFAOYSA-N 2 1 347.528 4.088 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(SC)c(OC)c1 ZINC000191474608 1023550616 /nfs/dbraw/zinc/55/06/16/1023550616.db2.gz FTOALQVVTURELY-UHFFFAOYSA-N 2 1 347.528 4.088 20 0 EIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc(C)c1O ZINC000311195079 1023622480 /nfs/dbraw/zinc/62/24/80/1023622480.db2.gz HOSNHISJYLNCSV-HXUWFJFHSA-N 2 1 338.495 4.011 20 0 EIADMP Cc1ccc([C@H](C2CC2)[N@H+](C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1 ZINC000377688619 1023688030 /nfs/dbraw/zinc/68/80/30/1023688030.db2.gz AFPXSLHYNQRNEL-ZRBLBEILSA-N 2 1 349.522 4.466 20 0 EIADMP CCCCOc1cc(C[N@H+](C)C2CC[NH+](CCC)CC2)ccc1OC ZINC000510468590 1023778723 /nfs/dbraw/zinc/77/87/23/1023778723.db2.gz FMGDFDIZBAQEPO-UHFFFAOYSA-N 2 1 348.531 4.180 20 0 EIADMP CCCCOc1cc(C[N@@H+](C)C2CC[NH+](CCC)CC2)ccc1OC ZINC000510468590 1023778730 /nfs/dbraw/zinc/77/87/30/1023778730.db2.gz FMGDFDIZBAQEPO-UHFFFAOYSA-N 2 1 348.531 4.180 20 0 EIADMP C[C@H]([NH2+]CC1(C(F)(F)F)CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000367698016 1023885281 /nfs/dbraw/zinc/88/52/81/1023885281.db2.gz NRSJTAUFTYPQCW-RDJZCZTQSA-N 2 1 340.433 4.219 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccc(Br)cc1)C1CCC1 ZINC000341590834 1023899043 /nfs/dbraw/zinc/89/90/43/1023899043.db2.gz VRQZUPLZXRIPMR-QGZVFWFLSA-N 2 1 348.288 4.085 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccccc1OCc1ccccc1 ZINC000341591937 1023902133 /nfs/dbraw/zinc/90/21/33/1023902133.db2.gz WPMIHGIBIPPMMN-QGZVFWFLSA-N 2 1 335.451 4.121 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@H]2C)o1 ZINC000581948652 1023924258 /nfs/dbraw/zinc/92/42/58/1023924258.db2.gz VHXHHOFUDNIDJS-KUHUBIRLSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@H]2C)o1 ZINC000581948652 1023924262 /nfs/dbraw/zinc/92/42/62/1023924262.db2.gz VHXHHOFUDNIDJS-KUHUBIRLSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)o1 ZINC000581948652 1023924265 /nfs/dbraw/zinc/92/42/65/1023924265.db2.gz VHXHHOFUDNIDJS-KUHUBIRLSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)o1 ZINC000581948652 1023924271 /nfs/dbraw/zinc/92/42/71/1023924271.db2.gz VHXHHOFUDNIDJS-KUHUBIRLSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000510696133 1024241872 /nfs/dbraw/zinc/24/18/72/1024241872.db2.gz QALCQHGTNWGAMP-VGOFRKELSA-N 2 1 338.470 4.297 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000510696133 1024241888 /nfs/dbraw/zinc/24/18/88/1024241888.db2.gz QALCQHGTNWGAMP-VGOFRKELSA-N 2 1 338.470 4.297 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@H]([NH3+])[C@H](C)C3)s2)cc1 ZINC000430950047 1024266551 /nfs/dbraw/zinc/26/65/51/1024266551.db2.gz PPHIMICNLXDAGA-KDOFPFPSSA-N 2 1 329.513 4.103 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@H]([NH3+])[C@H](C)C3)s2)cc1 ZINC000430950047 1024266574 /nfs/dbraw/zinc/26/65/74/1024266574.db2.gz PPHIMICNLXDAGA-KDOFPFPSSA-N 2 1 329.513 4.103 20 0 EIADMP CCSc1cccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000473138877 1024382329 /nfs/dbraw/zinc/38/23/29/1024382329.db2.gz HGCCRADDZDMVMT-XLIONFOSSA-N 2 1 330.541 4.247 20 0 EIADMP CCSc1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000473138877 1024382347 /nfs/dbraw/zinc/38/23/47/1024382347.db2.gz HGCCRADDZDMVMT-XLIONFOSSA-N 2 1 330.541 4.247 20 0 EIADMP CCSc1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000473138877 1024382361 /nfs/dbraw/zinc/38/23/61/1024382361.db2.gz HGCCRADDZDMVMT-XLIONFOSSA-N 2 1 330.541 4.247 20 0 EIADMP Cc1ccc2[nH]c(C[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)cc2c1C ZINC000473146657 1024525322 /nfs/dbraw/zinc/52/53/22/1024525322.db2.gz NDWANXMKVIWYGT-GOSISDBHSA-N 2 1 325.500 4.093 20 0 EIADMP Cc1ccc2[nH]c(C[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)cc2c1C ZINC000473146657 1024525339 /nfs/dbraw/zinc/52/53/39/1024525339.db2.gz NDWANXMKVIWYGT-GOSISDBHSA-N 2 1 325.500 4.093 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccccc1OC(F)(F)F ZINC000164600916 1024669640 /nfs/dbraw/zinc/66/96/40/1024669640.db2.gz IPTJPFKSTGTQOX-ZDUSSCGKSA-N 2 1 341.377 4.221 20 0 EIADMP CC(C)c1ccc([C@H](C)[N@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)cc1 ZINC000652350439 1024702542 /nfs/dbraw/zinc/70/25/42/1024702542.db2.gz YMHSDDVBIKOYEF-VRXWPRPYSA-N 2 1 330.516 4.089 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CCN(Cc2cnc(-c3ccc(C)cc3)s2)C1 ZINC000093753219 1024843990 /nfs/dbraw/zinc/84/39/90/1024843990.db2.gz MWVKRALCKOSBHX-KRWDZBQOSA-N 2 1 343.540 4.282 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510967780 1024869974 /nfs/dbraw/zinc/86/99/74/1024869974.db2.gz NFQLLUKTGNDOSV-RXVVDRJESA-N 2 1 337.511 4.341 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510967780 1024869977 /nfs/dbraw/zinc/86/99/77/1024869977.db2.gz NFQLLUKTGNDOSV-RXVVDRJESA-N 2 1 337.511 4.341 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000249059197 1024875381 /nfs/dbraw/zinc/87/53/81/1024875381.db2.gz ZLRGILIFJDQZNB-OFNKIYASSA-N 2 1 349.522 4.088 20 0 EIADMP Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)Cc1cccc2c1CC[NH2+]C2 ZINC000662278575 1025024482 /nfs/dbraw/zinc/02/44/82/1025024482.db2.gz HELVGZNCAONQGR-HNNXBMFYSA-N 2 1 343.540 4.414 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2nc3ccccc3o2)CC1 ZINC000180981546 1025025814 /nfs/dbraw/zinc/02/58/14/1025025814.db2.gz BEOVRMWFSCDYQM-MRXNPFEDSA-N 2 1 329.488 4.333 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CCCc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000684613737 1025087117 /nfs/dbraw/zinc/08/71/17/1025087117.db2.gz KWQZEZWWMMSKHA-DYVFJYSZSA-N 2 1 329.315 4.246 20 0 EIADMP CC(C)(C)Oc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cn1 ZINC000181342073 1025163797 /nfs/dbraw/zinc/16/37/97/1025163797.db2.gz RRTBVEPVDJALKU-UHFFFAOYSA-N 2 1 345.531 4.146 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+]C2(Cc3ccccc3)CCCCC2)s1 ZINC000511973790 1025214615 /nfs/dbraw/zinc/21/46/15/1025214615.db2.gz PDWKBFNJYGQMCN-UHFFFAOYSA-N 2 1 343.540 4.240 20 0 EIADMP C[NH+]1CCC([C@@H]2CCN(c3cc[nH+]c4cc(Cl)ccc43)C2)CC1 ZINC000535911443 1025298896 /nfs/dbraw/zinc/29/88/96/1025298896.db2.gz XFCVLKVNQDURHC-OAHLLOKOSA-N 2 1 329.875 4.056 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cnc2ccsc2c1 ZINC000663470615 1025420491 /nfs/dbraw/zinc/42/04/91/1025420491.db2.gz VMOQNMWCNJMMKX-GOEBONIOSA-N 2 1 329.513 4.069 20 0 EIADMP Oc1cc(F)cc(C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)c1 ZINC000472056766 1025566299 /nfs/dbraw/zinc/56/62/99/1025566299.db2.gz ZGZRXLLUWVHUGY-UHFFFAOYSA-N 2 1 342.458 4.197 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1C[C@H]2[C@@H](C1)CCC[C@@H]2OCC1CC1 ZINC001167827670 1025665794 /nfs/dbraw/zinc/66/57/94/1025665794.db2.gz UNZHZGIPXRADAH-PBASOCQRSA-N 2 1 336.564 4.024 20 0 EIADMP CCC[C@@H](CCc1ccccc1)[NH2+]Cc1ncc(C[NH+](C)C)s1 ZINC000512022468 1025759244 /nfs/dbraw/zinc/75/92/44/1025759244.db2.gz GGQROFGUKNIASL-KRWDZBQOSA-N 2 1 331.529 4.096 20 0 EIADMP CN(CCSc1cccc(Cl)c1)CC[C@@H]1CCCC[N@H+]1C ZINC001167508630 1025770915 /nfs/dbraw/zinc/77/09/15/1025770915.db2.gz ILXUPWZJLPNARX-INIZCTEOSA-N 2 1 326.937 4.238 20 0 EIADMP C[N@H+](CCSc1cccc(Cl)c1)CC[C@@H]1CCCC[NH+]1C ZINC001167508630 1025770931 /nfs/dbraw/zinc/77/09/31/1025770931.db2.gz ILXUPWZJLPNARX-INIZCTEOSA-N 2 1 326.937 4.238 20 0 EIADMP C[N@@H+](CCSc1cccc(Cl)c1)CC[C@@H]1CCCC[NH+]1C ZINC001167508630 1025770957 /nfs/dbraw/zinc/77/09/57/1025770957.db2.gz ILXUPWZJLPNARX-INIZCTEOSA-N 2 1 326.937 4.238 20 0 EIADMP C[NH+](CCSc1cccc(Cl)c1)CC[C@@H]1CCCC[N@@H+]1C ZINC001167508630 1025770966 /nfs/dbraw/zinc/77/09/66/1025770966.db2.gz ILXUPWZJLPNARX-INIZCTEOSA-N 2 1 326.937 4.238 20 0 EIADMP C[NH+](CCSc1cccc(Cl)c1)CC[C@@H]1CCCC[N@H+]1C ZINC001167508630 1025771000 /nfs/dbraw/zinc/77/10/00/1025771000.db2.gz ILXUPWZJLPNARX-INIZCTEOSA-N 2 1 326.937 4.238 20 0 EIADMP CC(C)c1ccc(CCC[NH2+]Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000512027078 1025785434 /nfs/dbraw/zinc/78/54/34/1025785434.db2.gz SYGISJNTIMTBMZ-UHFFFAOYSA-N 2 1 331.529 4.051 20 0 EIADMP CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)[C@@H](C)CCC[NH+](CC)CC ZINC001167835291 1025835822 /nfs/dbraw/zinc/83/58/22/1025835822.db2.gz RBOJGSXQGMSUTF-ICSRJNTNSA-N 2 1 332.532 4.480 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1c1ccc(C(=O)OC)cc1 ZINC001167836396 1025846047 /nfs/dbraw/zinc/84/60/47/1025846047.db2.gz ZHBCKCYUTFODNU-PXNSSMCTSA-N 2 1 346.515 4.121 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001167836224 1025846271 /nfs/dbraw/zinc/84/62/71/1025846271.db2.gz XUJIZKVZKPHALS-LJQANCHMSA-N 2 1 337.596 4.226 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001167836224 1025846272 /nfs/dbraw/zinc/84/62/72/1025846272.db2.gz XUJIZKVZKPHALS-LJQANCHMSA-N 2 1 337.596 4.226 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001167836224 1025846273 /nfs/dbraw/zinc/84/62/73/1025846273.db2.gz XUJIZKVZKPHALS-LJQANCHMSA-N 2 1 337.596 4.226 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H](OCc2ccccc2)C1 ZINC001167837908 1025850356 /nfs/dbraw/zinc/85/03/56/1025850356.db2.gz NSONGBWXQUSDOW-CTNGQTDRSA-N 2 1 332.532 4.178 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCOC[C@H]1c1ccc(Cl)cc1 ZINC001167839894 1025854935 /nfs/dbraw/zinc/85/49/35/1025854935.db2.gz COSOXEBHSLPHAN-LPHOPBHVSA-N 2 1 338.923 4.224 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCOC[C@H]1c1ccc(Cl)cc1 ZINC001167839894 1025854932 /nfs/dbraw/zinc/85/49/32/1025854932.db2.gz COSOXEBHSLPHAN-LPHOPBHVSA-N 2 1 338.923 4.224 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](CCc1ccc(Cl)cc1)CC1CC1 ZINC000536475530 1025866483 /nfs/dbraw/zinc/86/64/83/1025866483.db2.gz INZJMLVTUIMBFW-UHFFFAOYSA-N 2 1 331.891 4.190 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](CCc1ccc(Cl)cc1)CC1CC1 ZINC000536475530 1025866492 /nfs/dbraw/zinc/86/64/92/1025866492.db2.gz INZJMLVTUIMBFW-UHFFFAOYSA-N 2 1 331.891 4.190 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC=C(c2ccc(OC)cc2)CC1 ZINC001167841354 1025882843 /nfs/dbraw/zinc/88/28/43/1025882843.db2.gz KXJAGGWCGCGYPS-SFHVURJKSA-N 2 1 330.516 4.295 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000432412234 1025883585 /nfs/dbraw/zinc/88/35/85/1025883585.db2.gz FSAQSRXSGVXEEL-QFBILLFUSA-N 2 1 338.923 4.128 20 0 EIADMP C[C@H]1C[N@H+](CCC[NH2+][C@@H](c2cccs2)C2CCCC2)CCCO1 ZINC000432418666 1025893015 /nfs/dbraw/zinc/89/30/15/1025893015.db2.gz UIBJZMVKKCLDMT-QFBILLFUSA-N 2 1 336.545 4.070 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+][C@@H](c2cccs2)C2CCCC2)CCCO1 ZINC000432418666 1025893017 /nfs/dbraw/zinc/89/30/17/1025893017.db2.gz UIBJZMVKKCLDMT-QFBILLFUSA-N 2 1 336.545 4.070 20 0 EIADMP Clc1cccc(CCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167968191 1025894589 /nfs/dbraw/zinc/89/45/89/1025894589.db2.gz NUCVMBLTLOOQOC-IHWFROFDSA-N 2 1 332.919 4.268 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167968911 1025935157 /nfs/dbraw/zinc/93/51/57/1025935157.db2.gz WSJOZLHANZAXER-KXZRCVDZSA-N 2 1 339.527 4.000 20 0 EIADMP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000582032426 1025995068 /nfs/dbraw/zinc/99/50/68/1025995068.db2.gz HPIUCIVEQPOBRU-XJABCFGWSA-N 2 1 338.495 4.051 20 0 EIADMP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000582032426 1025995108 /nfs/dbraw/zinc/99/51/08/1025995108.db2.gz HPIUCIVEQPOBRU-XJABCFGWSA-N 2 1 338.495 4.051 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H]2CCCC[C@H]2Cc2ccccc2)s1 ZINC000512135405 1026108403 /nfs/dbraw/zinc/10/84/03/1026108403.db2.gz JVHSKQHOKCTOAY-HKUYNNGSSA-N 2 1 343.540 4.096 20 0 EIADMP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ncc(C(C)(C)C)s2)c1 ZINC000279223167 1026218141 /nfs/dbraw/zinc/21/81/41/1026218141.db2.gz XNTPWYQVYDWGJH-UHFFFAOYSA-N 2 1 331.529 4.182 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ncc(C(C)(C)C)s2)c1 ZINC000279223167 1026218157 /nfs/dbraw/zinc/21/81/57/1026218157.db2.gz XNTPWYQVYDWGJH-UHFFFAOYSA-N 2 1 331.529 4.182 20 0 EIADMP Clc1cncc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)c1 ZINC001167975033 1026218927 /nfs/dbraw/zinc/21/89/27/1026218927.db2.gz FWGSBQPCHJIAKS-RAFMOHDBSA-N 2 1 345.918 4.181 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(C3CCC3)cc2)[C@H](C)C1 ZINC000550138375 1026224645 /nfs/dbraw/zinc/22/46/45/1026224645.db2.gz DKRAVRWHUSBTAN-XMSQKQJNSA-N 2 1 344.543 4.181 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CCCc2cnccc2C)CC1)CC1CC1 ZINC000582148847 1026258101 /nfs/dbraw/zinc/25/81/01/1026258101.db2.gz KKPCNNLASYHVLW-UHFFFAOYSA-N 2 1 343.559 4.157 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]([C@@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000342443094 1026300065 /nfs/dbraw/zinc/30/00/65/1026300065.db2.gz BJZNREBDONXISR-ZDUSSCGKSA-N 2 1 337.389 4.436 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]([C@@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000342443094 1026300075 /nfs/dbraw/zinc/30/00/75/1026300075.db2.gz BJZNREBDONXISR-ZDUSSCGKSA-N 2 1 337.389 4.436 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CCCS2 ZINC000152450343 1026574891 /nfs/dbraw/zinc/57/48/91/1026574891.db2.gz ZOTYRNXZXXDPND-CXAGYDPISA-N 2 1 336.932 4.341 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CCCS2 ZINC000152450135 1026575306 /nfs/dbraw/zinc/57/53/06/1026575306.db2.gz ZOTYRNXZXXDPND-SUMWQHHRSA-N 2 1 336.932 4.341 20 0 EIADMP CCOc1ccc([C@H](CC)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1OCC ZINC000152466836 1026586762 /nfs/dbraw/zinc/58/67/62/1026586762.db2.gz ULVCCFQPFKQDSA-APWZRJJASA-N 2 1 346.515 4.009 20 0 EIADMP C[C@H](NCc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccn1 ZINC000158671002 1026621589 /nfs/dbraw/zinc/62/15/89/1026621589.db2.gz AQWCYSGSEPENMI-OTWHNJEPSA-N 2 1 337.511 4.410 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccccn1 ZINC000158671002 1026621596 /nfs/dbraw/zinc/62/15/96/1026621596.db2.gz AQWCYSGSEPENMI-OTWHNJEPSA-N 2 1 337.511 4.410 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccn1 ZINC000158671002 1026621603 /nfs/dbraw/zinc/62/16/03/1026621603.db2.gz AQWCYSGSEPENMI-OTWHNJEPSA-N 2 1 337.511 4.410 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(OC(C)C)c(Cl)c1 ZINC000342603541 1026723000 /nfs/dbraw/zinc/72/30/00/1026723000.db2.gz XRWIUKNNUPPPAD-AWEZNQCLSA-N 2 1 335.879 4.373 20 0 EIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000507507622 1026821441 /nfs/dbraw/zinc/82/14/41/1026821441.db2.gz IOOLLBJQJRQTIL-CADBVGFASA-N 2 1 334.454 4.065 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OC(C)C)c(OC)c2)CC1 ZINC000125275063 1026821960 /nfs/dbraw/zinc/82/19/60/1026821960.db2.gz CXXPZFLECIADAD-INIZCTEOSA-N 2 1 334.504 4.007 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)c(C)c1 ZINC000152870296 1026858162 /nfs/dbraw/zinc/85/81/62/1026858162.db2.gz OAKNZHMBNHFLHE-IBGZPJMESA-N 2 1 337.511 4.056 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@H]3CCCc4cccnc43)cc2)C1 ZINC000684954074 1026888568 /nfs/dbraw/zinc/88/85/68/1026888568.db2.gz PJDFCSLTKCFGES-AVRDEDQJSA-N 2 1 349.522 4.481 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1ccncc1 ZINC000582664257 1026914700 /nfs/dbraw/zinc/91/47/00/1026914700.db2.gz CKYKUFOZCXIROC-RTWAWAEBSA-N 2 1 335.495 4.320 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1ccncc1 ZINC000582664257 1026914709 /nfs/dbraw/zinc/91/47/09/1026914709.db2.gz CKYKUFOZCXIROC-RTWAWAEBSA-N 2 1 335.495 4.320 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2noc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000657534228 1026985688 /nfs/dbraw/zinc/98/56/88/1026985688.db2.gz UTBJKTNWFAJNQO-MJGOQNOKSA-N 2 1 349.478 4.013 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2noc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000657534228 1026985701 /nfs/dbraw/zinc/98/57/01/1026985701.db2.gz UTBJKTNWFAJNQO-MJGOQNOKSA-N 2 1 349.478 4.013 20 0 EIADMP FC(F)(F)c1cccc(CCCC[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000474470002 1027095978 /nfs/dbraw/zinc/09/59/78/1027095978.db2.gz CYJYJKDSTSAWOZ-ROUUACIJSA-N 2 1 340.433 4.245 20 0 EIADMP FC(F)(F)c1ccc2c(c1)[nH+]ccc2N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000301986911 1027174757 /nfs/dbraw/zinc/17/47/57/1027174757.db2.gz MTXAPCNOKJGDAO-HNNXBMFYSA-N 2 1 349.400 4.318 20 0 EIADMP Cc1ccc2[nH+]ccc(NCCc3[nH+]ccn3Cc3ccccc3)c2c1 ZINC000302137808 1027229852 /nfs/dbraw/zinc/22/98/52/1027229852.db2.gz CBDRQXMXWIWYEM-UHFFFAOYSA-N 2 1 342.446 4.443 20 0 EIADMP Cc1cc2c(cn1)[C@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C1)CC2 ZINC001168037448 1027252859 /nfs/dbraw/zinc/25/28/59/1027252859.db2.gz YNXQNUNCCVXXKE-NNTZPNAXSA-N 2 1 349.522 4.409 20 0 EIADMP CC[N@H+](CCCn1cc[nH+]c1C)Cc1ccc(Cl)c(Cl)c1 ZINC000342856601 1027319253 /nfs/dbraw/zinc/31/92/53/1027319253.db2.gz FPGJUIVBXRQKJR-UHFFFAOYSA-N 2 1 326.271 4.411 20 0 EIADMP CC[N@@H+](CCCn1cc[nH+]c1C)Cc1ccc(Cl)c(Cl)c1 ZINC000342856601 1027319271 /nfs/dbraw/zinc/31/92/71/1027319271.db2.gz FPGJUIVBXRQKJR-UHFFFAOYSA-N 2 1 326.271 4.411 20 0 EIADMP Cc1ccc(-c2n[nH]cc2C[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1 ZINC000520212200 1027323122 /nfs/dbraw/zinc/32/31/22/1027323122.db2.gz SUMLLSWCIUVREF-UHFFFAOYSA-N 2 1 340.515 4.129 20 0 EIADMP Cc1ccc(-c2n[nH]cc2C[NH2+]CCC[N@H+](C)C2CCCCC2)cc1 ZINC000520212200 1027323141 /nfs/dbraw/zinc/32/31/41/1027323141.db2.gz SUMLLSWCIUVREF-UHFFFAOYSA-N 2 1 340.515 4.129 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CSc3ccccc32)C[C@@H]1c1ccccc1 ZINC000453217924 1027339261 /nfs/dbraw/zinc/33/92/61/1027339261.db2.gz JPMCNZVXWICEMB-CMKODMSKSA-N 2 1 338.520 4.301 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CSc3ccccc32)C[C@@H]1c1ccccc1 ZINC000453217924 1027339272 /nfs/dbraw/zinc/33/92/72/1027339272.db2.gz JPMCNZVXWICEMB-CMKODMSKSA-N 2 1 338.520 4.301 20 0 EIADMP C[C@H]1CC([N@H+]2CCc3ccccc3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039975 1027351815 /nfs/dbraw/zinc/35/18/15/1027351815.db2.gz JEZKLHMOMIMYEP-OALUTQOASA-N 2 1 334.507 4.486 20 0 EIADMP CN1CCC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c2ccccc21 ZINC000453348351 1027416408 /nfs/dbraw/zinc/41/64/08/1027416408.db2.gz GCYYCWMHUNINKH-RRPUWOKSSA-N 2 1 349.522 4.383 20 0 EIADMP CN1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c2ccccc21 ZINC000453348351 1027416420 /nfs/dbraw/zinc/41/64/20/1027416420.db2.gz GCYYCWMHUNINKH-RRPUWOKSSA-N 2 1 349.522 4.383 20 0 EIADMP CN1CCC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c2ccccc21 ZINC000453348349 1027417510 /nfs/dbraw/zinc/41/75/10/1027417510.db2.gz GCYYCWMHUNINKH-IEIRFRATSA-N 2 1 349.522 4.383 20 0 EIADMP CN1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c2ccccc21 ZINC000453348349 1027417523 /nfs/dbraw/zinc/41/75/23/1027417523.db2.gz GCYYCWMHUNINKH-IEIRFRATSA-N 2 1 349.522 4.383 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1)c1ccccc1 ZINC000153465303 1027474411 /nfs/dbraw/zinc/47/44/11/1027474411.db2.gz GQXFIXXRVNQOTE-GCJKJVERSA-N 2 1 338.495 4.148 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@H](C)C2)c1)c1ccccc1 ZINC000153465303 1027474419 /nfs/dbraw/zinc/47/44/19/1027474419.db2.gz GQXFIXXRVNQOTE-GCJKJVERSA-N 2 1 338.495 4.148 20 0 EIADMP Cc1cc(C)cc(OCCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441400059 1027523904 /nfs/dbraw/zinc/52/39/04/1027523904.db2.gz ZAPWJDIBLAJDMK-DENIHFKCSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441400059 1027523910 /nfs/dbraw/zinc/52/39/10/1027523910.db2.gz ZAPWJDIBLAJDMK-DENIHFKCSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441400059 1027523923 /nfs/dbraw/zinc/52/39/23/1027523923.db2.gz ZAPWJDIBLAJDMK-DENIHFKCSA-N 2 1 342.527 4.021 20 0 EIADMP Cc1cc(C)cc(OCCC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000441400059 1027523935 /nfs/dbraw/zinc/52/39/35/1027523935.db2.gz ZAPWJDIBLAJDMK-DENIHFKCSA-N 2 1 342.527 4.021 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC[N@H+]1C ZINC000474813336 1027536977 /nfs/dbraw/zinc/53/69/77/1027536977.db2.gz GVCJIMONCACQAH-HIFRSBDPSA-N 2 1 329.315 4.388 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000474818035 1027539281 /nfs/dbraw/zinc/53/92/81/1027539281.db2.gz RJOIYUWTFAWKDB-RHSMWYFYSA-N 2 1 328.422 4.100 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2cccc(Br)c21 ZINC000152452862 1027596621 /nfs/dbraw/zinc/59/66/21/1027596621.db2.gz KVIRHUJTDJHUEY-IIYDPXPESA-N 2 1 349.316 4.071 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1CCSCC1 ZINC000474879490 1027710155 /nfs/dbraw/zinc/71/01/55/1027710155.db2.gz QSEBCSBXVSYDQW-HBFSDRIKSA-N 2 1 346.584 4.408 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@@H]3CCC[C@H](CC(C)C)C3)CC2)nc(C)[nH+]1 ZINC000474881715 1027726816 /nfs/dbraw/zinc/72/68/16/1027726816.db2.gz WKXKXQNNSOLCBV-UYAOXDASSA-N 2 1 344.547 4.257 20 0 EIADMP CC(C)[C@H](C[NH2+]CC1([NH+]2CCCCC2)CCOCC1)c1ccccc1 ZINC000474893266 1027744736 /nfs/dbraw/zinc/74/47/36/1027744736.db2.gz XAMDXSLIQFLAIK-NRFANRHFSA-N 2 1 344.543 4.051 20 0 EIADMP C[N@@H+](CCc1ccccc1Cl)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995402 1027756409 /nfs/dbraw/zinc/75/64/09/1027756409.db2.gz DRHTXJWREUTILX-DFNIBXOVSA-N 2 1 332.919 4.220 20 0 EIADMP C[NH+](CCc1ccccc1Cl)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167995402 1027756433 /nfs/dbraw/zinc/75/64/33/1027756433.db2.gz DRHTXJWREUTILX-DFNIBXOVSA-N 2 1 332.919 4.220 20 0 EIADMP C[NH+](CCc1ccccc1Cl)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167995402 1027756451 /nfs/dbraw/zinc/75/64/51/1027756451.db2.gz DRHTXJWREUTILX-DFNIBXOVSA-N 2 1 332.919 4.220 20 0 EIADMP Cc1cc(C[N@@H+]2CCC[NH2+]CC2)cc(C)c1-c1ccc(F)cc1F ZINC001204685110 1027781666 /nfs/dbraw/zinc/78/16/66/1027781666.db2.gz TWYGZKOWQBNTPJ-UHFFFAOYSA-N 2 1 330.422 4.044 20 0 EIADMP Cc1cc(C[N@H+]2CCC[NH2+]CC2)cc(C)c1-c1ccc(F)cc1F ZINC001204685110 1027781680 /nfs/dbraw/zinc/78/16/80/1027781680.db2.gz TWYGZKOWQBNTPJ-UHFFFAOYSA-N 2 1 330.422 4.044 20 0 EIADMP CCCc1nc(C)c(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)o1 ZINC000428366738 1027803917 /nfs/dbraw/zinc/80/39/17/1027803917.db2.gz ZABQIFAWVPZULD-QGZVFWFLSA-N 2 1 347.547 4.412 20 0 EIADMP C[N@@H+]1CC[C@H]2CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000474924702 1027805483 /nfs/dbraw/zinc/80/54/83/1027805483.db2.gz IRVJRCALAQBJGG-YJBOKZPZSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@H]2CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000474924702 1027805490 /nfs/dbraw/zinc/80/54/90/1027805490.db2.gz IRVJRCALAQBJGG-YJBOKZPZSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@H+](CCCCc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000474924702 1027805492 /nfs/dbraw/zinc/80/54/92/1027805492.db2.gz IRVJRCALAQBJGG-YJBOKZPZSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2CC[N@@H+](CCCCc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000474924702 1027805496 /nfs/dbraw/zinc/80/54/96/1027805496.db2.gz IRVJRCALAQBJGG-YJBOKZPZSA-N 2 1 341.326 4.342 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2cc(F)cc(F)c2)cc1F ZINC000153716792 1027885985 /nfs/dbraw/zinc/88/59/85/1027885985.db2.gz GUBAOGKNYZAQDG-GFCCVEGCSA-N 2 1 345.368 4.449 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000520460118 1028047304 /nfs/dbraw/zinc/04/73/04/1028047304.db2.gz XUCYOUUHUYTUOZ-LJISPDSOSA-N 2 1 326.937 4.213 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+]C3CC[NH+](C4CC4)CC3)cc2)c1 ZINC000443965812 1028155506 /nfs/dbraw/zinc/15/55/06/1028155506.db2.gz KSEUAXOLZRRNBD-UHFFFAOYSA-N 2 1 340.442 4.334 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000583174987 1028173704 /nfs/dbraw/zinc/17/37/04/1028173704.db2.gz LTXNOSJHYOIEIJ-AKMXKPQHSA-N 2 1 338.442 4.107 20 0 EIADMP C/C(=C/c1ccccc1OC(F)F)C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000583174987 1028173712 /nfs/dbraw/zinc/17/37/12/1028173712.db2.gz LTXNOSJHYOIEIJ-AKMXKPQHSA-N 2 1 338.442 4.107 20 0 EIADMP CCc1ccc(C[NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)o1 ZINC000150830369 1028254537 /nfs/dbraw/zinc/25/45/37/1028254537.db2.gz ACDLGHACUBPLSL-UHFFFAOYSA-N 2 1 338.451 4.357 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H]1c1cccc(C)c1 ZINC000346164582 1028300944 /nfs/dbraw/zinc/30/09/44/1028300944.db2.gz DJZGMCXOHVNMMR-NRFANRHFSA-N 2 1 332.451 4.221 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@H](c1ccccc1)C(C)C ZINC000346178406 1028307537 /nfs/dbraw/zinc/30/75/37/1028307537.db2.gz PRNARHNAGNXDDS-NRFANRHFSA-N 2 1 334.467 4.405 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000346207113 1028329733 /nfs/dbraw/zinc/32/97/33/1028329733.db2.gz MCOSMCTXVJPVJN-HNNXBMFYSA-N 2 1 340.858 4.422 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000346350245 1028384245 /nfs/dbraw/zinc/38/42/45/1028384245.db2.gz JTRFTWXYTDLOFE-YUQDSPFASA-N 2 1 344.462 4.254 20 0 EIADMP COCc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)o1 ZINC000125542690 1028424552 /nfs/dbraw/zinc/42/45/52/1028424552.db2.gz SXQBWCJXHLDYGP-QGZVFWFLSA-N 2 1 342.483 4.090 20 0 EIADMP COCc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)o1 ZINC000125542690 1028424562 /nfs/dbraw/zinc/42/45/62/1028424562.db2.gz SXQBWCJXHLDYGP-QGZVFWFLSA-N 2 1 342.483 4.090 20 0 EIADMP COc1ccc([C@H](CC(C)C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000647289981 1028654343 /nfs/dbraw/zinc/65/43/43/1028654343.db2.gz ROIHIWCHMAUNSZ-FQEVSTJZSA-N 2 1 329.488 4.357 20 0 EIADMP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1cnc(C(F)(F)F)s1 ZINC000444003989 1028724305 /nfs/dbraw/zinc/72/43/05/1028724305.db2.gz PLORCEVWLPETJA-TZMCWYRMSA-N 2 1 349.466 4.152 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)Cc1cccc(C(F)(F)F)c1 ZINC000281603242 1028801819 /nfs/dbraw/zinc/80/18/19/1028801819.db2.gz MHJLOHPDKMOOPV-AWEZNQCLSA-N 2 1 339.405 4.211 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CNc2ccccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000635021329 1028830925 /nfs/dbraw/zinc/83/09/25/1028830925.db2.gz NXESBSKLAMBYHW-SESVDKBCSA-N 2 1 349.522 4.086 20 0 EIADMP CC(C)O[C@H](C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000428326125 1028879688 /nfs/dbraw/zinc/87/96/88/1028879688.db2.gz OMVAWMLDOVTIHS-SYYKKAFVSA-N 2 1 344.543 4.395 20 0 EIADMP C[C@H]([NH2+]CCCc1c[nH+]cn1C)c1cccc(OCc2ccccc2)c1 ZINC000583572573 1028882465 /nfs/dbraw/zinc/88/24/65/1028882465.db2.gz PERMNZNSONLRLK-SFHVURJKSA-N 2 1 349.478 4.283 20 0 EIADMP FC1(F)CCC([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC000657771850 1028891233 /nfs/dbraw/zinc/89/12/33/1028891233.db2.gz HHNHMSVAPPAUOG-SFHVURJKSA-N 2 1 348.481 4.456 20 0 EIADMP CC(C)OC1CC[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168050736 1028911859 /nfs/dbraw/zinc/91/18/59/1028911859.db2.gz CODMMJPJPLSGLX-CEQLMSFQSA-N 2 1 344.543 4.317 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH+]3CCC[C@H](C(C)(C)C)C3)sc2C1 ZINC000475634084 1028912645 /nfs/dbraw/zinc/91/26/45/1028912645.db2.gz ZMFQJYUGNJSAOV-HNNXBMFYSA-N 2 1 335.561 4.168 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH+]3CCC[C@H](C(C)(C)C)C3)sc2C1 ZINC000475634084 1028912671 /nfs/dbraw/zinc/91/26/71/1028912671.db2.gz ZMFQJYUGNJSAOV-HNNXBMFYSA-N 2 1 335.561 4.168 20 0 EIADMP CC(C)[NH+]1CCc2nc(C[N@@H+]3CCC[C@H](C(C)(C)C)C3)sc2C1 ZINC000475634084 1028912680 /nfs/dbraw/zinc/91/26/80/1028912680.db2.gz ZMFQJYUGNJSAOV-HNNXBMFYSA-N 2 1 335.561 4.168 20 0 EIADMP CC(C)[NH+]1CCc2nc(C[N@H+]3CCC[C@H](C(C)(C)C)C3)sc2C1 ZINC000475634084 1028912700 /nfs/dbraw/zinc/91/27/00/1028912700.db2.gz ZMFQJYUGNJSAOV-HNNXBMFYSA-N 2 1 335.561 4.168 20 0 EIADMP CCCCCOc1ccc(C[N@H+]2CCCC23CC[NH+](C)CC3)cc1 ZINC000475125803 1029281702 /nfs/dbraw/zinc/28/17/02/1029281702.db2.gz WOQMZFWEOBLSDF-UHFFFAOYSA-N 2 1 330.516 4.316 20 0 EIADMP CCCN(CCC[NH+](C)C)[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168056818 1029313362 /nfs/dbraw/zinc/31/33/62/1029313362.db2.gz ITDSZQIWIRWWHC-VTYHHJSWSA-N 2 1 345.575 4.092 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)cc1 ZINC000278532057 1029436427 /nfs/dbraw/zinc/43/64/27/1029436427.db2.gz UHSAKHNDUQIBTQ-INIZCTEOSA-N 2 1 346.478 4.305 20 0 EIADMP CCOCC1CC[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168059677 1029440834 /nfs/dbraw/zinc/44/08/34/1029440834.db2.gz GHENJZRINXOISQ-HATOLVCRSA-N 2 1 344.543 4.177 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2c(OC(F)F)ccc3ccccc32)CC[N@@H+]1C ZINC000525195098 1029519184 /nfs/dbraw/zinc/51/91/84/1029519184.db2.gz PBLMXMVQPXKHGJ-UKRRQHHQSA-N 2 1 334.410 4.014 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2c(OC(F)F)ccc3ccccc32)CC[N@H+]1C ZINC000525195098 1029519193 /nfs/dbraw/zinc/51/91/93/1029519193.db2.gz PBLMXMVQPXKHGJ-UKRRQHHQSA-N 2 1 334.410 4.014 20 0 EIADMP CC[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](CC)CC1 ZINC000657824194 1029585283 /nfs/dbraw/zinc/58/52/83/1029585283.db2.gz DMEUJWLQRHDPMF-INIZCTEOSA-N 2 1 328.422 4.100 20 0 EIADMP CC(C)[N@H+](C1CCOCC1)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168063621 1029613328 /nfs/dbraw/zinc/61/33/28/1029613328.db2.gz DARLQSCIEDFXRE-RTBURBONSA-N 2 1 344.543 4.317 20 0 EIADMP CC(C)[N@@H+](C1CCOCC1)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168063621 1029613338 /nfs/dbraw/zinc/61/33/38/1029613338.db2.gz DARLQSCIEDFXRE-RTBURBONSA-N 2 1 344.543 4.317 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000657841285 1029755012 /nfs/dbraw/zinc/75/50/12/1029755012.db2.gz OPFNPJMHCNKEAE-TZMCWYRMSA-N 2 1 348.840 4.221 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)C(C)(C)C(F)F)cc1F ZINC000657852481 1029809864 /nfs/dbraw/zinc/80/98/64/1029809864.db2.gz USLYMGMBZFZXAW-LLVKDONJSA-N 2 1 325.378 4.089 20 0 EIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000081632085 1029810950 /nfs/dbraw/zinc/81/09/50/1029810950.db2.gz ULNWZQRTQPIOOM-MRXNPFEDSA-N 2 1 343.902 4.052 20 0 EIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000081632085 1029810953 /nfs/dbraw/zinc/81/09/53/1029810953.db2.gz ULNWZQRTQPIOOM-MRXNPFEDSA-N 2 1 343.902 4.052 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000081632085 1029810956 /nfs/dbraw/zinc/81/09/56/1029810956.db2.gz ULNWZQRTQPIOOM-MRXNPFEDSA-N 2 1 343.902 4.052 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000081632085 1029810958 /nfs/dbraw/zinc/81/09/58/1029810958.db2.gz ULNWZQRTQPIOOM-MRXNPFEDSA-N 2 1 343.902 4.052 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccc(OC)c(OC)c1 ZINC000090586285 1029867695 /nfs/dbraw/zinc/86/76/95/1029867695.db2.gz ZLTFGVIRUJHFKJ-MJGOQNOKSA-N 2 1 348.531 4.113 20 0 EIADMP CC[NH+](CC)CCCC1CCN(C[C@@H]2CCCC[N@@H+]2C(C)C)CC1 ZINC000450722132 1029916507 /nfs/dbraw/zinc/91/65/07/1029916507.db2.gz ZGLGKRSIXXCLBP-NRFANRHFSA-N 2 1 337.596 4.083 20 0 EIADMP CC[NH+](CC)CCCC1CCN(C[C@@H]2CCCC[N@H+]2C(C)C)CC1 ZINC000450722132 1029916521 /nfs/dbraw/zinc/91/65/21/1029916521.db2.gz ZGLGKRSIXXCLBP-NRFANRHFSA-N 2 1 337.596 4.083 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1ccc(F)cn1 ZINC000092739199 1029932547 /nfs/dbraw/zinc/93/25/47/1029932547.db2.gz IINWQCKZOMSQAU-SJORKVTESA-N 2 1 341.474 4.446 20 0 EIADMP Cc1ccoc1C[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000525694530 1029935128 /nfs/dbraw/zinc/93/51/28/1029935128.db2.gz ACCDUGKHDOTXJL-CALCHBBNSA-N 2 1 326.484 4.356 20 0 EIADMP CC[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1OC ZINC000183187539 1029992810 /nfs/dbraw/zinc/99/28/10/1029992810.db2.gz UNTAPTLJWLZMII-MBOZVWFJSA-N 2 1 330.516 4.389 20 0 EIADMP Cc1ncsc1CN(C)C[C@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC000450875809 1030076646 /nfs/dbraw/zinc/07/66/46/1030076646.db2.gz OETMKJFRHIZBPB-GOSISDBHSA-N 2 1 333.545 4.096 20 0 EIADMP Cc1ncsc1CN(C)C[C@@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC000450875821 1030077286 /nfs/dbraw/zinc/07/72/86/1030077286.db2.gz OETMKJFRHIZBPB-SFHVURJKSA-N 2 1 333.545 4.096 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)[C@@H](C)c1nc2ccccc2s1 ZINC000121472666 1030121311 /nfs/dbraw/zinc/12/13/11/1030121311.db2.gz CJEHZSJWGWLJNW-KFWWJZLASA-N 2 1 342.512 4.219 20 0 EIADMP FC1(F)CCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000447577525 1030205815 /nfs/dbraw/zinc/20/58/15/1030205815.db2.gz AKLJDXZMSMXKRW-LDLYASANSA-N 2 1 334.454 4.350 20 0 EIADMP Clc1ccc2c(c1)CC[C@H]2[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000530217933 1030225084 /nfs/dbraw/zinc/22/50/84/1030225084.db2.gz CUYJBJOIXGCIRF-RLLQIKCJSA-N 2 1 326.871 4.410 20 0 EIADMP Cc1cnccc1OC1CCN(c2ccnc3cc(F)ccc32)CC1 ZINC000447684022 1030271621 /nfs/dbraw/zinc/27/16/21/1030271621.db2.gz WERNPUIQWUGNIH-UHFFFAOYSA-N 2 1 337.398 4.125 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000237322845 1030281050 /nfs/dbraw/zinc/28/10/50/1030281050.db2.gz QXWQNYLNEPISBC-UHFFFAOYSA-N 2 1 326.484 4.201 20 0 EIADMP C[C@@H]([NH2+]CCc1ccc(F)c(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527041848 1030422411 /nfs/dbraw/zinc/42/24/11/1030422411.db2.gz BSTWTEHIJUHSFI-VQIMIIECSA-N 2 1 344.449 4.008 20 0 EIADMP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)CCO1 ZINC000648423712 1030441201 /nfs/dbraw/zinc/44/12/01/1030441201.db2.gz WUALTKPMLVBRDW-DUXKGJEZSA-N 2 1 330.516 4.108 20 0 EIADMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cnn1C(C)(C)C ZINC000191325764 1030616980 /nfs/dbraw/zinc/61/69/80/1030616980.db2.gz JLNLOWYSWRGGMH-MRXNPFEDSA-N 2 1 346.563 4.394 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCCSCC2)C[N@H+]1Cc1ccccc1 ZINC000657934215 1030632481 /nfs/dbraw/zinc/63/24/81/1030632481.db2.gz ZZRLTWMYIHHYPQ-MISYRCLQSA-N 2 1 332.557 4.162 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000548851784 1030632514 /nfs/dbraw/zinc/63/25/14/1030632514.db2.gz FHCPGEDZZOCZAD-LTBFUDJGSA-N 2 1 326.406 4.040 20 0 EIADMP COCC1(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCCCC1 ZINC000685665272 1030663155 /nfs/dbraw/zinc/66/31/55/1030663155.db2.gz QERVGKLNGHBMDL-CTNGQTDRSA-N 2 1 344.543 4.084 20 0 EIADMP CCOc1ccccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398026957 1030686915 /nfs/dbraw/zinc/68/69/15/1030686915.db2.gz CPJUQOZVXCPTBP-GHTZIAJQSA-N 2 1 338.495 4.086 20 0 EIADMP CCOc1ccccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398026957 1030686921 /nfs/dbraw/zinc/68/69/21/1030686921.db2.gz CPJUQOZVXCPTBP-GHTZIAJQSA-N 2 1 338.495 4.086 20 0 EIADMP Cc1cc(F)ccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398051031 1030693764 /nfs/dbraw/zinc/69/37/64/1030693764.db2.gz XSMZPGYZINEKAE-DYESRHJHSA-N 2 1 326.459 4.134 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCc2c1cccc2F ZINC000398131416 1030713911 /nfs/dbraw/zinc/71/39/11/1030713911.db2.gz JQSJITNNAOJIFK-XGRCMKMKSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCc2c1cccc2F ZINC000398131416 1030713935 /nfs/dbraw/zinc/71/39/35/1030713935.db2.gz JQSJITNNAOJIFK-XGRCMKMKSA-N 2 1 338.470 4.313 20 0 EIADMP Brc1ccc(/C=C/CC[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000527741682 1030838912 /nfs/dbraw/zinc/83/89/12/1030838912.db2.gz AEKFDMYGDLWECB-HNBCNZSYSA-N 2 1 349.316 4.069 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ncc(-c3cccc(F)c3)o2)CC1 ZINC000531107712 1030880717 /nfs/dbraw/zinc/88/07/17/1030880717.db2.gz KCDQOBDZDILYMM-UHFFFAOYSA-N 2 1 345.462 4.033 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccccn1 ZINC000658320162 1030978736 /nfs/dbraw/zinc/97/87/36/1030978736.db2.gz OVZJZDZZTIAJMU-UYAOXDASSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccccn1 ZINC000658320162 1030978754 /nfs/dbraw/zinc/97/87/54/1030978754.db2.gz OVZJZDZZTIAJMU-UYAOXDASSA-N 2 1 335.495 4.035 20 0 EIADMP Cc1cncc([C@@H](C)[NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000658320180 1030980598 /nfs/dbraw/zinc/98/05/98/1030980598.db2.gz PLRQHZYWPSYAOD-DENIHFKCSA-N 2 1 349.522 4.343 20 0 EIADMP C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527964488 1031006204 /nfs/dbraw/zinc/00/62/04/1031006204.db2.gz KSCRHKLTRJXPFS-ZEYPLWLESA-N 2 1 349.522 4.423 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CSCCc2ccccc21 ZINC000532459796 1031100284 /nfs/dbraw/zinc/10/02/84/1031100284.db2.gz MGUXAHSFRAMYGF-PXNSSMCTSA-N 2 1 332.557 4.261 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](Cc1ccc(Cl)cc1)c1ccccc1 ZINC000532494789 1031234991 /nfs/dbraw/zinc/23/49/91/1031234991.db2.gz DDYFWDKOMACAGC-HXUWFJFHSA-N 2 1 339.870 4.419 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@@H](C)[C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000532514292 1031245124 /nfs/dbraw/zinc/24/51/24/1031245124.db2.gz GIXISHXEKCNYDD-MOPGFXCFSA-N 2 1 344.543 4.192 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)C2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000897451800 1031341856 /nfs/dbraw/zinc/34/18/56/1031341856.db2.gz QCJCPMQDXFCAAO-NQIIRXRSSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)C2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000897451800 1031341871 /nfs/dbraw/zinc/34/18/71/1031341871.db2.gz QCJCPMQDXFCAAO-NQIIRXRSSA-N 2 1 344.543 4.082 20 0 EIADMP Clc1ccc(C[C@@H]2CCC[C@H]2[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000449071472 1031423159 /nfs/dbraw/zinc/42/31/59/1031423159.db2.gz NYIYDNSDLNVTOK-OXJNMPFZSA-N 2 1 332.919 4.268 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cc2cccnc2o1 ZINC000449080974 1031437189 /nfs/dbraw/zinc/43/71/89/1031437189.db2.gz ATIQUIDCLZEUSB-QGZVFWFLSA-N 2 1 349.478 4.492 20 0 EIADMP COc1cc(C)ccc1C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000449098405 1031441689 /nfs/dbraw/zinc/44/16/89/1031441689.db2.gz JGHDBKOIDDNKPS-UHFFFAOYSA-N 2 1 326.484 4.134 20 0 EIADMP Clc1ccc(C2=CC[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000449089122 1031449457 /nfs/dbraw/zinc/44/94/57/1031449457.db2.gz JICCKKQQTOBXDY-XUVXKRRUSA-N 2 1 330.903 4.492 20 0 EIADMP Clc1ccc(C[C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000449090466 1031449896 /nfs/dbraw/zinc/44/98/96/1031449896.db2.gz NDBVQOMVJODAMD-FFGOWVMKSA-N 2 1 332.919 4.268 20 0 EIADMP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000531678116 1031470878 /nfs/dbraw/zinc/47/08/78/1031470878.db2.gz VRROQNAPIHJLCV-ZHRRBRCNSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CSCCc3ccccc32)C1 ZINC000531681415 1031473464 /nfs/dbraw/zinc/47/34/64/1031473464.db2.gz VHWIFIOIVVOQKZ-XLIONFOSSA-N 2 1 332.557 4.119 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)C1CCOCC1 ZINC000531682142 1031473779 /nfs/dbraw/zinc/47/37/79/1031473779.db2.gz HNOMNZUCSCQWCA-PGRDOPGGSA-N 2 1 344.543 4.356 20 0 EIADMP COc1cc(F)cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1 ZINC000449159597 1031486836 /nfs/dbraw/zinc/48/68/36/1031486836.db2.gz HPGBTQXJUOGYQK-DNVCBOLYSA-N 2 1 348.487 4.069 20 0 EIADMP COc1cc(F)cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1 ZINC000449159597 1031486858 /nfs/dbraw/zinc/48/68/58/1031486858.db2.gz HPGBTQXJUOGYQK-DNVCBOLYSA-N 2 1 348.487 4.069 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)c1 ZINC000123913889 1031491610 /nfs/dbraw/zinc/49/16/10/1031491610.db2.gz FAZSWWPAVZOLEF-FQEVSTJZSA-N 2 1 342.458 4.281 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3cc(C)ccc32)c1 ZINC000123914216 1031493148 /nfs/dbraw/zinc/49/31/48/1031493148.db2.gz SOTGBNULVKXIRS-OAQYLSRUSA-N 2 1 338.495 4.450 20 0 EIADMP C[NH+]1CCC([NH2+][C@H](Cc2ccccc2Cl)c2ccsc2)CC1 ZINC000453098614 1031558077 /nfs/dbraw/zinc/55/80/77/1031558077.db2.gz VJNXRVOCNDWBAD-GOSISDBHSA-N 2 1 334.916 4.369 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccccc2Oc2cccnc2)C[C@H]1C ZINC000531140008 1031583933 /nfs/dbraw/zinc/58/39/33/1031583933.db2.gz SFKMHDRSDYQSHV-MJGOQNOKSA-N 2 1 339.483 4.179 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2Oc2cccnc2)C[C@H]1C ZINC000531140008 1031583940 /nfs/dbraw/zinc/58/39/40/1031583940.db2.gz SFKMHDRSDYQSHV-MJGOQNOKSA-N 2 1 339.483 4.179 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2Oc2cccnc2)C[C@H]1C ZINC000531140008 1031583948 /nfs/dbraw/zinc/58/39/48/1031583948.db2.gz SFKMHDRSDYQSHV-MJGOQNOKSA-N 2 1 339.483 4.179 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2Oc2cccnc2)C[C@H]1C ZINC000531140008 1031583952 /nfs/dbraw/zinc/58/39/52/1031583952.db2.gz SFKMHDRSDYQSHV-MJGOQNOKSA-N 2 1 339.483 4.179 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1cccc(OC(F)(F)F)c1 ZINC000125354463 1031590286 /nfs/dbraw/zinc/59/02/86/1031590286.db2.gz HHAUUWJZDBUTDE-UHFFFAOYSA-N 2 1 341.377 4.002 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1cccc(OC(F)(F)F)c1 ZINC000125354463 1031590299 /nfs/dbraw/zinc/59/02/99/1031590299.db2.gz HHAUUWJZDBUTDE-UHFFFAOYSA-N 2 1 341.377 4.002 20 0 EIADMP C[C@@H](Cc1ccoc1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000449307334 1031613352 /nfs/dbraw/zinc/61/33/52/1031613352.db2.gz OVJRKERVUWOMJD-PXNSSMCTSA-N 2 1 326.484 4.101 20 0 EIADMP C[C@@H](Cc1ccoc1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000449307334 1031613359 /nfs/dbraw/zinc/61/33/59/1031613359.db2.gz OVJRKERVUWOMJD-PXNSSMCTSA-N 2 1 326.484 4.101 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000125892469 1031621587 /nfs/dbraw/zinc/62/15/87/1031621587.db2.gz DAWSDYWFVDZYSA-IEBWSBKVSA-N 2 1 328.500 4.143 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000125892469 1031621599 /nfs/dbraw/zinc/62/15/99/1031621599.db2.gz DAWSDYWFVDZYSA-IEBWSBKVSA-N 2 1 328.500 4.143 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1)c1cccc(Cl)c1 ZINC000375979329 1031641977 /nfs/dbraw/zinc/64/19/77/1031641977.db2.gz DPJUGSTWYJJNMN-BPAFIMBUSA-N 2 1 343.902 4.121 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)c1cccc(Cl)c1 ZINC000375979329 1031641989 /nfs/dbraw/zinc/64/19/89/1031641989.db2.gz DPJUGSTWYJJNMN-BPAFIMBUSA-N 2 1 343.902 4.121 20 0 EIADMP CC1(C)C[N@@H+](Cc2cccnc2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449413591 1031696407 /nfs/dbraw/zinc/69/64/07/1031696407.db2.gz JLEQUDOGHOUGMZ-JOCHJYFZSA-N 2 1 349.522 4.204 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c(C)s1 ZINC000128088394 1031722876 /nfs/dbraw/zinc/72/28/76/1031722876.db2.gz AIRVXDGFLMGPBL-HNNXBMFYSA-N 2 1 329.513 4.388 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1cc(F)ccc1F ZINC000128119677 1031728160 /nfs/dbraw/zinc/72/81/60/1031728160.db2.gz UEQROEHJQATOOV-LJQANCHMSA-N 2 1 345.437 4.378 20 0 EIADMP FC(F)C1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)CC1 ZINC000453228680 1031749282 /nfs/dbraw/zinc/74/92/82/1031749282.db2.gz UTBGRQFFYXVERG-KZNAEPCWSA-N 2 1 334.454 4.065 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)C1CCOCC1 ZINC000531947153 1031859375 /nfs/dbraw/zinc/85/93/75/1031859375.db2.gz HNGSHGJGTZTUDG-XMSQKQJNSA-N 2 1 344.543 4.213 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+]C3CC[NH+](C(C)C)CC3)cc2)cs1 ZINC000531954645 1031869806 /nfs/dbraw/zinc/86/98/06/1031869806.db2.gz QVZUQMQFZWNMEC-UHFFFAOYSA-N 2 1 329.513 4.081 20 0 EIADMP CCN(c1ccccc1)c1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000531980329 1031928448 /nfs/dbraw/zinc/92/84/48/1031928448.db2.gz ZZLICZRAQDKBBY-QUCCMNQESA-N 2 1 337.511 4.417 20 0 EIADMP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000453419656 1031973087 /nfs/dbraw/zinc/97/30/87/1031973087.db2.gz VVKSITMDZXNWTP-PVIWCNJMSA-N 2 1 342.527 4.119 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(OC(F)(F)F)cc1 ZINC000453420100 1031975355 /nfs/dbraw/zinc/97/53/55/1031975355.db2.gz ZCLSHIBLHNIXJP-ZDUSSCGKSA-N 2 1 330.394 4.110 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)CCCS2 ZINC000453420456 1031975755 /nfs/dbraw/zinc/97/57/55/1031975755.db2.gz ZOWYIZKDDDQTEQ-SFHVURJKSA-N 2 1 334.529 4.086 20 0 EIADMP Cc1cnc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)s1 ZINC000411545856 1033978171 /nfs/dbraw/zinc/97/81/71/1033978171.db2.gz YLFKJSKYNQZTBW-INIZCTEOSA-N 2 1 329.513 4.288 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000512848749 1034066600 /nfs/dbraw/zinc/06/66/00/1034066600.db2.gz JDDDYIBUQDHLRE-CQSZACIVSA-N 2 1 334.916 4.500 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2cc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000513053794 1034373251 /nfs/dbraw/zinc/37/32/51/1034373251.db2.gz YIPUERXUFQKWHR-YLJYHZDGSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+]Cc2ccc(Cl)o2)C[N@H+]1Cc1ccccc1 ZINC000513501544 1034998093 /nfs/dbraw/zinc/99/80/93/1034998093.db2.gz TVTQRHXIURNJQL-RDJZCZTQSA-N 2 1 332.875 4.323 20 0 EIADMP CCc1ncc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)s1 ZINC000513500613 1034999358 /nfs/dbraw/zinc/99/93/58/1034999358.db2.gz NMKKXRFBVBDCFV-SJLPKXTDSA-N 2 1 343.540 4.096 20 0 EIADMP COc1cccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000513510916 1035006578 /nfs/dbraw/zinc/00/65/78/1035006578.db2.gz GNHOOBOTGVCYPJ-WIYYLYMNSA-N 2 1 338.495 4.086 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cc(Cl)ccc1OCC1CC1 ZINC000430016582 1035009851 /nfs/dbraw/zinc/00/98/51/1035009851.db2.gz GDSUUVRNJWUQHZ-AWEZNQCLSA-N 2 1 347.890 4.060 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000414170130 1035057039 /nfs/dbraw/zinc/05/70/39/1035057039.db2.gz BRWLMMLYWXWXTK-CABCVRRESA-N 2 1 342.499 4.426 20 0 EIADMP C[C@@H](CCc1ccccc1)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501066456 1035366262 /nfs/dbraw/zinc/36/62/62/1035366262.db2.gz CQJSPKUHTYTRKQ-IBGZPJMESA-N 2 1 337.511 4.251 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)[C@H]2CCC[C@@H]21 ZINC000513712196 1035425120 /nfs/dbraw/zinc/42/51/20/1035425120.db2.gz AJPCAEFOAIROLQ-SQNIBIBYSA-N 2 1 340.433 4.100 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000501423737 1035444063 /nfs/dbraw/zinc/44/40/63/1035444063.db2.gz OJDHFAZUHJSFJS-RBFDBLARSA-N 2 1 340.433 4.430 20 0 EIADMP CSCC1(CC[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000595067423 1035552235 /nfs/dbraw/zinc/55/22/35/1035552235.db2.gz ILNPRTXKAGURLZ-IEBWSBKVSA-N 2 1 332.557 4.020 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000595073425 1035555105 /nfs/dbraw/zinc/55/51/05/1035555105.db2.gz SLDWDSCGUNGRBI-HKUYNNGSSA-N 2 1 332.557 4.020 20 0 EIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C2)c(C)c1 ZINC000629561779 1035829833 /nfs/dbraw/zinc/82/98/33/1035829833.db2.gz KKJWUZKTAKQDHN-JYJNAYRXSA-N 2 1 328.422 4.132 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1 ZINC000502452273 1036224173 /nfs/dbraw/zinc/22/41/73/1036224173.db2.gz MJPVPWYTKLPIJQ-SESVDKBCSA-N 2 1 344.543 4.445 20 0 EIADMP C[C@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cnn(C2CCCC2)c1 ZINC000502469654 1036247492 /nfs/dbraw/zinc/24/74/92/1036247492.db2.gz CWWZEARNNUJVNN-OKZBNKHCSA-N 2 1 344.547 4.302 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cnn(C2CCCC2)c1 ZINC000502469654 1036247510 /nfs/dbraw/zinc/24/75/10/1036247510.db2.gz CWWZEARNNUJVNN-OKZBNKHCSA-N 2 1 344.547 4.302 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cnn(C2CCCC2)c1 ZINC000502469654 1036247536 /nfs/dbraw/zinc/24/75/36/1036247536.db2.gz CWWZEARNNUJVNN-OKZBNKHCSA-N 2 1 344.547 4.302 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000669614721 1036254385 /nfs/dbraw/zinc/25/43/85/1036254385.db2.gz JIOUIVXMJVFUMP-UWWQBHOKSA-N 2 1 340.433 4.273 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000669614718 1036255457 /nfs/dbraw/zinc/25/54/57/1036255457.db2.gz JIOUIVXMJVFUMP-HFTRVMKXSA-N 2 1 340.433 4.273 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000669614720 1036255536 /nfs/dbraw/zinc/25/55/36/1036255536.db2.gz JIOUIVXMJVFUMP-QGPMSJSTSA-N 2 1 340.433 4.273 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502729032 1036592859 /nfs/dbraw/zinc/59/28/59/1036592859.db2.gz VICITSWNRADEPX-MSOLQXFVSA-N 2 1 332.536 4.161 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000502881364 1036766840 /nfs/dbraw/zinc/76/68/40/1036766840.db2.gz QKVGLKGXSJGKQX-HXUWFJFHSA-N 2 1 331.479 4.310 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000502881364 1036766857 /nfs/dbraw/zinc/76/68/57/1036766857.db2.gz QKVGLKGXSJGKQX-HXUWFJFHSA-N 2 1 331.479 4.310 20 0 EIADMP COC1([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCC1 ZINC000421829858 1036789036 /nfs/dbraw/zinc/78/90/36/1036789036.db2.gz JALFRUNWCQLYIF-XSLAUPDRSA-N 2 1 342.527 4.119 20 0 EIADMP COc1cccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1F ZINC000669679259 1036820613 /nfs/dbraw/zinc/82/06/13/1036820613.db2.gz AWBDBYZQUXEGTC-UHFFFAOYSA-N 2 1 342.458 4.110 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cc(F)cc(F)c2)CC1 ZINC000513761780 1036882420 /nfs/dbraw/zinc/88/24/20/1036882420.db2.gz OLIOQHCIFAZRBF-UHFFFAOYSA-N 2 1 344.449 4.498 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@](C)(CCc2ccccc2)C1 ZINC000503079156 1036895441 /nfs/dbraw/zinc/89/54/41/1036895441.db2.gz CHZKSPVKWSPWJW-OAQYLSRUSA-N 2 1 325.500 4.317 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@](C)(CCc2ccccc2)C1 ZINC000503079156 1036895447 /nfs/dbraw/zinc/89/54/47/1036895447.db2.gz CHZKSPVKWSPWJW-OAQYLSRUSA-N 2 1 325.500 4.317 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C/C=C\c1ccncc1 ZINC000486944397 1036899310 /nfs/dbraw/zinc/89/93/10/1036899310.db2.gz PMNQBJUKCOWGFW-QJSCKGPTSA-N 2 1 335.495 4.259 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C/C=C\c2ccncc2)cc1 ZINC000486965478 1036905942 /nfs/dbraw/zinc/90/59/42/1036905942.db2.gz JGTXQNGCAIFUJG-UTSMFGRCSA-N 2 1 335.495 4.259 20 0 EIADMP CC[N@@H+](CCO[C@@H]1CCCC[C@@H]1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999650 1036918678 /nfs/dbraw/zinc/91/86/78/1036918678.db2.gz QIMFCIVCMWQDNE-GHTZIAJQSA-N 2 1 332.532 4.165 20 0 EIADMP C[N@@H+](CCc1ccc(C(F)(F)F)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168397977 1036975085 /nfs/dbraw/zinc/97/50/85/1036975085.db2.gz RFTQFFJMTPWMOR-UHFFFAOYSA-N 2 1 340.433 4.054 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C3CC[NH+](C4CCC4)CC3)oc21 ZINC000271854483 1037035329 /nfs/dbraw/zinc/03/53/29/1037035329.db2.gz JELDBBCMLNJMAT-AWEZNQCLSA-N 2 1 328.456 4.109 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cccc(OC(F)(F)F)c2)C1 ZINC000590301380 1037038380 /nfs/dbraw/zinc/03/83/80/1037038380.db2.gz CLJYQADKTALOFP-OAHLLOKOSA-N 2 1 344.421 4.187 20 0 EIADMP Clc1ccc(C2([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)cc1Cl ZINC000272025618 1037082995 /nfs/dbraw/zinc/08/29/95/1037082995.db2.gz YRSFKTINSHIBJO-ZIAGYGMSSA-N 2 1 325.283 4.199 20 0 EIADMP Clc1ccc(C2([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1Cl ZINC000272025618 1037083012 /nfs/dbraw/zinc/08/30/12/1037083012.db2.gz YRSFKTINSHIBJO-ZIAGYGMSSA-N 2 1 325.283 4.199 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000590786794 1037167618 /nfs/dbraw/zinc/16/76/18/1037167618.db2.gz MVVYREKJTTYVIO-UHFFFAOYSA-N 2 1 328.422 4.258 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000590819075 1037182856 /nfs/dbraw/zinc/18/28/56/1037182856.db2.gz ZXFSWIAJEPUNIM-UHFFFAOYSA-N 2 1 344.421 4.137 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=[NH2+])Nc2ccccc2)cc1 ZINC000057887899 1037290158 /nfs/dbraw/zinc/29/01/58/1037290158.db2.gz BROGNUAVQBKVEE-KRWDZBQOSA-N 2 1 336.483 4.197 20 0 EIADMP FC(F)(F)c1ccc(C[NH2+]C2CC[NH+]([C@H]3C[C@H]4C[C@H]4C3)CC2)cc1 ZINC001167948345 1037429521 /nfs/dbraw/zinc/42/95/21/1037429521.db2.gz MIKGEOSNROBENV-HWWDLCQESA-N 2 1 338.417 4.058 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCSc2ccccc2)C1 ZINC000605151024 1037694201 /nfs/dbraw/zinc/69/42/01/1037694201.db2.gz ZBNXNYDZWXHKGP-RBUKOAKNSA-N 2 1 332.557 4.365 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCSc2ccccc2)C1 ZINC000605151024 1037694207 /nfs/dbraw/zinc/69/42/07/1037694207.db2.gz ZBNXNYDZWXHKGP-RBUKOAKNSA-N 2 1 332.557 4.365 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCSc2ccccc2)C1 ZINC000605151024 1037694216 /nfs/dbraw/zinc/69/42/16/1037694216.db2.gz ZBNXNYDZWXHKGP-RBUKOAKNSA-N 2 1 332.557 4.365 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCSc2ccccc2)C1 ZINC000605151024 1037694222 /nfs/dbraw/zinc/69/42/22/1037694222.db2.gz ZBNXNYDZWXHKGP-RBUKOAKNSA-N 2 1 332.557 4.365 20 0 EIADMP Cc1nc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)oc1-c1ccc(Cl)cc1 ZINC000422625614 1037783248 /nfs/dbraw/zinc/78/32/48/1037783248.db2.gz BZDKDVQCACVCHK-IOASZLSFSA-N 2 1 347.890 4.109 20 0 EIADMP Cc1nc(C[N@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)oc1-c1ccc(Cl)cc1 ZINC000422625614 1037783265 /nfs/dbraw/zinc/78/32/65/1037783265.db2.gz BZDKDVQCACVCHK-IOASZLSFSA-N 2 1 347.890 4.109 20 0 EIADMP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C1CCN([C@@H](C)c2ccccc2)CC1 ZINC000422740251 1037822805 /nfs/dbraw/zinc/82/28/05/1037822805.db2.gz BJZHZMNFODVQQN-DXIQSLLYSA-N 2 1 343.559 4.112 20 0 EIADMP CC[C@@H]1C[C@H](C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000503572727 1037823632 /nfs/dbraw/zinc/82/36/32/1037823632.db2.gz HHKMJPMHYLVUCB-PSWRPDDJSA-N 2 1 344.543 4.082 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)cc1OCC ZINC000422751006 1037825339 /nfs/dbraw/zinc/82/53/39/1037825339.db2.gz FDKWSUWNPMNXGM-JVPBZIDWSA-N 2 1 340.467 4.279 20 0 EIADMP CC1CC[NH+](Cc2ccc(C[NH2+][C@H]3C[C@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000422800322 1037835714 /nfs/dbraw/zinc/83/57/14/1037835714.db2.gz BGIKWOZIMUEWGY-GOTSBHOMSA-N 3 1 349.522 4.153 20 0 EIADMP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000422801908 1037836311 /nfs/dbraw/zinc/83/63/11/1037836311.db2.gz COECIXQKVGXKCO-GHMZBOCLSA-N 2 1 343.418 4.044 20 0 EIADMP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c2ccccc21 ZINC000422792884 1037840598 /nfs/dbraw/zinc/84/05/98/1037840598.db2.gz ZYSCPOHCGXBQJG-DHIUTWEWSA-N 3 1 349.522 4.297 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CN[C@@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000422874196 1037858798 /nfs/dbraw/zinc/85/87/98/1037858798.db2.gz CGFMFZGQGORYSN-MQNAVGNWSA-N 2 1 349.522 4.153 20 0 EIADMP Cc1sc(C[NH2+][C@@H]2CC[NH2+]CC[C@@H]2C)nc1-c1ccc(Cl)cc1 ZINC000422936812 1037875882 /nfs/dbraw/zinc/87/58/82/1037875882.db2.gz BYWIITNKEJFSLI-BLLLJJGKSA-N 2 1 349.931 4.250 20 0 EIADMP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000423000441 1037897142 /nfs/dbraw/zinc/89/71/42/1037897142.db2.gz ZDUTZOCMFAUMBZ-QMMMGPOBSA-N 2 1 330.284 4.068 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c2ccccc21 ZINC000423019751 1037907689 /nfs/dbraw/zinc/90/76/89/1037907689.db2.gz WZVNPLBIODRIHF-YDZRNGNQSA-N 2 1 346.833 4.044 20 0 EIADMP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423052559 1037938454 /nfs/dbraw/zinc/93/84/54/1037938454.db2.gz QSANYEQCZBHXHY-YWPYICTPSA-N 2 1 333.476 4.042 20 0 EIADMP COCCC[C@H](C[NH2+][C@H](C)c1c[nH+]ccc1N)c1ccc(Cl)cc1 ZINC000423108390 1037980591 /nfs/dbraw/zinc/98/05/91/1037980591.db2.gz RDOQSNXLDIRKOU-GDBMZVCRSA-N 2 1 347.890 4.009 20 0 EIADMP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(Cl)c(Cl)c1 ZINC000423187181 1038043175 /nfs/dbraw/zinc/04/31/75/1038043175.db2.gz MEABVSSRIXJSMR-ZDUSSCGKSA-N 2 1 338.282 4.219 20 0 EIADMP Clc1cccc([C@H]2CC[C@H]([NH2+]CCC[NH2+]Cc3cccnc3)C2)c1 ZINC000423191780 1038045540 /nfs/dbraw/zinc/04/55/40/1038045540.db2.gz TYPBVVVFUXXWPC-ICSRJNTNSA-N 2 1 343.902 4.141 20 0 EIADMP FC(F)(F)c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000606447672 1038069029 /nfs/dbraw/zinc/06/90/29/1038069029.db2.gz JSZXLVDFUFWENS-KRWDZBQOSA-N 2 1 326.406 4.156 20 0 EIADMP FC(F)(F)c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000606447672 1038069052 /nfs/dbraw/zinc/06/90/52/1038069052.db2.gz JSZXLVDFUFWENS-KRWDZBQOSA-N 2 1 326.406 4.156 20 0 EIADMP Cc1cccc(C)c1OCCC[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000606447864 1038069811 /nfs/dbraw/zinc/06/98/11/1038069811.db2.gz IOHLNUHWUFGOFQ-FQEVSTJZSA-N 2 1 330.516 4.023 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)NC[C@H]([NH3+])c1ccccc1 ZINC000423246120 1038077337 /nfs/dbraw/zinc/07/73/37/1038077337.db2.gz PHILJKRCFDWWEB-KDOFPFPSSA-N 2 1 337.492 4.469 20 0 EIADMP CCC([NH3+])(CC)C[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423287649 1038093328 /nfs/dbraw/zinc/09/33/28/1038093328.db2.gz NSZAPNLFZQACRC-SFHVURJKSA-N 2 1 331.891 4.126 20 0 EIADMP Cc1ccc(C)c(OCCC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000606540423 1038126856 /nfs/dbraw/zinc/12/68/56/1038126856.db2.gz NHVPYCPJCNUKGF-HXUWFJFHSA-N 2 1 330.516 4.023 20 0 EIADMP Cc1cc(C(C)(C)C)cc2c1OCCC[C@H]2[NH2+]C1CC[NH+](C)CC1 ZINC000489562186 1038138356 /nfs/dbraw/zinc/13/83/56/1038138356.db2.gz UUCILHDININVKC-LJQANCHMSA-N 2 1 330.516 4.190 20 0 EIADMP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423435287 1038236694 /nfs/dbraw/zinc/23/66/94/1038236694.db2.gz DNIZTMRGBXCOEW-HLTSFMKQSA-N 2 1 328.300 4.111 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)oc1C ZINC000423477977 1038253025 /nfs/dbraw/zinc/25/30/25/1038253025.db2.gz SRWCFJMWMJADHZ-UCLAIMLFSA-N 2 1 330.447 4.079 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423511979 1038267006 /nfs/dbraw/zinc/26/70/06/1038267006.db2.gz UFQIKIJLTMIGEE-HTAPYJJXSA-N 3 1 348.494 4.312 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1Cl ZINC000539052648 1038801086 /nfs/dbraw/zinc/80/10/86/1038801086.db2.gz NXEMFGUBIGTKKJ-HZPDHXFCSA-N 2 1 338.923 4.367 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@H]1Cc1ccccc1 ZINC000539088420 1038830255 /nfs/dbraw/zinc/83/02/55/1038830255.db2.gz SHKGEYDSSOOHOU-QQUTXWOLSA-N 2 1 334.507 4.118 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@H]1Cc1ccccc1 ZINC000539088420 1038830258 /nfs/dbraw/zinc/83/02/58/1038830258.db2.gz SHKGEYDSSOOHOU-QQUTXWOLSA-N 2 1 334.507 4.118 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(C)cc2C)[C@H](C)C1 ZINC000480887604 1038853602 /nfs/dbraw/zinc/85/36/02/1038853602.db2.gz FMIFRNMICOYHPG-DYXWJJEUSA-N 2 1 332.532 4.091 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000539162850 1038865638 /nfs/dbraw/zinc/86/56/38/1038865638.db2.gz MLXCARWRSAMKGX-KBXCAEBGSA-N 2 1 340.433 4.476 20 0 EIADMP Clc1ccc([C@H]([NH2+]CC2([NH+]3CCCC3)CCOCC2)C2CC2)cc1 ZINC000539200334 1038877298 /nfs/dbraw/zinc/87/72/98/1038877298.db2.gz FFSXCDQUVVZOMW-LJQANCHMSA-N 2 1 348.918 4.026 20 0 EIADMP CC[N@H+](Cc1cccc2cc[nH]c21)CC1CCN(c2ccccn2)CC1 ZINC000537617398 1038899044 /nfs/dbraw/zinc/89/90/44/1038899044.db2.gz IUPAVVGEMCQHIB-UHFFFAOYSA-N 2 1 348.494 4.301 20 0 EIADMP C[NH+]1CCC([NH2+][C@H]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000462122742 1038941171 /nfs/dbraw/zinc/94/11/71/1038941171.db2.gz UCEDIHGBYAPWMH-MSOLQXFVSA-N 2 1 340.433 4.415 20 0 EIADMP C[C@H](c1cccc(Br)c1)[N@@H+](C)C1CCC([NH+](C)C)CC1 ZINC001168328748 1038946739 /nfs/dbraw/zinc/94/67/39/1038946739.db2.gz CAXJOUQSNDZUNR-NVPAJSRCSA-N 2 1 339.321 4.315 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000481032538 1038955469 /nfs/dbraw/zinc/95/54/69/1038955469.db2.gz FCQMNYNJJPNSKN-OXJNMPFZSA-N 2 1 328.525 4.003 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555232555 1038999968 /nfs/dbraw/zinc/99/99/68/1038999968.db2.gz HVPRVHXZAGIKNW-NMTNEYKDSA-N 2 1 348.534 4.333 20 0 EIADMP Cc1cccnc1[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)C(C)C ZINC000120458465 1039115003 /nfs/dbraw/zinc/11/50/03/1039115003.db2.gz KAHFGFZKGXCMKB-FQEVSTJZSA-N 2 1 329.532 4.474 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)s1 ZINC000090406548 1039222030 /nfs/dbraw/zinc/22/20/30/1039222030.db2.gz HMAZGXVJIRAFOE-ZFWWWQNUSA-N 2 1 335.542 4.076 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc3ccccc3c2OC(F)F)C1 ZINC000481296911 1039235976 /nfs/dbraw/zinc/23/59/76/1039235976.db2.gz BDIMYOLMVBQDEG-CABCVRRESA-N 2 1 348.437 4.434 20 0 EIADMP Clc1c[nH+]ccc1N1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534244325 1039242145 /nfs/dbraw/zinc/24/21/45/1039242145.db2.gz UQNVRKNHAGAZAH-UHFFFAOYSA-N 2 1 341.886 4.228 20 0 EIADMP Clc1c[nH+]ccc1N1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000534244325 1039242168 /nfs/dbraw/zinc/24/21/68/1039242168.db2.gz UQNVRKNHAGAZAH-UHFFFAOYSA-N 2 1 341.886 4.228 20 0 EIADMP CSCc1cccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550795724 1039301676 /nfs/dbraw/zinc/30/16/76/1039301676.db2.gz XBCGODVDJSZLJG-RTWAWAEBSA-N 2 1 340.536 4.475 20 0 EIADMP CSCc1cccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550795724 1039301696 /nfs/dbraw/zinc/30/16/96/1039301696.db2.gz XBCGODVDJSZLJG-RTWAWAEBSA-N 2 1 340.536 4.475 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]C3CC[NH+](C4CCC4)CC3)c(C)c2c1 ZINC000481436785 1039410186 /nfs/dbraw/zinc/41/01/86/1039410186.db2.gz OXYHFNQTODJPMH-OAHLLOKOSA-N 2 1 342.483 4.417 20 0 EIADMP CCC[C@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CCOC)c1ccccc1 ZINC000552392094 1039444639 /nfs/dbraw/zinc/44/46/39/1039444639.db2.gz GGYJHKJKEKNJBM-IZCSPVGOSA-N 2 1 344.543 4.144 20 0 EIADMP CCC[C@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2CCOC)c1ccccc1 ZINC000552392094 1039444667 /nfs/dbraw/zinc/44/46/67/1039444667.db2.gz GGYJHKJKEKNJBM-IZCSPVGOSA-N 2 1 344.543 4.144 20 0 EIADMP CCC[C@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CCOC)c1ccccc1 ZINC000552392094 1039444700 /nfs/dbraw/zinc/44/47/00/1039444700.db2.gz GGYJHKJKEKNJBM-IZCSPVGOSA-N 2 1 344.543 4.144 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc3ccccc3s2)[C@@H](C)C1 ZINC000550856240 1039653156 /nfs/dbraw/zinc/65/31/56/1039653156.db2.gz ITARHSAFPBFCMO-QFBILLFUSA-N 2 1 346.540 4.128 20 0 EIADMP C[N@@H+](CC1CCN(c2cc[nH+]cc2)CC1)C[C@H]1CCCC(F)(F)C1 ZINC000514145209 1039655534 /nfs/dbraw/zinc/65/55/34/1039655534.db2.gz LQLODPYZYOTTRC-KRWDZBQOSA-N 2 1 337.458 4.055 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCOc2c(C)cc(Cl)cc21 ZINC000122475422 1039726653 /nfs/dbraw/zinc/72/66/53/1039726653.db2.gz SBRPJJPTCZMEBW-SFHVURJKSA-N 2 1 347.890 4.437 20 0 EIADMP C[NH+](C)CC(C)(C)C[NH2+]Cc1c(OC(F)F)ccc2ccccc21 ZINC000060816789 1039755688 /nfs/dbraw/zinc/75/56/88/1039755688.db2.gz NWHNPFRCOHQZTF-UHFFFAOYSA-N 2 1 336.426 4.119 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537647471 1039808158 /nfs/dbraw/zinc/80/81/58/1039808158.db2.gz OGEZZRWBZKTVDE-SFHVURJKSA-N 2 1 326.484 4.012 20 0 EIADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000430110656 1039850262 /nfs/dbraw/zinc/85/02/62/1039850262.db2.gz ZSFFOHDWTDLZHQ-PKOBYXMFSA-N 2 1 336.470 4.122 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000430110656 1039850263 /nfs/dbraw/zinc/85/02/63/1039850263.db2.gz ZSFFOHDWTDLZHQ-PKOBYXMFSA-N 2 1 336.470 4.122 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000430110656 1039850264 /nfs/dbraw/zinc/85/02/64/1039850264.db2.gz ZSFFOHDWTDLZHQ-PKOBYXMFSA-N 2 1 336.470 4.122 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000430110656 1039850266 /nfs/dbraw/zinc/85/02/66/1039850266.db2.gz ZSFFOHDWTDLZHQ-PKOBYXMFSA-N 2 1 336.470 4.122 20 0 EIADMP CN1CC[C@H]([NH2+]Cc2ccccc2OC(F)F)C[C@@H]1c1ccccc1 ZINC000550990268 1039855748 /nfs/dbraw/zinc/85/57/48/1039855748.db2.gz FZBNQKFQXNIYJC-ZWKOTPCHSA-N 2 1 346.421 4.213 20 0 EIADMP Cc1cccc(OC[C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551004982 1039867277 /nfs/dbraw/zinc/86/72/77/1039867277.db2.gz CEBLAGYSNCSKAI-VCOUNFBDSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1cccc(OC[C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551004982 1039867279 /nfs/dbraw/zinc/86/72/79/1039867279.db2.gz CEBLAGYSNCSKAI-VCOUNFBDSA-N 2 1 338.495 4.187 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)s2)C[C@H]1c1ccccc1 ZINC000551012533 1039874314 /nfs/dbraw/zinc/87/43/14/1039874314.db2.gz RPYKINXGHQDCQT-WBVHZDCISA-N 2 1 334.916 4.369 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)s2)C[C@H]1c1ccccc1 ZINC000551012533 1039874316 /nfs/dbraw/zinc/87/43/16/1039874316.db2.gz RPYKINXGHQDCQT-WBVHZDCISA-N 2 1 334.916 4.369 20 0 EIADMP c1c2ccccc2sc1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000537692196 1039906497 /nfs/dbraw/zinc/90/64/97/1039906497.db2.gz GKCMHQRFDBPXSI-QFBILLFUSA-N 2 1 326.509 4.350 20 0 EIADMP c1c2ccccc2sc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000537692196 1039906520 /nfs/dbraw/zinc/90/65/20/1039906520.db2.gz GKCMHQRFDBPXSI-QFBILLFUSA-N 2 1 326.509 4.350 20 0 EIADMP c1c2ccccc2sc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000537692196 1039906539 /nfs/dbraw/zinc/90/65/39/1039906539.db2.gz GKCMHQRFDBPXSI-QFBILLFUSA-N 2 1 326.509 4.350 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OCC)c(OCC)c2)CC1 ZINC000481973096 1039922065 /nfs/dbraw/zinc/92/20/65/1039922065.db2.gz OYSMLJKLDAIPSN-QGZVFWFLSA-N 2 1 348.531 4.399 20 0 EIADMP Cc1cc2[nH]c(C[N@@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)cc2c(C)c1 ZINC000481989922 1039930046 /nfs/dbraw/zinc/93/00/46/1039930046.db2.gz CVYZECWUNQZZOX-LJQANCHMSA-N 2 1 325.500 4.235 20 0 EIADMP Cc1cc2[nH]c(C[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)cc2c(C)c1 ZINC000481989922 1039930067 /nfs/dbraw/zinc/93/00/67/1039930067.db2.gz CVYZECWUNQZZOX-LJQANCHMSA-N 2 1 325.500 4.235 20 0 EIADMP CCC(CC)[C@H](CC[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)OC ZINC000551087465 1039973760 /nfs/dbraw/zinc/97/37/60/1039973760.db2.gz RPWICWWETKKLHR-HBMCJLEFSA-N 2 1 332.532 4.253 20 0 EIADMP CCC(CC)[C@H](CC[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)OC ZINC000551087465 1039973771 /nfs/dbraw/zinc/97/37/71/1039973771.db2.gz RPWICWWETKKLHR-HBMCJLEFSA-N 2 1 332.532 4.253 20 0 EIADMP CCO[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccccc1 ZINC000551174993 1040020234 /nfs/dbraw/zinc/02/02/34/1040020234.db2.gz DXBBAXBMINPPBH-BHDDXSALSA-N 2 1 338.495 4.189 20 0 EIADMP CCO[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccccc1 ZINC000551174993 1040020245 /nfs/dbraw/zinc/02/02/45/1040020245.db2.gz DXBBAXBMINPPBH-BHDDXSALSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CC[C@](C)(c2ccc(C)cc2)C1 ZINC000435034227 1040023210 /nfs/dbraw/zinc/02/32/10/1040023210.db2.gz CDTYTEKXAVOXKE-QFIPXVFZSA-N 2 1 346.478 4.048 20 0 EIADMP Clc1cccc(Cl)c1CCC[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000482242598 1040098518 /nfs/dbraw/zinc/09/85/18/1040098518.db2.gz UEZDIMZSLIVIRF-KGLIPLIRSA-N 2 1 327.299 4.142 20 0 EIADMP CN(c1cc[nH+]c2cc(C(F)(F)F)ccc21)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000553298513 1040105414 /nfs/dbraw/zinc/10/54/14/1040105414.db2.gz XWZZASNIUKZQSO-YIONKMFJSA-N 2 1 349.400 4.315 20 0 EIADMP CN(c1cc[nH+]c2cc(C(F)(F)F)ccc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000553298513 1040105434 /nfs/dbraw/zinc/10/54/34/1040105434.db2.gz XWZZASNIUKZQSO-YIONKMFJSA-N 2 1 349.400 4.315 20 0 EIADMP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccccc4F)s3)C2)C1 ZINC000430137897 1040125583 /nfs/dbraw/zinc/12/55/83/1040125583.db2.gz ZTTWMPSVJKFLQZ-LJQANCHMSA-N 2 1 330.472 4.082 20 0 EIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccccc4F)s3)C2)C1 ZINC000430137897 1040125598 /nfs/dbraw/zinc/12/55/98/1040125598.db2.gz ZTTWMPSVJKFLQZ-LJQANCHMSA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(-c4ccccc4F)s3)C2)C1 ZINC000430137897 1040125605 /nfs/dbraw/zinc/12/56/05/1040125605.db2.gz ZTTWMPSVJKFLQZ-LJQANCHMSA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(-c4ccccc4F)s3)C2)C1 ZINC000430137897 1040125620 /nfs/dbraw/zinc/12/56/20/1040125620.db2.gz ZTTWMPSVJKFLQZ-LJQANCHMSA-N 2 1 330.472 4.082 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+][C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482273003 1040129519 /nfs/dbraw/zinc/12/95/19/1040129519.db2.gz VNRVPJKRKDVMGN-MRXNPFEDSA-N 2 1 345.531 4.079 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](CN[C@@H](C)c2ccccc2Br)C1 ZINC000482362198 1040199849 /nfs/dbraw/zinc/19/98/49/1040199849.db2.gz VSZBVVZWTSTGKC-GJZGRUSLSA-N 2 1 339.321 4.220 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000482360662 1040201025 /nfs/dbraw/zinc/20/10/25/1040201025.db2.gz PWNPKNDLFDULPH-LSDHHAIUSA-N 2 1 344.421 4.356 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000514812796 1040255104 /nfs/dbraw/zinc/25/51/04/1040255104.db2.gz UEQQHFQKQQGNJF-IUYQLWOBSA-N 2 1 340.433 4.430 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)ccc1F ZINC000482455945 1040257886 /nfs/dbraw/zinc/25/78/86/1040257886.db2.gz YUWCFVCFFNYDJI-SJLPKXTDSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)ccc1F ZINC000482455945 1040257903 /nfs/dbraw/zinc/25/79/03/1040257903.db2.gz YUWCFVCFFNYDJI-SJLPKXTDSA-N 2 1 344.449 4.180 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CC(C)(C)c3ccc(Br)cc32)CC1 ZINC000479402072 1040304727 /nfs/dbraw/zinc/30/47/27/1040304727.db2.gz KEKJVMCBKYCQMS-QGZVFWFLSA-N 2 1 349.316 4.023 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cc(C)cc(C)c2)[C@@H](C)C1 ZINC000482647709 1040408364 /nfs/dbraw/zinc/40/83/64/1040408364.db2.gz BMAQCEUHBIJGKV-ZVDOUQERSA-N 2 1 332.532 4.091 20 0 EIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(C(F)(F)F)c1 ZINC000479511480 1040430377 /nfs/dbraw/zinc/43/03/77/1040430377.db2.gz OOYHUDGHOXMBQO-IGEOTXOUSA-N 2 1 326.406 4.373 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccccc1OCc1ccccc1 ZINC000539507422 1040486198 /nfs/dbraw/zinc/48/61/98/1040486198.db2.gz NHGFOPPWVAPIHX-GOSISDBHSA-N 2 1 336.479 4.178 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(F)c1F ZINC000539546537 1040534863 /nfs/dbraw/zinc/53/48/63/1040534863.db2.gz QXHPFYWFPKHXKL-SJLPKXTDSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc(F)c1F ZINC000539546537 1040534877 /nfs/dbraw/zinc/53/48/77/1040534877.db2.gz QXHPFYWFPKHXKL-SJLPKXTDSA-N 2 1 344.449 4.180 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C3(Cc4ccccc4)CCC3)CC2)cc1 ZINC000539656756 1040653643 /nfs/dbraw/zinc/65/36/43/1040653643.db2.gz KCMJFTUOZFOYRH-UHFFFAOYSA-N 2 1 348.534 4.449 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(CC)cc2)[C@@H](C)C1 ZINC000479876916 1040740332 /nfs/dbraw/zinc/74/03/32/1040740332.db2.gz VJCIZYFQVPBEGG-UEXGIBASSA-N 2 1 332.532 4.037 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccc(F)cn1 ZINC000491282256 1040751872 /nfs/dbraw/zinc/75/18/72/1040751872.db2.gz DWNDGNDPCWAHJC-FQEVSTJZSA-N 2 1 341.474 4.448 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295836 1040808631 /nfs/dbraw/zinc/80/86/31/1040808631.db2.gz ZZIIQRCVOXXBNU-HNNXBMFYSA-N 2 1 348.437 4.389 20 0 EIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295836 1040808632 /nfs/dbraw/zinc/80/86/32/1040808632.db2.gz ZZIIQRCVOXXBNU-HNNXBMFYSA-N 2 1 348.437 4.389 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295836 1040808644 /nfs/dbraw/zinc/80/86/44/1040808644.db2.gz ZZIIQRCVOXXBNU-HNNXBMFYSA-N 2 1 348.437 4.389 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295836 1040808646 /nfs/dbraw/zinc/80/86/46/1040808646.db2.gz ZZIIQRCVOXXBNU-HNNXBMFYSA-N 2 1 348.437 4.389 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295836 1040808647 /nfs/dbraw/zinc/80/86/47/1040808647.db2.gz ZZIIQRCVOXXBNU-HNNXBMFYSA-N 2 1 348.437 4.389 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cc(Cl)cc(Cl)c2OC)C[C@@H]1C ZINC000539816807 1040809533 /nfs/dbraw/zinc/80/95/33/1040809533.db2.gz DIRFXEZYNUPJKL-WFASDCNBSA-N 2 1 345.314 4.307 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@@H]1C ZINC000539838132 1040818819 /nfs/dbraw/zinc/81/88/19/1040818819.db2.gz LAWFABGJPQUATP-DOTOQJQBSA-N 2 1 340.458 4.209 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@@H]1C ZINC000539838132 1040818822 /nfs/dbraw/zinc/81/88/22/1040818822.db2.gz LAWFABGJPQUATP-DOTOQJQBSA-N 2 1 340.458 4.209 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@@H]1C ZINC000539838132 1040818828 /nfs/dbraw/zinc/81/88/28/1040818828.db2.gz LAWFABGJPQUATP-DOTOQJQBSA-N 2 1 340.458 4.209 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000539834797 1040828546 /nfs/dbraw/zinc/82/85/46/1040828546.db2.gz FZURXILMAVCPNV-MLGOLLRUSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000539834797 1040828556 /nfs/dbraw/zinc/82/85/56/1040828556.db2.gz FZURXILMAVCPNV-MLGOLLRUSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000539834797 1040828566 /nfs/dbraw/zinc/82/85/66/1040828566.db2.gz FZURXILMAVCPNV-MLGOLLRUSA-N 2 1 332.385 4.007 20 0 EIADMP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000539864341 1040849597 /nfs/dbraw/zinc/84/95/97/1040849597.db2.gz YHVZEYXPMLUISU-QGZVFWFLSA-N 2 1 344.528 4.360 20 0 EIADMP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000539864341 1040849600 /nfs/dbraw/zinc/84/96/00/1040849600.db2.gz YHVZEYXPMLUISU-QGZVFWFLSA-N 2 1 344.528 4.360 20 0 EIADMP CCc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc1 ZINC000462727849 1040860493 /nfs/dbraw/zinc/86/04/93/1040860493.db2.gz XJQJBCOOMDPBBI-UYAOXDASSA-N 2 1 328.525 4.483 20 0 EIADMP CCc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cc1 ZINC000462727849 1040860495 /nfs/dbraw/zinc/86/04/95/1040860495.db2.gz XJQJBCOOMDPBBI-UYAOXDASSA-N 2 1 328.525 4.483 20 0 EIADMP Cc1ccc(N2CCC([NH2+]Cc3ccc(C(C)(C)C)cc3)CC2)[nH+]c1 ZINC000462717595 1040864736 /nfs/dbraw/zinc/86/47/36/1040864736.db2.gz JVUGQXFIOJQAFC-UHFFFAOYSA-N 2 1 337.511 4.446 20 0 EIADMP CCC[C@H]([NH2+][C@@H]1CC[N@@H+](CCCOCC)C[C@@H]1C)c1ccccc1 ZINC000480034156 1040869576 /nfs/dbraw/zinc/86/95/76/1040869576.db2.gz JJSHPFSSAUJFHH-TYPHKJRUSA-N 2 1 332.532 4.254 20 0 EIADMP CCC[C@H]([NH2+][C@H]1CC[N@@H+](CCCOCC)C[C@@H]1C)c1ccccc1 ZINC000480034154 1040871028 /nfs/dbraw/zinc/87/10/28/1040871028.db2.gz JJSHPFSSAUJFHH-JBACZVJFSA-N 2 1 332.532 4.254 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCc2c1cc(Cl)cc2Cl ZINC000537967790 1040967855 /nfs/dbraw/zinc/96/78/55/1040967855.db2.gz AMFACMYNTRLZEY-APPDUMDISA-N 2 1 338.282 4.412 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]C[C@H](C)Cn3cc[nH+]c3C)c(C)c2c1 ZINC000537967506 1040969869 /nfs/dbraw/zinc/96/98/69/1040969869.db2.gz MAUSEWCWGVPPIP-DZGCQCFKSA-N 2 1 341.455 4.242 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000537991009 1040969965 /nfs/dbraw/zinc/96/99/65/1040969965.db2.gz QBXCBWGKXUQIKK-YJBOKZPZSA-N 2 1 348.943 4.444 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH2+][C@H]4CCCSCC4)C[C@@H]3C2)cc1 ZINC000898519252 1040973133 /nfs/dbraw/zinc/97/31/33/1040973133.db2.gz OBFQDPVLDUINKF-JSXRDJHFSA-N 2 1 344.568 4.162 20 0 EIADMP COc1cccc2c1CC[C@H]2[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000537968845 1040974233 /nfs/dbraw/zinc/97/42/33/1040974233.db2.gz ZOBLZEISBXJOGS-OAQYLSRUSA-N 2 1 338.495 4.313 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000483725991 1040978812 /nfs/dbraw/zinc/97/88/12/1040978812.db2.gz IZQQMJQWVLASAP-IPYPFGDCSA-N 2 1 346.462 4.474 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000483725991 1040978829 /nfs/dbraw/zinc/97/88/29/1040978829.db2.gz IZQQMJQWVLASAP-IPYPFGDCSA-N 2 1 346.462 4.474 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000483741368 1040993557 /nfs/dbraw/zinc/99/35/57/1040993557.db2.gz FTAXEQCWBIEJNK-DLVCFXQMSA-N 2 1 326.484 4.372 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000483741368 1040993572 /nfs/dbraw/zinc/99/35/72/1040993572.db2.gz FTAXEQCWBIEJNK-DLVCFXQMSA-N 2 1 326.484 4.372 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]CCC[NH+]2CCCCC2)c1 ZINC000480164487 1041020759 /nfs/dbraw/zinc/02/07/59/1041020759.db2.gz XNXUPPYVERARGU-HNNXBMFYSA-N 2 1 326.431 4.123 20 0 EIADMP FC(F)(F)c1cc(Cl)cc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000436284962 1041033562 /nfs/dbraw/zinc/03/35/62/1041033562.db2.gz CGHBUHQHXCIOJS-LSDHHAIUSA-N 2 1 332.797 4.075 20 0 EIADMP FC(F)(F)c1cc(Cl)cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000436284962 1041033567 /nfs/dbraw/zinc/03/35/67/1041033567.db2.gz CGHBUHQHXCIOJS-LSDHHAIUSA-N 2 1 332.797 4.075 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436271261 1041042837 /nfs/dbraw/zinc/04/28/37/1041042837.db2.gz CWZXDKRUTMEATM-GFCCVEGCSA-N 2 1 334.813 4.180 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436271261 1041042856 /nfs/dbraw/zinc/04/28/56/1041042856.db2.gz CWZXDKRUTMEATM-GFCCVEGCSA-N 2 1 334.813 4.180 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccc(Sc2ccc(F)cc2)cc1 ZINC000538097056 1041045904 /nfs/dbraw/zinc/04/59/04/1041045904.db2.gz OHMYDKFSQMEMBG-FOIQADDNSA-N 2 1 344.499 4.407 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)C1 ZINC000462889309 1041050350 /nfs/dbraw/zinc/05/03/50/1041050350.db2.gz SJINKFOZHFMYAK-IAGOWNOFSA-N 2 1 327.516 4.156 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2cc[nH+]c3ccsc32)C1 ZINC000484146082 1041135620 /nfs/dbraw/zinc/13/56/20/1041135620.db2.gz TUTMGENXRLLYES-HZPDHXFCSA-N 2 1 329.513 4.387 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cc[nH+]c3ccsc32)C1 ZINC000484146082 1041135662 /nfs/dbraw/zinc/13/56/62/1041135662.db2.gz TUTMGENXRLLYES-HZPDHXFCSA-N 2 1 329.513 4.387 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2cc[nH+]c3ccsc32)C1 ZINC000484146079 1041137763 /nfs/dbraw/zinc/13/77/63/1041137763.db2.gz TUTMGENXRLLYES-CVEARBPZSA-N 2 1 329.513 4.387 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cc[nH+]c3ccsc32)C1 ZINC000484146079 1041137773 /nfs/dbraw/zinc/13/77/73/1041137773.db2.gz TUTMGENXRLLYES-CVEARBPZSA-N 2 1 329.513 4.387 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccc(Oc3ccc(F)cc3)cc2)CC[N@H+]1C ZINC000540140583 1041160240 /nfs/dbraw/zinc/16/02/40/1041160240.db2.gz PCYQAEVBTZYWLR-VQIMIIECSA-N 2 1 342.458 4.233 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCC1 ZINC000540163762 1041227481 /nfs/dbraw/zinc/22/74/81/1041227481.db2.gz JQNRLHHFLQVDPH-DYVFJYSZSA-N 2 1 341.326 4.345 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(C)(C)c1c(F)cccc1Cl ZINC000540188950 1041231801 /nfs/dbraw/zinc/23/18/01/1041231801.db2.gz MXWPAJHLSJZFEN-IOASZLSFSA-N 2 1 326.887 4.075 20 0 EIADMP C[C@H]([NH2+]C1(C[NH2+][C@@H]2CCC23CCOCC3)CCCC1)c1ccccc1 ZINC000554559546 1041244141 /nfs/dbraw/zinc/24/41/41/1041244141.db2.gz DFEYIPKKNDJOLT-AZUAARDMSA-N 2 1 342.527 4.199 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@@H]3CCC[C@@H]([NH+](C)C)C3)c(C)c2c1 ZINC000484470378 1041245951 /nfs/dbraw/zinc/24/59/51/1041245951.db2.gz SUOIRRBGUYCXMX-ARFHVFGLSA-N 2 1 330.472 4.273 20 0 EIADMP COCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CCCC1 ZINC000484508610 1041291709 /nfs/dbraw/zinc/29/17/09/1041291709.db2.gz PZOPMQYWSOVDFT-FPOVZHCZSA-N 2 1 344.543 4.084 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2cncc(C(F)(F)F)c2)CC1 ZINC000463081025 1041310312 /nfs/dbraw/zinc/31/03/12/1041310312.db2.gz HTDFVPRELBXXQG-UHFFFAOYSA-N 2 1 343.437 4.044 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cncc(C(F)(F)F)c2)CC1 ZINC000463081025 1041310323 /nfs/dbraw/zinc/31/03/23/1041310323.db2.gz HTDFVPRELBXXQG-UHFFFAOYSA-N 2 1 343.437 4.044 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+]Cc2ccc(-c3cccc(Cl)c3)s2)CC1 ZINC000538445468 1041351969 /nfs/dbraw/zinc/35/19/69/1041351969.db2.gz MZVQMHUEJLAXLE-UHFFFAOYSA-N 2 1 332.900 4.420 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+]CCCc3ccccc3)CC2)cc1 ZINC000463147423 1041369123 /nfs/dbraw/zinc/36/91/23/1041369123.db2.gz VLULOKBYOFWUAS-UHFFFAOYSA-N 2 1 340.486 4.055 20 0 EIADMP CCS[C@H]1CCC[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000463189500 1041406602 /nfs/dbraw/zinc/40/66/02/1041406602.db2.gz AKVUGFSKCALAPQ-SFTDATJTSA-N 2 1 346.584 4.347 20 0 EIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+]([C@@H]4C[C@@H]4c4ccccc4)C3)C2)cc1 ZINC000463195391 1041410555 /nfs/dbraw/zinc/41/05/55/1041410555.db2.gz WXQLQIMQIKDFFF-ZLNRFVROSA-N 2 1 332.491 4.141 20 0 EIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+]([C@@H]4C[C@@H]4c4ccccc4)C3)C2)cc1 ZINC000463195391 1041410562 /nfs/dbraw/zinc/41/05/62/1041410562.db2.gz WXQLQIMQIKDFFF-ZLNRFVROSA-N 2 1 332.491 4.141 20 0 EIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+]([C@@H]4C[C@@H]4c4ccccc4)C3)C2)cc1 ZINC000463195391 1041410566 /nfs/dbraw/zinc/41/05/66/1041410566.db2.gz WXQLQIMQIKDFFF-ZLNRFVROSA-N 2 1 332.491 4.141 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cc(F)ccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463187845 1041417793 /nfs/dbraw/zinc/41/77/93/1041417793.db2.gz DYLNNYMVHDUEAC-UZLBHIALSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2cc(F)ccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463187845 1041417799 /nfs/dbraw/zinc/41/77/99/1041417799.db2.gz DYLNNYMVHDUEAC-UZLBHIALSA-N 2 1 344.449 4.150 20 0 EIADMP COc1ccc(OC)c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000480617994 1041427820 /nfs/dbraw/zinc/42/78/20/1041427820.db2.gz VRBMIILHSPLWRZ-IRXDYDNUSA-N 2 1 334.504 4.009 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc(F)c(F)c(F)c1 ZINC000480630604 1041434543 /nfs/dbraw/zinc/43/45/43/1041434543.db2.gz KOSYQUUAICONBP-KGLIPLIRSA-N 2 1 328.422 4.409 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1N(C)C ZINC000480638495 1041450725 /nfs/dbraw/zinc/45/07/25/1041450725.db2.gz IXZQRFUQUVQIIR-SJORKVTESA-N 2 1 335.511 4.197 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000463262584 1041459614 /nfs/dbraw/zinc/45/96/14/1041459614.db2.gz ZKCOIRDQSKPOTC-GCJKJVERSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000463262584 1041459621 /nfs/dbraw/zinc/45/96/21/1041459621.db2.gz ZKCOIRDQSKPOTC-GCJKJVERSA-N 2 1 347.506 4.353 20 0 EIADMP C[N@@H+]1CCC[C@H]1CC[NH2+][C@H](COCc1ccccc1)c1ccccc1 ZINC000540445423 1041460232 /nfs/dbraw/zinc/46/02/32/1041460232.db2.gz NJFDBDIAKRVGJV-FCHUYYIVSA-N 2 1 338.495 4.018 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@H](COCc1ccccc1)c1ccccc1 ZINC000540445423 1041460240 /nfs/dbraw/zinc/46/02/40/1041460240.db2.gz NJFDBDIAKRVGJV-FCHUYYIVSA-N 2 1 338.495 4.018 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CCC(=O)c2ccccc2)CC1)CC1CC1 ZINC000538628743 1041460983 /nfs/dbraw/zinc/46/09/83/1041460983.db2.gz PMIBTJFONBNRTA-UHFFFAOYSA-N 2 1 342.527 4.093 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463251316 1041464028 /nfs/dbraw/zinc/46/40/28/1041464028.db2.gz DKBMSXZHQLWYFJ-UREXAPBRSA-N 2 1 344.543 4.224 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463251316 1041464033 /nfs/dbraw/zinc/46/40/33/1041464033.db2.gz DKBMSXZHQLWYFJ-UREXAPBRSA-N 2 1 344.543 4.224 20 0 EIADMP COc1cccc(CCC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000540462547 1041471418 /nfs/dbraw/zinc/47/14/18/1041471418.db2.gz URLBGZFHJHEBHT-QGZVFWFLSA-N 2 1 349.478 4.473 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2(Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463285436 1041474221 /nfs/dbraw/zinc/47/42/21/1041474221.db2.gz XPBNQHVRSROCAS-SIKLNZKXSA-N 2 1 334.507 4.404 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2(Cc3ccccc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463285436 1041474225 /nfs/dbraw/zinc/47/42/25/1041474225.db2.gz XPBNQHVRSROCAS-SIKLNZKXSA-N 2 1 334.507 4.404 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2(Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463285437 1041474672 /nfs/dbraw/zinc/47/46/72/1041474672.db2.gz XPBNQHVRSROCAS-UGKGYDQZSA-N 2 1 334.507 4.404 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2(Cc3ccccc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463285437 1041474678 /nfs/dbraw/zinc/47/46/78/1041474678.db2.gz XPBNQHVRSROCAS-UGKGYDQZSA-N 2 1 334.507 4.404 20 0 EIADMP COCCC[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480693540 1041476045 /nfs/dbraw/zinc/47/60/45/1041476045.db2.gz CMYZSRXIODLASE-CEXWTWQISA-N 2 1 332.532 4.069 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cnc(-c4ccsc4)s3)C2)CC1 ZINC000554879289 1041476260 /nfs/dbraw/zinc/47/62/60/1041476260.db2.gz QAXRWIXRIZJOJK-HNNXBMFYSA-N 2 1 347.553 4.035 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1F ZINC000195133286 1041484292 /nfs/dbraw/zinc/48/42/92/1041484292.db2.gz YIIMKTDJUNETCW-NVXWUHKLSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1F ZINC000195133286 1041484297 /nfs/dbraw/zinc/48/42/97/1041484297.db2.gz YIIMKTDJUNETCW-NVXWUHKLSA-N 2 1 330.422 4.138 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cccc(OCc3ccccc3)c2)C1 ZINC000538750095 1041524950 /nfs/dbraw/zinc/52/49/50/1041524950.db2.gz AOFDWJWXBHRCPJ-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2cccc(OCc3ccccc3)c2)C1 ZINC000538750095 1041524957 /nfs/dbraw/zinc/52/49/57/1041524957.db2.gz AOFDWJWXBHRCPJ-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2cccc(OCc3ccccc3)c2)C1 ZINC000538750095 1041524960 /nfs/dbraw/zinc/52/49/60/1041524960.db2.gz AOFDWJWXBHRCPJ-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2cccc(OCc3ccccc3)c2)C1 ZINC000538750095 1041524966 /nfs/dbraw/zinc/52/49/66/1041524966.db2.gz AOFDWJWXBHRCPJ-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2OCc2ccccc2)C1 ZINC000538750188 1041525793 /nfs/dbraw/zinc/52/57/93/1041525793.db2.gz JDBCTXLQYNJRJF-HXUWFJFHSA-N 2 1 338.495 4.039 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2OCc2ccccc2)C1 ZINC000538750188 1041525810 /nfs/dbraw/zinc/52/58/10/1041525810.db2.gz JDBCTXLQYNJRJF-HXUWFJFHSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2OCc2ccccc2)C1 ZINC000538750188 1041525822 /nfs/dbraw/zinc/52/58/22/1041525822.db2.gz JDBCTXLQYNJRJF-HXUWFJFHSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2OCc2ccccc2)C1 ZINC000538750188 1041525830 /nfs/dbraw/zinc/52/58/30/1041525830.db2.gz JDBCTXLQYNJRJF-HXUWFJFHSA-N 2 1 338.495 4.039 20 0 EIADMP CCCn1ccnc1CCC[N@@H+](C)[C@H](C)CCc1cccc(F)c1 ZINC000516347559 1041538910 /nfs/dbraw/zinc/53/89/10/1041538910.db2.gz BSUPXKPBTCIQTN-QGZVFWFLSA-N 2 1 331.479 4.318 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)CCc1cccc(F)c1 ZINC000516347559 1041538912 /nfs/dbraw/zinc/53/89/12/1041538912.db2.gz BSUPXKPBTCIQTN-QGZVFWFLSA-N 2 1 331.479 4.318 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)CCc1cccc(F)c1 ZINC000516347559 1041538914 /nfs/dbraw/zinc/53/89/14/1041538914.db2.gz BSUPXKPBTCIQTN-QGZVFWFLSA-N 2 1 331.479 4.318 20 0 EIADMP CCCn1ccnc1CCC[N@@H+](C)[C@@H](C)CCc1cccc(F)c1 ZINC000516347558 1041539691 /nfs/dbraw/zinc/53/96/91/1041539691.db2.gz BSUPXKPBTCIQTN-KRWDZBQOSA-N 2 1 331.479 4.318 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)CCc1cccc(F)c1 ZINC000516347558 1041539698 /nfs/dbraw/zinc/53/96/98/1041539698.db2.gz BSUPXKPBTCIQTN-KRWDZBQOSA-N 2 1 331.479 4.318 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)CCc1cccc(F)c1 ZINC000516347558 1041539705 /nfs/dbraw/zinc/53/97/05/1041539705.db2.gz BSUPXKPBTCIQTN-KRWDZBQOSA-N 2 1 331.479 4.318 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3cccc(OCC)c3o2)C1 ZINC000540596472 1041552595 /nfs/dbraw/zinc/55/25/95/1041552595.db2.gz BBVPPGDGWVAGES-CVEARBPZSA-N 2 1 330.472 4.214 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3cccc(OCC)c3o2)C1 ZINC000540596472 1041552604 /nfs/dbraw/zinc/55/26/04/1041552604.db2.gz BBVPPGDGWVAGES-CVEARBPZSA-N 2 1 330.472 4.214 20 0 EIADMP CC(C)[C@@H](CC(F)(F)F)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000437083240 1041630292 /nfs/dbraw/zinc/63/02/92/1041630292.db2.gz OOTMJGSTEMRRPP-QGZVFWFLSA-N 2 1 328.422 4.218 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1ccccn1 ZINC000516650158 1041690185 /nfs/dbraw/zinc/69/01/85/1041690185.db2.gz HATHNHHLMKKNOG-FQEVSTJZSA-N 2 1 349.522 4.146 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1ccccn1 ZINC000516650158 1041690188 /nfs/dbraw/zinc/69/01/88/1041690188.db2.gz HATHNHHLMKKNOG-FQEVSTJZSA-N 2 1 349.522 4.146 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(=Cc2cccc(F)c2)CC1 ZINC000540918717 1041739509 /nfs/dbraw/zinc/73/95/09/1041739509.db2.gz LZCSXKNXYCDAOI-UHFFFAOYSA-N 2 1 327.447 4.290 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2cnn(C)c2)C(C)(C)C)CC1 ZINC000540984049 1041766847 /nfs/dbraw/zinc/76/68/47/1041766847.db2.gz CMSPVPUVYRLHKF-AHRSYUTCSA-N 2 1 346.563 4.140 20 0 EIADMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H]2C[C@@H](c3ccccc3)C2(C)C)C[C@H](C)O1 ZINC000464059663 1041844982 /nfs/dbraw/zinc/84/49/82/1041844982.db2.gz ZCTOVZJSENYSTE-IZZBFERCSA-N 2 1 344.543 4.048 20 0 EIADMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H]2C[C@H](c3ccccc3)C2(C)C)C[C@H](C)O1 ZINC000464059664 1041845114 /nfs/dbraw/zinc/84/51/14/1041845114.db2.gz ZCTOVZJSENYSTE-KOUHRCEDSA-N 2 1 344.543 4.048 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cc(-n2ccnc2)cs1 ZINC000541537122 1041999253 /nfs/dbraw/zinc/99/92/53/1041999253.db2.gz JUYVNUGDSYWPNH-LBPRGKRZSA-N 2 1 333.407 4.405 20 0 EIADMP c1ccc(OCCCCC[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000438132264 1042059884 /nfs/dbraw/zinc/05/98/84/1042059884.db2.gz YJQWRVYEXPEWEX-HXUWFJFHSA-N 2 1 330.516 4.044 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC[N@@H+]1C ZINC000426063894 1042246930 /nfs/dbraw/zinc/24/69/30/1042246930.db2.gz VTFZVTSWWVFMGN-XPGWFJOJSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC[N@H+]1C ZINC000426063894 1042246933 /nfs/dbraw/zinc/24/69/33/1042246933.db2.gz VTFZVTSWWVFMGN-XPGWFJOJSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H](c1ccccn1)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000293490065 1042266002 /nfs/dbraw/zinc/26/60/02/1042266002.db2.gz YXFKJUXNCULONF-IBGZPJMESA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](NCCC[N@@H+]1CCc2ccccc2C1)c1nccc2ccccc21 ZINC000518014087 1042312887 /nfs/dbraw/zinc/31/28/87/1042312887.db2.gz DFYFNMONCVLKLK-GOSISDBHSA-N 2 1 345.490 4.334 20 0 EIADMP C[C@@H](NCCC[N@H+]1CCc2ccccc2C1)c1nccc2ccccc21 ZINC000518014087 1042312895 /nfs/dbraw/zinc/31/28/95/1042312895.db2.gz DFYFNMONCVLKLK-GOSISDBHSA-N 2 1 345.490 4.334 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1nccc2ccccc21 ZINC000518014087 1042312902 /nfs/dbraw/zinc/31/29/02/1042312902.db2.gz DFYFNMONCVLKLK-GOSISDBHSA-N 2 1 345.490 4.334 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1nccc2ccccc21 ZINC000518014087 1042312909 /nfs/dbraw/zinc/31/29/09/1042312909.db2.gz DFYFNMONCVLKLK-GOSISDBHSA-N 2 1 345.490 4.334 20 0 EIADMP CC(C)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000303163338 1042336773 /nfs/dbraw/zinc/33/67/73/1042336773.db2.gz HMOFLKCZQMTPBV-QFIPXVFZSA-N 2 1 336.523 4.464 20 0 EIADMP COc1ccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)cc1OCC(C)C ZINC000506371299 1042354344 /nfs/dbraw/zinc/35/43/44/1042354344.db2.gz UKJBYKJSKJUENO-UHFFFAOYSA-N 2 1 348.531 4.035 20 0 EIADMP COc1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc1OCC(C)C ZINC000506371299 1042354352 /nfs/dbraw/zinc/35/43/52/1042354352.db2.gz UKJBYKJSKJUENO-UHFFFAOYSA-N 2 1 348.531 4.035 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC2(CCC[N@@H+]2C)CC1 ZINC000542267119 1042365436 /nfs/dbraw/zinc/36/54/36/1042365436.db2.gz ADYSUQCCYGWTEL-CQSZACIVSA-N 2 1 326.406 4.327 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC000542267119 1042365440 /nfs/dbraw/zinc/36/54/40/1042365440.db2.gz ADYSUQCCYGWTEL-CQSZACIVSA-N 2 1 326.406 4.327 20 0 EIADMP COc1ccc(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)cc1 ZINC000438840783 1042377885 /nfs/dbraw/zinc/37/78/85/1042377885.db2.gz ZTIYNFMBTCADST-UHFFFAOYSA-N 2 1 338.495 4.228 20 0 EIADMP COc1ccc2cc(C[NH2+]CCCC[N@H+]3CCC[C@H](C)C3)ccc2c1 ZINC000518268148 1042442110 /nfs/dbraw/zinc/44/21/10/1042442110.db2.gz YYNYCYQOIQAUGO-SFHVURJKSA-N 2 1 340.511 4.450 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+][C@@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000426289008 1042514418 /nfs/dbraw/zinc/51/44/18/1042514418.db2.gz FJHMJMMQTCHPLV-VLCRHTCISA-N 2 1 344.543 4.099 20 0 EIADMP Cc1nc2ccc(C[N@@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)cc2s1 ZINC000426410933 1042677876 /nfs/dbraw/zinc/67/78/76/1042677876.db2.gz NXPGVFVRSHYGOT-QGZVFWFLSA-N 2 1 329.513 4.055 20 0 EIADMP Cc1nc2ccc(C[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)cc2s1 ZINC000426410933 1042677881 /nfs/dbraw/zinc/67/78/81/1042677881.db2.gz NXPGVFVRSHYGOT-QGZVFWFLSA-N 2 1 329.513 4.055 20 0 EIADMP Fc1cccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000518769284 1042684240 /nfs/dbraw/zinc/68/42/40/1042684240.db2.gz KSYPLTKDLPFIPT-NRFANRHFSA-N 2 1 338.470 4.155 20 0 EIADMP Fc1cccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000518769284 1042684241 /nfs/dbraw/zinc/68/42/41/1042684241.db2.gz KSYPLTKDLPFIPT-NRFANRHFSA-N 2 1 338.470 4.155 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@H](C)c1ccc(C)cc1C ZINC000542465029 1042831546 /nfs/dbraw/zinc/83/15/46/1042831546.db2.gz ZQAZKIFKFATBCZ-GOSISDBHSA-N 2 1 334.467 4.386 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310537055 1042839321 /nfs/dbraw/zinc/83/93/21/1042839321.db2.gz RNGFZEDVUMOLHA-SQGPQFPESA-N 2 1 326.459 4.387 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2ccccc2n1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311621654 1042863181 /nfs/dbraw/zinc/86/31/81/1042863181.db2.gz HIEGOLHNOFKRLJ-NQIIRXRSSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2ccccc2n1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311621654 1042863182 /nfs/dbraw/zinc/86/31/82/1042863182.db2.gz HIEGOLHNOFKRLJ-NQIIRXRSSA-N 2 1 345.490 4.235 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@H]1C ZINC000493282723 1042892515 /nfs/dbraw/zinc/89/25/15/1042892515.db2.gz TZGWWDYVRCVDTC-NVXWUHKLSA-N 2 1 338.923 4.432 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@H]1C ZINC000493282723 1042892517 /nfs/dbraw/zinc/89/25/17/1042892517.db2.gz TZGWWDYVRCVDTC-NVXWUHKLSA-N 2 1 338.923 4.432 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@H]1C ZINC000493282723 1042892520 /nfs/dbraw/zinc/89/25/20/1042892520.db2.gz TZGWWDYVRCVDTC-NVXWUHKLSA-N 2 1 338.923 4.432 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@H]1C ZINC000493282723 1042892521 /nfs/dbraw/zinc/89/25/21/1042892521.db2.gz TZGWWDYVRCVDTC-NVXWUHKLSA-N 2 1 338.923 4.432 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168005031 1042949946 /nfs/dbraw/zinc/94/99/46/1042949946.db2.gz DZAJJHRMXAMKMU-UPHUGPLXSA-N 2 1 326.459 4.357 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168005031 1042949952 /nfs/dbraw/zinc/94/99/52/1042949952.db2.gz DZAJJHRMXAMKMU-UPHUGPLXSA-N 2 1 326.459 4.357 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@@H+](C)CC1CC[NH2+]CC1 ZINC000262124522 1042992200 /nfs/dbraw/zinc/99/22/00/1042992200.db2.gz CHTOFHGJSWFVIZ-INIZCTEOSA-N 2 1 343.540 4.419 20 0 EIADMP CCCc1csc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)n1 ZINC000494015733 1043004276 /nfs/dbraw/zinc/00/42/76/1043004276.db2.gz GKVXASYKPVRHFC-UHFFFAOYSA-N 2 1 331.529 4.226 20 0 EIADMP CCCc1csc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)n1 ZINC000494015733 1043004284 /nfs/dbraw/zinc/00/42/84/1043004284.db2.gz GKVXASYKPVRHFC-UHFFFAOYSA-N 2 1 331.529 4.226 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168006687 1043008335 /nfs/dbraw/zinc/00/83/35/1043008335.db2.gz OFAHIWAUDSCHNX-OPMZPASUSA-N 2 1 340.486 4.399 20 0 EIADMP C[C@H]1CC([NH2+]Cc2ccnc(Cl)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168006943 1043010131 /nfs/dbraw/zinc/01/01/31/1043010131.db2.gz PSHGUCPCZMUBCZ-HOTGVXAUSA-N 2 1 343.902 4.266 20 0 EIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(Br)c(Cl)c2)C1 ZINC000494081521 1043014676 /nfs/dbraw/zinc/01/46/76/1043014676.db2.gz ZBUMBUJLQYGBJZ-CHWSQXEVSA-N 2 1 345.712 4.065 20 0 EIADMP COc1ccc2oc(C[NH2+][C@@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)cc2c1 ZINC000183100873 1043037867 /nfs/dbraw/zinc/03/78/67/1043037867.db2.gz LLFPMPQQKFLGON-JKSUJKDBSA-N 2 1 342.483 4.184 20 0 EIADMP COc1ccc2oc(C[NH2+][C@@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)cc2c1 ZINC000183100873 1043037872 /nfs/dbraw/zinc/03/78/72/1043037872.db2.gz LLFPMPQQKFLGON-JKSUJKDBSA-N 2 1 342.483 4.184 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)nc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168008169 1043038271 /nfs/dbraw/zinc/03/82/71/1043038271.db2.gz WIVGNAQVRLYYQW-HGKCTWBKSA-N 2 1 343.902 4.266 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)nc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168008169 1043038277 /nfs/dbraw/zinc/03/82/77/1043038277.db2.gz WIVGNAQVRLYYQW-HGKCTWBKSA-N 2 1 343.902 4.266 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000183185655 1043039840 /nfs/dbraw/zinc/03/98/40/1043039840.db2.gz ILTAOIGWUOPEKF-JENIJYKNSA-N 2 1 330.516 4.389 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2scnc2C2CC2)CC1)CC1CC1 ZINC000495028019 1043099556 /nfs/dbraw/zinc/09/95/56/1043099556.db2.gz MASAJUYUVDSLQL-UHFFFAOYSA-N 2 1 347.572 4.355 20 0 EIADMP Cc1ccc([C@@H]([NH2+]CC2([NH+]3CCCC3)CCOCC2)C2CCC2)cc1 ZINC000427713418 1043172887 /nfs/dbraw/zinc/17/28/87/1043172887.db2.gz GZBBOEUFRJMQKO-NRFANRHFSA-N 2 1 342.527 4.071 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cn1ccn(C(C)C)c1=S ZINC000727426403 1043220487 /nfs/dbraw/zinc/22/04/87/1043220487.db2.gz NCAUKQFOHGRDDO-UHFFFAOYSA-N 2 1 346.544 4.141 20 0 EIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cn1ccn(C(C)C)c1=S ZINC000727426403 1043220493 /nfs/dbraw/zinc/22/04/93/1043220493.db2.gz NCAUKQFOHGRDDO-UHFFFAOYSA-N 2 1 346.544 4.141 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@@H+]2CCC[C@@H]2CCCc2ccccc2)s1 ZINC000347859283 1043242953 /nfs/dbraw/zinc/24/29/53/1043242953.db2.gz QMUQXAPGMMSDSI-SFHVURJKSA-N 2 1 343.540 4.192 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@H+]2CCC[C@@H]2CCCc2ccccc2)s1 ZINC000347859283 1043242963 /nfs/dbraw/zinc/24/29/63/1043242963.db2.gz QMUQXAPGMMSDSI-SFHVURJKSA-N 2 1 343.540 4.192 20 0 EIADMP CCSc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)ccn1 ZINC000427885467 1043250788 /nfs/dbraw/zinc/25/07/88/1043250788.db2.gz MDTGMMPZMZJPIS-QFBILLFUSA-N 2 1 347.572 4.326 20 0 EIADMP C[NH+](C/C=C\C[N@H+](C)Cc1cccc(F)c1)Cc1cccc(F)c1 ZINC000613366034 1043256621 /nfs/dbraw/zinc/25/66/21/1043256621.db2.gz SQGKZNXQACHGGP-ARJAWSKDSA-N 2 1 330.422 4.085 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000674005782 1043271021 /nfs/dbraw/zinc/27/10/21/1043271021.db2.gz OKTPLRBLDJJRIR-YJBOKZPZSA-N 2 1 342.449 4.443 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000674005782 1043271034 /nfs/dbraw/zinc/27/10/34/1043271034.db2.gz OKTPLRBLDJJRIR-YJBOKZPZSA-N 2 1 342.449 4.443 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000674005782 1043271048 /nfs/dbraw/zinc/27/10/48/1043271048.db2.gz OKTPLRBLDJJRIR-YJBOKZPZSA-N 2 1 342.449 4.443 20 0 EIADMP Cc1nccn1CCCC[N@H+]1CCC[C@H](c2ccc(F)c(F)c2)C1 ZINC000625658421 1043320211 /nfs/dbraw/zinc/32/02/11/1043320211.db2.gz YYTYHBFDNTXYLD-KRWDZBQOSA-N 2 1 333.426 4.130 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H](c2ccc(F)c(F)c2)C1 ZINC000625658421 1043320219 /nfs/dbraw/zinc/32/02/19/1043320219.db2.gz YYTYHBFDNTXYLD-KRWDZBQOSA-N 2 1 333.426 4.130 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H](c2ccc(F)c(F)c2)C1 ZINC000625658421 1043320228 /nfs/dbraw/zinc/32/02/28/1043320228.db2.gz YYTYHBFDNTXYLD-KRWDZBQOSA-N 2 1 333.426 4.130 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1ncc[nH]1 ZINC000285978859 1043366063 /nfs/dbraw/zinc/36/60/63/1043366063.db2.gz HOHXNACANWCUPE-INIZCTEOSA-N 2 1 326.488 4.025 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)c1ncc[nH]1 ZINC000285978859 1043366070 /nfs/dbraw/zinc/36/60/70/1043366070.db2.gz HOHXNACANWCUPE-INIZCTEOSA-N 2 1 326.488 4.025 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1ncc[nH]1 ZINC000285978862 1043366384 /nfs/dbraw/zinc/36/63/84/1043366384.db2.gz HOHXNACANWCUPE-MRXNPFEDSA-N 2 1 326.488 4.025 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)c1ncc[nH]1 ZINC000285978862 1043366387 /nfs/dbraw/zinc/36/63/87/1043366387.db2.gz HOHXNACANWCUPE-MRXNPFEDSA-N 2 1 326.488 4.025 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2[C@@H]2CCOC2)c1 ZINC000474029118 1043441915 /nfs/dbraw/zinc/44/19/15/1043441915.db2.gz LEEKHBHTUFICGT-BHIFYINESA-N 2 1 344.543 4.212 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@H](c2ccccc2C)C[C@@H]1C ZINC000346197012 1043656095 /nfs/dbraw/zinc/65/60/95/1043656095.db2.gz DCWIQCSVWHXZCT-PKOBYXMFSA-N 2 1 346.478 4.262 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCCC[C@@H]1[C@H]1CCOC1)[N@@H+](C)Cc1ccccc1 ZINC000474035177 1043694643 /nfs/dbraw/zinc/69/46/43/1043694643.db2.gz OWLPQOXPLDYQJO-FVTFTPSCSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H](CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000223216468 1043702764 /nfs/dbraw/zinc/70/27/64/1043702764.db2.gz WCNUDIHWHNYIMP-FQEVSTJZSA-N 2 1 336.523 4.477 20 0 EIADMP C[C@@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccccn1 ZINC000658065421 1043722622 /nfs/dbraw/zinc/72/26/22/1043722622.db2.gz BIWYQXROUGCDMJ-PELRDEGISA-N 2 1 337.511 4.218 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccc(Br)s1 ZINC000542488564 1043802803 /nfs/dbraw/zinc/80/28/03/1043802803.db2.gz LMSIYBKRGBCOOU-QWHCGFSZSA-N 2 1 345.350 4.426 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)C1CCC(F)(F)CC1 ZINC000474037288 1043831977 /nfs/dbraw/zinc/83/19/77/1043831977.db2.gz QCLDKSKRUBHZGP-MRXNPFEDSA-N 2 1 336.470 4.455 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000521814053 1043981724 /nfs/dbraw/zinc/98/17/24/1043981724.db2.gz UOXPCCXHFAEPSI-OAHLLOKOSA-N 2 1 332.488 4.376 20 0 EIADMP CCc1nc(C)c([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000195137276 1044026034 /nfs/dbraw/zinc/02/60/34/1044026034.db2.gz IPPMCUBVLGIEKT-MAUKXSAKSA-N 2 1 343.540 4.187 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCSc2c(Cl)cccc21 ZINC000358082490 1044154773 /nfs/dbraw/zinc/15/47/73/1044154773.db2.gz NSQHXZQEDKYIQS-WBMJQRKESA-N 2 1 335.904 4.308 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCSc2c(Cl)cccc21 ZINC000358082487 1044155854 /nfs/dbraw/zinc/15/58/54/1044155854.db2.gz NSQHXZQEDKYIQS-MLGOLLRUSA-N 2 1 335.904 4.308 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000193973987 1044225918 /nfs/dbraw/zinc/22/59/18/1044225918.db2.gz SYSNDIKJARECGP-GDBMZVCRSA-N 2 1 340.433 4.100 20 0 EIADMP CS[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)C(C)(C)C ZINC000542499937 1044228724 /nfs/dbraw/zinc/22/87/24/1044228724.db2.gz RTNWSLRFRBTEIY-YTQUADARSA-N 2 1 334.573 4.264 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(Br)cs2)C1 ZINC000194027918 1044244073 /nfs/dbraw/zinc/24/40/73/1044244073.db2.gz FBVDPBPAPAFXNI-STQMWFEESA-N 2 1 345.350 4.282 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168714744 1044272258 /nfs/dbraw/zinc/27/22/58/1044272258.db2.gz KYLPZLLQLOQXJN-SZMVWBNQSA-N 2 1 332.919 4.322 20 0 EIADMP COCC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000347930242 1044328776 /nfs/dbraw/zinc/32/87/76/1044328776.db2.gz KOMGPTOIUAIAAY-DSKINZAPSA-N 2 1 330.516 4.007 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)s1 ZINC001168019130 1044335652 /nfs/dbraw/zinc/33/56/52/1044335652.db2.gz GRCVJAQLOIWPGX-CCWDJLKJSA-N 2 1 343.540 4.291 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)s1 ZINC001168019130 1044335669 /nfs/dbraw/zinc/33/56/69/1044335669.db2.gz GRCVJAQLOIWPGX-CCWDJLKJSA-N 2 1 343.540 4.291 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC(C)(C)N2CCCCC2)cc1 ZINC000347960128 1044342427 /nfs/dbraw/zinc/34/24/27/1044342427.db2.gz PDUUFYZWYXVMJO-KRWDZBQOSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](COc1c(C)cccc1C)C(C)(C)C ZINC001168767044 1044400552 /nfs/dbraw/zinc/40/05/52/1044400552.db2.gz XIDZJYNENLESAZ-IBGZPJMESA-N 2 1 343.515 4.282 20 0 EIADMP Cc1nc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)c(C)s1 ZINC000443609696 1044540000 /nfs/dbraw/zinc/54/00/00/1044540000.db2.gz MOFZGKYGDXVETP-HNNXBMFYSA-N 2 1 335.561 4.236 20 0 EIADMP Cc1nc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c(C)s1 ZINC000443609696 1044540014 /nfs/dbraw/zinc/54/00/14/1044540014.db2.gz MOFZGKYGDXVETP-HNNXBMFYSA-N 2 1 335.561 4.236 20 0 EIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1cccs1 ZINC000675880285 1044553633 /nfs/dbraw/zinc/55/36/33/1044553633.db2.gz CUNAOOCJXCXTIH-ROUUACIJSA-N 2 1 336.545 4.068 20 0 EIADMP Cc1ccccc1[C@H]([NH2+]CCCC[N@H+]1CCC[C@H]1CO)C1CCCC1 ZINC000495081003 1044648588 /nfs/dbraw/zinc/64/85/88/1044648588.db2.gz FLTKWKNGFHJEMQ-RBBKRZOGSA-N 2 1 344.543 4.053 20 0 EIADMP C[C@H](C[NH2+]Cc1ccc(-c2c(F)cccc2F)o1)C[NH+]1CCCC1 ZINC000522378760 1044673202 /nfs/dbraw/zinc/67/32/02/1044673202.db2.gz KJQXSSWPGPVPKO-CQSZACIVSA-N 2 1 334.410 4.046 20 0 EIADMP Clc1cccc2c1C[C@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001168728214 1044817928 /nfs/dbraw/zinc/81/79/28/1044817928.db2.gz QPUGLCYFISCFQY-GOSISDBHSA-N 2 1 344.930 4.148 20 0 EIADMP Clc1cccc2c1C[C@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001168728214 1044817930 /nfs/dbraw/zinc/81/79/30/1044817930.db2.gz QPUGLCYFISCFQY-GOSISDBHSA-N 2 1 344.930 4.148 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000673600219 1044861333 /nfs/dbraw/zinc/86/13/33/1044861333.db2.gz WPAXHEQWJOTUKX-IOTGCTKJSA-N 2 1 338.417 4.325 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168741227 1045229990 /nfs/dbraw/zinc/22/99/90/1045229990.db2.gz XLFIOEUITOUGAD-RCCFBDPRSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168741227 1045229998 /nfs/dbraw/zinc/22/99/98/1045229998.db2.gz XLFIOEUITOUGAD-RCCFBDPRSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168741227 1045230003 /nfs/dbraw/zinc/23/00/03/1045230003.db2.gz XLFIOEUITOUGAD-RCCFBDPRSA-N 2 1 332.919 4.146 20 0 EIADMP CC[N@H+]1CC[C@H](N[C@H]2CCOc3c(Cl)c(Cl)ccc32)[C@H](C)C1 ZINC000766259418 1045251512 /nfs/dbraw/zinc/25/15/12/1045251512.db2.gz YLSAAUYOGXAUSR-UGFHNGPFSA-N 2 1 343.298 4.137 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000495728073 1045316213 /nfs/dbraw/zinc/31/62/13/1045316213.db2.gz WCUDFFWKQFZUEQ-CVEARBPZSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000495728073 1045316221 /nfs/dbraw/zinc/31/62/21/1045316221.db2.gz WCUDFFWKQFZUEQ-CVEARBPZSA-N 2 1 332.488 4.450 20 0 EIADMP CC(C)[NH+]1CCC([NH2+]Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000236603935 1045360247 /nfs/dbraw/zinc/36/02/47/1045360247.db2.gz LIRMHOXMLDVKRS-UHFFFAOYSA-N 2 1 338.495 4.228 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2ccc(F)cc2C)o1 ZINC000237409164 1045383874 /nfs/dbraw/zinc/38/38/74/1045383874.db2.gz PCTPKXBADIGUCK-AWEZNQCLSA-N 2 1 341.430 4.325 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000915681642 1045446865 /nfs/dbraw/zinc/44/68/65/1045446865.db2.gz FMOHFPITTWQQBT-PMACEKPBSA-N 2 1 330.516 4.362 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001168498142 1045454921 /nfs/dbraw/zinc/45/49/21/1045454921.db2.gz QTXMWMNPGDULOT-RXVVDRJESA-N 2 1 340.486 4.211 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001168498142 1045454923 /nfs/dbraw/zinc/45/49/23/1045454923.db2.gz QTXMWMNPGDULOT-RXVVDRJESA-N 2 1 340.486 4.211 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001168498142 1045454925 /nfs/dbraw/zinc/45/49/25/1045454925.db2.gz QTXMWMNPGDULOT-RXVVDRJESA-N 2 1 340.486 4.211 20 0 EIADMP C[C@H]1C[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CCC[C@H]1C[NH3+] ZINC001206026685 1045712289 /nfs/dbraw/zinc/71/22/89/1045712289.db2.gz TZBDZPMOSDNFDY-JQWIXIFHSA-N 2 1 335.706 4.454 20 0 EIADMP CCC(CC)[N@H+](C1CC(C)(C)N(O)C(C)(C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169984085 1045722101 /nfs/dbraw/zinc/72/21/01/1045722101.db2.gz CSWPIYFPWDDUHH-JCNLHEQBSA-N 2 1 339.568 4.158 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000247201891 1045843113 /nfs/dbraw/zinc/84/31/13/1045843113.db2.gz WIKYXDQVCGRQDY-RTBURBONSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1OC ZINC000248407630 1045872290 /nfs/dbraw/zinc/87/22/90/1045872290.db2.gz UNTAPTLJWLZMII-UWVAXJGDSA-N 2 1 330.516 4.389 20 0 EIADMP C[N@H+]1CCC[C@H]1CCN1CCc2sccc2[C@@H]1c1cccs1 ZINC000163310362 1045939635 /nfs/dbraw/zinc/93/96/35/1045939635.db2.gz QLLIYAYUFKRJRM-KBXCAEBGSA-N 2 1 332.538 4.241 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000161612811 1046007820 /nfs/dbraw/zinc/00/78/20/1046007820.db2.gz BTFUURMQZUDJHZ-CPUCHLNUSA-N 2 1 340.433 4.055 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)C3CCCC3)CC2)cs1 ZINC000161793067 1046036010 /nfs/dbraw/zinc/03/60/10/1046036010.db2.gz HJIZKSDJRSXEBT-HNNXBMFYSA-N 2 1 335.561 4.086 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCC[C@H](CC(C)C)C2)cn1 ZINC000792922669 1046109176 /nfs/dbraw/zinc/10/91/76/1046109176.db2.gz QFESFQGRSSYWFI-MJGOQNOKSA-N 2 1 326.488 4.270 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000261932082 1046165319 /nfs/dbraw/zinc/16/53/19/1046165319.db2.gz LROFGFGVTRBGQM-IRXDYDNUSA-N 2 1 343.540 4.419 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)C1CCCCC1 ZINC000162318507 1046173057 /nfs/dbraw/zinc/17/30/57/1046173057.db2.gz BJEAQKBNYAZNRG-LJQANCHMSA-N 2 1 330.520 4.011 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](CCCCc2cccc(C(F)(F)F)c2)C1 ZINC000476006474 1046251025 /nfs/dbraw/zinc/25/10/25/1046251025.db2.gz BURJBNOXFDPDCB-QGZVFWFLSA-N 2 1 342.449 4.302 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](CCCCc2cccc(C(F)(F)F)c2)C1 ZINC000476006474 1046251048 /nfs/dbraw/zinc/25/10/48/1046251048.db2.gz BURJBNOXFDPDCB-QGZVFWFLSA-N 2 1 342.449 4.302 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](CCCCc2cccc(C(F)(F)F)c2)C1 ZINC000476006474 1046251074 /nfs/dbraw/zinc/25/10/74/1046251074.db2.gz BURJBNOXFDPDCB-QGZVFWFLSA-N 2 1 342.449 4.302 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2cc(C)ccc2C)OC[C@H]1C ZINC000125531594 1046312671 /nfs/dbraw/zinc/31/26/71/1046312671.db2.gz MIXYFZLFKMLBDK-WIYYLYMNSA-N 2 1 341.499 4.051 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2cc(C)ccc2C)OC[C@H]1C ZINC000125531594 1046312689 /nfs/dbraw/zinc/31/26/89/1046312689.db2.gz MIXYFZLFKMLBDK-WIYYLYMNSA-N 2 1 341.499 4.051 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](c2cc(C)ccc2C)OC[C@H]1C ZINC000125531381 1046312882 /nfs/dbraw/zinc/31/28/82/1046312882.db2.gz MIXYFZLFKMLBDK-NQIIRXRSSA-N 2 1 341.499 4.051 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](c2cc(C)ccc2C)OC[C@H]1C ZINC000125531381 1046312899 /nfs/dbraw/zinc/31/28/99/1046312899.db2.gz MIXYFZLFKMLBDK-NQIIRXRSSA-N 2 1 341.499 4.051 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000125521114 1046313783 /nfs/dbraw/zinc/31/37/83/1046313783.db2.gz KHBSFDVAOVQCHZ-QFBILLFUSA-N 2 1 329.513 4.150 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000125521114 1046313799 /nfs/dbraw/zinc/31/37/99/1046313799.db2.gz KHBSFDVAOVQCHZ-QFBILLFUSA-N 2 1 329.513 4.150 20 0 EIADMP C[C@@H](Nc1cccc(C[NH+](C)C)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508688663 1046321749 /nfs/dbraw/zinc/32/17/49/1046321749.db2.gz DLAGTOFQMIXOFR-WIYYLYMNSA-N 2 1 337.511 4.071 20 0 EIADMP C[C@@H]([NH2+]C[C@@H](C)Cc1cccs1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508692943 1046323758 /nfs/dbraw/zinc/32/37/58/1046323758.db2.gz XMTQOQCIZQMNIP-NSHGMRRFSA-N 2 1 342.552 4.427 20 0 EIADMP COc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1C ZINC000508698030 1046329842 /nfs/dbraw/zinc/32/98/42/1046329842.db2.gz KSTQEXQRXZCKPL-GHTZIAJQSA-N 2 1 338.495 4.004 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Br)s2)C1 ZINC000125784716 1046344671 /nfs/dbraw/zinc/34/46/71/1046344671.db2.gz FLKUXUWKOIVNGJ-STQMWFEESA-N 2 1 345.350 4.282 20 0 EIADMP C[N@@H+](CCC[NH2+]C1CCC(C(F)(F)F)CC1)Cc1ccccc1 ZINC000125888058 1046363855 /nfs/dbraw/zinc/36/38/55/1046363855.db2.gz HHRSPACMJQIPJK-UHFFFAOYSA-N 2 1 328.422 4.219 20 0 EIADMP C[C@H]([NH2+]CCc1cccc(F)c1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710052 1046364856 /nfs/dbraw/zinc/36/48/56/1046364856.db2.gz KVEZBTYQWLFUND-QFBILLFUSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@@H]([NH2+]CC1(c2ccccc2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710704 1046370343 /nfs/dbraw/zinc/37/03/43/1046370343.db2.gz NRFRVNSJNRLIAS-TZIWHRDSSA-N 2 1 334.507 4.218 20 0 EIADMP COc1ccc2oc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)cc2c1 ZINC000126301336 1046473546 /nfs/dbraw/zinc/47/35/46/1046473546.db2.gz IOBWDFYRSBNWLF-UHFFFAOYSA-N 2 1 342.483 4.328 20 0 EIADMP COCc1ccccc1/C=C(\C)CN(C)CC[C@H]1CCCC[N@H+]1C ZINC000508742995 1046493631 /nfs/dbraw/zinc/49/36/31/1046493631.db2.gz IOKVETOHESQPCX-BKBDBRRMSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000508742995 1046493642 /nfs/dbraw/zinc/49/36/42/1046493642.db2.gz IOKVETOHESQPCX-BKBDBRRMSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000508742995 1046493650 /nfs/dbraw/zinc/49/36/50/1046493650.db2.gz IOKVETOHESQPCX-BKBDBRRMSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC000508742995 1046493655 /nfs/dbraw/zinc/49/36/55/1046493655.db2.gz IOKVETOHESQPCX-BKBDBRRMSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC000508742995 1046493661 /nfs/dbraw/zinc/49/36/61/1046493661.db2.gz IOKVETOHESQPCX-BKBDBRRMSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(/C)CN(C)CC[C@H]1CCCC[N@H+]1C ZINC000508743000 1046493911 /nfs/dbraw/zinc/49/39/11/1046493911.db2.gz IOKVETOHESQPCX-WOBAJENOSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000508743000 1046493916 /nfs/dbraw/zinc/49/39/16/1046493916.db2.gz IOKVETOHESQPCX-WOBAJENOSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000508743000 1046493923 /nfs/dbraw/zinc/49/39/23/1046493923.db2.gz IOKVETOHESQPCX-WOBAJENOSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(/C)C[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC000508743000 1046493925 /nfs/dbraw/zinc/49/39/25/1046493925.db2.gz IOKVETOHESQPCX-WOBAJENOSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(/C)C[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC000508743000 1046493930 /nfs/dbraw/zinc/49/39/30/1046493930.db2.gz IOKVETOHESQPCX-WOBAJENOSA-N 2 1 330.516 4.043 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CCCO2 ZINC000126535265 1046494138 /nfs/dbraw/zinc/49/41/38/1046494138.db2.gz XDDJVTJLBSAVKD-OXJNMPFZSA-N 2 1 328.500 4.098 20 0 EIADMP C[C@H](C[NH2+]C1CC[NH+](C2CC2)CC1)c1c(Cl)cccc1Cl ZINC000459400553 1046599192 /nfs/dbraw/zinc/59/91/92/1046599192.db2.gz MPOZQEPELXBVRC-GFCCVEGCSA-N 2 1 327.299 4.313 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@H]1C ZINC000536659112 1046610882 /nfs/dbraw/zinc/61/08/82/1046610882.db2.gz FHRSUOVCMROXQR-RDTXWAMCSA-N 2 1 346.906 4.035 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@H]1C ZINC000536659112 1046610887 /nfs/dbraw/zinc/61/08/87/1046610887.db2.gz FHRSUOVCMROXQR-RDTXWAMCSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@H]1C ZINC000536659112 1046610897 /nfs/dbraw/zinc/61/08/97/1046610897.db2.gz FHRSUOVCMROXQR-RDTXWAMCSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@H]1C ZINC000536659112 1046610909 /nfs/dbraw/zinc/61/09/09/1046610909.db2.gz FHRSUOVCMROXQR-RDTXWAMCSA-N 2 1 346.906 4.035 20 0 EIADMP CCOc1cc(C[N@H+](C)[C@@H]2CCN(C)[C@@H](C)C2)ccc1OCC(C)C ZINC000536658658 1046622169 /nfs/dbraw/zinc/62/21/69/1046622169.db2.gz PMXMAAFICKTECU-PKOBYXMFSA-N 2 1 348.531 4.035 20 0 EIADMP CCOc1cc(C[N@@H+](C)[C@@H]2CCN(C)[C@@H](C)C2)ccc1OCC(C)C ZINC000536658658 1046622178 /nfs/dbraw/zinc/62/21/78/1046622178.db2.gz PMXMAAFICKTECU-PKOBYXMFSA-N 2 1 348.531 4.035 20 0 EIADMP CCCCOc1cc(C[N@@H+](C)[C@@H]2CC[NH+](CC)C[C@H]2C)ccc1OC ZINC000536658859 1046622870 /nfs/dbraw/zinc/62/28/70/1046622870.db2.gz PPTKFBNCRVCPAE-IEBWSBKVSA-N 2 1 348.531 4.036 20 0 EIADMP c1cc(-c2ccccc2)sc1C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000536658921 1046623405 /nfs/dbraw/zinc/62/34/05/1046623405.db2.gz UUPHRPZXIRCPNO-KRWDZBQOSA-N 2 1 326.509 4.333 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@@H](C)C1 ZINC000536660000 1046624504 /nfs/dbraw/zinc/62/45/04/1046624504.db2.gz SASDIZZBPCSPCK-DOTOQJQBSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@@H](C)C1 ZINC000536660000 1046624509 /nfs/dbraw/zinc/62/45/09/1046624509.db2.gz SASDIZZBPCSPCK-DOTOQJQBSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@@H](C)C1 ZINC000536660000 1046624524 /nfs/dbraw/zinc/62/45/24/1046624524.db2.gz SASDIZZBPCSPCK-DOTOQJQBSA-N 2 1 340.458 4.067 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[N@@H+]1C ZINC000536660053 1046627443 /nfs/dbraw/zinc/62/74/43/1046627443.db2.gz VCRMDIHVFPCHCQ-RHSMWYFYSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[N@H+]1C ZINC000536660053 1046627456 /nfs/dbraw/zinc/62/74/56/1046627456.db2.gz VCRMDIHVFPCHCQ-RHSMWYFYSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[NH+]1C ZINC000536660053 1046627468 /nfs/dbraw/zinc/62/74/68/1046627468.db2.gz VCRMDIHVFPCHCQ-RHSMWYFYSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[NH+]1C ZINC000536660053 1046627486 /nfs/dbraw/zinc/62/74/86/1046627486.db2.gz VCRMDIHVFPCHCQ-RHSMWYFYSA-N 2 1 332.488 4.469 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2c(OC)ccc3ccccc32)C1 ZINC000536664035 1046635800 /nfs/dbraw/zinc/63/58/00/1046635800.db2.gz DAHBRQQMFLFXIA-QGZVFWFLSA-N 2 1 326.484 4.012 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2c(OC)ccc3ccccc32)C1 ZINC000536664035 1046635804 /nfs/dbraw/zinc/63/58/04/1046635804.db2.gz DAHBRQQMFLFXIA-QGZVFWFLSA-N 2 1 326.484 4.012 20 0 EIADMP c1ccc(SC2(C[NH2+]C3CC[NH+](C4CC4)CC3)CCCC2)cc1 ZINC000459414416 1046640514 /nfs/dbraw/zinc/64/05/14/1046640514.db2.gz YYISOHHFJQLFGJ-UHFFFAOYSA-N 2 1 330.541 4.308 20 0 EIADMP c1csc([C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)C2CCCC2)c1 ZINC000772457388 1046644310 /nfs/dbraw/zinc/64/43/10/1046644310.db2.gz VMPOEVITXLCNDV-ICSRJNTNSA-N 2 1 348.556 4.212 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCC[C@@H](C(F)(F)F)C3)CC2)[nH+]c1 ZINC000127366788 1046658950 /nfs/dbraw/zinc/65/89/50/1046658950.db2.gz MLRQAQXRRXZQTO-GDBMZVCRSA-N 2 1 341.421 4.070 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(OC(F)F)c(Cl)c2)[C@@H](C)C1 ZINC000536678538 1046664704 /nfs/dbraw/zinc/66/47/04/1046664704.db2.gz CASQGRBTSJJWQA-SWLSCSKDSA-N 2 1 346.849 4.104 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)[C@@H](C)C1 ZINC000536678538 1046664720 /nfs/dbraw/zinc/66/47/20/1046664720.db2.gz CASQGRBTSJJWQA-SWLSCSKDSA-N 2 1 346.849 4.104 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)[C@@H](C)C1 ZINC000536678538 1046664739 /nfs/dbraw/zinc/66/47/39/1046664739.db2.gz CASQGRBTSJJWQA-SWLSCSKDSA-N 2 1 346.849 4.104 20 0 EIADMP Cc1nc2c(n1[C@H]1CC[N@@H+](CC3CCC(F)(F)CC3)C1)CCCC2 ZINC000459434139 1046668895 /nfs/dbraw/zinc/66/88/95/1046668895.db2.gz UHTILLHWSDLPDJ-INIZCTEOSA-N 2 1 337.458 4.143 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@H+](CC3CCC(F)(F)CC3)C1)CCCC2 ZINC000459434139 1046668913 /nfs/dbraw/zinc/66/89/13/1046668913.db2.gz UHTILLHWSDLPDJ-INIZCTEOSA-N 2 1 337.458 4.143 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@@H+](CC3CCC(F)(F)CC3)C1)CCCC2 ZINC000459434139 1046668925 /nfs/dbraw/zinc/66/89/25/1046668925.db2.gz UHTILLHWSDLPDJ-INIZCTEOSA-N 2 1 337.458 4.143 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)[C@@H](C)C1 ZINC000536682260 1046683605 /nfs/dbraw/zinc/68/36/05/1046683605.db2.gz BJCDJJXDORATLU-HRAATJIYSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc3cc(OC)ccc3c2)[C@@H](C)C1 ZINC000536682260 1046683614 /nfs/dbraw/zinc/68/36/14/1046683614.db2.gz BJCDJJXDORATLU-HRAATJIYSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc3cc(OC)ccc3c2)[C@@H](C)C1 ZINC000536682260 1046683624 /nfs/dbraw/zinc/68/36/24/1046683624.db2.gz BJCDJJXDORATLU-HRAATJIYSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2c(OC)ccc3ccccc32)C1 ZINC000536697294 1046694465 /nfs/dbraw/zinc/69/44/65/1046694465.db2.gz OLWWFHGSSIAAOT-QGZVFWFLSA-N 2 1 326.484 4.012 20 0 EIADMP CC[C@H](NCC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000379636733 1046724722 /nfs/dbraw/zinc/72/47/22/1046724722.db2.gz XTBZBTZYCLBUJQ-LPHOPBHVSA-N 2 1 329.463 4.172 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379630280 1046733647 /nfs/dbraw/zinc/73/36/47/1046733647.db2.gz PKRPOZRVBJGGCM-HBFSDRIKSA-N 2 1 326.484 4.243 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379630280 1046733657 /nfs/dbraw/zinc/73/36/57/1046733657.db2.gz PKRPOZRVBJGGCM-HBFSDRIKSA-N 2 1 326.484 4.243 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ncccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379644943 1046738070 /nfs/dbraw/zinc/73/80/70/1046738070.db2.gz HLTZUMXKXGYXQU-GCJKJVERSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ncccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379644943 1046738080 /nfs/dbraw/zinc/73/80/80/1046738080.db2.gz HLTZUMXKXGYXQU-GCJKJVERSA-N 2 1 345.490 4.378 20 0 EIADMP CO[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379645995 1046739766 /nfs/dbraw/zinc/73/97/66/1046739766.db2.gz IIKBSQKVVDTSQN-YUXAGFNASA-N 2 1 338.495 4.017 20 0 EIADMP CO[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379645995 1046739779 /nfs/dbraw/zinc/73/97/79/1046739779.db2.gz IIKBSQKVVDTSQN-YUXAGFNASA-N 2 1 338.495 4.017 20 0 EIADMP CO[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379645728 1046740341 /nfs/dbraw/zinc/74/03/41/1046740341.db2.gz IIKBSQKVVDTSQN-BVYCBKJFSA-N 2 1 338.495 4.017 20 0 EIADMP CO[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379645728 1046740350 /nfs/dbraw/zinc/74/03/50/1046740350.db2.gz IIKBSQKVVDTSQN-BVYCBKJFSA-N 2 1 338.495 4.017 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCCC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000379651225 1046743012 /nfs/dbraw/zinc/74/30/12/1046743012.db2.gz UJEQNTIMWVEJHV-NZSAHSFTSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3c2cccc3F)CC[N@@H+]1Cc1ccccc1 ZINC000379655814 1046760162 /nfs/dbraw/zinc/76/01/62/1046760162.db2.gz NEORSYVVVRCJQZ-RADWXHQJSA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3c2cccc3F)CC[N@H+]1Cc1ccccc1 ZINC000379655814 1046760176 /nfs/dbraw/zinc/76/01/76/1046760176.db2.gz NEORSYVVVRCJQZ-RADWXHQJSA-N 2 1 338.470 4.456 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3cc4c(s3)CCC4)CC2)[nH+]1 ZINC000128159430 1046772158 /nfs/dbraw/zinc/77/21/58/1046772158.db2.gz LCRJFIQOEHUJFJ-HNNXBMFYSA-N 2 1 341.524 4.260 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3cccc(Cl)c3)CC2)[nH+]1 ZINC000128161859 1046773217 /nfs/dbraw/zinc/77/32/17/1046773217.db2.gz UYHHXOHZYKJRGF-OAHLLOKOSA-N 2 1 329.875 4.363 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3cc4ccccc4o3)CC2)[nH+]1 ZINC000128233099 1046784843 /nfs/dbraw/zinc/78/48/43/1046784843.db2.gz AYRDKDZZLRBANV-MRXNPFEDSA-N 2 1 335.451 4.456 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)C1 ZINC000536838978 1046814289 /nfs/dbraw/zinc/81/42/89/1046814289.db2.gz MVCZNDXVEQTOME-ZIAGYGMSSA-N 2 1 328.422 4.123 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)C1 ZINC000536838978 1046814291 /nfs/dbraw/zinc/81/42/91/1046814291.db2.gz MVCZNDXVEQTOME-ZIAGYGMSSA-N 2 1 328.422 4.123 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2OCc2ccccc2)[C@@H](C)C1 ZINC000536853813 1046822895 /nfs/dbraw/zinc/82/28/95/1046822895.db2.gz VKXIFJNBZJUDMT-GHTZIAJQSA-N 2 1 338.495 4.086 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccccc2OCc2ccccc2)[C@@H](C)C1 ZINC000536853813 1046822897 /nfs/dbraw/zinc/82/28/97/1046822897.db2.gz VKXIFJNBZJUDMT-GHTZIAJQSA-N 2 1 338.495 4.086 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000536859838 1046828824 /nfs/dbraw/zinc/82/88/24/1046828824.db2.gz WTZMNZPRZCTSPG-ZMYBRWDISA-N 2 1 331.891 4.407 20 0 EIADMP COc1cccc2c1C[C@@H]([NH2+][C@@H](C)c1ccc(-n3cc[nH+]c3C)cc1)C2 ZINC000459722639 1046864582 /nfs/dbraw/zinc/86/45/82/1046864582.db2.gz IDSVSYGRCBUHQY-KXBFYZLASA-N 2 1 347.462 4.007 20 0 EIADMP CCCc1ccc([C@@H]([NH2+]CC2([NH+](C)C)CCOCC2)C(C)C)cc1 ZINC000537000209 1046890989 /nfs/dbraw/zinc/89/09/89/1046890989.db2.gz TWVCLDGGADIVMC-FQEVSTJZSA-N 2 1 332.532 4.037 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000537304358 1047084769 /nfs/dbraw/zinc/08/47/69/1047084769.db2.gz ONCJFIBCMAMQBO-OAQYLSRUSA-N 2 1 342.433 4.100 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@@H]3CC[C@H]3C3CC3)cc2)CC1 ZINC000806158297 1047182084 /nfs/dbraw/zinc/18/20/84/1047182084.db2.gz WXYBOPZUGBCVRH-LEWJYISDSA-N 2 1 327.516 4.065 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000537406714 1047199384 /nfs/dbraw/zinc/19/93/84/1047199384.db2.gz IAAGTFBSTJYNCM-NMIHRBCNSA-N 2 1 344.543 4.080 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCn2ccc3ccccc32)C[C@H]1c1ccccc1 ZINC000556052951 1047418661 /nfs/dbraw/zinc/41/86/61/1047418661.db2.gz LDMKZOXMQAOAJW-GGAORHGYSA-N 2 1 347.506 4.457 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCn2ccc3ccccc32)C[C@H]1c1ccccc1 ZINC000556052951 1047418667 /nfs/dbraw/zinc/41/86/67/1047418667.db2.gz LDMKZOXMQAOAJW-GGAORHGYSA-N 2 1 347.506 4.457 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000129650718 1047457255 /nfs/dbraw/zinc/45/72/55/1047457255.db2.gz MGBXCGXGFDUUGO-XUWVNRHRSA-N 2 1 332.454 4.350 20 0 EIADMP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000129671591 1047462454 /nfs/dbraw/zinc/46/24/54/1047462454.db2.gz VUDBNJSRIAWOFP-LBPRGKRZSA-N 2 1 327.299 4.141 20 0 EIADMP Cc1cccnc1C(C)(C)C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556195251 1047554348 /nfs/dbraw/zinc/55/43/48/1047554348.db2.gz UGFIPPFCMRIORP-VQTJNVASSA-N 2 1 337.511 4.093 20 0 EIADMP Cc1cccnc1C(C)(C)C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556195251 1047554367 /nfs/dbraw/zinc/55/43/67/1047554367.db2.gz UGFIPPFCMRIORP-VQTJNVASSA-N 2 1 337.511 4.093 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](c2ccncc2)C2CC2)cc1 ZINC000898319484 1047612392 /nfs/dbraw/zinc/61/23/92/1047612392.db2.gz GLOODLNQEZTNMK-VFNWGFHPSA-N 2 1 332.451 4.378 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccncc2)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000898321898 1047613746 /nfs/dbraw/zinc/61/37/46/1047613746.db2.gz DVUOAAQTSMSZTB-VOQZNFBZSA-N 2 1 335.495 4.175 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccncc2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000898321898 1047613758 /nfs/dbraw/zinc/61/37/58/1047613758.db2.gz DVUOAAQTSMSZTB-VOQZNFBZSA-N 2 1 335.495 4.175 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccncc2)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000898321899 1047615380 /nfs/dbraw/zinc/61/53/80/1047615380.db2.gz DVUOAAQTSMSZTB-WTNAPCKOSA-N 2 1 335.495 4.175 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccncc2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000898321899 1047615398 /nfs/dbraw/zinc/61/53/98/1047615398.db2.gz DVUOAAQTSMSZTB-WTNAPCKOSA-N 2 1 335.495 4.175 20 0 EIADMP C[C@H](Nc1cccc2cc[nH+]cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000537526048 1047667746 /nfs/dbraw/zinc/66/77/46/1047667746.db2.gz PCZLUUXOBRCZKJ-INIZCTEOSA-N 2 1 335.451 4.348 20 0 EIADMP Cc1ccccc1C1(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000550642808 1047801241 /nfs/dbraw/zinc/80/12/41/1047801241.db2.gz UUDYDAFVFBNORL-IFMALSPDSA-N 2 1 334.507 4.452 20 0 EIADMP Cc1ccccc1C1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000550642808 1047801242 /nfs/dbraw/zinc/80/12/42/1047801242.db2.gz UUDYDAFVFBNORL-IFMALSPDSA-N 2 1 334.507 4.452 20 0 EIADMP Cc1ccccc1C1(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000550642810 1047801643 /nfs/dbraw/zinc/80/16/43/1047801643.db2.gz UUDYDAFVFBNORL-RBBKRZOGSA-N 2 1 334.507 4.452 20 0 EIADMP Cc1ccccc1C1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000550642810 1047801646 /nfs/dbraw/zinc/80/16/46/1047801646.db2.gz UUDYDAFVFBNORL-RBBKRZOGSA-N 2 1 334.507 4.452 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2csc(-c3ccoc3)n2)CC1 ZINC000108492035 1047803975 /nfs/dbraw/zinc/80/39/75/1047803975.db2.gz BLOUJJLPXUPWDH-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2csc(-c3ccoc3)n2)CC1 ZINC000108492035 1047803976 /nfs/dbraw/zinc/80/39/76/1047803976.db2.gz BLOUJJLPXUPWDH-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CC2(Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000550701164 1047819873 /nfs/dbraw/zinc/81/98/73/1047819873.db2.gz STEZTFZBQUEVAB-VXKWHMMOSA-N 2 1 334.507 4.434 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC2(Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000550701164 1047819875 /nfs/dbraw/zinc/81/98/75/1047819875.db2.gz STEZTFZBQUEVAB-VXKWHMMOSA-N 2 1 334.507 4.434 20 0 EIADMP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000556589893 1047834751 /nfs/dbraw/zinc/83/47/51/1047834751.db2.gz QPMLMMWPJMIJCC-XWDORNJCSA-N 2 1 330.516 4.041 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000131294632 1047860193 /nfs/dbraw/zinc/86/01/93/1047860193.db2.gz YUTBIOTUFKSOFJ-MSOLQXFVSA-N 3 1 342.531 4.342 20 0 EIADMP CC1(C)[C@@H]2C[C@H]([N@@H+](Cc3ccc(F)cc3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170736418 1047923520 /nfs/dbraw/zinc/92/35/20/1047923520.db2.gz MFKIEMXTVLUVBN-CCQCEHTISA-N 2 1 330.491 4.332 20 0 EIADMP C[NH+](C)CCC[N@H+](C)Cc1ccc2ccc(-c3ccccc3)nc2c1 ZINC001136943547 1047947118 /nfs/dbraw/zinc/94/71/18/1047947118.db2.gz KIEDFZVWINTYIV-UHFFFAOYSA-N 2 1 333.479 4.285 20 0 EIADMP C[NH+](C)CCC[N@@H+](C)Cc1ccc2ccc(-c3ccccc3)nc2c1 ZINC001136943547 1047947141 /nfs/dbraw/zinc/94/71/41/1047947141.db2.gz KIEDFZVWINTYIV-UHFFFAOYSA-N 2 1 333.479 4.285 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000824988014 1048017493 /nfs/dbraw/zinc/01/74/93/1048017493.db2.gz GAFOGGJIRFEOCB-MGLUKCQKSA-N 2 1 340.433 4.412 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+]([C@@H]1C[C@@H]3[C@H](C1)C3(C)C)CC2 ZINC001170752068 1048065756 /nfs/dbraw/zinc/06/57/56/1048065756.db2.gz IMINEGUHDLPFIH-FFGOWVMKSA-N 2 1 342.527 4.391 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)c1 ZINC000556871310 1048088894 /nfs/dbraw/zinc/08/88/94/1048088894.db2.gz SKXKMESSOVJTLB-IBGZPJMESA-N 2 1 337.511 4.473 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCc2ccccc2[C@H](c2ccccc2)[C@H]1C ZINC000499052833 1048129782 /nfs/dbraw/zinc/12/97/82/1048129782.db2.gz DKRBEDBZSYQVIC-JPYJTQIMSA-N 2 1 345.490 4.270 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCc2ccccc2[C@H](c2ccccc2)[C@H]1C ZINC000499052833 1048129787 /nfs/dbraw/zinc/12/97/87/1048129787.db2.gz DKRBEDBZSYQVIC-JPYJTQIMSA-N 2 1 345.490 4.270 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)C[C@H]3CC3(Cl)Cl)C2)s1 ZINC000844327417 1048286241 /nfs/dbraw/zinc/28/62/41/1048286241.db2.gz CIFRSXNLMBQUAK-ZIAGYGMSSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)C[C@H]3CC3(Cl)Cl)C2)s1 ZINC000844327417 1048286258 /nfs/dbraw/zinc/28/62/58/1048286258.db2.gz CIFRSXNLMBQUAK-ZIAGYGMSSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)C[C@H]3CC3(Cl)Cl)C2)s1 ZINC000844327417 1048286273 /nfs/dbraw/zinc/28/62/73/1048286273.db2.gz CIFRSXNLMBQUAK-ZIAGYGMSSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)C[C@H]3CC3(Cl)Cl)C2)s1 ZINC000844327417 1048286285 /nfs/dbraw/zinc/28/62/85/1048286285.db2.gz CIFRSXNLMBQUAK-ZIAGYGMSSA-N 2 1 347.355 4.004 20 0 EIADMP CN(C)c1ccccc1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499126486 1048304485 /nfs/dbraw/zinc/30/44/85/1048304485.db2.gz WPPIZEHJKPAYEC-KOUNCHBCSA-N 2 1 349.522 4.038 20 0 EIADMP Cc1ccsc1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499147373 1048353002 /nfs/dbraw/zinc/35/30/02/1048353002.db2.gz PXPXOHKJJSHVOD-LDLYASANSA-N 2 1 326.509 4.342 20 0 EIADMP FC1(F)C[C@@]12CC[NH+](CCCCCC[N@@H+]1CC[C@]3(CC3(F)F)C1)C2 ZINC000844470879 1048356064 /nfs/dbraw/zinc/35/60/64/1048356064.db2.gz MCXCVOUUDILSJK-IYBDPMFKSA-N 2 1 348.428 4.009 20 0 EIADMP FC1(F)C[C@@]12CC[N@@H+](CCCCCC[NH+]1CC[C@]3(CC3(F)F)C1)C2 ZINC000844470879 1048356082 /nfs/dbraw/zinc/35/60/82/1048356082.db2.gz MCXCVOUUDILSJK-IYBDPMFKSA-N 2 1 348.428 4.009 20 0 EIADMP FC1(F)C[C@@]12CC[N@H+](CCCCCC[NH+]1CC[C@]3(CC3(F)F)C1)C2 ZINC000844470879 1048356091 /nfs/dbraw/zinc/35/60/91/1048356091.db2.gz MCXCVOUUDILSJK-IYBDPMFKSA-N 2 1 348.428 4.009 20 0 EIADMP Oc1cccc2c1CC[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499153571 1048363390 /nfs/dbraw/zinc/36/33/90/1048363390.db2.gz RVFXRCBDDJZJFB-VWNVYAMZSA-N 2 1 348.490 4.165 20 0 EIADMP Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000815622221 1048547653 /nfs/dbraw/zinc/54/76/53/1048547653.db2.gz PRERQPXJGDLASI-MJGOQNOKSA-N 2 1 326.459 4.307 20 0 EIADMP CCc1cccc(CN2CCC([N@H+](C)Cc3ccccc3F)CC2)c1 ZINC001144326697 1048599414 /nfs/dbraw/zinc/59/94/14/1048599414.db2.gz NRFIPDUAKUAXIV-UHFFFAOYSA-N 2 1 340.486 4.485 20 0 EIADMP CCc1cccc(CN2CCC([N@@H+](C)Cc3ccccc3F)CC2)c1 ZINC001144326697 1048599429 /nfs/dbraw/zinc/59/94/29/1048599429.db2.gz NRFIPDUAKUAXIV-UHFFFAOYSA-N 2 1 340.486 4.485 20 0 EIADMP CSc1ccc(C[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000810155965 1048662146 /nfs/dbraw/zinc/66/21/46/1048662146.db2.gz NIOMCDINBMIROY-IBGZPJMESA-N 2 1 346.565 4.472 20 0 EIADMP CSc1ccc(C[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000810155966 1048662591 /nfs/dbraw/zinc/66/25/91/1048662591.db2.gz NIOMCDINBMIROY-LJQANCHMSA-N 2 1 346.565 4.472 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC[C@@]1(C)C[C@]1(F)Cl ZINC000846188818 1048838906 /nfs/dbraw/zinc/83/89/06/1048838906.db2.gz JTERVABTEPDIAM-XGXHKWSGSA-N 2 1 338.898 4.191 20 0 EIADMP Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCC[N@H+]1CCCCCC[NH3+] ZINC000846219416 1048843648 /nfs/dbraw/zinc/84/36/48/1048843648.db2.gz QLOXHHPYNDYYQU-INIZCTEOSA-N 2 1 340.943 4.157 20 0 EIADMP CCCC[N@@H+](C)CC1CCN(Cc2ncccc2C(F)(F)F)CC1 ZINC000134148647 1048887665 /nfs/dbraw/zinc/88/76/65/1048887665.db2.gz CSGNETSSFQGADB-UHFFFAOYSA-N 2 1 343.437 4.044 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2ncccc2C(F)(F)F)CC1 ZINC000134148647 1048887669 /nfs/dbraw/zinc/88/76/69/1048887669.db2.gz CSGNETSSFQGADB-UHFFFAOYSA-N 2 1 343.437 4.044 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ncccc2C(F)(F)F)CC1 ZINC000134148647 1048887672 /nfs/dbraw/zinc/88/76/72/1048887672.db2.gz CSGNETSSFQGADB-UHFFFAOYSA-N 2 1 343.437 4.044 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H](C[NH3+])CC(C)C)ccc1SC(F)F ZINC000817958189 1049066094 /nfs/dbraw/zinc/06/60/94/1049066094.db2.gz INHRBFAXTGRZCA-AAEUAGOBSA-N 2 1 332.460 4.034 20 0 EIADMP COc1cc([C@@H](C)[NH2+][C@H](C[NH3+])C2CCCC2)ccc1SC(F)F ZINC000817980496 1049077805 /nfs/dbraw/zinc/07/78/05/1049077805.db2.gz CBJULTWCJDEGDJ-BXUZGUMPSA-N 2 1 344.471 4.178 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911501 1049195338 /nfs/dbraw/zinc/19/53/38/1049195338.db2.gz XXXKVWWTYHVKKL-BZSNNMDCSA-N 2 1 332.919 4.179 20 0 EIADMP CC1([NH+]2CCCC2)CC[NH+]([C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170941911 1049408844 /nfs/dbraw/zinc/40/88/44/1049408844.db2.gz GWJGJPIVNAGZAP-KRWDZBQOSA-N 2 1 332.919 4.148 20 0 EIADMP CCO[C@@H](CC[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C(C)C ZINC000348095195 1049413947 /nfs/dbraw/zinc/41/39/47/1049413947.db2.gz JREUFDBLXRZNML-UZLBHIALSA-N 2 1 329.488 4.283 20 0 EIADMP CC[C@@H]([NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C1CCOCC1 ZINC000348095364 1049417512 /nfs/dbraw/zinc/41/75/12/1049417512.db2.gz KZGFXGBEFLANCZ-MGPUTAFESA-N 2 1 327.472 4.037 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCC2CC(OC(C)(C)C)C2)C[C@H]1c1ccccc1 ZINC000517226227 1049506984 /nfs/dbraw/zinc/50/69/84/1049506984.db2.gz GPEUNCDPDPLNDY-WDQDQHCCSA-N 2 1 344.543 4.395 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCC2CC(OC(C)(C)C)C2)C[C@H]1c1ccccc1 ZINC000517226227 1049507001 /nfs/dbraw/zinc/50/70/01/1049507001.db2.gz GPEUNCDPDPLNDY-WDQDQHCCSA-N 2 1 344.543 4.395 20 0 EIADMP CC(C)COC[C@@H]([NH2+][C@H](C)c1cccc(C[NH+](C)C)c1)c1ccco1 ZINC000820808376 1049555226 /nfs/dbraw/zinc/55/52/26/1049555226.db2.gz DPIXASSLUBGTHB-YLJYHZDGSA-N 2 1 344.499 4.406 20 0 EIADMP Fc1cc(F)c2c(c1)C[C@@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001171381931 1049576330 /nfs/dbraw/zinc/57/63/30/1049576330.db2.gz VZKRYRLXMKFBAI-MOPGFXCFSA-N 2 1 348.481 4.163 20 0 EIADMP Fc1cc(F)c2c(c1)C[C@@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001171381931 1049576343 /nfs/dbraw/zinc/57/63/43/1049576343.db2.gz VZKRYRLXMKFBAI-MOPGFXCFSA-N 2 1 348.481 4.163 20 0 EIADMP Fc1cccc2c1CC[C@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001171434018 1049674868 /nfs/dbraw/zinc/67/48/68/1049674868.db2.gz PMPLLEMGYBUIAV-MOPGFXCFSA-N 2 1 330.491 4.023 20 0 EIADMP CN1CCC([N@@H+](C2CCCC2)[C@@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171500529 1049736743 /nfs/dbraw/zinc/73/67/43/1049736743.db2.gz QXTFAFZHSANXCG-LJQANCHMSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1(C)C ZINC001171625862 1049768447 /nfs/dbraw/zinc/76/84/47/1049768447.db2.gz PDYOJXLJKUIXRS-UHFFFAOYSA-N 3 1 335.580 4.025 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1nc2c(s1)CCCC2 ZINC000245535849 1049768812 /nfs/dbraw/zinc/76/88/12/1049768812.db2.gz KSBHPZQJGDIKMT-JKSUJKDBSA-N 2 1 335.561 4.185 20 0 EIADMP C[C@@H](C[NH3+])C[N@@H+](C)C1CCC(c2ccc(Br)cc2)CC1 ZINC001171648207 1049769885 /nfs/dbraw/zinc/76/98/85/1049769885.db2.gz QNVULFCTQMFYHT-KTAKPFMOSA-N 2 1 339.321 4.002 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706775 1049776221 /nfs/dbraw/zinc/77/62/21/1049776221.db2.gz MACDXJRERGAPMZ-IPMKNSEASA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706775 1049776230 /nfs/dbraw/zinc/77/62/30/1049776230.db2.gz MACDXJRERGAPMZ-IPMKNSEASA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706775 1049776239 /nfs/dbraw/zinc/77/62/39/1049776239.db2.gz MACDXJRERGAPMZ-IPMKNSEASA-N 2 1 348.481 4.161 20 0 EIADMP C[C@H]1C[C@@H](NC(=[NH2+])c2ccc(F)c(Cl)c2)C[N@@H+]1Cc1ccccc1 ZINC001171740573 1049801371 /nfs/dbraw/zinc/80/13/71/1049801371.db2.gz SKBOCVISIOQFFA-XJKSGUPXSA-N 2 1 345.849 4.057 20 0 EIADMP C[C@H]1C[C@@H](NC(=[NH2+])c2ccc(F)c(Cl)c2)C[N@H+]1Cc1ccccc1 ZINC001171740573 1049801373 /nfs/dbraw/zinc/80/13/73/1049801373.db2.gz SKBOCVISIOQFFA-XJKSGUPXSA-N 2 1 345.849 4.057 20 0 EIADMP COC(C)(C)C[C@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813788981 1049816515 /nfs/dbraw/zinc/81/65/15/1049816515.db2.gz FHXOQQFDNXUSBB-XSLAUPDRSA-N 2 1 344.543 4.365 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCCc2ccccn2)CC[N@H+]1Cc1ccccc1 ZINC001171971919 1049835144 /nfs/dbraw/zinc/83/51/44/1049835144.db2.gz LEVBAVDLKOXTKC-OAQYLSRUSA-N 2 1 337.511 4.047 20 0 EIADMP CC1(C)C[C@H]([NH+]2CC[C@H](c3ccccn3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171983811 1049840249 /nfs/dbraw/zinc/84/02/49/1049840249.db2.gz GWHZCPGRAPDMNJ-LEWJYISDSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CC[C@H](c3ccccn3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983811 1049840251 /nfs/dbraw/zinc/84/02/51/1049840251.db2.gz GWHZCPGRAPDMNJ-LEWJYISDSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CC[C@H](c3ccccn3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983811 1049840255 /nfs/dbraw/zinc/84/02/55/1049840255.db2.gz GWHZCPGRAPDMNJ-LEWJYISDSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC(C)(C)O1 ZINC001171985864 1049840715 /nfs/dbraw/zinc/84/07/15/1049840715.db2.gz CKYHDFDYOZRNCF-LJQANCHMSA-N 2 1 344.543 4.319 20 0 EIADMP CC1(C)C[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC(C)(C)O1 ZINC001171985864 1049840717 /nfs/dbraw/zinc/84/07/17/1049840717.db2.gz CKYHDFDYOZRNCF-LJQANCHMSA-N 2 1 344.543 4.319 20 0 EIADMP FC[C@@H]1CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172074131 1049845143 /nfs/dbraw/zinc/84/51/43/1049845143.db2.gz FURMTDYIBZZTPI-UWHLTILDSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@@H]1CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172074131 1049845145 /nfs/dbraw/zinc/84/51/45/1049845145.db2.gz FURMTDYIBZZTPI-UWHLTILDSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172074131 1049845146 /nfs/dbraw/zinc/84/51/46/1049845146.db2.gz FURMTDYIBZZTPI-UWHLTILDSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172074131 1049845148 /nfs/dbraw/zinc/84/51/48/1049845148.db2.gz FURMTDYIBZZTPI-UWHLTILDSA-N 2 1 330.491 4.254 20 0 EIADMP FC1(F)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172080353 1049846215 /nfs/dbraw/zinc/84/62/15/1049846215.db2.gz ULCWQNDYCAQYNX-BWTSREIZSA-N 2 1 334.454 4.303 20 0 EIADMP FC1(F)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172080353 1049846216 /nfs/dbraw/zinc/84/62/16/1049846216.db2.gz ULCWQNDYCAQYNX-BWTSREIZSA-N 2 1 334.454 4.303 20 0 EIADMP CC(C)O[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172082431 1049847614 /nfs/dbraw/zinc/84/76/14/1049847614.db2.gz JWBQXKNRWMHQCY-CIAFKFPVSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H](C)C1 ZINC001172089921 1049849048 /nfs/dbraw/zinc/84/90/48/1049849048.db2.gz SSJAVIZOBKQIMN-TXZRGUEPSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H](C)C1 ZINC001172089921 1049849050 /nfs/dbraw/zinc/84/90/50/1049849050.db2.gz SSJAVIZOBKQIMN-TXZRGUEPSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@@H](C)C1 ZINC001172089921 1049849053 /nfs/dbraw/zinc/84/90/53/1049849053.db2.gz SSJAVIZOBKQIMN-TXZRGUEPSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@@H](C)C1 ZINC001172089921 1049849055 /nfs/dbraw/zinc/84/90/55/1049849055.db2.gz SSJAVIZOBKQIMN-TXZRGUEPSA-N 2 1 342.527 4.071 20 0 EIADMP F[C@H]1CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172067066 1049851161 /nfs/dbraw/zinc/85/11/61/1049851161.db2.gz AEAWBMWKJZGXCZ-UWHLTILDSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172067066 1049851163 /nfs/dbraw/zinc/85/11/63/1049851163.db2.gz AEAWBMWKJZGXCZ-UWHLTILDSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172067066 1049851165 /nfs/dbraw/zinc/85/11/65/1049851165.db2.gz AEAWBMWKJZGXCZ-UWHLTILDSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172067066 1049851166 /nfs/dbraw/zinc/85/11/66/1049851166.db2.gz AEAWBMWKJZGXCZ-UWHLTILDSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCC[C@H]1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067768 1049851379 /nfs/dbraw/zinc/85/13/79/1049851379.db2.gz NRWYAYXCTPVMCF-JRSUCEMESA-N 2 1 330.491 4.300 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCc3cccc(C(F)(F)F)c3C1)C2 ZINC001172128062 1049852807 /nfs/dbraw/zinc/85/28/07/1049852807.db2.gz NSVABFDNOILMPC-ZSHCYNCHSA-N 2 1 338.417 4.079 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCc3cccc(C(F)(F)F)c3C1)C2 ZINC001172128062 1049852811 /nfs/dbraw/zinc/85/28/11/1049852811.db2.gz NSVABFDNOILMPC-ZSHCYNCHSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCc3cccc(C(F)(F)F)c3C1)C2 ZINC001172128062 1049852813 /nfs/dbraw/zinc/85/28/13/1049852813.db2.gz NSVABFDNOILMPC-ZSHCYNCHSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCc3cccc(C(F)(F)F)c3C1)C2 ZINC001172128062 1049852817 /nfs/dbraw/zinc/85/28/17/1049852817.db2.gz NSVABFDNOILMPC-ZSHCYNCHSA-N 2 1 338.417 4.079 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Cc3ccccc3F)CC1)C2 ZINC001172126499 1049853881 /nfs/dbraw/zinc/85/38/81/1049853881.db2.gz WNDXEHIEDBSHRC-ACDBMABISA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Cc3ccccc3F)CC1)C2 ZINC001172126499 1049853884 /nfs/dbraw/zinc/85/38/84/1049853884.db2.gz WNDXEHIEDBSHRC-ACDBMABISA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1ccc(Cl)c(Cl)c1)C2 ZINC001172103124 1049855729 /nfs/dbraw/zinc/85/57/29/1049855729.db2.gz SEEYHHSUAYRGKP-QKDCVEJESA-N 2 1 327.299 4.141 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](n1cc(C3CC[NH2+]CC3)c3ccccc31)C2 ZINC001172120926 1049858030 /nfs/dbraw/zinc/85/80/30/1049858030.db2.gz HRMYIYPYHACMCT-REPLKXPHSA-N 2 1 337.511 4.296 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCc3ccc(C(F)(F)F)cc31)C2 ZINC001172110676 1049858903 /nfs/dbraw/zinc/85/89/03/1049858903.db2.gz LIWXPSIRGKURKA-XLMAVXFVSA-N 2 1 338.417 4.298 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCc3ccc(C(F)(F)F)cc31)C2 ZINC001172110676 1049858908 /nfs/dbraw/zinc/85/89/08/1049858908.db2.gz LIWXPSIRGKURKA-XLMAVXFVSA-N 2 1 338.417 4.298 20 0 EIADMP C[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172124293 1049859848 /nfs/dbraw/zinc/85/98/48/1049859848.db2.gz KKJWEGURDRXURG-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172124293 1049859850 /nfs/dbraw/zinc/85/98/50/1049859850.db2.gz KKJWEGURDRXURG-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172124293 1049859853 /nfs/dbraw/zinc/85/98/53/1049859853.db2.gz KKJWEGURDRXURG-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP Fc1c(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)ccnc1Cl ZINC000823609368 1049862205 /nfs/dbraw/zinc/86/22/05/1049862205.db2.gz UQETWGGSUPACTE-UHFFFAOYSA-N 2 1 347.865 4.150 20 0 EIADMP Fc1c(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)ccnc1Cl ZINC000823609177 1049862263 /nfs/dbraw/zinc/86/22/63/1049862263.db2.gz PPVFUCQSQMGISV-UHFFFAOYSA-N 2 1 347.865 4.150 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@H]2CSc3ccccc3C2)CC1 ZINC001172200073 1049869197 /nfs/dbraw/zinc/86/91/97/1049869197.db2.gz GGSULAYCOMXABS-BHIYHBOVSA-N 2 1 330.541 4.218 20 0 EIADMP CCC(CC)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CSc2ccccc2C1 ZINC001172198578 1049869394 /nfs/dbraw/zinc/86/93/94/1049869394.db2.gz QIYFMZBLEHLFIW-WDSOQIARSA-N 2 1 332.557 4.464 20 0 EIADMP CCC(CC)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CSc2ccccc2C1 ZINC001172198577 1049869910 /nfs/dbraw/zinc/86/99/10/1049869910.db2.gz QIYFMZBLEHLFIW-BHIYHBOVSA-N 2 1 332.557 4.464 20 0 EIADMP COCCC[NH+]1CCC([NH2+][C@H](CC(C)C)c2ccccc2F)CC1 ZINC001172246912 1049871996 /nfs/dbraw/zinc/87/19/96/1049871996.db2.gz ZSYFCZHZOXKHPQ-HXUWFJFHSA-N 2 1 336.495 4.003 20 0 EIADMP COCCC[NH+]1CCC([N@H+](C)[C@H](C)c2cccc3ccccc32)CC1 ZINC001172253769 1049872215 /nfs/dbraw/zinc/87/22/15/1049872215.db2.gz BILSLPREDZPUQX-GOSISDBHSA-N 2 1 340.511 4.334 20 0 EIADMP COCCC[NH+]1CCC([N@@H+](C)[C@H](C)c2cccc3ccccc32)CC1 ZINC001172253769 1049872218 /nfs/dbraw/zinc/87/22/18/1049872218.db2.gz BILSLPREDZPUQX-GOSISDBHSA-N 2 1 340.511 4.334 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172315280 1049875560 /nfs/dbraw/zinc/87/55/60/1049875560.db2.gz BLJRQWGABSLJAU-UMBQZNGKSA-N 2 1 344.543 4.365 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001172352498 1049892069 /nfs/dbraw/zinc/89/20/69/1049892069.db2.gz RMBMFKDIESEKDC-MOPGFXCFSA-N 2 1 332.532 4.224 20 0 EIADMP CCOCC[C@H](C)[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001172427493 1049901025 /nfs/dbraw/zinc/90/10/25/1049901025.db2.gz OXTMPMIBXBNNMO-INIZCTEOSA-N 2 1 338.923 4.051 20 0 EIADMP CCOCC[C@H](C)[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001172427493 1049901031 /nfs/dbraw/zinc/90/10/31/1049901031.db2.gz OXTMPMIBXBNNMO-INIZCTEOSA-N 2 1 338.923 4.051 20 0 EIADMP CC(C)OCC[C@@H](C)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001172450546 1049914151 /nfs/dbraw/zinc/91/41/51/1049914151.db2.gz ISVVISJCXZMORL-HXUWFJFHSA-N 2 1 344.543 4.178 20 0 EIADMP [NH3+]C1(c2cccc(F)c2)CC[NH+]([C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172558887 1049933605 /nfs/dbraw/zinc/93/36/05/1049933605.db2.gz XZZHGVKDBYIPIB-NQIIRXRSSA-N 2 1 338.470 4.412 20 0 EIADMP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@H]1CCC[N@H+]1C ZINC001172568173 1049938108 /nfs/dbraw/zinc/93/81/08/1049938108.db2.gz OXUPDLNJZHBXJM-GXTWGEPZSA-N 2 1 330.850 4.013 20 0 EIADMP C[C@H](CCc1c(F)cc(Cl)cc1F)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC001172573301 1049940316 /nfs/dbraw/zinc/94/03/16/1049940316.db2.gz GYBDOEWPTITXJT-CYBMUJFWSA-N 2 1 344.877 4.213 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CC(C)(C)OC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001172646510 1049954870 /nfs/dbraw/zinc/95/48/70/1049954870.db2.gz BOCVJGHRPFMQAR-MJGOQNOKSA-N 2 1 344.543 4.365 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2CC(C)(C)OC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC001172646510 1049954873 /nfs/dbraw/zinc/95/48/73/1049954873.db2.gz BOCVJGHRPFMQAR-MJGOQNOKSA-N 2 1 344.543 4.365 20 0 EIADMP CC1(C)CC([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)CC(C)(C)O1 ZINC001172654562 1049957243 /nfs/dbraw/zinc/95/72/43/1049957243.db2.gz HDOPHEDTZUPIHN-UHFFFAOYSA-N 2 1 344.543 4.367 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cnc3ccsc3c2)C1 ZINC000246356504 1049959076 /nfs/dbraw/zinc/95/90/76/1049959076.db2.gz ICLXUSJAOKYSIV-HZPDHXFCSA-N 2 1 331.529 4.315 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccs1 ZINC000247073243 1050012120 /nfs/dbraw/zinc/01/21/20/1050012120.db2.gz OJMWLTDNDWHDNS-IXDOHACOSA-N 2 1 344.524 4.208 20 0 EIADMP C[C@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cncc(F)c1 ZINC000247231012 1050017559 /nfs/dbraw/zinc/01/75/59/1050017559.db2.gz WYOBNXHURKUDDL-GRXQJBFDSA-N 2 1 341.474 4.028 20 0 EIADMP C[C@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1cncc(F)c1 ZINC000247231012 1050017566 /nfs/dbraw/zinc/01/75/66/1050017566.db2.gz WYOBNXHURKUDDL-GRXQJBFDSA-N 2 1 341.474 4.028 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@@H](C)C1 ZINC000248044620 1050039872 /nfs/dbraw/zinc/03/98/72/1050039872.db2.gz UPSCYLKKUSDFQV-XJKSGUPXSA-N 2 1 349.569 4.042 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248397944 1050054189 /nfs/dbraw/zinc/05/41/89/1050054189.db2.gz ILTAOIGWUOPEKF-LNLFQRSKSA-N 2 1 330.516 4.389 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C3CCC3)C1)CCC2 ZINC000248408982 1050055463 /nfs/dbraw/zinc/05/54/63/1050055463.db2.gz WBEJTDBHONPFKX-YQQAZPJKSA-N 2 1 347.572 4.326 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172827719 1050166321 /nfs/dbraw/zinc/16/63/21/1050166321.db2.gz DJHSADCWHOYEPM-ACRUOGEOSA-N 2 1 328.544 4.470 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C)CC2 ZINC001172843754 1050181772 /nfs/dbraw/zinc/18/17/72/1050181772.db2.gz OKODCFULFVWSGI-FKBYEOEOSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C)CC2 ZINC001172843754 1050181777 /nfs/dbraw/zinc/18/17/77/1050181777.db2.gz OKODCFULFVWSGI-FKBYEOEOSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C)CC2 ZINC001172843754 1050181787 /nfs/dbraw/zinc/18/17/87/1050181787.db2.gz OKODCFULFVWSGI-FKBYEOEOSA-N 2 1 326.528 4.191 20 0 EIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H](C)Cc2c(F)cccc2Cl)[C@H](C)C1 ZINC001172849529 1050188486 /nfs/dbraw/zinc/18/84/86/1050188486.db2.gz NPSIXVIBKSUVMT-HBUWYVDXSA-N 2 1 326.887 4.119 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)CCC2 ZINC000090586938 1050190166 /nfs/dbraw/zinc/19/01/66/1050190166.db2.gz RQXDKKINSMBAAX-HZPDHXFCSA-N 2 1 335.561 4.041 20 0 EIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001172860264 1050198570 /nfs/dbraw/zinc/19/85/70/1050198570.db2.gz ZPTMVAZWJYSWIZ-AWEZNQCLSA-N 2 1 338.898 4.394 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H](C)Cc2ccc(F)cc2Cl)CC1 ZINC001172869331 1050207903 /nfs/dbraw/zinc/20/79/03/1050207903.db2.gz ZKLOXGVHKKOTRY-OAHLLOKOSA-N 2 1 340.914 4.462 20 0 EIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cccc(Cl)c2Br)CC1 ZINC001206303142 1050217670 /nfs/dbraw/zinc/21/76/70/1050217670.db2.gz BQKGNFJEPUPLAJ-OAHLLOKOSA-N 2 1 345.712 4.053 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@@H](c3ccccc3)C(C)C)CC2)nc(C)[nH+]1 ZINC000091368023 1050255504 /nfs/dbraw/zinc/25/55/04/1050255504.db2.gz QJQLDDGMJZALTJ-OAQYLSRUSA-N 2 1 338.499 4.049 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1C1CCC2(CCOCC2)CC1 ZINC001173048797 1050274298 /nfs/dbraw/zinc/27/42/98/1050274298.db2.gz VEALEIWAGUGBCQ-PMACEKPBSA-N 2 1 334.548 4.065 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1C1CCC2(CCOCC2)CC1 ZINC001173048797 1050274300 /nfs/dbraw/zinc/27/43/00/1050274300.db2.gz VEALEIWAGUGBCQ-PMACEKPBSA-N 2 1 334.548 4.065 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1C1CCC2(CCOCC2)CC1 ZINC001173048797 1050274301 /nfs/dbraw/zinc/27/43/01/1050274301.db2.gz VEALEIWAGUGBCQ-PMACEKPBSA-N 2 1 334.548 4.065 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](CC)CCc2ccc(OC)cc2)CC1 ZINC001173113857 1050309461 /nfs/dbraw/zinc/30/94/61/1050309461.db2.gz NDPWJVZUKSMWAC-UHFFFAOYSA-N 2 1 332.532 4.213 20 0 EIADMP CNc1ccc(C)cc1C[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC001177875323 1050309804 /nfs/dbraw/zinc/30/98/04/1050309804.db2.gz JFRRQHVAJIZXNI-GOSISDBHSA-N 2 1 337.511 4.352 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@@H](Oc3ccccc3C)C2)CC1 ZINC001173112176 1050310082 /nfs/dbraw/zinc/31/00/82/1050310082.db2.gz ROXHEIFSZURQTL-SOAGJPPSSA-N 2 1 330.516 4.101 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H](Sc3ccncc3)C2)CC1 ZINC001173114701 1050310643 /nfs/dbraw/zinc/31/06/43/1050310643.db2.gz QMJNCKDAZSINCW-QLOJAFMTSA-N 2 1 347.572 4.291 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](CC(=O)c2ccccc2)C(C)C)CC1 ZINC001173113260 1050311159 /nfs/dbraw/zinc/31/11/59/1050311159.db2.gz LWMCHSOWUZRHQX-UHFFFAOYSA-N 2 1 330.516 4.233 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H]2Cc2ccc(F)cc2)CC1 ZINC001173117468 1050315259 /nfs/dbraw/zinc/31/52/59/1050315259.db2.gz MVJVJSOQYJVSGR-CBNMVNINSA-N 2 1 332.507 4.486 20 0 EIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccccc2OC)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272788 1050391451 /nfs/dbraw/zinc/39/14/51/1050391451.db2.gz WWCPNVZHRMSPLC-LEAZDLGRSA-N 2 1 330.516 4.346 20 0 EIADMP CCc1ccc(C[C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC001173236939 1050393766 /nfs/dbraw/zinc/39/37/66/1050393766.db2.gz GEKTVFKHLODGKI-LJQANCHMSA-N 2 1 336.523 4.434 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2cccc(F)c2F)C[N@H+]1Cc1ccccc1 ZINC001178208286 1050404376 /nfs/dbraw/zinc/40/43/76/1050404376.db2.gz KYQLEIDDVKHLAH-AEFFLSMTSA-N 2 1 344.449 4.355 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@H]2CC2(Cl)Cl)CC1)CC(C)C ZINC000773730258 1050415704 /nfs/dbraw/zinc/41/57/04/1050415704.db2.gz HGGIWIURGJIUHP-MRXNPFEDSA-N 2 1 335.363 4.260 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cccnc2Cl)CC1)CC(C)C ZINC000773730304 1050415834 /nfs/dbraw/zinc/41/58/34/1050415834.db2.gz ILCMJZAPDQQZQY-UHFFFAOYSA-N 2 1 337.939 4.315 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC001178284840 1050428062 /nfs/dbraw/zinc/42/80/62/1050428062.db2.gz CTZVDLJPZFNAEF-DNVJHFABSA-N 2 1 334.507 4.385 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2c1CCC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001178331334 1050439465 /nfs/dbraw/zinc/43/94/65/1050439465.db2.gz QCNMOXNMEMRELY-PGRDOPGGSA-N 2 1 334.507 4.176 20 0 EIADMP Cc1csc([C@@H](C)C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)n1 ZINC001178445369 1050459680 /nfs/dbraw/zinc/45/96/80/1050459680.db2.gz VXHRNEOBIDIIFC-INIZCTEOSA-N 2 1 345.556 4.303 20 0 EIADMP COC(=O)CCCC[C@@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173445650 1050462821 /nfs/dbraw/zinc/46/28/21/1050462821.db2.gz NPEUVRBXFQXUSA-ZHALLVOQSA-N 2 1 338.536 4.013 20 0 EIADMP CC[N@@H+]1C[C@@H]2C[NH+]([C@H](C)CCc3ccc(Cl)c(Cl)c3)C[C@@H]2C1 ZINC001173551149 1050487440 /nfs/dbraw/zinc/48/74/40/1050487440.db2.gz QYJWWIJXKUVYGU-BMFZPTHFSA-N 2 1 341.326 4.198 20 0 EIADMP CC[NH+]1C[C@@H]2C[N@H+]([C@H](C)CCc3ccc(Cl)c(Cl)c3)C[C@@H]2C1 ZINC001173551149 1050487452 /nfs/dbraw/zinc/48/74/52/1050487452.db2.gz QYJWWIJXKUVYGU-BMFZPTHFSA-N 2 1 341.326 4.198 20 0 EIADMP CC[NH+]1C[C@@H]2C[N@@H+]([C@H](C)CCc3ccc(Cl)c(Cl)c3)C[C@@H]2C1 ZINC001173551149 1050487457 /nfs/dbraw/zinc/48/74/57/1050487457.db2.gz QYJWWIJXKUVYGU-BMFZPTHFSA-N 2 1 341.326 4.198 20 0 EIADMP COc1cc(Cl)c(CNCCC[N@@H+](C)CC(C)C)cc1Cl ZINC001179081792 1050626785 /nfs/dbraw/zinc/62/67/85/1050626785.db2.gz OOJQYSOXBBDFPF-UHFFFAOYSA-N 2 1 333.303 4.070 20 0 EIADMP CC[N@@H+](CCC[NH2+][C@H]1CCc2ccc(OC)cc2C1)C1CCCCC1 ZINC001179090989 1050629876 /nfs/dbraw/zinc/62/98/76/1050629876.db2.gz MVLUQULHJWRAJG-FQEVSTJZSA-N 2 1 344.543 4.187 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+]CC3CCC4(CC4)CC3)CC2)cc1 ZINC001179285674 1050661621 /nfs/dbraw/zinc/66/16/21/1050661621.db2.gz PZVBFXDVDCSEHH-UHFFFAOYSA-N 2 1 344.518 4.393 20 0 EIADMP Fc1ccccc1-c1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)o1 ZINC001179258649 1050662939 /nfs/dbraw/zinc/66/29/39/1050662939.db2.gz PBBVDBBYXVYSGC-KRWDZBQOSA-N 2 1 342.458 4.297 20 0 EIADMP Fc1ccccc1-c1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)o1 ZINC001179258649 1050662948 /nfs/dbraw/zinc/66/29/48/1050662948.db2.gz PBBVDBBYXVYSGC-KRWDZBQOSA-N 2 1 342.458 4.297 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CC(Nc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001179520730 1050705511 /nfs/dbraw/zinc/70/55/11/1050705511.db2.gz OAKQQOFHDWXYSM-AQUNBJMESA-N 2 1 349.522 4.272 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CC(Nc3ccccc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001179520730 1050705521 /nfs/dbraw/zinc/70/55/21/1050705521.db2.gz OAKQQOFHDWXYSM-AQUNBJMESA-N 2 1 349.522 4.272 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1N(C)C ZINC000093942347 1050723776 /nfs/dbraw/zinc/72/37/76/1050723776.db2.gz KKPAILRFHCQAGF-SFHVURJKSA-N 2 1 339.527 4.444 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc3ccnc(Cl)c3s2)C[C@H]1C ZINC001179899197 1050807467 /nfs/dbraw/zinc/80/74/67/1050807467.db2.gz ZIUJLKSTQUOODP-OCCSQVGLSA-N 2 1 337.920 4.254 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3ccnc(Cl)c3s2)C[C@H]1C ZINC001179899197 1050807470 /nfs/dbraw/zinc/80/74/70/1050807470.db2.gz ZIUJLKSTQUOODP-OCCSQVGLSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc3ccnc(Cl)c3s2)C[C@H]1C ZINC001179899197 1050807475 /nfs/dbraw/zinc/80/74/75/1050807475.db2.gz ZIUJLKSTQUOODP-OCCSQVGLSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc3ccnc(Cl)c3s2)C[C@H]1C ZINC001179899197 1050807478 /nfs/dbraw/zinc/80/74/78/1050807478.db2.gz ZIUJLKSTQUOODP-OCCSQVGLSA-N 2 1 337.920 4.254 20 0 EIADMP FC(F)(F)CCC[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001179864171 1050809640 /nfs/dbraw/zinc/80/96/40/1050809640.db2.gz UNNOHOGNSPZZFI-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001179864171 1050809647 /nfs/dbraw/zinc/80/96/47/1050809647.db2.gz UNNOHOGNSPZZFI-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001179864171 1050809653 /nfs/dbraw/zinc/80/96/53/1050809653.db2.gz UNNOHOGNSPZZFI-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP CC(C)(C)c1ccc(CC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001179925499 1050819252 /nfs/dbraw/zinc/81/92/52/1050819252.db2.gz ROCUJSBQWQVIDE-SIKLNZKXSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001179925499 1050819254 /nfs/dbraw/zinc/81/92/54/1050819254.db2.gz ROCUJSBQWQVIDE-SIKLNZKXSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC001179925499 1050819261 /nfs/dbraw/zinc/81/92/61/1050819261.db2.gz ROCUJSBQWQVIDE-SIKLNZKXSA-N 2 1 340.555 4.475 20 0 EIADMP CC(C)(C)c1ccc(CC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC001179925499 1050819265 /nfs/dbraw/zinc/81/92/65/1050819265.db2.gz ROCUJSBQWQVIDE-SIKLNZKXSA-N 2 1 340.555 4.475 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc3c(n2)CCC3)CC1 ZINC001180225305 1050920961 /nfs/dbraw/zinc/92/09/61/1050920961.db2.gz QDSYIINWSJOSGH-GOSISDBHSA-N 2 1 341.543 4.047 20 0 EIADMP CC(C)(C)[C@]1(C[N@@H+]2CCOC(C)(C)C2)CC[NH+](Cc2ccccc2)C1 ZINC001180271129 1050939815 /nfs/dbraw/zinc/93/98/15/1050939815.db2.gz DFEBKZGCMVZJQX-JOCHJYFZSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)(C)[C@]1(C[N@H+]2CCOC(C)(C)C2)CC[NH+](Cc2ccccc2)C1 ZINC001180271129 1050939823 /nfs/dbraw/zinc/93/98/23/1050939823.db2.gz DFEBKZGCMVZJQX-JOCHJYFZSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)(C)[C@]1(C[NH+]2CCOC(C)(C)C2)CC[N@H+](Cc2ccccc2)C1 ZINC001180271129 1050939837 /nfs/dbraw/zinc/93/98/37/1050939837.db2.gz DFEBKZGCMVZJQX-JOCHJYFZSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)(C)[C@]1(C[NH+]2CCOC(C)(C)C2)CC[N@@H+](Cc2ccccc2)C1 ZINC001180271129 1050939852 /nfs/dbraw/zinc/93/98/52/1050939852.db2.gz DFEBKZGCMVZJQX-JOCHJYFZSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001180302567 1050943892 /nfs/dbraw/zinc/94/38/92/1050943892.db2.gz ZLYNMXDPUBINFN-KDXIVRHGSA-N 2 1 326.528 4.455 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)C1CCCC1 ZINC001180301652 1050944718 /nfs/dbraw/zinc/94/47/18/1050944718.db2.gz OUDFYHZMGVUPNG-GUGJDKNPSA-N 2 1 326.528 4.455 20 0 EIADMP Cc1cc(C)cc(CC[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001180350255 1050964559 /nfs/dbraw/zinc/96/45/59/1050964559.db2.gz WYNODVIKEGDCLT-REWPJTCUSA-N 2 1 336.523 4.346 20 0 EIADMP COc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c2ccccc12 ZINC000620109492 1051025838 /nfs/dbraw/zinc/02/58/38/1051025838.db2.gz KHZHPTGZUARIME-SFHVURJKSA-N 2 1 340.511 4.450 20 0 EIADMP COc1ccc(SCC[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001180795292 1051080422 /nfs/dbraw/zinc/08/04/22/1051080422.db2.gz UOTZOKJBQUHDPF-SJORKVTESA-N 2 1 348.556 4.030 20 0 EIADMP CCN(Cc1ccc(Cl)nc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076154976 1051117721 /nfs/dbraw/zinc/11/77/21/1051117721.db2.gz NXIQTPMSWCYOOB-LJQANCHMSA-N 2 1 343.902 4.079 20 0 EIADMP CC[N@@H+](Cc1ccc(Cl)nc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076154976 1051117730 /nfs/dbraw/zinc/11/77/30/1051117730.db2.gz NXIQTPMSWCYOOB-LJQANCHMSA-N 2 1 343.902 4.079 20 0 EIADMP CC[N@H+](Cc1ccc(Cl)nc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076154976 1051117738 /nfs/dbraw/zinc/11/77/38/1051117738.db2.gz NXIQTPMSWCYOOB-LJQANCHMSA-N 2 1 343.902 4.079 20 0 EIADMP CC(C)(C)[C@]1(C[NH2+][C@H]2CSC2(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001181204823 1051180240 /nfs/dbraw/zinc/18/02/40/1051180240.db2.gz IMBBSNPNWGJUDA-RXVVDRJESA-N 2 1 346.584 4.408 20 0 EIADMP Cc1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c(F)c1 ZINC001181255691 1051200681 /nfs/dbraw/zinc/20/06/81/1051200681.db2.gz NQOVKIFUISEUQX-UHFFFAOYSA-N 2 1 327.447 4.047 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2c3ccccc3C[C@H]2C)cc1F ZINC000153707889 1051217673 /nfs/dbraw/zinc/21/76/73/1051217673.db2.gz POPPWNBPDPTBKU-SPLOXXLWSA-N 2 1 335.426 4.343 20 0 EIADMP CCC[N@H+](CCC[NH+](C)C)Cc1cc(Cl)cc(Br)c1 ZINC001181514262 1051244123 /nfs/dbraw/zinc/24/41/23/1051244123.db2.gz CLUWPZUHXVYKRI-UHFFFAOYSA-N 2 1 347.728 4.266 20 0 EIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1cc(Cl)cc(Br)c1 ZINC001181514262 1051244131 /nfs/dbraw/zinc/24/41/31/1051244131.db2.gz CLUWPZUHXVYKRI-UHFFFAOYSA-N 2 1 347.728 4.266 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCc2ccccc2Cl)C1 ZINC001191057546 1051334421 /nfs/dbraw/zinc/33/44/21/1051334421.db2.gz KIKZWQCPXVYFGH-ZWKOTPCHSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCc2ccccc2Cl)C1 ZINC001191057546 1051334435 /nfs/dbraw/zinc/33/44/35/1051334435.db2.gz KIKZWQCPXVYFGH-ZWKOTPCHSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCc2ccccc2Cl)C1 ZINC001191057546 1051334447 /nfs/dbraw/zinc/33/44/47/1051334447.db2.gz KIKZWQCPXVYFGH-ZWKOTPCHSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCc2ccccc2Cl)C1 ZINC001191057546 1051334454 /nfs/dbraw/zinc/33/44/54/1051334454.db2.gz KIKZWQCPXVYFGH-ZWKOTPCHSA-N 2 1 334.935 4.469 20 0 EIADMP COc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)cc1 ZINC000154873252 1051346976 /nfs/dbraw/zinc/34/69/76/1051346976.db2.gz UFPRYDRLQIXZSL-KRWDZBQOSA-N 2 1 326.484 4.386 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)C1 ZINC001181982681 1051362899 /nfs/dbraw/zinc/36/28/99/1051362899.db2.gz JTSZWKLVWYKHCD-INIZCTEOSA-N 2 1 342.508 4.302 20 0 EIADMP CC(C)[C@H]1CCC[N@H+]1CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001191204638 1051385659 /nfs/dbraw/zinc/38/56/59/1051385659.db2.gz UGOVLDFYEGCWGA-JOCHJYFZSA-N 2 1 328.544 4.452 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1cncs1 ZINC000268835722 1051396943 /nfs/dbraw/zinc/39/69/43/1051396943.db2.gz SFOQRWXVGBYLHK-HZPDHXFCSA-N 2 1 329.513 4.368 20 0 EIADMP C[C@@H](CCc1ccccc1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191233026 1051403801 /nfs/dbraw/zinc/40/38/01/1051403801.db2.gz KEEDDUCXBREVGG-NZQKXSOJSA-N 2 1 336.523 4.462 20 0 EIADMP C[C@@H](CCc1ccccc1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001191233026 1051403819 /nfs/dbraw/zinc/40/38/19/1051403819.db2.gz KEEDDUCXBREVGG-NZQKXSOJSA-N 2 1 336.523 4.462 20 0 EIADMP C[C@@H](CCc1ccccc1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001191233026 1051403833 /nfs/dbraw/zinc/40/38/33/1051403833.db2.gz KEEDDUCXBREVGG-NZQKXSOJSA-N 2 1 336.523 4.462 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+]CCCCc2cccc(C(F)(F)F)c2)C1 ZINC001182251083 1051443652 /nfs/dbraw/zinc/44/36/52/1051443652.db2.gz LTJIVSLISCBGQP-QGZVFWFLSA-N 2 1 342.449 4.350 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2cc[nH]c2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311009194 1051452099 /nfs/dbraw/zinc/45/20/99/1051452099.db2.gz WXUZODRPQNQOLU-LAUBAEHRSA-N 2 1 333.479 4.168 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCc2c(Cl)cccc2Cl)C[C@@H]1C ZINC001191417638 1051452556 /nfs/dbraw/zinc/45/25/56/1051452556.db2.gz PZSKEHNRLJOPMB-UONOGXRCSA-N 2 1 329.315 4.341 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCc2c(Cl)cccc2Cl)C[C@@H]1C ZINC001191417638 1051452559 /nfs/dbraw/zinc/45/25/59/1051452559.db2.gz PZSKEHNRLJOPMB-UONOGXRCSA-N 2 1 329.315 4.341 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCc2c(Cl)cccc2Cl)C[C@@H]1C ZINC001191417638 1051452564 /nfs/dbraw/zinc/45/25/64/1051452564.db2.gz PZSKEHNRLJOPMB-UONOGXRCSA-N 2 1 329.315 4.341 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)cc2)cs1 ZINC000774111460 1051458036 /nfs/dbraw/zinc/45/80/36/1051458036.db2.gz XAGAJIGBZWYCFQ-RIJRJKGBSA-N 2 1 341.524 4.394 20 0 EIADMP C[C@H](CC[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000155863113 1051469557 /nfs/dbraw/zinc/46/95/57/1051469557.db2.gz NEGOSMYXOVFGLO-KEYYUXOJSA-N 2 1 328.422 4.271 20 0 EIADMP C/C=C\COc1ccc(CC[C@H](C)[NH2+]CC[N@@H+]2CCCC2(C)C)cc1 ZINC001182307447 1051485909 /nfs/dbraw/zinc/48/59/09/1051485909.db2.gz BAEAYVBGZQOTND-VOFKWLDRSA-N 2 1 344.543 4.427 20 0 EIADMP C/C=C\COc1ccc(CC[C@H](C)[NH2+]CC[N@H+]2CCCC2(C)C)cc1 ZINC001182307447 1051485915 /nfs/dbraw/zinc/48/59/15/1051485915.db2.gz BAEAYVBGZQOTND-VOFKWLDRSA-N 2 1 344.543 4.427 20 0 EIADMP CC1(C)C(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1(C)C ZINC000716674266 1051499516 /nfs/dbraw/zinc/49/95/16/1051499516.db2.gz XAOUHSXPEYKUCH-FHWLQOOXSA-N 2 1 326.528 4.311 20 0 EIADMP CC(=O)c1c(C)cc(C)c(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1C ZINC000157250911 1051619421 /nfs/dbraw/zinc/61/94/21/1051619421.db2.gz VDFKEBLNPQGWQZ-FQEVSTJZSA-N 2 1 342.527 4.265 20 0 EIADMP CC(=O)c1c(C)cc(C)c(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1C ZINC000157250911 1051619430 /nfs/dbraw/zinc/61/94/30/1051619430.db2.gz VDFKEBLNPQGWQZ-FQEVSTJZSA-N 2 1 342.527 4.265 20 0 EIADMP CCC1(O)CCC([NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000671116498 1051687234 /nfs/dbraw/zinc/68/72/34/1051687234.db2.gz NSLWSNNRWRRECF-UHFFFAOYSA-N 2 1 344.543 4.103 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc2c(c1)OCCCO2 ZINC000157954604 1051687245 /nfs/dbraw/zinc/68/72/45/1051687245.db2.gz CTIPVIOBBJWKRF-ROUUACIJSA-N 2 1 346.515 4.011 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000158103381 1051711951 /nfs/dbraw/zinc/71/19/51/1051711951.db2.gz BFFSAQLGOJJYKT-ZIAGYGMSSA-N 2 1 328.472 4.036 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@@H]([NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC001182959834 1051748949 /nfs/dbraw/zinc/74/89/49/1051748949.db2.gz MPYVZNGBQLKLHG-SJBKTWHCSA-N 2 1 326.528 4.493 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@@H]([NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC001182959834 1051748969 /nfs/dbraw/zinc/74/89/69/1051748969.db2.gz MPYVZNGBQLKLHG-SJBKTWHCSA-N 2 1 326.528 4.493 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[N@H+]1CC[C@@H]2[C@@H](CC[NH+]2C)C1 ZINC001183371728 1051838723 /nfs/dbraw/zinc/83/87/23/1051838723.db2.gz SDGHTPYUEYNMAU-HSCUQBEKSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC001183371728 1051838713 /nfs/dbraw/zinc/83/87/13/1051838713.db2.gz SDGHTPYUEYNMAU-HSCUQBEKSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CC[C@@H]2[C@@H](CC[N@@H+]2C)C1 ZINC001183371728 1051838717 /nfs/dbraw/zinc/83/87/17/1051838717.db2.gz SDGHTPYUEYNMAU-HSCUQBEKSA-N 2 1 338.417 4.135 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[N@@H+]1CC[C@@H]2[C@@H](CC[NH+]2C)C1 ZINC001183371728 1051838719 /nfs/dbraw/zinc/83/87/19/1051838719.db2.gz SDGHTPYUEYNMAU-HSCUQBEKSA-N 2 1 338.417 4.135 20 0 EIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1cccc(OC2CC2)c1F ZINC001183511917 1051861421 /nfs/dbraw/zinc/86/14/21/1051861421.db2.gz VRWJLGHGKQQPGL-UHFFFAOYSA-N 2 1 334.479 4.065 20 0 EIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc3cc(Br)ccc3c2)CC1 ZINC001205274271 1051864684 /nfs/dbraw/zinc/86/46/84/1051864684.db2.gz UPMQIGPKBUNHOA-GOSISDBHSA-N 2 1 347.300 4.306 20 0 EIADMP CCC1([NH+]2CCC2)CC[NH+](Cc2c(C)cc(C)c(COC)c2C)CC1 ZINC001183863581 1051918345 /nfs/dbraw/zinc/91/83/45/1051918345.db2.gz DUIHXFKHQRJZCF-UHFFFAOYSA-N 2 1 344.543 4.209 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccc(-c3ccccc3OC)cc2)CC1 ZINC000159280575 1051969262 /nfs/dbraw/zinc/96/92/62/1051969262.db2.gz OJWNBLIAQGIGJL-QGZVFWFLSA-N 2 1 338.495 4.497 20 0 EIADMP C[NH+](C)[C@@H]1CC[C@H]2C[N@@H+](Cc3cc(F)cc(C(F)(F)F)c3)C[C@@H]2C1 ZINC001184303251 1051982811 /nfs/dbraw/zinc/98/28/11/1051982811.db2.gz NZSBTSAGSRRTRN-GRDNDAEWSA-N 2 1 344.396 4.007 20 0 EIADMP CC1(C)CC[N@H+](Cc2ccc(-c3ccncc3)cc2F)CC(C)(C)[NH2+]1 ZINC001184374503 1052000323 /nfs/dbraw/zinc/00/03/23/1052000323.db2.gz NXYFIFGGRFWVBB-UHFFFAOYSA-N 2 1 341.474 4.240 20 0 EIADMP CC1(C)CC[N@@H+](Cc2ccc(-c3ccncc3)cc2F)CC(C)(C)[NH2+]1 ZINC001184374503 1052000330 /nfs/dbraw/zinc/00/03/30/1052000330.db2.gz NXYFIFGGRFWVBB-UHFFFAOYSA-N 2 1 341.474 4.240 20 0 EIADMP CC(C)c1ccc(C[N@@H+]2CCC[C@@](C)([NH3+])CC2)c(Br)c1 ZINC001205296427 1052006296 /nfs/dbraw/zinc/00/62/96/1052006296.db2.gz PEHDZUPEROVITC-QGZVFWFLSA-N 2 1 339.321 4.276 20 0 EIADMP CC(C)c1ccc(C[N@H+]2CCC[C@@](C)([NH3+])CC2)c(Br)c1 ZINC001205296427 1052006306 /nfs/dbraw/zinc/00/63/06/1052006306.db2.gz PEHDZUPEROVITC-QGZVFWFLSA-N 2 1 339.321 4.276 20 0 EIADMP CCOc1ccc([C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)C(C)C)cc1OCC ZINC000164445052 1052030568 /nfs/dbraw/zinc/03/05/68/1052030568.db2.gz FZIGHMXKQSJQIS-HGHGUNKESA-N 2 1 348.531 4.253 20 0 EIADMP CCOc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)C(C)C)cc1OCC ZINC000164445052 1052030583 /nfs/dbraw/zinc/03/05/83/1052030583.db2.gz FZIGHMXKQSJQIS-HGHGUNKESA-N 2 1 348.531 4.253 20 0 EIADMP C[C@@H]1CC[N@H+](Cc2ccc(Br)c3ccccc23)C[C@@H]1C[NH3+] ZINC001205303513 1052054397 /nfs/dbraw/zinc/05/43/97/1052054397.db2.gz GTROHKBGYHPAIO-HIFRSBDPSA-N 2 1 347.300 4.019 20 0 EIADMP C[C@@H]1CC[N@@H+](Cc2ccc(Br)c3ccccc23)C[C@@H]1C[NH3+] ZINC001205303513 1052054411 /nfs/dbraw/zinc/05/44/11/1052054411.db2.gz GTROHKBGYHPAIO-HIFRSBDPSA-N 2 1 347.300 4.019 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC34CCC(CC3)C4)C2)s1 ZINC001194152443 1052089418 /nfs/dbraw/zinc/08/94/18/1052089418.db2.gz BCRJKCUBJZEZDN-FDYSRKEFSA-N 2 1 332.557 4.391 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC34CCC(CC3)C4)C2)s1 ZINC001194152443 1052089433 /nfs/dbraw/zinc/08/94/33/1052089433.db2.gz BCRJKCUBJZEZDN-FDYSRKEFSA-N 2 1 332.557 4.391 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC34CCC(CC3)C4)C2)s1 ZINC001194152443 1052089449 /nfs/dbraw/zinc/08/94/49/1052089449.db2.gz BCRJKCUBJZEZDN-FDYSRKEFSA-N 2 1 332.557 4.391 20 0 EIADMP CCC[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426547 1052147256 /nfs/dbraw/zinc/14/72/56/1052147256.db2.gz LBWINWMPIAIAMK-VQTJNVASSA-N 2 1 332.532 4.082 20 0 EIADMP CCC[C@@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426547 1052147262 /nfs/dbraw/zinc/14/72/62/1052147262.db2.gz LBWINWMPIAIAMK-VQTJNVASSA-N 2 1 332.532 4.082 20 0 EIADMP CCOc1cccc2cc([C@@H](C)N[C@H]3CC[N@@H+](C)C(C)(C)C3)oc21 ZINC000623342622 1052625894 /nfs/dbraw/zinc/62/58/94/1052625894.db2.gz GQXUTNKLQDJWIX-ZBFHGGJFSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+][C@H]3CCN(C)C(C)(C)C3)oc21 ZINC000623342622 1052625896 /nfs/dbraw/zinc/62/58/96/1052625896.db2.gz GQXUTNKLQDJWIX-ZBFHGGJFSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)oc21 ZINC000623342622 1052625899 /nfs/dbraw/zinc/62/58/99/1052625899.db2.gz GQXUTNKLQDJWIX-ZBFHGGJFSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+][C@H]3CC[N@@H+](C)C(C)(C)C3)oc21 ZINC000623342622 1052625900 /nfs/dbraw/zinc/62/59/00/1052625900.db2.gz GQXUTNKLQDJWIX-ZBFHGGJFSA-N 2 1 330.472 4.355 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc3n[nH]cc32)C1 ZINC000623357957 1052630967 /nfs/dbraw/zinc/63/09/67/1052630967.db2.gz IXFVMUTVALEXQW-QGZVFWFLSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1CN[C@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357838 1052632096 /nfs/dbraw/zinc/63/20/96/1052632096.db2.gz CAZRBZRLHWWQQM-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CN[C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357838 1052632100 /nfs/dbraw/zinc/63/21/00/1052632100.db2.gz CAZRBZRLHWWQQM-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccccc1CN[C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623357838 1052632102 /nfs/dbraw/zinc/63/21/02/1052632102.db2.gz CAZRBZRLHWWQQM-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357838 1052632105 /nfs/dbraw/zinc/63/21/05/1052632105.db2.gz CAZRBZRLHWWQQM-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357838 1052632109 /nfs/dbraw/zinc/63/21/09/1052632109.db2.gz CAZRBZRLHWWQQM-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccccc1C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623357838 1052632112 /nfs/dbraw/zinc/63/21/12/1052632112.db2.gz CAZRBZRLHWWQQM-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccccc1C[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623357838 1052632114 /nfs/dbraw/zinc/63/21/14/1052632114.db2.gz CAZRBZRLHWWQQM-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(F)c(Br)c1 ZINC000623410588 1052648925 /nfs/dbraw/zinc/64/89/25/1052648925.db2.gz WLFVJZLMRKNZCD-YPMHNXCESA-N 2 1 343.284 4.112 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(F)c(Br)c1 ZINC000623410588 1052648927 /nfs/dbraw/zinc/64/89/27/1052648927.db2.gz WLFVJZLMRKNZCD-YPMHNXCESA-N 2 1 343.284 4.112 20 0 EIADMP C[C@H]([NH2+]C1(CN[C@@H]2CC[N@@H+](C)C(C)(C)C2)CCCC1)c1ccccc1 ZINC000623427613 1052654918 /nfs/dbraw/zinc/65/49/18/1052654918.db2.gz FTQLKYLPBODQAX-AZUAARDMSA-N 2 1 343.559 4.112 20 0 EIADMP C[C@@H](C[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000623503878 1052668152 /nfs/dbraw/zinc/66/81/52/1052668152.db2.gz RFACSZBYBDEXGN-XJKSGUPXSA-N 2 1 328.422 4.271 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000177933360 1052694800 /nfs/dbraw/zinc/69/48/00/1052694800.db2.gz RGILGGXUTLPYBU-DBXWQHBBSA-N 2 1 338.495 4.051 20 0 EIADMP Cc1ccc(Br)cc1[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000623866016 1052825946 /nfs/dbraw/zinc/82/59/46/1052825946.db2.gz IJSORYRKXMLZGK-IMJJTQAJSA-N 2 1 337.305 4.035 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(F)cc1C(F)(F)F ZINC000623867504 1052826064 /nfs/dbraw/zinc/82/60/64/1052826064.db2.gz BBSKORMPGWMEQE-NSHDSACASA-N 2 1 329.341 4.090 20 0 EIADMP Cc1ccc(Br)cc1[C@H](C)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000623866015 1052826091 /nfs/dbraw/zinc/82/60/91/1052826091.db2.gz IJSORYRKXMLZGK-CWRNSKLLSA-N 2 1 337.305 4.035 20 0 EIADMP Cc1ccc(Br)cc1[C@H](C)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000623855185 1052826495 /nfs/dbraw/zinc/82/64/95/1052826495.db2.gz SKRUNPOGLJHJBN-ZDUSSCGKSA-N 2 1 337.305 4.035 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCCc3scnc32)c1 ZINC000623867323 1052830087 /nfs/dbraw/zinc/83/00/87/1052830087.db2.gz YBNRKUSUSILHAM-KRWDZBQOSA-N 2 1 329.513 4.152 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1C(F)(F)F ZINC000623995862 1052849411 /nfs/dbraw/zinc/84/94/11/1052849411.db2.gz KWUCBMOLAAQHOB-NDNKKMJESA-N 2 1 330.369 4.120 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1C(F)(F)F ZINC000623995862 1052849413 /nfs/dbraw/zinc/84/94/13/1052849413.db2.gz KWUCBMOLAAQHOB-NDNKKMJESA-N 2 1 330.369 4.120 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)CC[N@H+]1C ZINC000181798873 1052898115 /nfs/dbraw/zinc/89/81/15/1052898115.db2.gz KQODMOVTXGVFBR-XJKSGUPXSA-N 2 1 349.931 4.078 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000381210922 1053058091 /nfs/dbraw/zinc/05/80/91/1053058091.db2.gz UMPYGVHSJCBSQG-JBYIUTFZSA-N 2 1 338.495 4.084 20 0 EIADMP c1cc(C[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc(C2CCCC2)c1 ZINC000850135861 1053075658 /nfs/dbraw/zinc/07/56/58/1053075658.db2.gz RTFJKECQTFNMQN-JOCHJYFZSA-N 2 1 342.527 4.077 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000119684117 1053090303 /nfs/dbraw/zinc/09/03/03/1053090303.db2.gz DXAZOJNMBLSJMM-NLWGTHIKSA-N 2 1 344.543 4.259 20 0 EIADMP FC1(F)CCCC[C@@H]1C[N@H+]1C[C@@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000381874520 1053111949 /nfs/dbraw/zinc/11/19/49/1053111949.db2.gz JUQCFDHXBDZFCH-XUVXKRRUSA-N 2 1 348.481 4.266 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1C[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000381874520 1053111957 /nfs/dbraw/zinc/11/19/57/1053111957.db2.gz JUQCFDHXBDZFCH-XUVXKRRUSA-N 2 1 348.481 4.266 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000381874520 1053111964 /nfs/dbraw/zinc/11/19/64/1053111964.db2.gz JUQCFDHXBDZFCH-XUVXKRRUSA-N 2 1 348.481 4.266 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(Cl)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382069725 1053135665 /nfs/dbraw/zinc/13/56/65/1053135665.db2.gz RWYAIVIHTITHSO-VQIMIIECSA-N 2 1 328.887 4.340 20 0 EIADMP Cc1c([C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cnn1-c1ccccc1 ZINC000764636672 1053242625 /nfs/dbraw/zinc/24/26/25/1053242625.db2.gz TTWKHTFOXWJMKN-HNNXBMFYSA-N 2 1 340.515 4.141 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(SC(F)F)cc1 ZINC000764967860 1053401122 /nfs/dbraw/zinc/40/11/22/1053401122.db2.gz XXJRDNBPDPGNII-RCBQFDQVSA-N 2 1 326.456 4.279 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(SC(F)F)cc1 ZINC000764967860 1053401136 /nfs/dbraw/zinc/40/11/36/1053401136.db2.gz XXJRDNBPDPGNII-RCBQFDQVSA-N 2 1 326.456 4.279 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](Cc2ccc(C)cc2)C(C)C)cn1 ZINC000765239676 1053473834 /nfs/dbraw/zinc/47/38/34/1053473834.db2.gz RFSNPGVNGBYKIS-NRFANRHFSA-N 2 1 348.494 4.241 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000385671935 1053540027 /nfs/dbraw/zinc/54/00/27/1053540027.db2.gz DXSHQXWENFQPIQ-OPYAIIAOSA-N 2 1 340.486 4.257 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866226382 1053656215 /nfs/dbraw/zinc/65/62/15/1053656215.db2.gz MUOWNIFSXISNAN-ZDUSSCGKSA-N 2 1 335.879 4.252 20 0 EIADMP CC[C@@H](CO)[N@H+](CCCn1cc[nH+]c1C)C1CCC(C(C)(C)C)CC1 ZINC001196419055 1053667583 /nfs/dbraw/zinc/66/75/83/1053667583.db2.gz JPUAKVWCHOCRLO-GPJFCIFZSA-N 2 1 349.563 4.259 20 0 EIADMP CC[C@@H](CO)[N@@H+](CCCn1cc[nH+]c1C)C1CCC(C(C)(C)C)CC1 ZINC001196419055 1053667587 /nfs/dbraw/zinc/66/75/87/1053667587.db2.gz JPUAKVWCHOCRLO-GPJFCIFZSA-N 2 1 349.563 4.259 20 0 EIADMP C[C@@H]([NH2+]Cc1cc(F)c(F)c(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386394582 1053703862 /nfs/dbraw/zinc/70/38/62/1053703862.db2.gz VVTKSJJVECQCDM-RHSMWYFYSA-N 2 1 348.412 4.104 20 0 EIADMP C[C@@H]([NH2+]Cc1cc(F)c(F)c(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386394582 1053703878 /nfs/dbraw/zinc/70/38/78/1053703878.db2.gz VVTKSJJVECQCDM-RHSMWYFYSA-N 2 1 348.412 4.104 20 0 EIADMP CCC1([NH+](C)C)CC[NH+](CCSc2cccc(Cl)c2)CC1 ZINC001196684883 1053736573 /nfs/dbraw/zinc/73/65/73/1053736573.db2.gz OSVWSWNBEYVREL-UHFFFAOYSA-N 2 1 326.937 4.238 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2c1cccc2F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386578557 1053780144 /nfs/dbraw/zinc/78/01/44/1053780144.db2.gz ZGJCZCGMRKYEEG-CECAUBDESA-N 2 1 338.470 4.313 20 0 EIADMP Cn1cncc1CCC[N@H+]1CC[C@@H](c2ccccc2Cl)C1(C)C ZINC001197313424 1053872172 /nfs/dbraw/zinc/87/21/72/1053872172.db2.gz ACPDFIQARNUJBK-KRWDZBQOSA-N 2 1 331.891 4.274 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+]1CC[C@@H](c2ccccc2Cl)C1(C)C ZINC001197313424 1053872174 /nfs/dbraw/zinc/87/21/74/1053872174.db2.gz ACPDFIQARNUJBK-KRWDZBQOSA-N 2 1 331.891 4.274 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+]1CC[C@@H](c2ccccc2Cl)C1(C)C ZINC001197313424 1053872177 /nfs/dbraw/zinc/87/21/77/1053872177.db2.gz ACPDFIQARNUJBK-KRWDZBQOSA-N 2 1 331.891 4.274 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2cccc(Oc3ccccn3)c2)CC1 ZINC000921564795 1053885486 /nfs/dbraw/zinc/88/54/86/1053885486.db2.gz YVNPZAOPHCRNLV-UHFFFAOYSA-N 2 1 339.483 4.226 20 0 EIADMP CC(C)(C)OC[C@H]1CCC[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001197630150 1053967321 /nfs/dbraw/zinc/96/73/21/1053967321.db2.gz MIIGCAQNGRNRIJ-OAQYLSRUSA-N 2 1 344.543 4.452 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCOC3(CCCC3)C2)c1 ZINC000872026461 1054344442 /nfs/dbraw/zinc/34/44/42/1054344442.db2.gz BIRSYYQICMPVIH-FQEVSTJZSA-N 2 1 330.516 4.108 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCOC3(CCCC3)C2)[C@H]1c1cccs1 ZINC000872038082 1054352182 /nfs/dbraw/zinc/35/21/82/1054352182.db2.gz HTYMGSNOBVFSGI-LMMKCTJWSA-N 2 1 348.556 4.212 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCOC3(CCCC3)C2)[C@H]1c1cccs1 ZINC000872038082 1054352203 /nfs/dbraw/zinc/35/22/03/1054352203.db2.gz HTYMGSNOBVFSGI-LMMKCTJWSA-N 2 1 348.556 4.212 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCOC3(CCCC3)C2)[C@@H]1c1cccs1 ZINC000872038083 1054353588 /nfs/dbraw/zinc/35/35/88/1054353588.db2.gz HTYMGSNOBVFSGI-ZHALLVOQSA-N 2 1 348.556 4.212 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCOC3(CCCC3)C2)[C@@H]1c1cccs1 ZINC000872038083 1054353609 /nfs/dbraw/zinc/35/36/09/1054353609.db2.gz HTYMGSNOBVFSGI-ZHALLVOQSA-N 2 1 348.556 4.212 20 0 EIADMP CC(C)[C@@H](C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1)[NH+]1CCC(C)CC1 ZINC001199258526 1054373610 /nfs/dbraw/zinc/37/36/10/1054373610.db2.gz KQJBEPYYQMWXRJ-CEMLEFRQSA-N 2 1 343.559 4.454 20 0 EIADMP COc1ccsc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC001199267233 1054376795 /nfs/dbraw/zinc/37/67/95/1054376795.db2.gz NDDGJCMFBDJIEL-MRXNPFEDSA-N 2 1 344.524 4.421 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)sc1C ZINC001199275266 1054377804 /nfs/dbraw/zinc/37/78/04/1054377804.db2.gz GZSBHBJJRUBWKT-OAHLLOKOSA-N 2 1 343.540 4.424 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)sc1C ZINC001199275266 1054377815 /nfs/dbraw/zinc/37/78/15/1054377815.db2.gz GZSBHBJJRUBWKT-OAHLLOKOSA-N 2 1 343.540 4.424 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(CC(F)(F)F)cc2)C1 ZINC001199346356 1054388944 /nfs/dbraw/zinc/38/89/44/1054388944.db2.gz ZDTOYXPKGINQLJ-MRXNPFEDSA-N 2 1 342.449 4.393 20 0 EIADMP CC1([NH+]2CCCCC2)CC[NH+](C2CC(OCc3ccccc3)C2)CC1 ZINC000872102468 1054390208 /nfs/dbraw/zinc/39/02/08/1054390208.db2.gz RFMKDEGVSHSIJK-UHFFFAOYSA-N 2 1 342.527 4.075 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCO1 ZINC001199629672 1054434930 /nfs/dbraw/zinc/43/49/30/1054434930.db2.gz LRCRXIZUNPPZKK-YLJYHZDGSA-N 2 1 330.516 4.108 20 0 EIADMP Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000873206965 1054508669 /nfs/dbraw/zinc/50/86/69/1054508669.db2.gz GYGIFIKACZOJHI-CYBMUJFWSA-N 2 1 349.569 4.475 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(OC)c(OC)c2)c1 ZINC000173387747 1054556011 /nfs/dbraw/zinc/55/60/11/1054556011.db2.gz CIUHDTVTKQXEAV-MRXNPFEDSA-N 2 1 342.483 4.006 20 0 EIADMP Cc1nc(C(C)C)ccc1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859213005 1054645432 /nfs/dbraw/zinc/64/54/32/1054645432.db2.gz QEIAHNUJOXJELZ-UHFFFAOYSA-N 2 1 325.500 4.207 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000062426920 1054783453 /nfs/dbraw/zinc/78/34/53/1054783453.db2.gz XGEGJPYBAQUYKZ-HNNXBMFYSA-N 2 1 332.488 4.374 20 0 EIADMP Cc1noc(C)c1C[N@H+]1CCCC12CC[NH+](C[C@@H]1CC=CCC1)CC2 ZINC001201412222 1054790484 /nfs/dbraw/zinc/79/04/84/1054790484.db2.gz VBWYCNHCACOQLZ-LJQANCHMSA-N 2 1 343.515 4.078 20 0 EIADMP C[N@@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](C[C@H]1CC=CCC1)CC2 ZINC001201410342 1054803229 /nfs/dbraw/zinc/80/32/29/1054803229.db2.gz JNPWZSICIFPOQF-IBGZPJMESA-N 2 1 339.527 4.114 20 0 EIADMP Cn1c[nH+]c2cccc(NC3=C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)c21 ZINC001201478050 1054830679 /nfs/dbraw/zinc/83/06/79/1054830679.db2.gz SOHSCKHJEWTBIF-MOPGFXCFSA-N 2 1 344.462 4.306 20 0 EIADMP Cn1c[nH+]c2cccc(NC3=C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c21 ZINC001201478050 1054830680 /nfs/dbraw/zinc/83/06/80/1054830680.db2.gz SOHSCKHJEWTBIF-MOPGFXCFSA-N 2 1 344.462 4.306 20 0 EIADMP CSCCC[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001201697832 1054880639 /nfs/dbraw/zinc/88/06/39/1054880639.db2.gz QVFBEYPQPKRPGJ-UHFFFAOYSA-N 2 1 332.557 4.118 20 0 EIADMP C[C@H]([NH2+]C/C=C/c1cccc(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001201705171 1054882474 /nfs/dbraw/zinc/88/24/74/1054882474.db2.gz XGJFNCNFSCXVHX-MNVLBWLKSA-N 2 1 338.470 4.339 20 0 EIADMP Clc1csc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)n1 ZINC000876989125 1054995149 /nfs/dbraw/zinc/99/51/49/1054995149.db2.gz PBFPAAKIAJWJRI-UHFFFAOYSA-N 2 1 349.931 4.462 20 0 EIADMP Cc1noc(C)c1C[N@H+]1CCCC12CC[NH+](CCC(C)(C)C)CC2 ZINC001202073140 1054998657 /nfs/dbraw/zinc/99/86/57/1054998657.db2.gz IGAHHUZQOLVJOJ-UHFFFAOYSA-N 2 1 333.520 4.158 20 0 EIADMP C[N@@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](CCC(C)(C)C)CC2 ZINC001202072780 1055005103 /nfs/dbraw/zinc/00/51/03/1055005103.db2.gz BVLDESYSTCJVNV-UHFFFAOYSA-N 2 1 329.532 4.194 20 0 EIADMP C[C@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000877189853 1055034344 /nfs/dbraw/zinc/03/43/44/1055034344.db2.gz UEKUEJWILVRZRZ-KBPBESRZSA-N 2 1 347.890 4.224 20 0 EIADMP C[C@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000877189853 1055034355 /nfs/dbraw/zinc/03/43/55/1055034355.db2.gz UEKUEJWILVRZRZ-KBPBESRZSA-N 2 1 347.890 4.224 20 0 EIADMP Cc1cccc2[nH]c(C[NH2+]C[C@]3(C)CC[N@@H+](Cc4ccccc4)C3)cc21 ZINC001202220117 1055092334 /nfs/dbraw/zinc/09/23/34/1055092334.db2.gz MPMOIWXWVIETCR-QHCPKHFHSA-N 2 1 347.506 4.478 20 0 EIADMP C[C@H](N[C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccns1 ZINC000877659441 1055100841 /nfs/dbraw/zinc/10/08/41/1055100841.db2.gz SCQYPBLABBJNKZ-YXJHDRRASA-N 2 1 327.497 4.162 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1)c1ccns1 ZINC000877659441 1055100843 /nfs/dbraw/zinc/10/08/43/1055100843.db2.gz SCQYPBLABBJNKZ-YXJHDRRASA-N 2 1 327.497 4.162 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC000863546966 1055227171 /nfs/dbraw/zinc/22/71/71/1055227171.db2.gz IHQSPCNWBZKBSZ-SXLOBPIMSA-N 2 1 326.871 4.410 20 0 EIADMP Cc1ccc([C@H](C)Nc2ccc3c(c2)[nH+]cn3[C@H]2CCC[NH2+]CC2)nc1 ZINC001168855024 1060463327 /nfs/dbraw/zinc/46/33/27/1060463327.db2.gz SKPZZGROGCVNNY-WMZOPIPTSA-N 2 1 349.482 4.227 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)cc1C(F)(F)F)C2 ZINC001169097534 1060632720 /nfs/dbraw/zinc/63/27/20/1060632720.db2.gz BBUYHALNPABCDP-BTTYYORXSA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)cc1C(F)(F)F)C2 ZINC001169097534 1060632730 /nfs/dbraw/zinc/63/27/30/1060632730.db2.gz BBUYHALNPABCDP-BTTYYORXSA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCC(c1ccccc1)c1ccccc1)C2 ZINC001169098611 1060638087 /nfs/dbraw/zinc/63/80/87/1060638087.db2.gz JSFIIWLFRAGESC-DKUWSORSSA-N 2 1 334.507 4.423 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CCCc3ccc(Br)cc31)C2 ZINC001169082349 1060641709 /nfs/dbraw/zinc/64/17/09/1060641709.db2.gz YRWLNMBMBHGLDI-XLMAVXFVSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3ccc(Br)cc3)CCC1)C2 ZINC001169092140 1060646779 /nfs/dbraw/zinc/64/67/79/1060646779.db2.gz YKHIEHGREMMBFO-BJWYYQGGSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCCc3c(Br)cccc31)C2 ZINC001169118261 1060647901 /nfs/dbraw/zinc/64/79/01/1060647901.db2.gz GEZJYGDACRZKHT-KYZVSKTDSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](NC1(c3ccccc3Br)CCC1)C2 ZINC001169109358 1060657487 /nfs/dbraw/zinc/65/74/87/1060657487.db2.gz BDDOCWRBPMKNDD-QKDCVEJESA-N 2 1 349.316 4.043 20 0 EIADMP 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 1060664847 /nfs/dbraw/zinc/66/48/47/1060664847.db2.gz VSUPYEFXNMBVGX-NRSFXHEJSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CC[C@@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147654 1060664852 /nfs/dbraw/zinc/66/48/52/1060664852.db2.gz VSUPYEFXNMBVGX-NRSFXHEJSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CC[C@@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147654 1060664859 /nfs/dbraw/zinc/66/48/59/1060664859.db2.gz VSUPYEFXNMBVGX-NRSFXHEJSA-N 2 1 338.417 4.120 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147034 1060666630 /nfs/dbraw/zinc/66/66/30/1060666630.db2.gz RMUHRKPLVPREKM-LVQVYYBASA-N 2 1 339.310 4.408 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CC[C@@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147034 1060666638 /nfs/dbraw/zinc/66/66/38/1060666638.db2.gz RMUHRKPLVPREKM-LVQVYYBASA-N 2 1 339.310 4.408 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CC[C@@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147034 1060666644 /nfs/dbraw/zinc/66/66/44/1060666644.db2.gz RMUHRKPLVPREKM-LVQVYYBASA-N 2 1 339.310 4.408 20 0 EIADMP CC[NH+](CC)CCC[N@H+](C)C[C@H](C)Oc1ccc(Cl)c(Cl)c1 ZINC001169262575 1060708246 /nfs/dbraw/zinc/70/82/46/1060708246.db2.gz ZXPLBUNTNKOKGC-AWEZNQCLSA-N 2 1 347.330 4.424 20 0 EIADMP CC[NH+](CC)CCC[N@@H+](C)C[C@H](C)Oc1ccc(Cl)c(Cl)c1 ZINC001169262575 1060708267 /nfs/dbraw/zinc/70/82/67/1060708267.db2.gz ZXPLBUNTNKOKGC-AWEZNQCLSA-N 2 1 347.330 4.424 20 0 EIADMP Cc1c(C)n(C2CCCC2)c2nc[nH+]c(NC(C)(C)CC[NH+](C)C)c12 ZINC001169718245 1060920330 /nfs/dbraw/zinc/92/03/30/1060920330.db2.gz QXLTWGASSYUBKB-UHFFFAOYSA-N 2 1 343.519 4.305 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2c(F)cccc2F)CCCC1 ZINC000532219074 1032097470 /nfs/dbraw/zinc/09/74/70/1032097470.db2.gz KVGJJKXGTVTGDY-RVKKMQEKSA-N 2 1 336.470 4.095 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000173386159 1032359871 /nfs/dbraw/zinc/35/98/71/1032359871.db2.gz WQFJNABANNHMRJ-CHWSQXEVSA-N 2 1 325.378 4.197 20 0 EIADMP c1cc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cs1 ZINC000245690709 1032378088 /nfs/dbraw/zinc/37/80/88/1032378088.db2.gz KERXFEVETHJNSK-OWZKRDHZSA-N 2 1 326.509 4.076 20 0 EIADMP C[N@@H+](Cc1ccccc1C[NH2+]Cc1ccc(F)cn1)C1CCCCC1 ZINC000529531920 1032421568 /nfs/dbraw/zinc/42/15/68/1032421568.db2.gz MKOWVZXCOKXMCY-UHFFFAOYSA-N 2 1 341.474 4.275 20 0 EIADMP c1cc2ccc(C[NH+]3CCC(c4[nH+]cc5n4CCCC5)CC3)cc2[nH]1 ZINC000529553147 1032449534 /nfs/dbraw/zinc/44/95/34/1032449534.db2.gz FGSSLTQOQGJJKM-UHFFFAOYSA-N 2 1 334.467 4.080 20 0 EIADMP C[C@@H](c1ccc(C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)cc1)C(F)(F)F ZINC000450431106 1032495118 /nfs/dbraw/zinc/49/51/18/1032495118.db2.gz XPOJINKSSNXVRP-GOEBONIOSA-N 2 1 328.422 4.126 20 0 EIADMP C[C@@H](c1ccc(C[NH+](C)C[C@@H]2CCC[N@@H+](C)C2)cc1)C(F)(F)F ZINC000450431106 1032495123 /nfs/dbraw/zinc/49/51/23/1032495123.db2.gz XPOJINKSSNXVRP-GOEBONIOSA-N 2 1 328.422 4.126 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)s1 ZINC000178625567 1032543195 /nfs/dbraw/zinc/54/31/95/1032543195.db2.gz UVXBAEBYMMZVJX-NSHDSACASA-N 2 1 344.459 4.244 20 0 EIADMP CCOCCC[N@H+]1CC[C@H](N[C@H](CC)c2ccccc2F)[C@H](C)C1 ZINC000245987137 1032575733 /nfs/dbraw/zinc/57/57/33/1032575733.db2.gz QEVVFDUQGNZUND-AHRSYUTCSA-N 2 1 336.495 4.003 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](CC)c2ccccc2F)[C@H](C)C1 ZINC000245987137 1032575768 /nfs/dbraw/zinc/57/57/68/1032575768.db2.gz QEVVFDUQGNZUND-AHRSYUTCSA-N 2 1 336.495 4.003 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512391651 1032631621 /nfs/dbraw/zinc/63/16/21/1032631621.db2.gz OQRMBXGTHIMDQY-QFBILLFUSA-N 2 1 342.527 4.143 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512391651 1032631628 /nfs/dbraw/zinc/63/16/28/1032631628.db2.gz OQRMBXGTHIMDQY-QFBILLFUSA-N 2 1 342.527 4.143 20 0 EIADMP CCC[N@@H+](CC)Cc1ccc(-c2nc([C@@H]([NH3+])CC(C)C)no2)cc1 ZINC000339392474 1018839396 /nfs/dbraw/zinc/83/93/96/1018839396.db2.gz FFIAJDWGVKSPBU-KRWDZBQOSA-N 2 1 330.476 4.014 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2ccn(C(CC)CC)n2)CC1 ZINC000533459703 1032794279 /nfs/dbraw/zinc/79/42/79/1032794279.db2.gz FSDWYYFWUWOQTN-UHFFFAOYSA-N 2 1 334.552 4.188 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccn(C(CC)CC)n2)CC1 ZINC000533459703 1032794299 /nfs/dbraw/zinc/79/42/99/1032794299.db2.gz FSDWYYFWUWOQTN-UHFFFAOYSA-N 2 1 334.552 4.188 20 0 EIADMP COc1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)cc1OCCC(C)C ZINC000432794717 1032819548 /nfs/dbraw/zinc/81/95/48/1032819548.db2.gz URGLHCNYCYIKTR-IBGZPJMESA-N 2 1 348.531 4.036 20 0 EIADMP COc1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)cc1OCCC(C)C ZINC000432794717 1032819550 /nfs/dbraw/zinc/81/95/50/1032819550.db2.gz URGLHCNYCYIKTR-IBGZPJMESA-N 2 1 348.531 4.036 20 0 EIADMP C[C@H]1CC(C[N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)C[C@H](C)O1 ZINC001209390760 1020243353 /nfs/dbraw/zinc/24/33/53/1020243353.db2.gz NBRQFKHBKRMXKK-OALUTQOASA-N 2 1 344.543 4.034 20 0 EIADMP CN(c1ccccc1)c1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000683357890 1020381631 /nfs/dbraw/zinc/38/16/31/1020381631.db2.gz PIPBENXUWPYRGY-FQEVSTJZSA-N 2 1 337.511 4.371 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cnc2ccccc2c1 ZINC000398182556 1020526298 /nfs/dbraw/zinc/52/62/98/1020526298.db2.gz XHRNVYBEYQWKRG-AVRDEDQJSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cnc2ccccc2c1 ZINC000398182556 1020526314 /nfs/dbraw/zinc/52/63/14/1020526314.db2.gz XHRNVYBEYQWKRG-AVRDEDQJSA-N 2 1 345.490 4.235 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CC2(C1)CC[NH+](Cc1cc(C)on1)CC2 ZINC001279403508 1020547937 /nfs/dbraw/zinc/54/79/37/1020547937.db2.gz RQKIENHSBQBPDL-SFHVURJKSA-N 2 1 333.520 4.097 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000683472272 1020849389 /nfs/dbraw/zinc/84/93/89/1020849389.db2.gz KEKPDQXLXKAYGQ-KRWDZBQOSA-N 2 1 328.431 4.049 20 0 EIADMP CC(=O)Nc1cccc([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000121596807 1021001069 /nfs/dbraw/zinc/00/10/69/1021001069.db2.gz YHKSYBATFPTSFY-MRXNPFEDSA-N 2 1 343.515 4.093 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C1 ZINC000376132112 1021545444 /nfs/dbraw/zinc/54/54/44/1021545444.db2.gz LGZLNQOQNXFCNN-MJIXASBWSA-N 2 1 327.516 4.021 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)C1 ZINC000376132112 1021545458 /nfs/dbraw/zinc/54/54/58/1021545458.db2.gz LGZLNQOQNXFCNN-MJIXASBWSA-N 2 1 327.516 4.021 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc3cnccc3c2)C1 ZINC000683827229 1021723673 /nfs/dbraw/zinc/72/36/73/1021723673.db2.gz ADAVNNOGCLNGDG-QUCCMNQESA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc3cnccc3c2)C1 ZINC000683827229 1021723693 /nfs/dbraw/zinc/72/36/93/1021723693.db2.gz ADAVNNOGCLNGDG-QUCCMNQESA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc3cnccc3c2)C1 ZINC000683827229 1021723715 /nfs/dbraw/zinc/72/37/15/1021723715.db2.gz ADAVNNOGCLNGDG-QUCCMNQESA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc3cnccc3c2)C1 ZINC000683827229 1021723734 /nfs/dbraw/zinc/72/37/34/1021723734.db2.gz ADAVNNOGCLNGDG-QUCCMNQESA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc3cnccc3c2)C1 ZINC000683827229 1021723750 /nfs/dbraw/zinc/72/37/50/1021723750.db2.gz ADAVNNOGCLNGDG-QUCCMNQESA-N 2 1 337.511 4.321 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccc4cnccc4c3)C2)CC1 ZINC000683827442 1021726573 /nfs/dbraw/zinc/72/65/73/1021726573.db2.gz GXRXCWFSMNLYIQ-HXUWFJFHSA-N 2 1 337.511 4.179 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccc4cnccc4c3)C2)CC1 ZINC000683827442 1021726588 /nfs/dbraw/zinc/72/65/88/1021726588.db2.gz GXRXCWFSMNLYIQ-HXUWFJFHSA-N 2 1 337.511 4.179 20 0 EIADMP CC[NH+]1CCC([N@H+](C)CCCSc2ccccc2Cl)CC1 ZINC000531143397 1021842597 /nfs/dbraw/zinc/84/25/97/1021842597.db2.gz IQHKLHSAJNCYIF-UHFFFAOYSA-N 2 1 326.937 4.238 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)CCCSc2ccccc2Cl)CC1 ZINC000531143397 1021842600 /nfs/dbraw/zinc/84/26/00/1021842600.db2.gz IQHKLHSAJNCYIF-UHFFFAOYSA-N 2 1 326.937 4.238 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc3ccccc3[nH]2)[C@H]1c1cccs1 ZINC000683930266 1021999971 /nfs/dbraw/zinc/99/99/71/1021999971.db2.gz YITXFXZDCDRIGH-JXFKEZNVSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cc3ccccc3[nH]2)[C@H]1c1cccs1 ZINC000683930266 1021999991 /nfs/dbraw/zinc/99/99/91/1021999991.db2.gz YITXFXZDCDRIGH-JXFKEZNVSA-N 2 1 339.508 4.402 20 0 EIADMP Cc1ccnc([C@@H](C)[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000564429265 1022008658 /nfs/dbraw/zinc/00/86/58/1022008658.db2.gz PNXWTFOCIKYGHC-TZIWHRDSSA-N 2 1 337.511 4.343 20 0 EIADMP Cc1ccnc([C@@H](C)[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000564429265 1022008670 /nfs/dbraw/zinc/00/86/70/1022008670.db2.gz PNXWTFOCIKYGHC-TZIWHRDSSA-N 2 1 337.511 4.343 20 0 EIADMP CC[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000414168504 1022016163 /nfs/dbraw/zinc/01/61/63/1022016163.db2.gz AFEPZGYBROJFMW-PBHICJAKSA-N 2 1 326.431 4.061 20 0 EIADMP COc1ccsc1[C@@H](C)NCC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000471580446 1022063402 /nfs/dbraw/zinc/06/34/02/1022063402.db2.gz IFUKFAYONTXUKZ-JKSUJKDBSA-N 2 1 332.513 4.318 20 0 EIADMP COc1ccsc1[C@@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000471580446 1022063435 /nfs/dbraw/zinc/06/34/35/1022063435.db2.gz IFUKFAYONTXUKZ-JKSUJKDBSA-N 2 1 332.513 4.318 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@@H]2Cc4ccccc42)C3)cc1 ZINC000245731164 1033033703 /nfs/dbraw/zinc/03/37/03/1033033703.db2.gz QFHAFYNRQRYZEP-MYGLTJDJSA-N 2 1 332.491 4.112 20 0 EIADMP CCCCc1nc(C[NH+]2CCC(C[N@@H+](C)CCCC)CC2)cs1 ZINC000613491546 1022165053 /nfs/dbraw/zinc/16/50/53/1022165053.db2.gz WURGHSOFSYNUBA-UHFFFAOYSA-N 2 1 337.577 4.430 20 0 EIADMP CCCCc1nc(C[NH+]2CCC(C[N@H+](C)CCCC)CC2)cs1 ZINC000613491546 1022165062 /nfs/dbraw/zinc/16/50/62/1022165062.db2.gz WURGHSOFSYNUBA-UHFFFAOYSA-N 2 1 337.577 4.430 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@H](Cc1ccccc1Cl)c1ccsc1 ZINC000651327537 1022473345 /nfs/dbraw/zinc/47/33/45/1022473345.db2.gz WVEVFDPEDUVOSS-GOSISDBHSA-N 2 1 345.899 4.251 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1C ZINC000580945767 1022734684 /nfs/dbraw/zinc/73/46/84/1022734684.db2.gz ZVIQVSWXRBGARS-YLJYHZDGSA-N 2 1 344.524 4.238 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ccc1C ZINC000580945767 1022734701 /nfs/dbraw/zinc/73/47/01/1022734701.db2.gz ZVIQVSWXRBGARS-YLJYHZDGSA-N 2 1 344.524 4.238 20 0 EIADMP C[C@@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC2(C[C@@H]2C[N@@H+](C)C2CC2)CC1 ZINC000378354970 1022739118 /nfs/dbraw/zinc/73/91/18/1022739118.db2.gz MCWWHHIHHORZPY-JKSUJKDBSA-N 2 1 345.531 4.229 20 0 EIADMP Brc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C2CC2)cc1 ZINC000378431633 1022817307 /nfs/dbraw/zinc/81/73/07/1022817307.db2.gz ODKQNFPVEZOZLG-OKZBNKHCSA-N 2 1 349.316 4.117 20 0 EIADMP c1ccc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@H]2CC[C@@H]3[NH+](Cc3ccccc3)C2)cc1 ZINC000656404135 1022846132 /nfs/dbraw/zinc/84/61/32/1022846132.db2.gz WYQSTLLFJCLBJL-MLCQCVOFSA-N 2 1 332.491 4.029 20 0 EIADMP c1ccc(C[NH+]2C[C@H]3[C@@H](C2)[C@H]2CC[C@@H]3[N@@H+](Cc3ccccc3)C2)cc1 ZINC000656404135 1022846137 /nfs/dbraw/zinc/84/61/37/1022846137.db2.gz WYQSTLLFJCLBJL-MLCQCVOFSA-N 2 1 332.491 4.029 20 0 EIADMP c1ccc(C[NH+]2C[C@H]3[C@@H](C2)[C@H]2CC[C@@H]3[N@H+](Cc3ccccc3)C2)cc1 ZINC000656404135 1022846138 /nfs/dbraw/zinc/84/61/38/1022846138.db2.gz WYQSTLLFJCLBJL-MLCQCVOFSA-N 2 1 332.491 4.029 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000545457557 1022853628 /nfs/dbraw/zinc/85/36/28/1022853628.db2.gz GJENLTXWOBVXET-HXUWFJFHSA-N 2 1 343.902 4.093 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000545461206 1022870248 /nfs/dbraw/zinc/87/02/48/1022870248.db2.gz SEMYOSDJWXHMQS-YSGRDPCXSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC[N@H+]1C ZINC000545461206 1022870251 /nfs/dbraw/zinc/87/02/51/1022870251.db2.gz SEMYOSDJWXHMQS-YSGRDPCXSA-N 2 1 343.902 4.091 20 0 EIADMP C[NH+]1CCC2(CC[N@@H+](Cc3ccc(Cl)cc3C(F)(F)F)C2)CC1 ZINC001143505444 1022889472 /nfs/dbraw/zinc/88/94/72/1022889472.db2.gz HZBTZVWQSJHKTG-UHFFFAOYSA-N 2 1 346.824 4.277 20 0 EIADMP FC(F)(F)[C@@H]1CCCC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000128478912 1022890068 /nfs/dbraw/zinc/89/00/68/1022890068.db2.gz ZIMUTRWZKUGNFN-MSOLQXFVSA-N 2 1 340.433 4.362 20 0 EIADMP CC(C)[C@H]([NH2+]CCCc1c[nH+]cn1C)c1cccc(C(F)(F)F)c1 ZINC000581258306 1022922461 /nfs/dbraw/zinc/92/24/61/1022922461.db2.gz AIFLLSFTIIQKJE-KRWDZBQOSA-N 2 1 339.405 4.358 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CC2(OC)CCC(c3ccccc3)CC2)[C@H](C)C1 ZINC000581292418 1022969458 /nfs/dbraw/zinc/96/94/58/1022969458.db2.gz HVJXTFYSGNRFTE-NTYOPAKOSA-N 2 1 344.543 4.049 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CCC[C@H]([C@@H](C)[NH3+])C3)s2)cc1 ZINC000430556797 1023005965 /nfs/dbraw/zinc/00/59/65/1023005965.db2.gz VKDCODRWJDXUEO-QAPCUYQASA-N 2 1 343.540 4.493 20 0 EIADMP CCc1nocc1C[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000339190846 1023008602 /nfs/dbraw/zinc/00/86/02/1023008602.db2.gz VINRYBARMCWMFJ-IRXDYDNUSA-N 2 1 341.499 4.005 20 0 EIADMP CCc1nocc1C[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000339190845 1023009217 /nfs/dbraw/zinc/00/92/17/1023009217.db2.gz VINRYBARMCWMFJ-IAGOWNOFSA-N 2 1 341.499 4.005 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000624120501 1023085522 /nfs/dbraw/zinc/08/55/22/1023085522.db2.gz ALQHHGVSMURXMY-LSDHHAIUSA-N 2 1 344.421 4.010 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2c(OC)ccc3ccccc32)CC1 ZINC000510410740 1023110687 /nfs/dbraw/zinc/11/06/87/1023110687.db2.gz HQQYUDMKQSJVRK-UHFFFAOYSA-N 2 1 326.484 4.155 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2c(OC)ccc3ccccc32)CC1 ZINC000510410740 1023110696 /nfs/dbraw/zinc/11/06/96/1023110696.db2.gz HQQYUDMKQSJVRK-UHFFFAOYSA-N 2 1 326.484 4.155 20 0 EIADMP C[C@]1(C[NH2+]Cc2cncc3ccccc32)CC[N@@H+](Cc2ccccc2)C1 ZINC000311366689 1023129063 /nfs/dbraw/zinc/12/90/63/1023129063.db2.gz KHKSZDVIJYPLOR-HSZRJFAPSA-N 2 1 345.490 4.237 20 0 EIADMP Cc1c[nH+]ccc1N1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000584686516 1023187216 /nfs/dbraw/zinc/18/72/16/1023187216.db2.gz ZJWVALBPPQWTLR-UHFFFAOYSA-N 2 1 349.400 4.121 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(Cl)cn2)CC1 ZINC000581447645 1023239461 /nfs/dbraw/zinc/23/94/61/1023239461.db2.gz RPHFXHXYTVZLLV-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(Cl)cn2)CC1 ZINC000581447645 1023239471 /nfs/dbraw/zinc/23/94/71/1023239471.db2.gz RPHFXHXYTVZLLV-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)[C@H]1CC1(C)C ZINC000417300621 1023248023 /nfs/dbraw/zinc/24/80/23/1023248023.db2.gz APGZBZMGTMJZCR-RTBURBONSA-N 2 1 347.547 4.308 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H]2COCc4ccccc42)C3)cc1 ZINC000417364533 1023291346 /nfs/dbraw/zinc/29/13/46/1023291346.db2.gz MXFOBAADCNYXOC-CUDBPUKSSA-N 2 1 348.490 4.043 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H]2COCc4ccccc42)C3)cc1 ZINC000417364533 1023291350 /nfs/dbraw/zinc/29/13/50/1023291350.db2.gz MXFOBAADCNYXOC-CUDBPUKSSA-N 2 1 348.490 4.043 20 0 EIADMP C[C@@H]([NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310067394 1023346715 /nfs/dbraw/zinc/34/67/15/1023346715.db2.gz BYZLFJGPBUEYET-DYESRHJHSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310067394 1023346721 /nfs/dbraw/zinc/34/67/21/1023346721.db2.gz BYZLFJGPBUEYET-DYESRHJHSA-N 2 1 326.459 4.389 20 0 EIADMP [NH3+]CCC[C@@H]([NH2+][C@H](CCc1ccccc1)C(F)F)c1ccccc1 ZINC000415052415 1023409498 /nfs/dbraw/zinc/40/94/98/1023409498.db2.gz LDNRUHHXNRPNNK-RTBURBONSA-N 2 1 332.438 4.323 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1ccc(Cl)cn1 ZINC000549167903 1023411128 /nfs/dbraw/zinc/41/11/28/1023411128.db2.gz XUGZIVBRIWFBLC-IBGZPJMESA-N 2 1 343.902 4.125 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]C2C[C@H]3CC[C@@H](C2)S3)C[N@H+]1Cc1ccccc1 ZINC000925617566 1023411163 /nfs/dbraw/zinc/41/11/63/1023411163.db2.gz XGNRCHOAPCEBGI-VWWARQNISA-N 2 1 344.568 4.303 20 0 EIADMP c1ccc([C@H]2C[C@@H]([NH2+]CCOc3cccc4ccccc43)CC[NH2+]2)cc1 ZINC000415093829 1023439312 /nfs/dbraw/zinc/43/93/12/1023439312.db2.gz WEZHASLTYYDVHJ-RBBKRZOGSA-N 2 1 346.474 4.302 20 0 EIADMP C[N@@H+]1CCC[C@]2(CCN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)C2)C1 ZINC000549195744 1023454847 /nfs/dbraw/zinc/45/48/47/1023454847.db2.gz BCZJIACCEHXUGW-SFHVURJKSA-N 2 1 349.400 4.176 20 0 EIADMP C[N@H+]1CCC[C@]2(CCN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)C2)C1 ZINC000549195744 1023454856 /nfs/dbraw/zinc/45/48/56/1023454856.db2.gz BCZJIACCEHXUGW-SFHVURJKSA-N 2 1 349.400 4.176 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075196 1023483739 /nfs/dbraw/zinc/48/37/39/1023483739.db2.gz OOSYAWYCRPPOLI-LSDHHAIUSA-N 2 1 328.422 4.083 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075196 1023483751 /nfs/dbraw/zinc/48/37/51/1023483751.db2.gz OOSYAWYCRPPOLI-LSDHHAIUSA-N 2 1 328.422 4.083 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075196 1023483760 /nfs/dbraw/zinc/48/37/60/1023483760.db2.gz OOSYAWYCRPPOLI-LSDHHAIUSA-N 2 1 328.422 4.083 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Br)c(C)c2)C[C@@H]1C ZINC000500088700 1023494468 /nfs/dbraw/zinc/49/44/68/1023494468.db2.gz FQDAPNMFPWXYDZ-HOCLYGCPSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Br)c(C)c2)C[C@@H]1C ZINC000500088700 1023494472 /nfs/dbraw/zinc/49/44/72/1023494472.db2.gz FQDAPNMFPWXYDZ-HOCLYGCPSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Br)c(C)c2)C[C@@H]1C ZINC000500088700 1023494476 /nfs/dbraw/zinc/49/44/76/1023494476.db2.gz FQDAPNMFPWXYDZ-HOCLYGCPSA-N 2 1 339.321 4.062 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+]C(C3CCC3)C3CCC3)C2)cc1 ZINC000549237397 1023514315 /nfs/dbraw/zinc/51/43/15/1023514315.db2.gz OMFZOSGKFQEAEF-IBGZPJMESA-N 2 1 326.528 4.109 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCNc1ccc(F)c(C[NH+]2CCCC2)c1 ZINC001167753036 1023629007 /nfs/dbraw/zinc/62/90/07/1023629007.db2.gz AWGDZHPKNVOKFZ-QGZVFWFLSA-N 2 1 333.495 4.098 20 0 EIADMP CC[C@H](c1ccccc1F)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000377688603 1023688422 /nfs/dbraw/zinc/68/84/22/1023688422.db2.gz ACOOSTXBSHGQQG-WMQCIHAUSA-N 2 1 341.474 4.297 20 0 EIADMP CC[C@H](c1ccccc1F)N(C)C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1 ZINC000377688603 1023688426 /nfs/dbraw/zinc/68/84/26/1023688426.db2.gz ACOOSTXBSHGQQG-WMQCIHAUSA-N 2 1 341.474 4.297 20 0 EIADMP CC[C@H](c1ccccc1F)N(C)C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1 ZINC000377688603 1023688438 /nfs/dbraw/zinc/68/84/38/1023688438.db2.gz ACOOSTXBSHGQQG-WMQCIHAUSA-N 2 1 341.474 4.297 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[N@@H+]2CCC3(CCOCC3)[C@H]2C)cc1 ZINC000377710949 1023704503 /nfs/dbraw/zinc/70/45/03/1023704503.db2.gz YKLQOAWRXMNGSP-IAGOWNOFSA-N 2 1 339.483 4.133 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[N@H+]2CCC3(CCOCC3)[C@H]2C)cc1 ZINC000377710949 1023704512 /nfs/dbraw/zinc/70/45/12/1023704512.db2.gz YKLQOAWRXMNGSP-IAGOWNOFSA-N 2 1 339.483 4.133 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)Cc2cccc(OC3CCCC3)c2)CC1 ZINC000510468236 1023758354 /nfs/dbraw/zinc/75/83/54/1023758354.db2.gz YVRWAQJNTIQJKJ-UHFFFAOYSA-N 2 1 330.516 4.314 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cccc(OC3CCCC3)c2)CC1 ZINC000510468236 1023758360 /nfs/dbraw/zinc/75/83/60/1023758360.db2.gz YVRWAQJNTIQJKJ-UHFFFAOYSA-N 2 1 330.516 4.314 20 0 EIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000471775576 1023833517 /nfs/dbraw/zinc/83/35/17/1023833517.db2.gz XMMHFIPTDKFXNU-HNNXBMFYSA-N 2 1 339.414 4.245 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@H](Cc1ccccc1Cl)c1ccccc1 ZINC000471777097 1023834739 /nfs/dbraw/zinc/83/47/39/1023834739.db2.gz YWGWHZHTFSJUMP-HXUWFJFHSA-N 2 1 339.870 4.190 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]C2CCC(F)(F)CC2)C[N@H+]1Cc1ccccc1 ZINC000647196188 1023851441 /nfs/dbraw/zinc/85/14/41/1023851441.db2.gz RSAXFDRKKHQWMB-AEFFLSMTSA-N 2 1 336.470 4.455 20 0 EIADMP COc1cccc([C@@H](C)[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000430710903 1023966875 /nfs/dbraw/zinc/96/68/75/1023966875.db2.gz UYBMRFRSVCJWNL-QUCCMNQESA-N 2 1 338.495 4.210 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1cc2cnccc2o1 ZINC000651795505 1024034808 /nfs/dbraw/zinc/03/48/08/1024034808.db2.gz BUHKBXYITGJSKO-NRFANRHFSA-N 2 1 349.478 4.218 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1cc2cnccc2o1 ZINC000651795505 1024034823 /nfs/dbraw/zinc/03/48/23/1024034823.db2.gz BUHKBXYITGJSKO-NRFANRHFSA-N 2 1 349.478 4.218 20 0 EIADMP CCC[C@H]([NH2+]CCn1cc[nH+]c1C)c1cccc(C(F)(F)F)c1 ZINC000341633581 1024040980 /nfs/dbraw/zinc/04/09/80/1024040980.db2.gz BKFBNLGWJLASEA-INIZCTEOSA-N 2 1 325.378 4.341 20 0 EIADMP Cc1ccc2[nH]c(C[N@@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)cc2c1C ZINC000473132168 1024348138 /nfs/dbraw/zinc/34/81/38/1024348138.db2.gz LEXJTUWCQMDZET-LJQANCHMSA-N 2 1 325.500 4.235 20 0 EIADMP Cc1ccc2[nH]c(C[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)cc2c1C ZINC000473132168 1024348160 /nfs/dbraw/zinc/34/81/60/1024348160.db2.gz LEXJTUWCQMDZET-LJQANCHMSA-N 2 1 325.500 4.235 20 0 EIADMP Cc1cccc([C@H]([NH2+][C@H]2CCN(C)[C@H](C)C2)c2cccc(F)c2)c1 ZINC000510736758 1024378247 /nfs/dbraw/zinc/37/82/47/1024378247.db2.gz RFGWTPIKFYZAIN-CZAAIQMYSA-N 2 1 326.459 4.296 20 0 EIADMP CCSc1cccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000473138876 1024380135 /nfs/dbraw/zinc/38/01/35/1024380135.db2.gz HGCCRADDZDMVMT-PXNSSMCTSA-N 2 1 330.541 4.247 20 0 EIADMP CCSc1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000473138876 1024380152 /nfs/dbraw/zinc/38/01/52/1024380152.db2.gz HGCCRADDZDMVMT-PXNSSMCTSA-N 2 1 330.541 4.247 20 0 EIADMP CCSc1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000473138876 1024380170 /nfs/dbraw/zinc/38/01/70/1024380170.db2.gz HGCCRADDZDMVMT-PXNSSMCTSA-N 2 1 330.541 4.247 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000164610157 1024696809 /nfs/dbraw/zinc/69/68/09/1024696809.db2.gz HOYBOVRHRPCELC-QGZVFWFLSA-N 2 1 333.863 4.129 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582002537 1024835923 /nfs/dbraw/zinc/83/59/23/1024835923.db2.gz QSPRFYPJLPMWFP-AZUAARDMSA-N 2 1 338.495 4.388 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000582002537 1024835924 /nfs/dbraw/zinc/83/59/24/1024835924.db2.gz QSPRFYPJLPMWFP-AZUAARDMSA-N 2 1 338.495 4.388 20 0 EIADMP COc1cc2c(cc1F)CC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000510930543 1024841889 /nfs/dbraw/zinc/84/18/89/1024841889.db2.gz SOHMJVNNADLPIP-FQEVSTJZSA-N 2 1 346.490 4.208 20 0 EIADMP C[C@H](CC1CCOCC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510954627 1024864347 /nfs/dbraw/zinc/86/43/47/1024864347.db2.gz YIBMAARKOBCDLS-NQIIRXRSSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H](CC1CCOCC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510954627 1024864353 /nfs/dbraw/zinc/86/43/53/1024864353.db2.gz YIBMAARKOBCDLS-NQIIRXRSSA-N 2 1 344.543 4.082 20 0 EIADMP COCC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000510959286 1024865793 /nfs/dbraw/zinc/86/57/93/1024865793.db2.gz GEZQVOSMCFXMIE-OTYNDTSQSA-N 2 1 344.543 4.223 20 0 EIADMP Cc1cncc([C@@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000510964025 1024870750 /nfs/dbraw/zinc/87/07/50/1024870750.db2.gz BOZXZBADFBZVRP-NQIIRXRSSA-N 2 1 337.511 4.341 20 0 EIADMP Cc1cncc([C@@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000510964025 1024870751 /nfs/dbraw/zinc/87/07/51/1024870751.db2.gz BOZXZBADFBZVRP-NQIIRXRSSA-N 2 1 337.511 4.341 20 0 EIADMP CCC1([NH3+])CC[NH+]([C@@H](C)c2sc(Cc3ccccc3)nc2C)CC1 ZINC000925757694 1024960297 /nfs/dbraw/zinc/96/02/97/1024960297.db2.gz VZEYUMSSNLYEAP-INIZCTEOSA-N 2 1 343.540 4.307 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(-c2ccccc2)no1 ZINC000277014104 1024996580 /nfs/dbraw/zinc/99/65/80/1024996580.db2.gz CEXAUBDTPNOQCP-UHFFFAOYSA-N 2 1 338.455 4.013 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(-c2ccccc2)no1 ZINC000277014104 1024996584 /nfs/dbraw/zinc/99/65/84/1024996584.db2.gz CEXAUBDTPNOQCP-UHFFFAOYSA-N 2 1 338.455 4.013 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](CCc1ccccc1)Cc1ccccc1 ZINC000510990858 1025026881 /nfs/dbraw/zinc/02/68/81/1025026881.db2.gz FNPWIYQCKLCMMQ-QHCPKHFHSA-N 2 1 347.506 4.415 20 0 EIADMP c1sc(C2CCCC2)nc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662292603 1025043578 /nfs/dbraw/zinc/04/35/78/1025043578.db2.gz OROSIGJOKVIGJD-QGZVFWFLSA-N 2 1 333.545 4.012 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000301193062 1025175112 /nfs/dbraw/zinc/17/51/12/1025175112.db2.gz PJOOXZBTHHVZNZ-OAQYLSRUSA-N 2 1 338.495 4.086 20 0 EIADMP c1ccc2c(c1)[nH]c1c2CCC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663466122 1025393108 /nfs/dbraw/zinc/39/31/08/1025393108.db2.gz OGPKONRAAXYPMH-UTKZUKDTSA-N 2 1 337.511 4.257 20 0 EIADMP c1cncc([C@@H]([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)C2CCCCC2)c1 ZINC000663467020 1025400432 /nfs/dbraw/zinc/40/04/32/1025400432.db2.gz YZWZURYEBFPYEW-UGKGYDQZSA-N 2 1 341.543 4.415 20 0 EIADMP COc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)ccc1SC ZINC000663466976 1025401015 /nfs/dbraw/zinc/40/10/15/1025401015.db2.gz CIPIPSTWEQQFFB-DOTOQJQBSA-N 2 1 348.556 4.190 20 0 EIADMP COCC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)(C)C ZINC000511002530 1025414870 /nfs/dbraw/zinc/41/48/70/1025414870.db2.gz UAKPAWVGMGZFIA-SXLOBPIMSA-N 2 1 332.532 4.080 20 0 EIADMP COCC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)(C)C ZINC000511002530 1025414884 /nfs/dbraw/zinc/41/48/84/1025414884.db2.gz UAKPAWVGMGZFIA-SXLOBPIMSA-N 2 1 332.532 4.080 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(C)(C)CC(F)(F)F ZINC000663477439 1025436542 /nfs/dbraw/zinc/43/65/42/1025436542.db2.gz FDWWVHJJBAQBPN-NVXWUHKLSA-N 2 1 342.449 4.465 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(C)(C)CC(F)(F)F ZINC000663477439 1025436553 /nfs/dbraw/zinc/43/65/53/1025436553.db2.gz FDWWVHJJBAQBPN-NVXWUHKLSA-N 2 1 342.449 4.465 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@@H](c2ccc(C)cc2)C[C@@H]1C ZINC000426539583 1025490262 /nfs/dbraw/zinc/49/02/62/1025490262.db2.gz NEHVQJLHHAYKKK-PXNSSMCTSA-N 2 1 346.478 4.262 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H](Oc2cccc(OC)c2)C1 ZINC001167824728 1025583508 /nfs/dbraw/zinc/58/35/08/1025583508.db2.gz FZDOOYYTJGQFCV-RXVVDRJESA-N 2 1 348.531 4.049 20 0 EIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CCc3[nH+]ccn3C2)c2ccccc2)cc1 ZINC000278923992 1025619270 /nfs/dbraw/zinc/61/92/70/1025619270.db2.gz IEVAPRNHCBEXHZ-PGRDOPGGSA-N 2 1 331.463 4.133 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1C[C@H]2[C@@H](C1)CCC[C@H]2OCC1CC1 ZINC001167827662 1025667072 /nfs/dbraw/zinc/66/70/72/1025667072.db2.gz UNZHZGIPXRADAH-AYWYSENESA-N 2 1 336.564 4.024 20 0 EIADMP C[N@@H+](CCCOc1cccc2ccccc21)CC[C@H]1CCCC[NH+]1C ZINC001167508277 1025743987 /nfs/dbraw/zinc/74/39/87/1025743987.db2.gz FRTSUYTVKFESNC-HXUWFJFHSA-N 2 1 340.511 4.415 20 0 EIADMP C[NH+](CCCOc1cccc2ccccc21)CC[C@H]1CCCC[N@@H+]1C ZINC001167508277 1025744019 /nfs/dbraw/zinc/74/40/19/1025744019.db2.gz FRTSUYTVKFESNC-HXUWFJFHSA-N 2 1 340.511 4.415 20 0 EIADMP C[NH+](CCCOc1cccc2ccccc21)CC[C@H]1CCCC[N@H+]1C ZINC001167508277 1025744041 /nfs/dbraw/zinc/74/40/41/1025744041.db2.gz FRTSUYTVKFESNC-HXUWFJFHSA-N 2 1 340.511 4.415 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)n1ccc([C@@H](C)[NH2+]Cc2ccccc2)n1 ZINC001167833540 1025792300 /nfs/dbraw/zinc/79/23/00/1025792300.db2.gz CFBREMRMJUJQIE-RTBURBONSA-N 2 1 342.531 4.417 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H]2CCCOc3c(C(C)C)cccc32)CC1 ZINC000431324742 1025838820 /nfs/dbraw/zinc/83/88/20/1025838820.db2.gz XXRLTDQNBPWVOK-FQEVSTJZSA-N 2 1 330.516 4.488 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000431329989 1025888769 /nfs/dbraw/zinc/88/87/69/1025888769.db2.gz UKWHTWYFXDNIBL-OAQYLSRUSA-N 2 1 342.527 4.488 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cncc(F)c1 ZINC000157666637 1025922734 /nfs/dbraw/zinc/92/27/34/1025922734.db2.gz RKBPSDPMGLZASS-SJORKVTESA-N 2 1 341.474 4.446 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1cncc(F)c1 ZINC000157666637 1025922742 /nfs/dbraw/zinc/92/27/42/1025922742.db2.gz RKBPSDPMGLZASS-SJORKVTESA-N 2 1 341.474 4.446 20 0 EIADMP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000582032425 1025996565 /nfs/dbraw/zinc/99/65/65/1025996565.db2.gz HPIUCIVEQPOBRU-WEYGHZABSA-N 2 1 338.495 4.051 20 0 EIADMP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000582032425 1025996595 /nfs/dbraw/zinc/99/65/95/1025996595.db2.gz HPIUCIVEQPOBRU-WEYGHZABSA-N 2 1 338.495 4.051 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)s1 ZINC000512105005 1026005074 /nfs/dbraw/zinc/00/50/74/1026005074.db2.gz KPBARWIQPLWGMJ-ROUUACIJSA-N 2 1 329.513 4.021 20 0 EIADMP C[N@H+]1CCC[C@H](CNc2[nH+]ccc3[nH]ccc32)[C@H]1c1cccs1 ZINC000663660329 1026062614 /nfs/dbraw/zinc/06/26/14/1026062614.db2.gz MBTLFTLPVWLIHX-DYVFJYSZSA-N 2 1 326.469 4.119 20 0 EIADMP COc1cc(C)c(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)cc1C(C)C ZINC001204743034 1026075737 /nfs/dbraw/zinc/07/57/37/1026075737.db2.gz XYSFUACWXVUFEY-UHFFFAOYSA-N 2 1 330.516 4.093 20 0 EIADMP c1ccc([C@H](CC2CCC2)[NH2+]CC2([NH+]3CCCC3)CCOCC2)cc1 ZINC000344175604 1026095178 /nfs/dbraw/zinc/09/51/78/1026095178.db2.gz SMTLFWZAUVFZTI-NRFANRHFSA-N 2 1 342.527 4.153 20 0 EIADMP Fc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c(Cl)c1 ZINC001167972741 1026129531 /nfs/dbraw/zinc/12/95/31/1026129531.db2.gz ALMZMXQCJBXVNH-AYHJJNSGSA-N 2 1 336.882 4.017 20 0 EIADMP CC[C@](C)(NCc1cc(-n2ccnc2)cs1)c1nc(C)cs1 ZINC000344239201 1026171699 /nfs/dbraw/zinc/17/16/99/1026171699.db2.gz YCRHJPZYFRKNRA-INIZCTEOSA-N 2 1 332.498 4.114 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccc4ncccc4c3)C2)CC1 ZINC000512170523 1026211016 /nfs/dbraw/zinc/21/10/16/1026211016.db2.gz SOPWQEOGMADSTI-HXUWFJFHSA-N 2 1 337.511 4.179 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccc4ncccc4c3)C2)CC1 ZINC000512170523 1026211030 /nfs/dbraw/zinc/21/10/30/1026211030.db2.gz SOPWQEOGMADSTI-HXUWFJFHSA-N 2 1 337.511 4.179 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(C3CCC3)cc2)[C@H](C)C1 ZINC000550138373 1026223455 /nfs/dbraw/zinc/22/34/55/1026223455.db2.gz DKRAVRWHUSBTAN-GCJKJVERSA-N 2 1 344.543 4.181 20 0 EIADMP CCOc1c(Cl)cccc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000582157892 1026273416 /nfs/dbraw/zinc/27/34/16/1026273416.db2.gz GBIVTOKOBZMBKE-UHFFFAOYSA-N 2 1 338.923 4.291 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1OC ZINC000467834281 1026294127 /nfs/dbraw/zinc/29/41/27/1026294127.db2.gz IEFSAHODHCTBLJ-FGTMMUONSA-N 2 1 348.531 4.113 20 0 EIADMP CC[C@@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)c1cccs1 ZINC000162746956 1026303303 /nfs/dbraw/zinc/30/33/03/1026303303.db2.gz LHPYFNDBLMFYKD-QGZVFWFLSA-N 2 1 347.528 4.306 20 0 EIADMP Clc1ccc([C@@H]2C[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167982175 1026388556 /nfs/dbraw/zinc/38/85/56/1026388556.db2.gz ZLDWSDAWESBIHG-HLKUOHOZSA-N 2 1 330.903 4.191 20 0 EIADMP CC[N@H+](CCCc1c[nH+]cn1C)Cc1ccc(Cl)c(Cl)c1 ZINC000582309217 1026432883 /nfs/dbraw/zinc/43/28/83/1026432883.db2.gz UGNPOZKNXPFLLT-UHFFFAOYSA-N 2 1 326.271 4.182 20 0 EIADMP CC[N@@H+](CCCc1c[nH+]cn1C)Cc1ccc(Cl)c(Cl)c1 ZINC000582309217 1026432899 /nfs/dbraw/zinc/43/28/99/1026432899.db2.gz UGNPOZKNXPFLLT-UHFFFAOYSA-N 2 1 326.271 4.182 20 0 EIADMP Cc1cc(N2CCC([NH2+]C3CCC(C4CCC4)CC3)CC2)nc(C)[nH+]1 ZINC000657390559 1026445967 /nfs/dbraw/zinc/44/59/67/1026445967.db2.gz XZVXZBVXDCNPKK-UHFFFAOYSA-N 2 1 342.531 4.011 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cc[nH]c32)C1 ZINC000512214513 1026477145 /nfs/dbraw/zinc/47/71/45/1026477145.db2.gz WOIPRMWVYADPDZ-QZTJIDSGSA-N 2 1 325.500 4.254 20 0 EIADMP Fc1ccc(F)c(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c1 ZINC000432656007 1026683361 /nfs/dbraw/zinc/68/33/61/1026683361.db2.gz LLBJUMPUWKXZHR-SFHVURJKSA-N 2 1 348.462 4.171 20 0 EIADMP Fc1ccc(F)c(C[N@@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c1 ZINC000432656007 1026683370 /nfs/dbraw/zinc/68/33/70/1026683370.db2.gz LLBJUMPUWKXZHR-SFHVURJKSA-N 2 1 348.462 4.171 20 0 EIADMP Fc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1-c1cccs1 ZINC000391397340 1026752506 /nfs/dbraw/zinc/75/25/06/1026752506.db2.gz NGACIKXWBJKFLW-JKSUJKDBSA-N 2 1 330.472 4.271 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)c1ccccn1 ZINC000159212828 1026779932 /nfs/dbraw/zinc/77/99/32/1026779932.db2.gz RXSQKRMFTYRBAE-KRWDZBQOSA-N 2 1 335.451 4.157 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+][C@@H](c4cccnc4)C4CC4)[C@@H]3C2)cc1 ZINC000507463487 1026803612 /nfs/dbraw/zinc/80/36/12/1026803612.db2.gz UCGSBTBJCOGUAY-GSPCLOLRSA-N 2 1 347.506 4.033 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH+]2CCC(c3[nH]cc[nH+]3)CC2)o1 ZINC000512365280 1026807885 /nfs/dbraw/zinc/80/78/85/1026807885.db2.gz VOULUOXGOMEYNF-UHFFFAOYSA-N 2 1 339.414 4.497 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@H]1CCCOC1 ZINC000507491681 1026817014 /nfs/dbraw/zinc/81/70/14/1026817014.db2.gz CERWUDJOKKPDPX-MOXWOTFGSA-N 2 1 344.543 4.069 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCCOC1 ZINC000507513047 1026822119 /nfs/dbraw/zinc/82/21/19/1026822119.db2.gz QNKHQFOOXBDKMS-WEMPKCCASA-N 2 1 344.543 4.069 20 0 EIADMP C[C@H]([NH2+]C1(C[NH2+][C@@H](C)[C@H]2CCCOC2)CCCC1)c1ccccc1 ZINC000507533200 1026823753 /nfs/dbraw/zinc/82/37/53/1026823753.db2.gz NPUBOLSZZXUYTE-BJLQDIEVSA-N 2 1 330.516 4.055 20 0 EIADMP C[C@@H](Cc1ccsc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000582586268 1026834763 /nfs/dbraw/zinc/83/47/63/1026834763.db2.gz LHWAMJVGWAAZDD-DVWBAYGPSA-N 2 1 340.536 4.464 20 0 EIADMP Cc1cc(C)cc([C@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)c1 ZINC000152812672 1026853589 /nfs/dbraw/zinc/85/35/89/1026853589.db2.gz TVUJWFJARVIHIZ-IBGZPJMESA-N 2 1 337.511 4.056 20 0 EIADMP C[C@H]1CC[C@@H]([NH2+]C2CC[NH+](CCc3ccncc3)CC2)c2ccccc21 ZINC000152872127 1026858427 /nfs/dbraw/zinc/85/84/27/1026858427.db2.gz AVNMKKTZVGXIQZ-FDDCHVKYSA-N 2 1 349.522 4.317 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCCc3cccnc32)C[N@H+]1Cc1ccccc1 ZINC000684960979 1026899915 /nfs/dbraw/zinc/89/99/15/1026899915.db2.gz VVQREQUABORPIE-UZKOGDIHSA-N 2 1 349.522 4.349 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1cccc(F)c1 ZINC000188029518 1026941400 /nfs/dbraw/zinc/94/14/00/1026941400.db2.gz VXUSSODYLGGNAM-IBGZPJMESA-N 2 1 327.447 4.239 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]CC2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000117950839 1027027570 /nfs/dbraw/zinc/02/75/70/1027027570.db2.gz GSAPYNXEZCALMP-RDJZCZTQSA-N 2 1 326.406 4.088 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]CC2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000117950839 1027027578 /nfs/dbraw/zinc/02/75/78/1027027578.db2.gz GSAPYNXEZCALMP-RDJZCZTQSA-N 2 1 326.406 4.088 20 0 EIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1cc(Cl)ccc1OC ZINC000164605421 1027049465 /nfs/dbraw/zinc/04/94/65/1027049465.db2.gz GKJZMZJPVKSYCF-KRWDZBQOSA-N 2 1 335.879 4.375 20 0 EIADMP 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 1027164617 /nfs/dbraw/zinc/16/46/17/1027164617.db2.gz SEHWPXBTUMHCPE-VWPFQQQWSA-N 2 1 328.422 4.127 20 0 EIADMP COc1ccc([C@@H](C)[C@H](C)[NH2+]CC[N@H+](C)C2CCCCC2)cc1OC ZINC000474629208 1027337962 /nfs/dbraw/zinc/33/79/62/1027337962.db2.gz CSVUBWNXCXJIII-IRXDYDNUSA-N 2 1 348.531 4.050 20 0 EIADMP COc1ccc([C@@H](C)[C@H](C)[NH2+]CC[N@@H+](C)C2CCCCC2)cc1OC ZINC000474629208 1027337978 /nfs/dbraw/zinc/33/79/78/1027337978.db2.gz CSVUBWNXCXJIII-IRXDYDNUSA-N 2 1 348.531 4.050 20 0 EIADMP CO[C@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(C)(C)C ZINC000520262622 1027370608 /nfs/dbraw/zinc/37/06/08/1027370608.db2.gz PCCGHGNNFCFVKQ-SOAGJPPSSA-N 2 1 332.532 4.080 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1cccc(Cl)c1 ZINC000112517448 1027581281 /nfs/dbraw/zinc/58/12/81/1027581281.db2.gz IJMGHVVWWAHMFC-INIZCTEOSA-N 2 1 344.886 4.023 20 0 EIADMP COc1ccc(F)cc1C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000560848122 1027585489 /nfs/dbraw/zinc/58/54/89/1027585489.db2.gz SBIMSDRWWNYWJJ-UHFFFAOYSA-N 2 1 342.458 4.110 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)C1CCSCC1 ZINC000474879489 1027709981 /nfs/dbraw/zinc/70/99/81/1027709981.db2.gz QSEBCSBXVSYDQW-CMKODMSKSA-N 2 1 346.584 4.408 20 0 EIADMP CCOC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000474874640 1027717534 /nfs/dbraw/zinc/71/75/34/1027717534.db2.gz BVESUQMUTGBEAR-FKVLARQCSA-N 2 1 344.543 4.082 20 0 EIADMP CC(F)(F)CCC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167648719 1027850935 /nfs/dbraw/zinc/85/09/35/1027850935.db2.gz XLXFZCVLFLCJPK-OALUTQOASA-N 2 1 336.470 4.408 20 0 EIADMP CC(F)(F)CCC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001167648719 1027850937 /nfs/dbraw/zinc/85/09/37/1027850937.db2.gz XLXFZCVLFLCJPK-OALUTQOASA-N 2 1 336.470 4.408 20 0 EIADMP CC(F)(F)CCC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001167648719 1027850942 /nfs/dbraw/zinc/85/09/42/1027850942.db2.gz XLXFZCVLFLCJPK-OALUTQOASA-N 2 1 336.470 4.408 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@H](C)CCc2cccc(C(F)(F)F)c2)C1 ZINC000583052208 1027903925 /nfs/dbraw/zinc/90/39/25/1027903925.db2.gz XZOKBYUPMBPEDD-WBVHZDCISA-N 2 1 342.449 4.346 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000548786379 1027932924 /nfs/dbraw/zinc/93/29/24/1027932924.db2.gz UQZZIFGAYMJBOR-INIZCTEOSA-N 2 1 344.449 4.028 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188657912 1028014376 /nfs/dbraw/zinc/01/43/76/1028014376.db2.gz FWUYJXWUEOMHOY-JKIFEVAISA-N 2 1 340.433 4.055 20 0 EIADMP COC1CCC([NH2+]CC2([N@H+](C)Cc3ccccc3)CCCCC2)CC1 ZINC000714220368 1028109160 /nfs/dbraw/zinc/10/91/60/1028109160.db2.gz MVAVGIXDBBLEFI-UHFFFAOYSA-N 2 1 344.543 4.369 20 0 EIADMP COC1CCC([NH2+]CC2([N@@H+](C)Cc3ccccc3)CCCCC2)CC1 ZINC000714220368 1028109177 /nfs/dbraw/zinc/10/91/77/1028109177.db2.gz MVAVGIXDBBLEFI-UHFFFAOYSA-N 2 1 344.543 4.369 20 0 EIADMP CCc1cnc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)s1 ZINC000346145554 1028281883 /nfs/dbraw/zinc/28/18/83/1028281883.db2.gz SQZBMENMUOGRIJ-UHFFFAOYSA-N 2 1 343.540 4.050 20 0 EIADMP CCc1cnc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)s1 ZINC000346145554 1028281897 /nfs/dbraw/zinc/28/18/97/1028281897.db2.gz SQZBMENMUOGRIJ-UHFFFAOYSA-N 2 1 343.540 4.050 20 0 EIADMP CCC[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@H]1CCc2ccccc21 ZINC000346136971 1028290682 /nfs/dbraw/zinc/29/06/82/1028290682.db2.gz QBDKBGWUPDVCEZ-QFIPXVFZSA-N 2 1 346.478 4.475 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)C1CCC(F)CC1 ZINC000657743850 1028329257 /nfs/dbraw/zinc/32/92/57/1028329257.db2.gz KYGHENMWORJIBD-KKXNLOMOSA-N 2 1 332.507 4.200 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)Cc1ccccc1C(F)(F)F ZINC000281010431 1028337016 /nfs/dbraw/zinc/33/70/16/1028337016.db2.gz YOEIJBFSTVOENS-AWEZNQCLSA-N 2 1 339.405 4.211 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)o1 ZINC000162794086 1028364786 /nfs/dbraw/zinc/36/47/86/1028364786.db2.gz TWGSPEIBIKSJHP-HNNXBMFYSA-N 2 1 345.487 4.010 20 0 EIADMP C[N@@H+](CCCCOC(C)(C)C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000475048590 1028416654 /nfs/dbraw/zinc/41/66/54/1028416654.db2.gz IDKRSYOXVRRCRN-FQEVSTJZSA-N 2 1 332.532 4.036 20 0 EIADMP C[NH+](CCCCOC(C)(C)C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475048590 1028416663 /nfs/dbraw/zinc/41/66/63/1028416663.db2.gz IDKRSYOXVRRCRN-FQEVSTJZSA-N 2 1 332.532 4.036 20 0 EIADMP C[NH+](CCCCOC(C)(C)C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475048590 1028416668 /nfs/dbraw/zinc/41/66/68/1028416668.db2.gz IDKRSYOXVRRCRN-FQEVSTJZSA-N 2 1 332.532 4.036 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cccc3cccnc32)CC[N@@H+]1Cc1ccccc1 ZINC000080338935 1028714155 /nfs/dbraw/zinc/71/41/55/1028714155.db2.gz IGFJWDKCVHPEHE-PGRDOPGGSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2cccc3cccnc32)CC[N@H+]1Cc1ccccc1 ZINC000080338935 1028714174 /nfs/dbraw/zinc/71/41/74/1028714174.db2.gz IGFJWDKCVHPEHE-PGRDOPGGSA-N 2 1 345.490 4.378 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCOc2ccc3ccccc3c2)CC1 ZINC000524156222 1028724183 /nfs/dbraw/zinc/72/41/83/1028724183.db2.gz WBGPMFRIXSBTJX-UHFFFAOYSA-N 2 1 340.511 4.271 20 0 EIADMP C[C@@H](CC[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21)[NH+]1CCCCC1 ZINC000346868724 1028803850 /nfs/dbraw/zinc/80/38/50/1028803850.db2.gz CLLIAUIEOVXVDK-PKOBYXMFSA-N 2 1 328.500 4.287 20 0 EIADMP COCC[C@H]1CCCC[N@@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168050430 1028874898 /nfs/dbraw/zinc/87/48/98/1028874898.db2.gz ANHHGSXHRHIYOX-NPDDRXJXSA-N 2 1 344.543 4.319 20 0 EIADMP COCC[C@H]1CCCC[N@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168050430 1028874904 /nfs/dbraw/zinc/87/49/04/1028874904.db2.gz ANHHGSXHRHIYOX-NPDDRXJXSA-N 2 1 344.543 4.319 20 0 EIADMP COCC[C@H]1CCCC[NH+]1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168050430 1028874907 /nfs/dbraw/zinc/87/49/07/1028874907.db2.gz ANHHGSXHRHIYOX-NPDDRXJXSA-N 2 1 344.543 4.319 20 0 EIADMP COCC[C@H]1CCCC[NH+]1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168050430 1028874910 /nfs/dbraw/zinc/87/49/10/1028874910.db2.gz ANHHGSXHRHIYOX-NPDDRXJXSA-N 2 1 344.543 4.319 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(Br)cc1 ZINC000157421968 1029069832 /nfs/dbraw/zinc/06/98/32/1029069832.db2.gz LXWMPXBOUSZSKG-NVGVWMPQSA-N 2 1 331.257 4.245 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(Cl)cc1Cl ZINC000650752515 1029137995 /nfs/dbraw/zinc/13/79/95/1029137995.db2.gz SMPWKJRMKLZMNZ-SNVBAGLBSA-N 2 1 327.230 4.442 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@H](c3ccncc3)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168053361 1029159911 /nfs/dbraw/zinc/15/99/11/1029159911.db2.gz OCGOLJUOUGSCFN-YDLSIGKMSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@H](c3ccncc3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053361 1029159913 /nfs/dbraw/zinc/15/99/13/1029159913.db2.gz OCGOLJUOUGSCFN-YDLSIGKMSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3ccncc3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053361 1029159915 /nfs/dbraw/zinc/15/99/15/1029159915.db2.gz OCGOLJUOUGSCFN-YDLSIGKMSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000511244939 1029254438 /nfs/dbraw/zinc/25/44/38/1029254438.db2.gz XDDLYRHBZQWAPK-SYNHAJSKSA-N 2 1 344.524 4.057 20 0 EIADMP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000511244939 1029254455 /nfs/dbraw/zinc/25/44/55/1029254455.db2.gz XDDLYRHBZQWAPK-SYNHAJSKSA-N 2 1 344.524 4.057 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCOC2CCCCCC2)C1 ZINC000524892634 1029298599 /nfs/dbraw/zinc/29/85/99/1029298599.db2.gz XXUALWYLMPJARX-PMACEKPBSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCOC2CCCCCC2)C1 ZINC000524892634 1029298614 /nfs/dbraw/zinc/29/86/14/1029298614.db2.gz XXUALWYLMPJARX-PMACEKPBSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCOC2CCCCCC2)C1 ZINC000524892634 1029298629 /nfs/dbraw/zinc/29/86/29/1029298629.db2.gz XXUALWYLMPJARX-PMACEKPBSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCOC2CCCCCC2)C1 ZINC000524892634 1029298646 /nfs/dbraw/zinc/29/86/46/1029298646.db2.gz XXUALWYLMPJARX-PMACEKPBSA-N 2 1 336.564 4.312 20 0 EIADMP CCSc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)ccn1 ZINC000427887058 1029330696 /nfs/dbraw/zinc/33/06/96/1029330696.db2.gz RWZQORHETUEZMO-QFBILLFUSA-N 2 1 347.572 4.326 20 0 EIADMP Cc1ncccc1C[N@@H+](C)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060243 1029470173 /nfs/dbraw/zinc/47/01/73/1029470173.db2.gz VZWIIVAXJCIOAN-ROUUACIJSA-N 2 1 337.511 4.263 20 0 EIADMP Cc1ncccc1C[N@H+](C)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168060243 1029470182 /nfs/dbraw/zinc/47/01/82/1029470182.db2.gz VZWIIVAXJCIOAN-ROUUACIJSA-N 2 1 337.511 4.263 20 0 EIADMP C[C@@H]1[C@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000475278836 1029484215 /nfs/dbraw/zinc/48/42/15/1029484215.db2.gz XFRGCHVCJFGVPL-VOFXCDAESA-N 2 1 334.507 4.290 20 0 EIADMP C[N@@H+](CCCCOC(C)(C)C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000475322301 1029519179 /nfs/dbraw/zinc/51/91/79/1029519179.db2.gz ARWGBQMEIYVHMS-UHFFFAOYSA-N 2 1 347.547 4.215 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000508570760 1029535225 /nfs/dbraw/zinc/53/52/25/1029535225.db2.gz RVYQISPHQSKADU-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000508570760 1029535234 /nfs/dbraw/zinc/53/52/34/1029535234.db2.gz RVYQISPHQSKADU-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000508570760 1029535241 /nfs/dbraw/zinc/53/52/41/1029535241.db2.gz RVYQISPHQSKADU-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000508570760 1029535249 /nfs/dbraw/zinc/53/52/49/1029535249.db2.gz RVYQISPHQSKADU-SFHVURJKSA-N 2 1 338.495 4.136 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3occc32)[C@@H]1c1cccs1 ZINC000192899068 1029633173 /nfs/dbraw/zinc/63/31/73/1029633173.db2.gz KHYZQUPVYKTBOW-IDHHARJASA-N 2 1 330.497 4.391 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3occc32)[C@@H]1c1cccs1 ZINC000192899068 1029633177 /nfs/dbraw/zinc/63/31/77/1029633177.db2.gz KHYZQUPVYKTBOW-IDHHARJASA-N 2 1 330.497 4.391 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)C(C)(C)C(F)F)cc1F ZINC000657852485 1029809373 /nfs/dbraw/zinc/80/93/73/1029809373.db2.gz USLYMGMBZFZXAW-NSHDSACASA-N 2 1 325.378 4.089 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2COc3ccc(C)cc32)cc1 ZINC000090452397 1029860658 /nfs/dbraw/zinc/86/06/58/1029860658.db2.gz CFPQSIQHAQRLES-MGPUTAFESA-N 2 1 333.435 4.273 20 0 EIADMP CC[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@H](C)Cc1ccsc1 ZINC000428476863 1029943885 /nfs/dbraw/zinc/94/38/85/1029943885.db2.gz YSVGCEXMWMLHSZ-OAHLLOKOSA-N 2 1 340.496 4.090 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccc(F)cn1 ZINC000092746374 1029944142 /nfs/dbraw/zinc/94/41/42/1029944142.db2.gz PVPIIGFIHMYYPB-QGZVFWFLSA-N 2 1 341.474 4.303 20 0 EIADMP CC[NH+](CC)CCCC1CC[NH+](Cc2csc(C3CC3)n2)CC1 ZINC000182739965 1029982167 /nfs/dbraw/zinc/98/21/67/1029982167.db2.gz KWCOZPFOBKQVTA-UHFFFAOYSA-N 2 1 335.561 4.355 20 0 EIADMP Cc1sccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390640581 1030011635 /nfs/dbraw/zinc/01/16/35/1030011635.db2.gz HAZKXHXZTYYOHF-LJQANCHMSA-N 2 1 328.525 4.447 20 0 EIADMP Cc1sccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390640581 1030011655 /nfs/dbraw/zinc/01/16/55/1030011655.db2.gz HAZKXHXZTYYOHF-LJQANCHMSA-N 2 1 328.525 4.447 20 0 EIADMP Cc1ccc(C)c([C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000392266652 1030077769 /nfs/dbraw/zinc/07/77/69/1030077769.db2.gz OQQNUZCYDRYQMX-WMZHIEFXSA-N 2 1 334.507 4.467 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(C(F)F)nc2)c1 ZINC000657872236 1030089450 /nfs/dbraw/zinc/08/94/50/1030089450.db2.gz PNQFDQSCILELDG-AWEZNQCLSA-N 2 1 333.426 4.322 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447522307 1030116274 /nfs/dbraw/zinc/11/62/74/1030116274.db2.gz QDISWBXQPROLSE-AYWYSENESA-N 2 1 338.495 4.386 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)[C@@H](C)c1nc2ccccc2s1 ZINC000121472913 1030121609 /nfs/dbraw/zinc/12/16/09/1030121609.db2.gz CJEHZSJWGWLJNW-RBSFLKMASA-N 2 1 342.512 4.219 20 0 EIADMP CCOC1CCC([NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)CC1 ZINC000657885661 1030184110 /nfs/dbraw/zinc/18/41/10/1030184110.db2.gz BFGFRVNBDTUSJL-BOMAWHNGSA-N 2 1 336.545 4.068 20 0 EIADMP CCOC1CCC([NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CC1 ZINC000657885661 1030184118 /nfs/dbraw/zinc/18/41/18/1030184118.db2.gz BFGFRVNBDTUSJL-BOMAWHNGSA-N 2 1 336.545 4.068 20 0 EIADMP C[N@@H+](Cc1ccc(-c2ccccc2F)s1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000470008224 1030231760 /nfs/dbraw/zinc/23/17/60/1030231760.db2.gz HJMDLJUNPRUAON-YIONKMFJSA-N 2 1 330.472 4.269 20 0 EIADMP Cc1ccc([C@@H](Cc2ccccc2)[NH2+]CCc2c[nH+]cn2C)cc1C ZINC000530407446 1030381600 /nfs/dbraw/zinc/38/16/00/1030381600.db2.gz ZRRTWOMHYPTLFD-JOCHJYFZSA-N 2 1 333.479 4.153 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000708566641 1030384450 /nfs/dbraw/zinc/38/44/50/1030384450.db2.gz RHWMYNHBYYZAGA-WAOWUJCRSA-N 2 1 340.486 4.114 20 0 EIADMP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(c2ccc(F)cc2)CC1 ZINC001168169308 1030452622 /nfs/dbraw/zinc/45/26/22/1030452622.db2.gz WYJWUNNWEZORNB-OAHLLOKOSA-N 2 1 346.877 4.360 20 0 EIADMP C[C@H](C[NH2+][C@H](C)c1ccccc1OC(F)F)C[NH+]1CCCCC1 ZINC000321694074 1030518874 /nfs/dbraw/zinc/51/88/74/1030518874.db2.gz YUZDMJCHFQLNFL-HUUCEWRRSA-N 2 1 326.431 4.061 20 0 EIADMP COC[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccc(Cl)c1 ZINC000685645165 1030615955 /nfs/dbraw/zinc/61/59/55/1030615955.db2.gz KLIOHYXLUTZTLB-LPHOPBHVSA-N 2 1 338.923 4.129 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(OCc3ccccc3)cc2)CC[N@@H+]1C ZINC000530666082 1030623940 /nfs/dbraw/zinc/62/39/40/1030623940.db2.gz SANQCXAFOLTDLP-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(OCc3ccccc3)cc2)CC[N@H+]1C ZINC000530666082 1030623954 /nfs/dbraw/zinc/62/39/54/1030623954.db2.gz SANQCXAFOLTDLP-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(OCc3ccccc3)cc2)CC[NH+]1C ZINC000530666082 1030623971 /nfs/dbraw/zinc/62/39/71/1030623971.db2.gz SANQCXAFOLTDLP-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(OCc3ccccc3)cc2)CC[NH+]1C ZINC000530666082 1030623980 /nfs/dbraw/zinc/62/39/80/1030623980.db2.gz SANQCXAFOLTDLP-WIYYLYMNSA-N 2 1 338.495 4.180 20 0 EIADMP CCOc1ccccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398026960 1030684733 /nfs/dbraw/zinc/68/47/33/1030684733.db2.gz CPJUQOZVXCPTBP-RXVVDRJESA-N 2 1 338.495 4.086 20 0 EIADMP CCOc1ccccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398026960 1030684747 /nfs/dbraw/zinc/68/47/47/1030684747.db2.gz CPJUQOZVXCPTBP-RXVVDRJESA-N 2 1 338.495 4.086 20 0 EIADMP Cc1cc(F)ccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398051032 1030692870 /nfs/dbraw/zinc/69/28/70/1030692870.db2.gz XSMZPGYZINEKAE-LAUBAEHRSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1cc(F)ccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398051033 1030694848 /nfs/dbraw/zinc/69/48/48/1030694848.db2.gz XSMZPGYZINEKAE-UTKZUKDTSA-N 2 1 326.459 4.134 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000398133016 1030710735 /nfs/dbraw/zinc/71/07/35/1030710735.db2.gz KDLIBUYHNUNNGB-UWJYYQICSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3c(F)cccc3F)o2)CCN1C ZINC000093644177 1030741159 /nfs/dbraw/zinc/74/11/59/1030741159.db2.gz KJHJAGJMJGFZQR-ZIAGYGMSSA-N 2 1 334.410 4.139 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccc(C(F)F)nc1 ZINC000658041826 1030793362 /nfs/dbraw/zinc/79/33/62/1030793362.db2.gz JCVLEWJOVVTAMN-OLMNPRSZSA-N 2 1 345.437 4.015 20 0 EIADMP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccncc2Cl)C1 ZINC000527638922 1030794126 /nfs/dbraw/zinc/79/41/26/1030794126.db2.gz PCZZOYDBURDTGY-INIZCTEOSA-N 2 1 343.902 4.257 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2ccncc2Cl)C1 ZINC000527638922 1030794149 /nfs/dbraw/zinc/79/41/49/1030794149.db2.gz PCZZOYDBURDTGY-INIZCTEOSA-N 2 1 343.902 4.257 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21)c1ccccn1 ZINC000658066536 1030813186 /nfs/dbraw/zinc/81/31/86/1030813186.db2.gz MJXQFIANKRHLSJ-MBWHEUGSSA-N 2 1 349.522 4.218 20 0 EIADMP C[C@]1(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1(F)F ZINC000658223150 1030885025 /nfs/dbraw/zinc/88/50/25/1030885025.db2.gz SPHGYKJKOYLGLR-OKYOBFRVSA-N 2 1 334.454 4.207 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CCc4ccc(O)cc43)CC2)C1 ZINC000658241842 1030899678 /nfs/dbraw/zinc/89/96/78/1030899678.db2.gz VUAVROFXFMIZIT-FPDPHYFHSA-N 2 1 328.500 4.012 20 0 EIADMP C[C@@H]([NH2+]C1CCC2(CC2(F)F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000658265791 1030920685 /nfs/dbraw/zinc/92/06/85/1030920685.db2.gz PXOAUMDXURDDIG-HSFDUWRESA-N 2 1 348.481 4.455 20 0 EIADMP C[C@@H](Cc1ccoc1)[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658317263 1030979843 /nfs/dbraw/zinc/97/98/43/1030979843.db2.gz KBPMAQSBOBACFD-GHTZIAJQSA-N 2 1 338.495 4.103 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+](CCC)CC2)cc1OC ZINC000532454304 1031088806 /nfs/dbraw/zinc/08/88/06/1031088806.db2.gz KTSPRYXUWOBTCX-KRWDZBQOSA-N 2 1 348.531 4.399 20 0 EIADMP C[N@H+]1CC[C@@H](NCc2cnc3ccccc3c2)C[C@H]1c1ccccc1 ZINC000340209148 1031190192 /nfs/dbraw/zinc/19/01/92/1031190192.db2.gz IIIHEBRETUKJOW-IRLDBZIGSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cnc3ccccc3c2)C[C@H]1c1ccccc1 ZINC000340209148 1031190204 /nfs/dbraw/zinc/19/02/04/1031190204.db2.gz IIIHEBRETUKJOW-IRLDBZIGSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2cnc3ccccc3c2)C[C@H]1c1ccccc1 ZINC000340209148 1031190219 /nfs/dbraw/zinc/19/02/19/1031190219.db2.gz IIIHEBRETUKJOW-IRLDBZIGSA-N 2 1 331.463 4.160 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1NCc1ccc(Oc2ccccc2F)c(F)c1 ZINC000532525055 1031242284 /nfs/dbraw/zinc/24/22/84/1031242284.db2.gz QKXOIJYFANKAIF-RDTXWAMCSA-N 2 1 346.421 4.187 20 0 EIADMP C[C@@H]1CN(C)CC[C@H]1[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000532525055 1031242301 /nfs/dbraw/zinc/24/23/01/1031242301.db2.gz QKXOIJYFANKAIF-RDTXWAMCSA-N 2 1 346.421 4.187 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000532525055 1031242312 /nfs/dbraw/zinc/24/23/12/1031242312.db2.gz QKXOIJYFANKAIF-RDTXWAMCSA-N 2 1 346.421 4.187 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000532525055 1031242353 /nfs/dbraw/zinc/24/23/53/1031242353.db2.gz QKXOIJYFANKAIF-RDTXWAMCSA-N 2 1 346.421 4.187 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@H](C)[C@H](C)c3ccccc3)CCCC2)CC1 ZINC000532514294 1031247064 /nfs/dbraw/zinc/24/70/64/1031247064.db2.gz GIXISHXEKCNYDD-RBUKOAKNSA-N 2 1 344.543 4.192 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000531535470 1031340084 /nfs/dbraw/zinc/34/00/84/1031340084.db2.gz WGLPUHUVVGOTQI-GOSISDBHSA-N 2 1 338.495 4.184 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000531535470 1031340100 /nfs/dbraw/zinc/34/01/00/1031340100.db2.gz WGLPUHUVVGOTQI-GOSISDBHSA-N 2 1 338.495 4.184 20 0 EIADMP C[C@H](CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044071 1031394991 /nfs/dbraw/zinc/39/49/91/1031394991.db2.gz BJUZQIUZIQVOAR-STXHMFSFSA-N 2 1 334.454 4.017 20 0 EIADMP C[C@H](C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044071 1031395014 /nfs/dbraw/zinc/39/50/14/1031395014.db2.gz BJUZQIUZIQVOAR-STXHMFSFSA-N 2 1 334.454 4.017 20 0 EIADMP C[C@H](C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044071 1031395031 /nfs/dbraw/zinc/39/50/31/1031395031.db2.gz BJUZQIUZIQVOAR-STXHMFSFSA-N 2 1 334.454 4.017 20 0 EIADMP C[C@H](CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044070 1031396552 /nfs/dbraw/zinc/39/65/52/1031396552.db2.gz BJUZQIUZIQVOAR-SIFCLUCFSA-N 2 1 334.454 4.017 20 0 EIADMP C[C@H](C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044070 1031396560 /nfs/dbraw/zinc/39/65/60/1031396560.db2.gz BJUZQIUZIQVOAR-SIFCLUCFSA-N 2 1 334.454 4.017 20 0 EIADMP C[C@H](C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044070 1031396571 /nfs/dbraw/zinc/39/65/71/1031396571.db2.gz BJUZQIUZIQVOAR-SIFCLUCFSA-N 2 1 334.454 4.017 20 0 EIADMP Clc1ccc(C2=CC[C@H]([NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000449074348 1031426494 /nfs/dbraw/zinc/42/64/94/1031426494.db2.gz KPBATSWRXUUFFB-KXBFYZLASA-N 2 1 330.903 4.350 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000532626171 1031443683 /nfs/dbraw/zinc/44/36/83/1031443683.db2.gz MCVBXDINYMBSLK-IAGOWNOFSA-N 2 1 343.540 4.350 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000532626171 1031443685 /nfs/dbraw/zinc/44/36/85/1031443685.db2.gz MCVBXDINYMBSLK-IAGOWNOFSA-N 2 1 343.540 4.350 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000532626171 1031443691 /nfs/dbraw/zinc/44/36/91/1031443691.db2.gz MCVBXDINYMBSLK-IAGOWNOFSA-N 2 1 343.540 4.350 20 0 EIADMP Clc1ccc(C2=CC[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000449089123 1031450338 /nfs/dbraw/zinc/45/03/38/1031450338.db2.gz JICCKKQQTOBXDY-ZCNNSNEGSA-N 2 1 330.903 4.492 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2cnc(-c3ccccc3F)s2)C1 ZINC000449131038 1031467420 /nfs/dbraw/zinc/46/74/20/1031467420.db2.gz JSJPXMNQRGWPEV-HNNXBMFYSA-N 2 1 347.503 4.159 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2cnc(-c3ccccc3F)s2)C1 ZINC000449131038 1031467428 /nfs/dbraw/zinc/46/74/28/1031467428.db2.gz JSJPXMNQRGWPEV-HNNXBMFYSA-N 2 1 347.503 4.159 20 0 EIADMP C[C@@H]([NH2+]C1(C[NH2+][C@H]2CCOC3(CCC3)C2)CCCC1)c1ccccc1 ZINC000449154732 1031483864 /nfs/dbraw/zinc/48/38/64/1031483864.db2.gz JJLDQHRMQUNESO-QUCCMNQESA-N 2 1 342.527 4.341 20 0 EIADMP COc1cc(F)cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1 ZINC000449159599 1031487545 /nfs/dbraw/zinc/48/75/45/1031487545.db2.gz HPGBTQXJUOGYQK-KXBFYZLASA-N 2 1 348.487 4.069 20 0 EIADMP COc1cc(F)cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000449159599 1031487556 /nfs/dbraw/zinc/48/75/56/1031487556.db2.gz HPGBTQXJUOGYQK-KXBFYZLASA-N 2 1 348.487 4.069 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3cc(OC)ccc32)c1 ZINC000123983142 1031497217 /nfs/dbraw/zinc/49/72/17/1031497217.db2.gz REQCLAOAXXXZQI-JOCHJYFZSA-N 2 1 338.495 4.314 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449165878 1031508115 /nfs/dbraw/zinc/50/81/15/1031508115.db2.gz XXYOYJHCJCKUNE-UHFFFAOYSA-N 3 1 348.579 4.241 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccnn2C2CCCC2)cc1 ZINC000449185014 1031523315 /nfs/dbraw/zinc/52/33/15/1031523315.db2.gz HAVWEEPDAYJKHC-INIZCTEOSA-N 2 1 349.482 4.343 20 0 EIADMP CN(Cc1cnc(-c2ccccc2F)s1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000449321377 1031634596 /nfs/dbraw/zinc/63/45/96/1031634596.db2.gz LRBZTLLRPBBZOZ-YIONKMFJSA-N 2 1 345.487 4.006 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)c2ccccn2)CC[N@@H+]1Cc1ccccc1 ZINC000449399225 1031704952 /nfs/dbraw/zinc/70/49/52/1031704952.db2.gz YTJBVJYGUFZZGF-AZUAARDMSA-N 2 1 337.511 4.002 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)c2ccccn2)CC[N@H+]1Cc1ccccc1 ZINC000449399225 1031704968 /nfs/dbraw/zinc/70/49/68/1031704968.db2.gz YTJBVJYGUFZZGF-AZUAARDMSA-N 2 1 337.511 4.002 20 0 EIADMP CC(C)[C@@H]1C[C@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000449493653 1031787896 /nfs/dbraw/zinc/78/78/96/1031787896.db2.gz LXIPYKOQZGAACF-PDGJWGCVSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000449493653 1031787909 /nfs/dbraw/zinc/78/79/09/1031787909.db2.gz LXIPYKOQZGAACF-PDGJWGCVSA-N 2 1 344.543 4.080 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCCC2CCOCC2)CC1 ZINC000453243245 1031799616 /nfs/dbraw/zinc/79/96/16/1031799616.db2.gz YVQOARCLAZCDOH-UHFFFAOYSA-N 2 1 344.543 4.226 20 0 EIADMP Cc1cc(Cl)ccc1C1=CC[N@H+](CCCc2c[nH+]cn2C)CC1 ZINC000528743200 1031820276 /nfs/dbraw/zinc/82/02/76/1031820276.db2.gz RKMGNQNZSNXISG-UHFFFAOYSA-N 2 1 329.875 4.104 20 0 EIADMP Cc1cc(Cl)ccc1C1=CC[N@@H+](CCCc2c[nH+]cn2C)CC1 ZINC000528743200 1031820288 /nfs/dbraw/zinc/82/02/88/1031820288.db2.gz RKMGNQNZSNXISG-UHFFFAOYSA-N 2 1 329.875 4.104 20 0 EIADMP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000449560108 1031847427 /nfs/dbraw/zinc/84/74/27/1031847427.db2.gz GEUWPKXYXNJYOZ-NIZIRCGXSA-N 2 1 342.527 4.325 20 0 EIADMP COc1ccc2oc([C@H](C)NC3C[C@H]4CC[C@@H](C3)[N@@H+]4C)c(C)c2c1 ZINC000453341978 1031868221 /nfs/dbraw/zinc/86/82/21/1031868221.db2.gz HVXUUJJGPJMZJP-HNSVSWJLSA-N 2 1 328.456 4.026 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)c(C)c2c1 ZINC000453341978 1031868231 /nfs/dbraw/zinc/86/82/31/1031868231.db2.gz HVXUUJJGPJMZJP-HNSVSWJLSA-N 2 1 328.456 4.026 20 0 EIADMP CC[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000531967858 1031888667 /nfs/dbraw/zinc/88/86/67/1031888667.db2.gz ZJNNTKHMSBGNEZ-LXZKKBNFSA-N 2 1 328.422 4.476 20 0 EIADMP CC[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000531967858 1031888668 /nfs/dbraw/zinc/88/86/68/1031888668.db2.gz ZJNNTKHMSBGNEZ-LXZKKBNFSA-N 2 1 328.422 4.476 20 0 EIADMP COc1ccc([C@@H](CCC(C)C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000453363559 1031903897 /nfs/dbraw/zinc/90/38/97/1031903897.db2.gz RRFTVQNVIXLPME-SMLSOGCJSA-N 2 1 330.516 4.387 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000531993449 1031961247 /nfs/dbraw/zinc/96/12/47/1031961247.db2.gz REIDHIUROASVGN-XGRCMKMKSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000531993449 1031961259 /nfs/dbraw/zinc/96/12/59/1031961259.db2.gz REIDHIUROASVGN-XGRCMKMKSA-N 2 1 338.470 4.313 20 0 EIADMP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH2+]CC4CCSCC4)[C@@H]3C2)cc1 ZINC000512612349 1033491575 /nfs/dbraw/zinc/49/15/75/1033491575.db2.gz OMBCFARABUWQKZ-PWRODBHTSA-N 2 1 344.568 4.020 20 0 EIADMP CCc1nocc1C[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000645146260 1033829946 /nfs/dbraw/zinc/82/99/46/1033829946.db2.gz DSZLDWAGAQANJK-CALCHBBNSA-N 2 1 341.499 4.005 20 0 EIADMP Cc1nccn1CCC[N@H+](C)[C@H](C)c1nc2ccccc2n1C(F)F ZINC000411403182 1033882480 /nfs/dbraw/zinc/88/24/80/1033882480.db2.gz VUZKSRKVSHIELL-CYBMUJFWSA-N 2 1 347.413 4.019 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1nc2ccccc2n1C(F)F ZINC000411403182 1033882486 /nfs/dbraw/zinc/88/24/86/1033882486.db2.gz VUZKSRKVSHIELL-CYBMUJFWSA-N 2 1 347.413 4.019 20 0 EIADMP COc1cc(-c2ccccc2)ccc1CN(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000512774655 1033907011 /nfs/dbraw/zinc/90/70/11/1033907011.db2.gz YUTVMOZOYAHDGY-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+]CCCn1cc[nH+]c1C ZINC000513104585 1034583562 /nfs/dbraw/zinc/58/35/62/1034583562.db2.gz KTTUTENNJIJLIY-UHFFFAOYSA-N 2 1 325.456 4.460 20 0 EIADMP C[N@@H+](CCc1cc(Cl)cc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513127299 1034604568 /nfs/dbraw/zinc/60/45/68/1034604568.db2.gz GDIUIEAZMWNHLI-SJPCQFCGSA-N 2 1 327.299 4.093 20 0 EIADMP C[NH+](CCc1cc(Cl)cc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000513127299 1034604576 /nfs/dbraw/zinc/60/45/76/1034604576.db2.gz GDIUIEAZMWNHLI-SJPCQFCGSA-N 2 1 327.299 4.093 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000246556143 1034853503 /nfs/dbraw/zinc/85/35/03/1034853503.db2.gz WWXNLJCOCVAESK-SFTDATJTSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccsc1C[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513495370 1034986667 /nfs/dbraw/zinc/98/66/67/1034986667.db2.gz OWKUOZIHKDCVIU-FUHWJXTLSA-N 2 1 344.524 4.147 20 0 EIADMP COc1ccsc1C[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513495372 1034986698 /nfs/dbraw/zinc/98/66/98/1034986698.db2.gz OWKUOZIHKDCVIU-WMZOPIPTSA-N 2 1 344.524 4.147 20 0 EIADMP COc1ccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000513513007 1035008298 /nfs/dbraw/zinc/00/82/98/1035008298.db2.gz QZNFYGCYPMSIMR-GHTZIAJQSA-N 2 1 338.495 4.086 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000501380187 1035430325 /nfs/dbraw/zinc/43/03/25/1035430325.db2.gz CUIZLRKKNOWIDT-YVGNARHYSA-N 2 1 338.417 4.183 20 0 EIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501417425 1035439947 /nfs/dbraw/zinc/43/99/47/1035439947.db2.gz AYCWEIYDUWCEIA-HBFSDRIKSA-N 2 1 329.532 4.208 20 0 EIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501417425 1035439950 /nfs/dbraw/zinc/43/99/50/1035439950.db2.gz AYCWEIYDUWCEIA-HBFSDRIKSA-N 2 1 329.532 4.208 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000501408071 1035440830 /nfs/dbraw/zinc/44/08/30/1035440830.db2.gz TXJQPTJSMYJFAH-OMCKNOPTSA-N 2 1 338.417 4.325 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420283193 1035498282 /nfs/dbraw/zinc/49/82/82/1035498282.db2.gz BSEMODCKBXHAOC-INWMFGNUSA-N 2 1 347.890 4.424 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420283193 1035498291 /nfs/dbraw/zinc/49/82/91/1035498291.db2.gz BSEMODCKBXHAOC-INWMFGNUSA-N 2 1 347.890 4.424 20 0 EIADMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cc3ccccc3o2)CC1 ZINC000501795528 1035609527 /nfs/dbraw/zinc/60/95/27/1035609527.db2.gz ZDUUNIBXKJUSTL-UHFFFAOYSA-N 2 1 344.499 4.003 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(F)c2ccccc21 ZINC000568768693 1035696249 /nfs/dbraw/zinc/69/62/49/1035696249.db2.gz DRFFOXOECVKAOF-DLBZAZTESA-N 2 1 344.474 4.130 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(F)c2ccccc21 ZINC000568768693 1035696260 /nfs/dbraw/zinc/69/62/60/1035696260.db2.gz DRFFOXOECVKAOF-DLBZAZTESA-N 2 1 344.474 4.130 20 0 EIADMP Oc1cccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1Cl ZINC000646053750 1036116660 /nfs/dbraw/zinc/11/66/60/1036116660.db2.gz CYHFMWXTWAOOLQ-UHFFFAOYSA-N 2 1 336.907 4.134 20 0 EIADMP CC(C)[N@@H+](C)CC1CCN(c2ccnc3cc(Cl)ccc32)CC1 ZINC000601505386 1036121206 /nfs/dbraw/zinc/12/12/06/1036121206.db2.gz HWUMQMYDMITSJC-UHFFFAOYSA-N 2 1 331.891 4.445 20 0 EIADMP CC(C)[N@H+](C)CC1CCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000601505386 1036121219 /nfs/dbraw/zinc/12/12/19/1036121219.db2.gz HWUMQMYDMITSJC-UHFFFAOYSA-N 2 1 331.891 4.445 20 0 EIADMP CC(C)[N@@H+](C)CC1CCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000601505386 1036121259 /nfs/dbraw/zinc/12/12/59/1036121259.db2.gz HWUMQMYDMITSJC-UHFFFAOYSA-N 2 1 331.891 4.445 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2cccc(C3CC3)c2)cc1F ZINC000421319617 1036263263 /nfs/dbraw/zinc/26/32/63/1036263263.db2.gz ANLBOQZHKHXWHL-UHFFFAOYSA-N 2 1 335.426 4.487 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1cnn(C2CCCC2)c1 ZINC000502698435 1036513328 /nfs/dbraw/zinc/51/33/28/1036513328.db2.gz SFYAQHWYKYDODE-KRWDZBQOSA-N 2 1 332.536 4.303 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1cnn(C2CCCC2)c1 ZINC000502698435 1036513353 /nfs/dbraw/zinc/51/33/53/1036513353.db2.gz SFYAQHWYKYDODE-KRWDZBQOSA-N 2 1 332.536 4.303 20 0 EIADMP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165313258 1036774361 /nfs/dbraw/zinc/77/43/61/1036774361.db2.gz PINRHQNEEJFJCZ-HKUYNNGSSA-N 2 1 334.573 4.061 20 0 EIADMP COC1([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)CCCC1 ZINC000421835584 1036794929 /nfs/dbraw/zinc/79/49/29/1036794929.db2.gz PZMVNCQKLWIDBS-XYJFISCASA-N 2 1 336.545 4.068 20 0 EIADMP COC1([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CCCC1 ZINC000421835584 1036794945 /nfs/dbraw/zinc/79/49/45/1036794945.db2.gz PZMVNCQKLWIDBS-XYJFISCASA-N 2 1 336.545 4.068 20 0 EIADMP COC1([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CCCC1 ZINC000421835581 1036799410 /nfs/dbraw/zinc/79/94/10/1036799410.db2.gz PZMVNCQKLWIDBS-BQFCYCMXSA-N 2 1 336.545 4.068 20 0 EIADMP COC1([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CCCC1 ZINC000421835581 1036799429 /nfs/dbraw/zinc/79/94/29/1036799429.db2.gz PZMVNCQKLWIDBS-BQFCYCMXSA-N 2 1 336.545 4.068 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000486719638 1036826332 /nfs/dbraw/zinc/82/63/32/1036826332.db2.gz HMXVBOGXCOTLFH-GDBMZVCRSA-N 2 1 329.463 4.050 20 0 EIADMP COc1cccc(Cl)c1CNCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000237277038 1036841737 /nfs/dbraw/zinc/84/17/37/1036841737.db2.gz APVVABIGEXMQOP-UHFFFAOYSA-N 2 1 346.902 4.479 20 0 EIADMP COc1cccc(Cl)c1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000237277038 1036841745 /nfs/dbraw/zinc/84/17/45/1036841745.db2.gz APVVABIGEXMQOP-UHFFFAOYSA-N 2 1 346.902 4.479 20 0 EIADMP COc1cccc(Cl)c1C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000237277038 1036841752 /nfs/dbraw/zinc/84/17/52/1036841752.db2.gz APVVABIGEXMQOP-UHFFFAOYSA-N 2 1 346.902 4.479 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(OC(F)(F)F)cc1 ZINC000589836069 1036879907 /nfs/dbraw/zinc/87/99/07/1036879907.db2.gz FUQNOVJSRXLHHD-OAHLLOKOSA-N 2 1 344.421 4.329 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2cccc(COc3ccccc3)c2)[C@@H](C)C1 ZINC000469179837 1036880352 /nfs/dbraw/zinc/88/03/52/1036880352.db2.gz YONHYKHNMGEPCT-AVRDEDQJSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]CCCc1c[nH+]cn1C ZINC000569738792 1037022975 /nfs/dbraw/zinc/02/29/75/1037022975.db2.gz ZTOPYDQGYBTPBA-KBPBESRZSA-N 2 1 339.405 4.153 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000271867009 1037041197 /nfs/dbraw/zinc/04/11/97/1037041197.db2.gz LSMOULNSPCTIJP-KRWDZBQOSA-N 2 1 339.508 4.039 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000272048000 1037087165 /nfs/dbraw/zinc/08/71/65/1037087165.db2.gz RIUBIRWGCDJFGR-BDKRGJGYSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000272048000 1037087179 /nfs/dbraw/zinc/08/71/79/1037087179.db2.gz RIUBIRWGCDJFGR-BDKRGJGYSA-N 2 1 344.543 4.223 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000272049383 1037087335 /nfs/dbraw/zinc/08/73/35/1037087335.db2.gz QBUXUTZCMLHOSY-UHFFFAOYSA-N 2 1 331.769 4.044 20 0 EIADMP CC[C@@H]1C[C@H](C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000569860854 1037181954 /nfs/dbraw/zinc/18/19/54/1037181954.db2.gz MSSZQMDBIDHUDI-BHIFYINESA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc2c(c1)COC2 ZINC000272691534 1037269184 /nfs/dbraw/zinc/26/91/84/1037269184.db2.gz PQQGJUYLHSHXRI-BQFCYCMXSA-N 2 1 328.500 4.020 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168418237 1037403986 /nfs/dbraw/zinc/40/39/86/1037403986.db2.gz WOOAPUASKNYOKM-JBACZVJFSA-N 2 1 330.491 4.198 20 0 EIADMP CSc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000573528413 1037562355 /nfs/dbraw/zinc/56/23/55/1037562355.db2.gz AFVFOLAHOFNOGB-YJBOKZPZSA-N 2 1 346.565 4.470 20 0 EIADMP CSc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000573528413 1037562371 /nfs/dbraw/zinc/56/23/71/1037562371.db2.gz AFVFOLAHOFNOGB-YJBOKZPZSA-N 2 1 346.565 4.470 20 0 EIADMP Clc1cccc(Cl)c1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488416765 1037569666 /nfs/dbraw/zinc/56/96/66/1037569666.db2.gz DAVJZNDGLZLWGG-UHFFFAOYSA-N 2 1 327.299 4.301 20 0 EIADMP c1sc(C2CCCCC2)nc1C[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000573497381 1037570319 /nfs/dbraw/zinc/57/03/19/1037570319.db2.gz XJIWWWTYHJCQNP-IRXDYDNUSA-N 2 1 333.545 4.012 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CS1 ZINC000488434921 1037593176 /nfs/dbraw/zinc/59/31/76/1037593176.db2.gz UIGLUWJRYKDCER-LEAZDLGRSA-N 2 1 332.557 4.017 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CS1 ZINC000488434921 1037593182 /nfs/dbraw/zinc/59/31/82/1037593182.db2.gz UIGLUWJRYKDCER-LEAZDLGRSA-N 2 1 332.557 4.017 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CS[C@@H](C(C)(C)C)C2)cc1F ZINC000488434017 1037593498 /nfs/dbraw/zinc/59/34/98/1037593498.db2.gz IITDCFVMKQOGRM-CRAIPNDOSA-N 2 1 347.503 4.330 20 0 EIADMP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000414653265 1037678352 /nfs/dbraw/zinc/67/83/52/1037678352.db2.gz DZPOVSDMMAIABT-KGLIPLIRSA-N 2 1 341.480 4.116 20 0 EIADMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000414653265 1037678364 /nfs/dbraw/zinc/67/83/64/1037678364.db2.gz DZPOVSDMMAIABT-KGLIPLIRSA-N 2 1 341.480 4.116 20 0 EIADMP c1nc([C@H]2CCC[N@H+](CCSC3CCCCC3)C2)n2c1CCCC2 ZINC000503371262 1037711994 /nfs/dbraw/zinc/71/19/94/1037711994.db2.gz HTTVEYFEGLBFRG-KRWDZBQOSA-N 2 1 347.572 4.465 20 0 EIADMP C[C@H]([NH3+])[C@H]1CC[N@@H+](Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000414663838 1037723243 /nfs/dbraw/zinc/72/32/43/1037723243.db2.gz RWETVPMXQOHTNH-RDJZCZTQSA-N 2 1 344.886 4.088 20 0 EIADMP C[C@H](NC(C)(C)C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422733039 1037809531 /nfs/dbraw/zinc/80/95/31/1037809531.db2.gz QLWLXHJNNKYTJB-MJUUVYJYSA-N 2 1 343.559 4.016 20 0 EIADMP C[C@H]([NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1)c1c[nH+]ccc1N ZINC000422776328 1037830696 /nfs/dbraw/zinc/83/06/96/1037830696.db2.gz ACNUJCULIMISKZ-ZDUSSCGKSA-N 2 1 349.400 4.285 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]Cc3ccc(-c4ccncc4)cc3)CC[NH2+]2)cc1 ZINC000422773191 1037831111 /nfs/dbraw/zinc/83/11/11/1037831111.db2.gz TXUVACJESDDCPT-PKTZIBPZSA-N 2 1 343.474 4.332 20 0 EIADMP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000422801911 1037836454 /nfs/dbraw/zinc/83/64/54/1037836454.db2.gz COECIXQKVGXKCO-WDEREUQCSA-N 2 1 343.418 4.044 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CN[C@H]3C[C@@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866969 1037848289 /nfs/dbraw/zinc/84/82/89/1037848289.db2.gz RGZOJHFOMMLFJE-ZQMYSKGWSA-N 2 1 349.522 4.153 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3C[C@@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866969 1037848293 /nfs/dbraw/zinc/84/82/93/1037848293.db2.gz RGZOJHFOMMLFJE-ZQMYSKGWSA-N 3 1 349.522 4.153 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@H]3C[C@@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866969 1037848295 /nfs/dbraw/zinc/84/82/95/1037848295.db2.gz RGZOJHFOMMLFJE-ZQMYSKGWSA-N 3 1 349.522 4.153 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c(OC(C)C)c1 ZINC000422872170 1037857958 /nfs/dbraw/zinc/85/79/58/1037857958.db2.gz GACHLMVMPALSKH-NHCUHLMSSA-N 2 1 338.495 4.365 20 0 EIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cc(Br)ccc32)c2ccccc21 ZINC000422935982 1037873365 /nfs/dbraw/zinc/87/33/65/1037873365.db2.gz LMCZVGPQUQZCLY-KZNAEPCWSA-N 2 1 343.268 4.171 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC000423007047 1037899918 /nfs/dbraw/zinc/89/99/18/1037899918.db2.gz XCIZUZMXZAGSDI-FUAMJQMHSA-N 3 1 349.522 4.022 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2C[C@H](N)c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC000423007047 1037899924 /nfs/dbraw/zinc/89/99/24/1037899924.db2.gz XCIZUZMXZAGSDI-FUAMJQMHSA-N 2 1 349.522 4.022 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2C[C@H](N)c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC000423007047 1037899928 /nfs/dbraw/zinc/89/99/28/1037899928.db2.gz XCIZUZMXZAGSDI-FUAMJQMHSA-N 2 1 349.522 4.022 20 0 EIADMP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000423048938 1037913313 /nfs/dbraw/zinc/91/33/13/1037913313.db2.gz AMHFKNHDWNZVTR-KWBADKCTSA-N 2 1 342.327 4.414 20 0 EIADMP COc1c(Cl)cc(Cl)cc1C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000503805284 1037919491 /nfs/dbraw/zinc/91/94/91/1037919491.db2.gz USQLDDAAOLPVSV-UHFFFAOYSA-N 2 1 345.314 4.401 20 0 EIADMP Fc1cc(-c2ccco2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423081122 1037942564 /nfs/dbraw/zinc/94/25/64/1037942564.db2.gz BFTWOTSEKXLDHW-BHIYHBOVSA-N 2 1 328.431 4.096 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1)c1c[nH+]ccc1N ZINC000423096157 1037954991 /nfs/dbraw/zinc/95/49/91/1037954991.db2.gz HAFXCIRXDUYOGO-RAIGVLPGSA-N 2 1 336.266 4.398 20 0 EIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000423183752 1038018462 /nfs/dbraw/zinc/01/84/62/1038018462.db2.gz GWGPHSMMVVTYEF-MRXNPFEDSA-N 2 1 337.467 4.221 20 0 EIADMP Fc1ccc(C[C@@H]([NH2+]C2CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000423189703 1038046742 /nfs/dbraw/zinc/04/67/42/1038046742.db2.gz RBGMTNHEJLDYSA-LJQANCHMSA-N 2 1 332.850 4.105 20 0 EIADMP C[C@H]([NH2+][C@@H](C[NH3+])C1CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423265120 1038072058 /nfs/dbraw/zinc/07/20/58/1038072058.db2.gz ASMDIMQBGMAXIX-SDBXPKJASA-N 2 1 340.311 4.112 20 0 EIADMP C[C@H]([NH2+][C@H](C[NH3+])C1CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423265117 1038074494 /nfs/dbraw/zinc/07/44/94/1038074494.db2.gz ASMDIMQBGMAXIX-ISVAXAHUSA-N 2 1 340.311 4.112 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)NC[C@H]([NH3+])c1ccccc1 ZINC000423246121 1038075595 /nfs/dbraw/zinc/07/55/95/1038075595.db2.gz PHILJKRCFDWWEB-KSSFIOAISA-N 2 1 337.492 4.469 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCCOc3c(Cl)cc(C)cc32)C1 ZINC000489585740 1038132408 /nfs/dbraw/zinc/13/24/08/1038132408.db2.gz AXIXHKAHGGQJLD-YJBOKZPZSA-N 2 1 336.907 4.184 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCOc3c(Cl)cc(C)cc32)C1 ZINC000489585736 1038134747 /nfs/dbraw/zinc/13/47/47/1038134747.db2.gz AXIXHKAHGGQJLD-CRAIPNDOSA-N 2 1 336.907 4.184 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000423356672 1038170838 /nfs/dbraw/zinc/17/08/38/1038170838.db2.gz RBSSQOBAVIGSIL-VSDWSMLSSA-N 2 1 349.522 4.146 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000423356672 1038170853 /nfs/dbraw/zinc/17/08/53/1038170853.db2.gz RBSSQOBAVIGSIL-VSDWSMLSSA-N 2 1 349.522 4.146 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)C[NH3+])c1ccc(-c2ccccc2Br)s1 ZINC000423359937 1038179811 /nfs/dbraw/zinc/17/98/11/1038179811.db2.gz DQSSFZFKZMEXAJ-WDEREUQCSA-N 2 1 339.302 4.175 20 0 EIADMP FC(F)Oc1ccc([C@H]([NH2+]CCC[NH2+]C2CC2)c2ccccc2)cc1 ZINC000423556916 1038294068 /nfs/dbraw/zinc/29/40/68/1038294068.db2.gz NBOOFVKFAYMBSS-LJQANCHMSA-N 2 1 346.421 4.109 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc3cc[nH]c32)[C@H]1c1cccs1 ZINC000608059633 1038436041 /nfs/dbraw/zinc/43/60/41/1038436041.db2.gz MJUUVTRWKDEJFD-XLIONFOSSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cccc3cc[nH]c32)[C@H]1c1cccs1 ZINC000608059633 1038436049 /nfs/dbraw/zinc/43/60/49/1038436049.db2.gz MJUUVTRWKDEJFD-XLIONFOSSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@@H+](Cc1ccccc1)[C@H]1CCN(c2cc[nH+]c3cc(F)ccc32)C1 ZINC000608092839 1038604094 /nfs/dbraw/zinc/60/40/94/1038604094.db2.gz PUQXSJKEBGMKHF-SFHVURJKSA-N 2 1 335.426 4.085 20 0 EIADMP CCCCCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480769819 1038799043 /nfs/dbraw/zinc/79/90/43/1038799043.db2.gz MQSLKWJNMVCVTM-ZWKOTPCHSA-N 2 1 330.516 4.391 20 0 EIADMP c1ccc2c(c1)sc1c2CCC[C@@H]1[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000480758670 1038800712 /nfs/dbraw/zinc/80/07/12/1038800712.db2.gz NRWBESLRUYPHRP-KDOFPFPSSA-N 2 1 326.509 4.353 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)cc1Cl ZINC000539072157 1038822115 /nfs/dbraw/zinc/82/21/15/1038822115.db2.gz VEDDCVFJGJBYBI-ZNMIVQPWSA-N 2 1 342.886 4.019 20 0 EIADMP Clc1ccc([C@@H]([NH2+]CC2([NH+]3CCCC3)CCOCC2)C2CC2)cc1 ZINC000539200333 1038877489 /nfs/dbraw/zinc/87/74/89/1038877489.db2.gz FFSXCDQUVVZOMW-IBGZPJMESA-N 2 1 348.918 4.026 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000537616136 1038898244 /nfs/dbraw/zinc/89/82/44/1038898244.db2.gz YFTQYIZAJRGKSX-BLLLJJGKSA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000537616136 1038898247 /nfs/dbraw/zinc/89/82/47/1038898247.db2.gz YFTQYIZAJRGKSX-BLLLJJGKSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000537616136 1038898251 /nfs/dbraw/zinc/89/82/51/1038898251.db2.gz YFTQYIZAJRGKSX-BLLLJJGKSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000537616136 1038898262 /nfs/dbraw/zinc/89/82/62/1038898262.db2.gz YFTQYIZAJRGKSX-BLLLJJGKSA-N 2 1 332.385 4.007 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 ZINC000462120572 1038938392 /nfs/dbraw/zinc/93/83/92/1038938392.db2.gz UKPSHLOKUJQFIP-RZUBCFFCSA-N 2 1 326.528 4.252 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2cccc(Br)c2)C1 ZINC000481024775 1038963454 /nfs/dbraw/zinc/96/34/54/1038963454.db2.gz NJPQJONRZQKKHC-RHSMWYFYSA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000481040999 1038988170 /nfs/dbraw/zinc/98/81/70/1038988170.db2.gz RXZBAZFQRMVTPS-GJZGRUSLSA-N 2 1 342.499 4.426 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000481041001 1038988699 /nfs/dbraw/zinc/98/86/99/1038988699.db2.gz RXZBAZFQRMVTPS-HUUCEWRRSA-N 2 1 342.499 4.426 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](Cc1ccccc1)c1ccccc1F ZINC000539361290 1039022141 /nfs/dbraw/zinc/02/21/41/1039022141.db2.gz QIEWTHHCXHLMJO-OAQYLSRUSA-N 2 1 337.442 4.294 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)[C@H]2CCC[C@@H]21 ZINC000552057358 1039076506 /nfs/dbraw/zinc/07/65/06/1039076506.db2.gz QDNPBNQPRRABEN-NEWSRXKRSA-N 2 1 328.431 4.048 20 0 EIADMP CSc1ccccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000481187263 1039092857 /nfs/dbraw/zinc/09/28/57/1039092857.db2.gz ZAKFLJTZFYBXGZ-FXAWDEMLSA-N 2 1 340.536 4.409 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccc2n[nH]cc2c1 ZINC000552099422 1039157812 /nfs/dbraw/zinc/15/78/12/1039157812.db2.gz IEMODLIUSFRSPC-WWMYMODYSA-N 2 1 348.494 4.267 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccc2n[nH]cc2c1 ZINC000552099422 1039157824 /nfs/dbraw/zinc/15/78/24/1039157824.db2.gz IEMODLIUSFRSPC-WWMYMODYSA-N 2 1 348.494 4.267 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)[C@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000481322925 1039288272 /nfs/dbraw/zinc/28/82/72/1039288272.db2.gz NYEMHFXCEYJGSL-MELADBBJSA-N 2 1 345.314 4.081 20 0 EIADMP CCOCCC1(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000090722733 1039294227 /nfs/dbraw/zinc/29/42/27/1039294227.db2.gz JXQONRXWLNAKNA-INIZCTEOSA-N 2 1 327.472 4.038 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]C[C@H](C)C[NH+]3CCCC3)c(C)c2c1 ZINC000481327463 1039300438 /nfs/dbraw/zinc/30/04/38/1039300438.db2.gz IDNRCQZAEDOSRZ-HOCLYGCPSA-N 2 1 330.472 4.132 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCc3cc(F)ccc32)CC1 ZINC000481329456 1039304393 /nfs/dbraw/zinc/30/43/93/1039304393.db2.gz ZMGAFCTVIQOHLE-QFIPXVFZSA-N 2 1 338.470 4.376 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550798008 1039311385 /nfs/dbraw/zinc/31/13/85/1039311385.db2.gz UZERYWRDMFHCAU-ULQDDVLXSA-N 2 1 328.422 4.389 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550798008 1039311392 /nfs/dbraw/zinc/31/13/92/1039311392.db2.gz UZERYWRDMFHCAU-ULQDDVLXSA-N 2 1 328.422 4.389 20 0 EIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@@H+](CC)C1 ZINC000481339689 1039319996 /nfs/dbraw/zinc/31/99/96/1039319996.db2.gz QZXOQCIGDRZKGU-HOCLYGCPSA-N 2 1 326.937 4.142 20 0 EIADMP Fc1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000513858761 1039337386 /nfs/dbraw/zinc/33/73/86/1039337386.db2.gz DFRSBEOITUMAKH-YWZLYKJASA-N 2 1 344.499 4.376 20 0 EIADMP Fc1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000513858761 1039337407 /nfs/dbraw/zinc/33/74/07/1039337407.db2.gz DFRSBEOITUMAKH-YWZLYKJASA-N 2 1 344.499 4.376 20 0 EIADMP C[N@H+]1CCC[C@]2(CC[NH+](CCCSc3ccccc3Cl)C2)C1 ZINC000555598341 1039424692 /nfs/dbraw/zinc/42/46/92/1039424692.db2.gz XTCHPSXKTQDHJU-SFHVURJKSA-N 2 1 338.948 4.240 20 0 EIADMP C[NH+]1CCC[C@]2(CC[N@H+](CCCSc3ccccc3Cl)C2)C1 ZINC000555598341 1039424714 /nfs/dbraw/zinc/42/47/14/1039424714.db2.gz XTCHPSXKTQDHJU-SFHVURJKSA-N 2 1 338.948 4.240 20 0 EIADMP C[NH+]1CCC[C@]2(CC[N@@H+](CCCSc3ccccc3Cl)C2)C1 ZINC000555598341 1039424723 /nfs/dbraw/zinc/42/47/23/1039424723.db2.gz XTCHPSXKTQDHJU-SFHVURJKSA-N 2 1 338.948 4.240 20 0 EIADMP COc1ccccc1C[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000514086635 1039589785 /nfs/dbraw/zinc/58/97/85/1039589785.db2.gz BVJZTRMABOUNPC-UHFFFAOYSA-N 2 1 338.495 4.039 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(Br)cc1 ZINC000157421527 1039593235 /nfs/dbraw/zinc/59/32/35/1039593235.db2.gz LXWMPXBOUSZSKG-MZPVMMEZSA-N 2 1 331.257 4.245 20 0 EIADMP CCOCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000514103472 1039610512 /nfs/dbraw/zinc/61/05/12/1039610512.db2.gz CIONWXYZOWWFHF-FDFHNCONSA-N 2 1 344.543 4.084 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000469251661 1039864534 /nfs/dbraw/zinc/86/45/34/1039864534.db2.gz KWGLWAKFXCLDFO-GJZGRUSLSA-N 2 1 331.529 4.418 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1ccccc1OCc1ccccc1 ZINC000481956885 1039912031 /nfs/dbraw/zinc/91/20/31/1039912031.db2.gz DZPZXAXJNDIZSH-MSOLQXFVSA-N 2 1 326.484 4.256 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)s1 ZINC000551050750 1039917741 /nfs/dbraw/zinc/91/77/41/1039917741.db2.gz BQYDVIOAJONAQS-QKYXUNIQSA-N 2 1 328.525 4.413 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)s1 ZINC000551050750 1039917761 /nfs/dbraw/zinc/91/77/61/1039917761.db2.gz BQYDVIOAJONAQS-QKYXUNIQSA-N 2 1 328.525 4.413 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cnc(-c3ccccc3)s2)CC1 ZINC000535083288 1039924494 /nfs/dbraw/zinc/92/44/94/1039924494.db2.gz STZUBFOVMWQWPB-UHFFFAOYSA-N 2 1 343.540 4.362 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCO1 ZINC000551147353 1040006547 /nfs/dbraw/zinc/00/65/47/1040006547.db2.gz BWVJFXLBJGDXPS-XRXFAXGQSA-N 2 1 330.516 4.005 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCO1 ZINC000551147353 1040006568 /nfs/dbraw/zinc/00/65/68/1040006568.db2.gz BWVJFXLBJGDXPS-XRXFAXGQSA-N 2 1 330.516 4.005 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCCNc2cccc(F)c2)C[C@H]1c1ccccc1 ZINC000551170358 1040014255 /nfs/dbraw/zinc/01/42/55/1040014255.db2.gz SVFBJGBZJQMLIK-SFTDATJTSA-N 2 1 341.474 4.053 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCNc2cccc(F)c2)C[C@H]1c1ccccc1 ZINC000551170358 1040014274 /nfs/dbraw/zinc/01/42/74/1040014274.db2.gz SVFBJGBZJQMLIK-SFTDATJTSA-N 2 1 341.474 4.053 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000551175563 1040018084 /nfs/dbraw/zinc/01/80/84/1040018084.db2.gz MTYKFPLPLPEVBW-JJBAYQRUSA-N 2 1 330.516 4.007 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000551175563 1040018102 /nfs/dbraw/zinc/01/81/02/1040018102.db2.gz MTYKFPLPLPEVBW-JJBAYQRUSA-N 2 1 330.516 4.007 20 0 EIADMP c1[nH+]c(C2CC[NH+](C[C@@H]3C[C@@H]3c3ccccc3)CC2)n2c1CCCC2 ZINC000435059465 1040040478 /nfs/dbraw/zinc/04/04/78/1040040478.db2.gz PKHKKSPSKQUKKT-PZJWPPBQSA-N 2 1 335.495 4.203 20 0 EIADMP C[C@@H]1C[C@@H]1c1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)o1 ZINC000435062033 1040041282 /nfs/dbraw/zinc/04/12/82/1040041282.db2.gz WIPBGNZPCHKIPR-BEFAXECRSA-N 2 1 339.483 4.315 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000551267689 1040130066 /nfs/dbraw/zinc/13/00/66/1040130066.db2.gz SLEAXSPUKYIQAD-SJORKVTESA-N 2 1 339.527 4.298 20 0 EIADMP CSC1(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000514697414 1040151250 /nfs/dbraw/zinc/15/12/50/1040151250.db2.gz OOOXJCLXFBHTAQ-PKOBYXMFSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000514697414 1040151285 /nfs/dbraw/zinc/15/12/85/1040151285.db2.gz OOOXJCLXFBHTAQ-PKOBYXMFSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000514697414 1040151308 /nfs/dbraw/zinc/15/13/08/1040151308.db2.gz OOOXJCLXFBHTAQ-PKOBYXMFSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000514697414 1040151330 /nfs/dbraw/zinc/15/13/30/1040151330.db2.gz OOOXJCLXFBHTAQ-PKOBYXMFSA-N 2 1 332.557 4.257 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc(F)c1 ZINC000482442768 1040250395 /nfs/dbraw/zinc/25/03/95/1040250395.db2.gz XCIACAPNNAVCIN-PKOBYXMFSA-N 2 1 326.459 4.041 20 0 EIADMP Fc1ccc(F)c2c1CC[C@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479464051 1040372875 /nfs/dbraw/zinc/37/28/75/1040372875.db2.gz KRPRPUOIOWVXOY-OXQOHEQNSA-N 2 1 342.433 4.064 20 0 EIADMP Fc1ccc(F)c2c1CC[C@H]2[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000479464051 1040372889 /nfs/dbraw/zinc/37/28/89/1040372889.db2.gz KRPRPUOIOWVXOY-OXQOHEQNSA-N 2 1 342.433 4.064 20 0 EIADMP CN(C)c1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000514938646 1040379380 /nfs/dbraw/zinc/37/93/80/1040379380.db2.gz YAGDYVNMQNDXBV-NRFANRHFSA-N 2 1 349.522 4.039 20 0 EIADMP CN(C)c1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000514938646 1040379394 /nfs/dbraw/zinc/37/93/94/1040379394.db2.gz YAGDYVNMQNDXBV-NRFANRHFSA-N 2 1 349.522 4.039 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995715 1040392680 /nfs/dbraw/zinc/39/26/80/1040392680.db2.gz XPTQPKXHHOLZRO-HXUWFJFHSA-N 2 1 336.479 4.127 20 0 EIADMP CC[N@H+]1CC[C@@H](NCc2cnc(-c3ccc(Cl)cc3)s2)[C@H](C)C1 ZINC000551537063 1040396324 /nfs/dbraw/zinc/39/63/24/1040396324.db2.gz ZTASCQSZKNNQHE-CXAGYDPISA-N 2 1 349.931 4.283 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)[C@H](C)C1 ZINC000551537063 1040396341 /nfs/dbraw/zinc/39/63/41/1040396341.db2.gz ZTASCQSZKNNQHE-CXAGYDPISA-N 2 1 349.931 4.283 20 0 EIADMP CC(C)COc1ccc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000479539180 1040443728 /nfs/dbraw/zinc/44/37/28/1040443728.db2.gz DFKHYWFEPNQMSR-KKXNLOMOSA-N 2 1 330.516 4.389 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000482808294 1040503283 /nfs/dbraw/zinc/50/32/83/1040503283.db2.gz CKHONPKHYUHQHQ-GDBMZVCRSA-N 2 1 336.907 4.091 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000482808294 1040503301 /nfs/dbraw/zinc/50/33/01/1040503301.db2.gz CKHONPKHYUHQHQ-GDBMZVCRSA-N 2 1 336.907 4.091 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)C1 ZINC000435742449 1040595349 /nfs/dbraw/zinc/59/53/49/1040595349.db2.gz NMMVJGFXELBHPM-VYDXJSESSA-N 2 1 332.454 4.494 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc1 ZINC000668172369 1040604865 /nfs/dbraw/zinc/60/48/65/1040604865.db2.gz MCQRXBFJLKWDCD-OALUTQOASA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)cc1 ZINC000668172369 1040604875 /nfs/dbraw/zinc/60/48/75/1040604875.db2.gz MCQRXBFJLKWDCD-OALUTQOASA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)cc1 ZINC000668172369 1040604881 /nfs/dbraw/zinc/60/48/81/1040604881.db2.gz MCQRXBFJLKWDCD-OALUTQOASA-N 2 1 341.524 4.035 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccnc3ccccc23)c1 ZINC000539710572 1040719585 /nfs/dbraw/zinc/71/95/85/1040719585.db2.gz UAEXHFBUEYYURN-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP FC(F)(F)c1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167959818 1040722215 /nfs/dbraw/zinc/72/22/15/1040722215.db2.gz SMGZOSLADIPJFF-AYHJJNSGSA-N 2 1 338.417 4.200 20 0 EIADMP CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000483258616 1040795215 /nfs/dbraw/zinc/79/52/15/1040795215.db2.gz NJGSIKZABLLINO-PXNSSMCTSA-N 2 1 345.531 4.166 20 0 EIADMP CCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)C[C@H]2C)cc1OCC ZINC000539817501 1040812584 /nfs/dbraw/zinc/81/25/84/1040812584.db2.gz OJNBFMMYFKFRMO-MJGOQNOKSA-N 2 1 348.531 4.036 20 0 EIADMP CCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](CC)C[C@H]2C)cc1OCC ZINC000539817501 1040812590 /nfs/dbraw/zinc/81/25/90/1040812590.db2.gz OJNBFMMYFKFRMO-MJGOQNOKSA-N 2 1 348.531 4.036 20 0 EIADMP CCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](CC)C[C@H]2C)cc1OCC ZINC000539817501 1040812593 /nfs/dbraw/zinc/81/25/93/1040812593.db2.gz OJNBFMMYFKFRMO-MJGOQNOKSA-N 2 1 348.531 4.036 20 0 EIADMP CN(C/C=C\c1ccc(F)cc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539834037 1040828433 /nfs/dbraw/zinc/82/84/33/1040828433.db2.gz WFTRWPXVSWSNQU-DPVXCJKMSA-N 2 1 338.470 4.293 20 0 EIADMP C[NH+](C/C=C\c1ccc(F)cc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539834037 1040828452 /nfs/dbraw/zinc/82/84/52/1040828452.db2.gz WFTRWPXVSWSNQU-DPVXCJKMSA-N 2 1 338.470 4.293 20 0 EIADMP C[NH+](C/C=C\c1ccc(F)cc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539834037 1040828456 /nfs/dbraw/zinc/82/84/56/1040828456.db2.gz WFTRWPXVSWSNQU-DPVXCJKMSA-N 2 1 338.470 4.293 20 0 EIADMP CN(C/C=C/c1ccc(F)cc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539834040 1040828481 /nfs/dbraw/zinc/82/84/81/1040828481.db2.gz WFTRWPXVSWSNQU-WKOQKXSESA-N 2 1 338.470 4.293 20 0 EIADMP C[NH+](C/C=C/c1ccc(F)cc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539834040 1040828499 /nfs/dbraw/zinc/82/84/99/1040828499.db2.gz WFTRWPXVSWSNQU-WKOQKXSESA-N 2 1 338.470 4.293 20 0 EIADMP C[NH+](C/C=C/c1ccc(F)cc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539834040 1040828505 /nfs/dbraw/zinc/82/85/05/1040828505.db2.gz WFTRWPXVSWSNQU-WKOQKXSESA-N 2 1 338.470 4.293 20 0 EIADMP CC[C@@H](c1ccc(F)cc1)[N@@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1 ZINC000436048984 1040839410 /nfs/dbraw/zinc/83/94/10/1040839410.db2.gz GOIZLPAJQPLRCT-QAPCUYQASA-N 2 1 347.503 4.153 20 0 EIADMP CC[C@@H](c1ccc(F)cc1)[N@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1 ZINC000436048984 1040839421 /nfs/dbraw/zinc/83/94/21/1040839421.db2.gz GOIZLPAJQPLRCT-QAPCUYQASA-N 2 1 347.503 4.153 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1 ZINC000480007609 1040847494 /nfs/dbraw/zinc/84/74/94/1040847494.db2.gz KSZYCRIKOKMRPD-UXHICEINSA-N 2 1 346.559 4.328 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)[C@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000480033442 1040878915 /nfs/dbraw/zinc/87/89/15/1040878915.db2.gz GBJVOFGSTVGINV-OLZOCXBDSA-N 2 1 345.314 4.223 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C1CC[NH+](CC)CC1 ZINC000480030655 1040878750 /nfs/dbraw/zinc/87/87/50/1040878750.db2.gz KGHJPGKHXRZEOB-OAHLLOKOSA-N 2 1 326.937 4.285 20 0 EIADMP CC[NH+](CC)CC1CCN(c2cc[nH+]c3ccc(Cl)cc32)CC1 ZINC000462784485 1040923328 /nfs/dbraw/zinc/92/33/28/1040923328.db2.gz DQYCUDSDHIFLNH-UHFFFAOYSA-N 2 1 331.891 4.446 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCC2)CC[N@H+]1C ZINC000537964483 1040937703 /nfs/dbraw/zinc/93/77/03/1040937703.db2.gz RYNOQPCATQMHGK-ZFWWWQNUSA-N 2 1 341.326 4.487 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)[C@@H](C)C1 ZINC000537989794 1040967279 /nfs/dbraw/zinc/96/72/79/1040967279.db2.gz FCLMZIYQTIDAFK-AVRDEDQJSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000483725996 1040977871 /nfs/dbraw/zinc/97/78/71/1040977871.db2.gz IZQQMJQWVLASAP-VNHYZAJKSA-N 2 1 346.462 4.474 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000483725996 1040977894 /nfs/dbraw/zinc/97/78/94/1040977894.db2.gz IZQQMJQWVLASAP-VNHYZAJKSA-N 2 1 346.462 4.474 20 0 EIADMP C[NH+](C)CCCOc1ccc(CNc2cc[nH+]c3ccsc32)cc1 ZINC000462828010 1040980780 /nfs/dbraw/zinc/98/07/80/1040980780.db2.gz SSJUVEUDTKZKOC-UHFFFAOYSA-N 2 1 341.480 4.239 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000379740220 1040989245 /nfs/dbraw/zinc/98/92/45/1040989245.db2.gz HWPIKSPXGYGELJ-GHTZIAJQSA-N 2 1 326.459 4.389 20 0 EIADMP C[N@H+](Cc1ccc(-c2cccc(F)c2F)o1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000515710217 1040996947 /nfs/dbraw/zinc/99/69/47/1040996947.db2.gz AMNNEGXQLCWKCJ-YIONKMFJSA-N 2 1 346.421 4.282 20 0 EIADMP C[N@@H+](Cc1ccc(-c2cccc(F)c2F)o1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000515710217 1040996961 /nfs/dbraw/zinc/99/69/61/1040996961.db2.gz AMNNEGXQLCWKCJ-YIONKMFJSA-N 2 1 346.421 4.282 20 0 EIADMP C[NH+](Cc1ccc(-c2cccc(F)c2F)o1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000515710217 1040996973 /nfs/dbraw/zinc/99/69/73/1040996973.db2.gz AMNNEGXQLCWKCJ-YIONKMFJSA-N 2 1 346.421 4.282 20 0 EIADMP C[NH+](Cc1ccc(-c2cccc(F)c2F)o1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000515710217 1040997002 /nfs/dbraw/zinc/99/70/02/1040997002.db2.gz AMNNEGXQLCWKCJ-YIONKMFJSA-N 2 1 346.421 4.282 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436271262 1041043306 /nfs/dbraw/zinc/04/33/06/1041043306.db2.gz CWZXDKRUTMEATM-LBPRGKRZSA-N 2 1 334.813 4.180 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436271262 1041043322 /nfs/dbraw/zinc/04/33/22/1041043322.db2.gz CWZXDKRUTMEATM-LBPRGKRZSA-N 2 1 334.813 4.180 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000436306944 1041052150 /nfs/dbraw/zinc/05/21/50/1041052150.db2.gz QCFBOHSOHMNLFQ-RLLPEYFOSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000436306944 1041052162 /nfs/dbraw/zinc/05/21/62/1041052162.db2.gz QCFBOHSOHMNLFQ-RLLPEYFOSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000462889798 1041054249 /nfs/dbraw/zinc/05/42/49/1041054249.db2.gz UYJPOBYEMVZDAU-INIZCTEOSA-N 2 1 339.527 4.441 20 0 EIADMP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000554374165 1041058942 /nfs/dbraw/zinc/05/89/42/1041058942.db2.gz PKOFMVVZQXZXPM-YMQHIKHWSA-N 2 1 330.491 4.157 20 0 EIADMP FC1(CC[NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CCC1 ZINC000554374977 1041062180 /nfs/dbraw/zinc/06/21/80/1041062180.db2.gz DFGODXVOKUAYDI-HSALFYBXSA-N 2 1 330.491 4.159 20 0 EIADMP c1ccc2c(c1)sc1c2CCC[C@@H]1[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000480241713 1041118717 /nfs/dbraw/zinc/11/87/17/1041118717.db2.gz PYWLRKBNRDQIST-SFHVURJKSA-N 2 1 326.509 4.495 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000436399879 1041203173 /nfs/dbraw/zinc/20/31/73/1041203173.db2.gz GUVWAWGODCBOAG-CABCVRRESA-N 2 1 329.463 4.050 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc2ccccc21 ZINC000540169038 1041211987 /nfs/dbraw/zinc/21/19/87/1041211987.db2.gz JJQUMKAGIHPQNS-CEXWTWQISA-N 2 1 340.511 4.380 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2cccc3F)c1 ZINC000540172618 1041216963 /nfs/dbraw/zinc/21/69/63/1041216963.db2.gz PNJHRZVJFBXPCX-OAQYLSRUSA-N 2 1 326.459 4.443 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC2Cc3ccccc3C2)cc1 ZINC000540171303 1041217034 /nfs/dbraw/zinc/21/70/34/1041217034.db2.gz RSMUHLQWLRYWID-INIZCTEOSA-N 2 1 331.463 4.246 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cc(F)ccc1F ZINC000484471968 1041267272 /nfs/dbraw/zinc/26/72/72/1041267272.db2.gz JAVFSMHULNLQSC-IERDGZPVSA-N 2 1 344.449 4.008 20 0 EIADMP CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc[nH+]c2cc(F)ccc21 ZINC000463063265 1041295452 /nfs/dbraw/zinc/29/54/52/1041295452.db2.gz GPXDTBCOAXLMFE-SFHVURJKSA-N 2 1 349.453 4.332 20 0 EIADMP CC(C)[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000538406111 1041303576 /nfs/dbraw/zinc/30/35/76/1041303576.db2.gz PPKJVDBDNSBFPI-KRWDZBQOSA-N 2 1 326.406 4.254 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)CC1 ZINC000538408322 1041325281 /nfs/dbraw/zinc/32/52/81/1041325281.db2.gz XUZLALRVQFYHCL-IBGZPJMESA-N 2 1 326.484 4.065 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cc(F)cc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463114934 1041343831 /nfs/dbraw/zinc/34/38/31/1041343831.db2.gz IBNORDXGCPXBPM-KKSFZXQISA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cc(F)cc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463114934 1041343845 /nfs/dbraw/zinc/34/38/45/1041343845.db2.gz IBNORDXGCPXBPM-KKSFZXQISA-N 2 1 344.449 4.150 20 0 EIADMP CCc1ccc([C@@H]([NH2+]CC2([NH+]3CCCC3)CCOCC2)C(C)C)cc1 ZINC000540299987 1041350428 /nfs/dbraw/zinc/35/04/28/1041350428.db2.gz FWNMXSZIEHJUQP-NRFANRHFSA-N 2 1 344.543 4.181 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000540301595 1041353137 /nfs/dbraw/zinc/35/31/37/1041353137.db2.gz LQUYJOUCDUESDK-YVEFUNNKSA-N 2 1 327.299 4.376 20 0 EIADMP Cc1ccccc1C1(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC000463116788 1041358064 /nfs/dbraw/zinc/35/80/64/1041358064.db2.gz RWESNCORNJHDMR-UHFFFAOYSA-N 2 1 348.534 4.323 20 0 EIADMP Cc1cc(C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)ccc1F ZINC000463136459 1041370901 /nfs/dbraw/zinc/37/09/01/1041370901.db2.gz FCNCQIYERBXCKX-UHFFFAOYSA-N 2 1 344.449 4.070 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2(c3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463139935 1041375231 /nfs/dbraw/zinc/37/52/31/1041375231.db2.gz USFGGKNAHWYJMF-SIKLNZKXSA-N 2 1 334.507 4.361 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC2(c3ccccc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463139935 1041375242 /nfs/dbraw/zinc/37/52/42/1041375242.db2.gz USFGGKNAHWYJMF-SIKLNZKXSA-N 2 1 334.507 4.361 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463141463 1041375537 /nfs/dbraw/zinc/37/55/37/1041375537.db2.gz ZDONDTLABANVOK-JAXLGGSGSA-N 3 1 345.575 4.140 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463141463 1041375541 /nfs/dbraw/zinc/37/55/41/1041375541.db2.gz ZDONDTLABANVOK-JAXLGGSGSA-N 3 1 345.575 4.140 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCC[C@H]1Oc1ccccc1C ZINC000484635020 1041380503 /nfs/dbraw/zinc/38/05/03/1041380503.db2.gz HZMYEPHQCJGKFY-PZJWPPBQSA-N 2 1 341.499 4.260 20 0 EIADMP COc1ccc(C2([NH2+]C3CC[NH+]([C@@H]4CCCC[C@@H]4C)CC3)CC2)cc1 ZINC000538524305 1041392279 /nfs/dbraw/zinc/39/22/79/1041392279.db2.gz MHWNSXOBKWNNIH-LAUBAEHRSA-N 2 1 342.527 4.317 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463188316 1041418009 /nfs/dbraw/zinc/41/80/09/1041418009.db2.gz CIFDTCISOAMZPS-NQIIRXRSSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463188316 1041418012 /nfs/dbraw/zinc/41/80/12/1041418012.db2.gz CIFDTCISOAMZPS-NQIIRXRSSA-N 2 1 338.495 4.146 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cc(F)ccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463187844 1041418211 /nfs/dbraw/zinc/41/82/11/1041418211.db2.gz DYLNNYMVHDUEAC-OXQOHEQNSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cc(F)ccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463187844 1041418214 /nfs/dbraw/zinc/41/82/14/1041418214.db2.gz DYLNNYMVHDUEAC-OXQOHEQNSA-N 2 1 344.449 4.150 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CC(C)(C)C2=CCCCC2)[C@H](C)C1 ZINC000480693761 1041475629 /nfs/dbraw/zinc/47/56/29/1041475629.db2.gz NDDNXLGUXHNUAM-UYAOXDASSA-N 2 1 336.564 4.240 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CC(C)(C)C2=CCCCC2)[C@@H](C)C1 ZINC000480693757 1041476175 /nfs/dbraw/zinc/47/61/75/1041476175.db2.gz NDDNXLGUXHNUAM-ICSRJNTNSA-N 2 1 336.564 4.240 20 0 EIADMP CCC[N@H+]1CC[C@H](CN[C@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722226 1041489039 /nfs/dbraw/zinc/48/90/39/1041489039.db2.gz KALWYMVIIQRVPI-DYESRHJHSA-N 2 1 326.459 4.237 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722226 1041489044 /nfs/dbraw/zinc/48/90/44/1041489044.db2.gz KALWYMVIIQRVPI-DYESRHJHSA-N 2 1 326.459 4.237 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722226 1041489048 /nfs/dbraw/zinc/48/90/48/1041489048.db2.gz KALWYMVIIQRVPI-DYESRHJHSA-N 2 1 326.459 4.237 20 0 EIADMP CCC[N@H+]1CC[C@@H](CN[C@@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722229 1041489276 /nfs/dbraw/zinc/48/92/76/1041489276.db2.gz KALWYMVIIQRVPI-UWJYYQICSA-N 2 1 326.459 4.237 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722229 1041489282 /nfs/dbraw/zinc/48/92/82/1041489282.db2.gz KALWYMVIIQRVPI-UWJYYQICSA-N 2 1 326.459 4.237 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)C1 ZINC000480722229 1041489288 /nfs/dbraw/zinc/48/92/88/1041489288.db2.gz KALWYMVIIQRVPI-UWJYYQICSA-N 2 1 326.459 4.237 20 0 EIADMP Fc1cccc(F)c1-c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)o1 ZINC000538719543 1041489822 /nfs/dbraw/zinc/48/98/22/1041489822.db2.gz RNFZQPBJTAHCDT-OAHLLOKOSA-N 2 1 346.421 4.143 20 0 EIADMP Fc1cccc(F)c1-c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)o1 ZINC000538719543 1041489828 /nfs/dbraw/zinc/48/98/28/1041489828.db2.gz RNFZQPBJTAHCDT-OAHLLOKOSA-N 2 1 346.421 4.143 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@@H]1CCOC1 ZINC000480732584 1041496989 /nfs/dbraw/zinc/49/69/89/1041496989.db2.gz ZFZAYCFHVHXCDI-OSZJIOELSA-N 2 1 344.543 4.069 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000538750380 1041523999 /nfs/dbraw/zinc/52/39/99/1041523999.db2.gz WUVMTEXQOYQFJS-OAHLLOKOSA-N 2 1 332.875 4.374 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000538750380 1041524009 /nfs/dbraw/zinc/52/40/09/1041524009.db2.gz WUVMTEXQOYQFJS-OAHLLOKOSA-N 2 1 332.875 4.374 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000538750380 1041524028 /nfs/dbraw/zinc/52/40/28/1041524028.db2.gz WUVMTEXQOYQFJS-OAHLLOKOSA-N 2 1 332.875 4.374 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000538750380 1041524043 /nfs/dbraw/zinc/52/40/43/1041524043.db2.gz WUVMTEXQOYQFJS-OAHLLOKOSA-N 2 1 332.875 4.374 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000539040717 1041616456 /nfs/dbraw/zinc/61/64/56/1041616456.db2.gz PLDSAIMJORKVFZ-ZJOUEHCJSA-N 2 1 337.511 4.341 20 0 EIADMP [NH3+]Cc1cc2cc(Cl)ccc2n1C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167961692 1041619320 /nfs/dbraw/zinc/61/93/20/1041619320.db2.gz NBLPDYUBDVEJRM-JWTNVVGKSA-N 2 1 343.902 4.331 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000516881766 1041794565 /nfs/dbraw/zinc/79/45/65/1041794565.db2.gz GCGUBAXTWFKXPF-MRXNPFEDSA-N 2 1 338.499 4.409 20 0 EIADMP C[C@H]([NH2+]CCCCCOc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000437784858 1041907808 /nfs/dbraw/zinc/90/78/08/1041907808.db2.gz KZZOXKLAYQHDDO-PMACEKPBSA-N 2 1 344.543 4.478 20 0 EIADMP CC[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)CC(F)(F)F ZINC000402688698 1041947434 /nfs/dbraw/zinc/94/74/34/1041947434.db2.gz HENLUERVXJSJIO-SOLBZPMBSA-N 2 1 342.449 4.465 20 0 EIADMP CC[C@H]1CCC[C@@H](C[N@@H+](C)C2CCN(CCc3ccccn3)CC2)C1 ZINC000541536594 1041998638 /nfs/dbraw/zinc/99/86/38/1041998638.db2.gz CWDFCQMVGIDHCD-VQTJNVASSA-N 2 1 343.559 4.237 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438094687 1042043091 /nfs/dbraw/zinc/04/30/91/1042043091.db2.gz OBVLVGAIPKHDMW-NNWRFLSQSA-N 2 1 326.528 4.161 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438094687 1042043099 /nfs/dbraw/zinc/04/30/99/1042043099.db2.gz OBVLVGAIPKHDMW-NNWRFLSQSA-N 2 1 326.528 4.161 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438094687 1042043103 /nfs/dbraw/zinc/04/31/03/1042043103.db2.gz OBVLVGAIPKHDMW-NNWRFLSQSA-N 2 1 326.528 4.161 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]CC[C@@H]3CCCC[N@@H+]3C)c(C)c2c1 ZINC000541653725 1042058678 /nfs/dbraw/zinc/05/86/78/1042058678.db2.gz PFBJTIKVSWWYTE-HOTGVXAUSA-N 2 1 330.472 4.275 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]CC[C@@H]3CCCC[N@H+]3C)c(C)c2c1 ZINC000541653725 1042058685 /nfs/dbraw/zinc/05/86/85/1042058685.db2.gz PFBJTIKVSWWYTE-HOTGVXAUSA-N 2 1 330.472 4.275 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CC[C@](C)(c4ccccc4)C3)CC2)[nH+]c1 ZINC000438194490 1042084383 /nfs/dbraw/zinc/08/43/83/1042084383.db2.gz ZQUBKCZUVCAHSK-GMAHTHKFSA-N 2 1 349.522 4.459 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000464778303 1042159874 /nfs/dbraw/zinc/15/98/74/1042159874.db2.gz NQYYEIYNSUSEAI-CABCVRRESA-N 2 1 344.421 4.310 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000464778303 1042159884 /nfs/dbraw/zinc/15/98/84/1042159884.db2.gz NQYYEIYNSUSEAI-CABCVRRESA-N 2 1 344.421 4.310 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000541908758 1042165943 /nfs/dbraw/zinc/16/59/43/1042165943.db2.gz MCRNNYSBYDUBEI-CQSZACIVSA-N 2 1 334.916 4.452 20 0 EIADMP C[C@@H](c1cccc(F)c1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464836210 1042181908 /nfs/dbraw/zinc/18/19/08/1042181908.db2.gz JNMBOWHEOLUMBR-HKUYNNGSSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@@H](c1cccc(F)c1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464836210 1042181909 /nfs/dbraw/zinc/18/19/09/1042181909.db2.gz JNMBOWHEOLUMBR-HKUYNNGSSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@@H](c1cccc(F)c1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464836210 1042181910 /nfs/dbraw/zinc/18/19/10/1042181910.db2.gz JNMBOWHEOLUMBR-HKUYNNGSSA-N 2 1 326.459 4.341 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2ccc(F)c(F)c2)cc1 ZINC000541951651 1042193455 /nfs/dbraw/zinc/19/34/55/1042193455.db2.gz GOTXSGUBPQURNX-AWEZNQCLSA-N 2 1 341.405 4.352 20 0 EIADMP C[N@@H+](CCc1ccccc1Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845989 1042195031 /nfs/dbraw/zinc/19/50/31/1042195031.db2.gz HZWWFSBSVWPXCV-LJQANCHMSA-N 2 1 342.914 4.336 20 0 EIADMP C[NH+](CCc1ccccc1Cl)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464845989 1042195032 /nfs/dbraw/zinc/19/50/32/1042195032.db2.gz HZWWFSBSVWPXCV-LJQANCHMSA-N 2 1 342.914 4.336 20 0 EIADMP C[NH+](CCc1ccccc1Cl)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464845989 1042195036 /nfs/dbraw/zinc/19/50/36/1042195036.db2.gz HZWWFSBSVWPXCV-LJQANCHMSA-N 2 1 342.914 4.336 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCc2cccs2)CC1 ZINC000438824267 1042369315 /nfs/dbraw/zinc/36/93/15/1042369315.db2.gz COGSKKPPLKIIGB-UHFFFAOYSA-N 2 1 328.525 4.323 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]CC3CCSCC3)CC[N@@H+]2C2CC2)cc1 ZINC000638588492 1042498760 /nfs/dbraw/zinc/49/87/60/1042498760.db2.gz ZCLHHKAMZBLBPX-QUCCMNQESA-N 2 1 330.541 4.087 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]CC3CCSCC3)CC[N@H+]2C2CC2)cc1 ZINC000638588492 1042498764 /nfs/dbraw/zinc/49/87/64/1042498764.db2.gz ZCLHHKAMZBLBPX-QUCCMNQESA-N 2 1 330.541 4.087 20 0 EIADMP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)CC1 ZINC000173319592 1042564283 /nfs/dbraw/zinc/56/42/83/1042564283.db2.gz OVVIVKUNAYHPEQ-IBGZPJMESA-N 2 1 345.575 4.052 20 0 EIADMP C[C@@H]([NH2+]CCOC1CCCCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492398272 1042633221 /nfs/dbraw/zinc/63/32/21/1042633221.db2.gz GVDWKSMOSKSGOY-TZIWHRDSSA-N 2 1 344.543 4.226 20 0 EIADMP c1csc(CCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000518977270 1042779308 /nfs/dbraw/zinc/77/93/08/1042779308.db2.gz HCSJOCDQAKMGTF-IBGZPJMESA-N 2 1 340.536 4.468 20 0 EIADMP c1csc(CCC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000518977270 1042779318 /nfs/dbraw/zinc/77/93/18/1042779318.db2.gz HCSJOCDQAKMGTF-IBGZPJMESA-N 2 1 340.536 4.468 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000309710696 1042819507 /nfs/dbraw/zinc/81/95/07/1042819507.db2.gz JESXOHUZMZRMCF-AEFFLSMTSA-N 2 1 328.525 4.483 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000177271261 1042832980 /nfs/dbraw/zinc/83/29/80/1042832980.db2.gz BCQKTQWZGYLIGF-IRXDYDNUSA-N 2 1 344.524 4.320 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000177271261 1042832981 /nfs/dbraw/zinc/83/29/81/1042832981.db2.gz BCQKTQWZGYLIGF-IRXDYDNUSA-N 2 1 344.524 4.320 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1 ZINC000177371379 1042835860 /nfs/dbraw/zinc/83/58/60/1042835860.db2.gz MLCNDENILSQPLH-KNBMTAEXSA-N 2 1 344.524 4.490 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000177371379 1042835861 /nfs/dbraw/zinc/83/58/61/1042835861.db2.gz MLCNDENILSQPLH-KNBMTAEXSA-N 2 1 344.524 4.490 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3ccccc3Cl)CC2)[nH+]c1 ZINC000177367948 1042836014 /nfs/dbraw/zinc/83/60/14/1042836014.db2.gz OXWQKXYHUPSCJV-OAHLLOKOSA-N 2 1 329.875 4.363 20 0 EIADMP Cc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc(C)c1O ZINC000310842012 1042846804 /nfs/dbraw/zinc/84/68/04/1042846804.db2.gz NWLHYLIDLQUMBO-WIYYLYMNSA-N 2 1 338.495 4.009 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2[nH]ccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310902527 1042847781 /nfs/dbraw/zinc/84/77/81/1042847781.db2.gz BIVARKOEYZDMIA-YLJYHZDGSA-N 2 1 333.479 4.168 20 0 EIADMP FC1(F)CCC[C@H](C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)C1 ZINC000311007389 1042850387 /nfs/dbraw/zinc/85/03/87/1042850387.db2.gz WOYAWOMPCPZDHJ-ZGXWSNOMSA-N 2 1 348.481 4.312 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=[NH2+])Nc3ccccc3)cc2)C1 ZINC000057887943 1042859073 /nfs/dbraw/zinc/85/90/73/1042859073.db2.gz PUHFTIOFWUZEBE-KRWDZBQOSA-N 2 1 336.483 4.055 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000178253958 1042862102 /nfs/dbraw/zinc/86/21/02/1042862102.db2.gz YEJKRADPEUWOAZ-AWEZNQCLSA-N 2 1 338.442 4.121 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CC(OC(C)(C)C)C2)[C@H]1c1cccs1 ZINC000493305921 1042891314 /nfs/dbraw/zinc/89/13/14/1042891314.db2.gz QTJXGFGEHCOQLP-IDMDMSBLSA-N 2 1 336.545 4.067 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]C2CC(OC(C)(C)C)C2)[C@H]1c1cccs1 ZINC000493305921 1042891315 /nfs/dbraw/zinc/89/13/15/1042891315.db2.gz QTJXGFGEHCOQLP-IDMDMSBLSA-N 2 1 336.545 4.067 20 0 EIADMP CC[C@H]1C[C@@H](C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000507784920 1042934395 /nfs/dbraw/zinc/93/43/95/1042934395.db2.gz UERKNUIPWHBCQB-VXKWHMMOSA-N 2 1 344.543 4.036 20 0 EIADMP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000152421610 1043027628 /nfs/dbraw/zinc/02/76/28/1043027628.db2.gz OXCMLOGFHWJOTB-ABQVSZSXSA-N 2 1 342.527 4.037 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C3CCC3)C1)CCC2 ZINC000183186149 1043040184 /nfs/dbraw/zinc/04/01/84/1043040184.db2.gz WBEJTDBHONPFKX-ZMSDIMECSA-N 2 1 347.572 4.326 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2scnc2C2CC2)CC1 ZINC000494984390 1043095424 /nfs/dbraw/zinc/09/54/24/1043095424.db2.gz FBWBHPOMYBSUJG-INIZCTEOSA-N 2 1 347.572 4.497 20 0 EIADMP Cc1ccc(F)c(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000310095965 1043102156 /nfs/dbraw/zinc/10/21/56/1043102156.db2.gz VAQUWLPRJVABCI-IBGZPJMESA-N 2 1 326.459 4.136 20 0 EIADMP Cc1ccc(F)c(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310095965 1043102168 /nfs/dbraw/zinc/10/21/68/1043102168.db2.gz VAQUWLPRJVABCI-IBGZPJMESA-N 2 1 326.459 4.136 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000310336425 1043125575 /nfs/dbraw/zinc/12/55/75/1043125575.db2.gz BJYGGLMQZQMTDZ-MJGOQNOKSA-N 2 1 326.459 4.389 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000338773763 1043142696 /nfs/dbraw/zinc/14/26/96/1043142696.db2.gz FRMPCPBQLXRYSA-ZMMAXQRCSA-N 2 1 341.499 4.425 20 0 EIADMP Cc1cc2c(cc1C)[C@@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CCS2 ZINC000427709616 1043172015 /nfs/dbraw/zinc/17/20/15/1043172015.db2.gz AGNJTKNYQZCLEL-IBGZPJMESA-N 2 1 330.541 4.447 20 0 EIADMP Cc1cnc([C@H](C)NCc2ccccc2C[N@H+]2CCCC[C@H]2C)cn1 ZINC000427821003 1043214152 /nfs/dbraw/zinc/21/41/52/1043214152.db2.gz AVIGCRHPHMTYTR-MSOLQXFVSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1cnc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)cn1 ZINC000427821003 1043214162 /nfs/dbraw/zinc/21/41/62/1043214162.db2.gz AVIGCRHPHMTYTR-MSOLQXFVSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1cnc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)cn1 ZINC000427821003 1043214174 /nfs/dbraw/zinc/21/41/74/1043214174.db2.gz AVIGCRHPHMTYTR-MSOLQXFVSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1cnc([C@H](C)NCc2ccccc2C[N@H+]2CCCC[C@@H]2C)cn1 ZINC000427821006 1043215352 /nfs/dbraw/zinc/21/53/52/1043215352.db2.gz AVIGCRHPHMTYTR-ROUUACIJSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1cnc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)cn1 ZINC000427821006 1043215364 /nfs/dbraw/zinc/21/53/64/1043215364.db2.gz AVIGCRHPHMTYTR-ROUUACIJSA-N 2 1 338.499 4.010 20 0 EIADMP Cc1cnc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)cn1 ZINC000427821006 1043215374 /nfs/dbraw/zinc/21/53/74/1043215374.db2.gz AVIGCRHPHMTYTR-ROUUACIJSA-N 2 1 338.499 4.010 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]CC[C@H]3CCCC[N@@H+]3C)oc21 ZINC000543518910 1043236298 /nfs/dbraw/zinc/23/62/98/1043236298.db2.gz SSAQEGDKPNAMNN-DOTOQJQBSA-N 2 1 330.472 4.357 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]CC[C@H]3CCCC[N@H+]3C)oc21 ZINC000543518910 1043236307 /nfs/dbraw/zinc/23/63/07/1043236307.db2.gz SSAQEGDKPNAMNN-DOTOQJQBSA-N 2 1 330.472 4.357 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CC[C@H]3CCCC[N@@H+]3C)oc21 ZINC000543518911 1043237108 /nfs/dbraw/zinc/23/71/08/1043237108.db2.gz SSAQEGDKPNAMNN-NVXWUHKLSA-N 2 1 330.472 4.357 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CC[C@H]3CCCC[N@H+]3C)oc21 ZINC000543518911 1043237120 /nfs/dbraw/zinc/23/71/20/1043237120.db2.gz SSAQEGDKPNAMNN-NVXWUHKLSA-N 2 1 330.472 4.357 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@@H+]2CCC[C@H]2CCCc2ccccc2)s1 ZINC000347859282 1043242243 /nfs/dbraw/zinc/24/22/43/1043242243.db2.gz QMUQXAPGMMSDSI-GOSISDBHSA-N 2 1 343.540 4.192 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@H+]2CCC[C@H]2CCCc2ccccc2)s1 ZINC000347859282 1043242252 /nfs/dbraw/zinc/24/22/52/1043242252.db2.gz QMUQXAPGMMSDSI-GOSISDBHSA-N 2 1 343.540 4.192 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(F)cc2Cl)CCCC1 ZINC000427886275 1043248529 /nfs/dbraw/zinc/24/85/29/1043248529.db2.gz LOSFNZAAYVTJSF-KDOFPFPSSA-N 2 1 338.898 4.221 20 0 EIADMP Brc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCC2 ZINC000356682443 1043252319 /nfs/dbraw/zinc/25/23/19/1043252319.db2.gz SDWNQWRLVNSSAD-JFIYKMOQSA-N 2 1 349.316 4.043 20 0 EIADMP C[C@H](CC[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(C(F)(F)F)c1 ZINC000166755187 1043311005 /nfs/dbraw/zinc/31/10/05/1043311005.db2.gz DOSNPMUHLBNOBR-FHLIZLRMSA-N 2 1 340.433 4.415 20 0 EIADMP C[C@H]([NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)c1cccc(O)c1 ZINC001168011832 1043353176 /nfs/dbraw/zinc/35/31/76/1043353176.db2.gz SWLIBAJODVIKML-BZSNNMDCSA-N 2 1 338.495 4.484 20 0 EIADMP c1cc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cs1 ZINC000520811513 1043391190 /nfs/dbraw/zinc/39/11/90/1043391190.db2.gz KOWGQOJNNFNKAT-LJQANCHMSA-N 2 1 326.509 4.077 20 0 EIADMP c1cc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cs1 ZINC000520811513 1043391203 /nfs/dbraw/zinc/39/12/03/1043391203.db2.gz KOWGQOJNNFNKAT-LJQANCHMSA-N 2 1 326.509 4.077 20 0 EIADMP COCC[N@@H+](C)CC[C@@H](N[C@H](C)c1cccs1)c1ccccc1 ZINC000165985493 1043411820 /nfs/dbraw/zinc/41/18/20/1043411820.db2.gz IUGVXLXLOZMACR-SJLPKXTDSA-N 2 1 332.513 4.108 20 0 EIADMP COCCN(C)CC[C@@H]([NH2+][C@H](C)c1cccs1)c1ccccc1 ZINC000165985493 1043411835 /nfs/dbraw/zinc/41/18/35/1043411835.db2.gz IUGVXLXLOZMACR-SJLPKXTDSA-N 2 1 332.513 4.108 20 0 EIADMP Cc1nc2ccc(C[NH2+]CCC[N@H+](C)Cc3ccccc3)cc2s1 ZINC000494348383 1043427474 /nfs/dbraw/zinc/42/74/74/1043427474.db2.gz MDZDHLKRHGAQOB-UHFFFAOYSA-N 2 1 339.508 4.216 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3cccnc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012551 1043431874 /nfs/dbraw/zinc/43/18/74/1043431874.db2.gz BWXRMZUZGKPNTO-UDKICSLYSA-N 2 1 349.522 4.490 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3cccnc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168012551 1043431889 /nfs/dbraw/zinc/43/18/89/1043431889.db2.gz BWXRMZUZGKPNTO-UDKICSLYSA-N 2 1 349.522 4.490 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000674305333 1043572195 /nfs/dbraw/zinc/57/21/95/1043572195.db2.gz HLJLUXFJGCJIAM-QAPCUYQASA-N 2 1 342.449 4.300 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000674305333 1043572215 /nfs/dbraw/zinc/57/22/15/1043572215.db2.gz HLJLUXFJGCJIAM-QAPCUYQASA-N 2 1 342.449 4.300 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000674305333 1043572222 /nfs/dbraw/zinc/57/22/22/1043572222.db2.gz HLJLUXFJGCJIAM-QAPCUYQASA-N 2 1 342.449 4.300 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CC[N@@H+]1C ZINC000467439870 1043579311 /nfs/dbraw/zinc/57/93/11/1043579311.db2.gz YBRMTJZSGKCQEM-NMFUWQPSSA-N 2 1 327.299 4.312 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CC[N@H+]1C ZINC000467439870 1043579325 /nfs/dbraw/zinc/57/93/25/1043579325.db2.gz YBRMTJZSGKCQEM-NMFUWQPSSA-N 2 1 327.299 4.312 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000543064434 1043713610 /nfs/dbraw/zinc/71/36/10/1043713610.db2.gz LUJDGBMYZOMMTP-OKKATSDQSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000543064434 1043713626 /nfs/dbraw/zinc/71/36/26/1043713626.db2.gz LUJDGBMYZOMMTP-OKKATSDQSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000681394488 1043734005 /nfs/dbraw/zinc/73/40/05/1043734005.db2.gz SHHQWXJWQPWNHM-TYPHKJRUSA-N 2 1 344.543 4.082 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442643128 1043789170 /nfs/dbraw/zinc/78/91/70/1043789170.db2.gz GKRLKHAVODXWFK-MAUKXSAKSA-N 2 1 340.433 4.415 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)c1ccc(Br)s1)[NH+]1CCCCC1 ZINC000542488561 1043803820 /nfs/dbraw/zinc/80/38/20/1043803820.db2.gz LMSIYBKRGBCOOU-CHWSQXEVSA-N 2 1 345.350 4.426 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCc2ccccn2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168014448 1043853775 /nfs/dbraw/zinc/85/37/75/1043853775.db2.gz LGQMTLHPYSUDFD-HATOLVCRSA-N 2 1 337.511 4.045 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000674878091 1043905941 /nfs/dbraw/zinc/90/59/41/1043905941.db2.gz BIQAGPVUEGQPLJ-VQTJNVASSA-N 2 1 347.522 4.169 20 0 EIADMP CCCCCN(C)c1ccc(F)cc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000674878091 1043905953 /nfs/dbraw/zinc/90/59/53/1043905953.db2.gz BIQAGPVUEGQPLJ-VQTJNVASSA-N 2 1 347.522 4.169 20 0 EIADMP Cc1cc(C)cc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000521833949 1044024412 /nfs/dbraw/zinc/02/44/12/1044024412.db2.gz KYQQVVDJPHCPTD-SFHVURJKSA-N 2 1 328.525 4.367 20 0 EIADMP Cc1cc(C)cc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000521833949 1044024430 /nfs/dbraw/zinc/02/44/30/1044024430.db2.gz KYQQVVDJPHCPTD-SFHVURJKSA-N 2 1 328.525 4.367 20 0 EIADMP CCc1nc(C)c([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000195137247 1044025309 /nfs/dbraw/zinc/02/53/09/1044025309.db2.gz IPPMCUBVLGIEKT-QAPCUYQASA-N 2 1 343.540 4.187 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cc(Br)cs2)CC1 ZINC000226391430 1044172715 /nfs/dbraw/zinc/17/27/15/1044172715.db2.gz NJAQHIXUKARDDD-LLVKDONJSA-N 2 1 331.323 4.036 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)CCc1ccc(C(F)(F)F)cc1 ZINC000193976770 1044224655 /nfs/dbraw/zinc/22/46/55/1044224655.db2.gz CJFVPSPFZYKJRI-AWEZNQCLSA-N 2 1 339.405 4.211 20 0 EIADMP Cc1cc(F)cc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001143590547 1044315181 /nfs/dbraw/zinc/31/51/81/1044315181.db2.gz YLYFNTXADQRBBC-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)cc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001143590547 1044315195 /nfs/dbraw/zinc/31/51/95/1044315195.db2.gz YLYFNTXADQRBBC-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001143590547 1044315205 /nfs/dbraw/zinc/31/52/05/1044315205.db2.gz YLYFNTXADQRBBC-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP Cc1cc(F)cc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001143590547 1044315218 /nfs/dbraw/zinc/31/52/18/1044315218.db2.gz YLYFNTXADQRBBC-IBGZPJMESA-N 2 1 326.459 4.088 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C1CCC(F)(F)CC1 ZINC000474079414 1044357981 /nfs/dbraw/zinc/35/79/81/1044357981.db2.gz IXISZHDEECMEMO-YQQAZPJKSA-N 2 1 328.491 4.443 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)oc1C ZINC000282358326 1044684961 /nfs/dbraw/zinc/68/49/61/1044684961.db2.gz VZZQRQURFVARHI-OAHLLOKOSA-N 2 1 345.487 4.064 20 0 EIADMP c1ccc(CC[N@@H+](CCC[NH+]2CCCCC2)Cc2cccnc2)cc1 ZINC000429303549 1044920464 /nfs/dbraw/zinc/92/04/64/1044920464.db2.gz DDKFADBPBRDOGU-UHFFFAOYSA-N 2 1 337.511 4.002 20 0 EIADMP c1ccc(CC[N@H+](CCC[NH+]2CCCCC2)Cc2cccnc2)cc1 ZINC000429303549 1044920489 /nfs/dbraw/zinc/92/04/89/1044920489.db2.gz DDKFADBPBRDOGU-UHFFFAOYSA-N 2 1 337.511 4.002 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1csc(-c2ccccc2)n1 ZINC000635003484 1045057224 /nfs/dbraw/zinc/05/72/24/1045057224.db2.gz KEMBGBVBCZDYHR-HNNXBMFYSA-N 2 1 349.503 4.307 20 0 EIADMP Fc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1Cl ZINC000237769212 1045395307 /nfs/dbraw/zinc/39/53/07/1045395307.db2.gz SPDUVHLHFFQVLB-UHFFFAOYSA-N 2 1 332.850 4.233 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CCC[C@H]1C[NH3+] ZINC001206026686 1045711828 /nfs/dbraw/zinc/71/18/28/1045711828.db2.gz TZBDZPMOSDNFDY-PWSUYJOCSA-N 2 1 335.706 4.454 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000397993098 1045821272 /nfs/dbraw/zinc/82/12/72/1045821272.db2.gz RANXRNJAFJXBEF-BHIYHBOVSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000397993101 1045821964 /nfs/dbraw/zinc/82/19/64/1045821964.db2.gz RANXRNJAFJXBEF-QRQLOZEOSA-N 2 1 336.470 4.312 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](CC)c2ccc(F)cc2)[C@H](C)C1 ZINC000246825167 1045833475 /nfs/dbraw/zinc/83/34/75/1045833475.db2.gz ADSMFFUVCAJAEV-AHRSYUTCSA-N 2 1 336.495 4.003 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccsc1 ZINC000246982208 1045837051 /nfs/dbraw/zinc/83/70/51/1045837051.db2.gz KCJAFKGVPRKVAG-IXDOHACOSA-N 2 1 344.524 4.208 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(CSC(F)F)o2)CC1 ZINC000768926783 1045861951 /nfs/dbraw/zinc/86/19/51/1045861951.db2.gz NSGCXHAPUSCJBE-UHFFFAOYSA-N 2 1 346.487 4.288 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1cc[n+](C[C@H]2CCC3(CCCCC3)O2)cc1 ZINC000249121906 1045894122 /nfs/dbraw/zinc/89/41/22/1045894122.db2.gz UEPZIYZFRQBTPZ-TZIWHRDSSA-N 2 1 343.535 4.230 20 0 EIADMP FC1(F)CCCC[C@H]1C[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170206009 1045926306 /nfs/dbraw/zinc/92/63/06/1045926306.db2.gz QGMUZIFQPJXYFS-PMACEKPBSA-N 2 1 348.481 4.410 20 0 EIADMP FC1(F)CCCC[C@H]1C[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001170206009 1045926317 /nfs/dbraw/zinc/92/63/17/1045926317.db2.gz QGMUZIFQPJXYFS-PMACEKPBSA-N 2 1 348.481 4.410 20 0 EIADMP FC1(F)CCCC[C@H]1C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001170206009 1045926326 /nfs/dbraw/zinc/92/63/26/1045926326.db2.gz QGMUZIFQPJXYFS-PMACEKPBSA-N 2 1 348.481 4.410 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(SC(F)(F)F)cc2)CC[N@@H+]1C ZINC000769484503 1045970628 /nfs/dbraw/zinc/97/06/28/1045970628.db2.gz KPBUZWKDBOLFDI-JSGCOSHPSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(SC(F)(F)F)cc2)CC[NH+]1C ZINC000769484503 1045970668 /nfs/dbraw/zinc/97/06/68/1045970668.db2.gz KPBUZWKDBOLFDI-JSGCOSHPSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(SC(F)(F)F)cc2)CC[N@H+]1C ZINC000769484503 1045970647 /nfs/dbraw/zinc/97/06/47/1045970647.db2.gz KPBUZWKDBOLFDI-JSGCOSHPSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(SC(F)(F)F)cc2)CC[NH+]1C ZINC000769484503 1045970681 /nfs/dbraw/zinc/97/06/81/1045970681.db2.gz KPBUZWKDBOLFDI-JSGCOSHPSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@H](Cc1ccccc1Cl)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001170250349 1045973144 /nfs/dbraw/zinc/97/31/44/1045973144.db2.gz KPKKZEFUQFTTAJ-MJGOQNOKSA-N 2 1 342.914 4.383 20 0 EIADMP CC(C)([NH3+])c1ccccc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001170336608 1046006500 /nfs/dbraw/zinc/00/65/00/1046006500.db2.gz AFKIVRCGEQZMRK-OWZKRDHZSA-N 2 1 349.522 4.488 20 0 EIADMP CC(C)C[C@H](C[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccccc1 ZINC000792979125 1046115144 /nfs/dbraw/zinc/11/51/44/1046115144.db2.gz YEAZNKOMKANVHH-IFMALSPDSA-N 2 1 344.543 4.049 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cccc(Br)c1 ZINC000037786205 1046159350 /nfs/dbraw/zinc/15/93/50/1046159350.db2.gz JMJGWQWFAMPNKM-ZDUSSCGKSA-N 2 1 339.321 4.363 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1cc(Br)cs1)C1CCCCC1 ZINC000037860315 1046162935 /nfs/dbraw/zinc/16/29/35/1046162935.db2.gz BZOMRAGSKDRMTQ-UHFFFAOYSA-N 2 1 345.350 4.255 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1cc(Br)cs1)C1CCCCC1 ZINC000037860315 1046162946 /nfs/dbraw/zinc/16/29/46/1046162946.db2.gz BZOMRAGSKDRMTQ-UHFFFAOYSA-N 2 1 345.350 4.255 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccccc3OC)cc2)CC1 ZINC000125249970 1046294830 /nfs/dbraw/zinc/29/48/30/1046294830.db2.gz TUFLOZUSFRJXTB-UHFFFAOYSA-N 2 1 338.495 4.278 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccccc3OC)cc2)CC1 ZINC000125249970 1046294846 /nfs/dbraw/zinc/29/48/46/1046294846.db2.gz TUFLOZUSFRJXTB-UHFFFAOYSA-N 2 1 338.495 4.278 20 0 EIADMP Cc1ccc(-c2ccc(C[N@@H+]3CCC[C@H](Cc4nccn4C)C3)o2)cc1 ZINC000508682422 1046318074 /nfs/dbraw/zinc/31/80/74/1046318074.db2.gz YCCAIVXCLMRFIB-GOSISDBHSA-N 2 1 349.478 4.443 20 0 EIADMP COCCC1(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCCC1 ZINC000508699886 1046326281 /nfs/dbraw/zinc/32/62/81/1046326281.db2.gz OYYMIPPBIMEFEE-PZJWPPBQSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@H]([NH2+]CCc1cc2ccccc2o1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508701210 1046333512 /nfs/dbraw/zinc/33/35/12/1046333512.db2.gz SHLPOKPKYKPLSH-NQIIRXRSSA-N 2 1 348.490 4.476 20 0 EIADMP CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000166227222 1046354153 /nfs/dbraw/zinc/35/41/53/1046354153.db2.gz KMVKARBQAAMMFX-MISYRCLQSA-N 2 1 330.516 4.011 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)[C@@H](C)c2nc3ccccc3s2)C1 ZINC000125857726 1046356994 /nfs/dbraw/zinc/35/69/94/1046356994.db2.gz JGIVLSNKGKSIEI-IKGGRYGDSA-N 2 1 345.556 4.498 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508709194 1046359835 /nfs/dbraw/zinc/35/98/35/1046359835.db2.gz GMDXFVKHFKIQPO-XSEFMFLKSA-N 2 1 334.507 4.118 20 0 EIADMP C[C@H]([NH2+]CCc1cc(F)cc(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508712200 1046369198 /nfs/dbraw/zinc/36/91/98/1046369198.db2.gz CHGFJHWTZUOCLR-QFBILLFUSA-N 2 1 344.449 4.008 20 0 EIADMP CCCC[C@@H](COC)Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000154203185 1046382649 /nfs/dbraw/zinc/38/26/49/1046382649.db2.gz SORMDIGSMUXDPK-FQEVSTJZSA-N 2 1 347.547 4.082 20 0 EIADMP CC(C)=CCC[C@H](C)CC[NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1 ZINC000916839989 1046384552 /nfs/dbraw/zinc/38/45/52/1046384552.db2.gz VIWPYABZPOVNNG-KRWDZBQOSA-N 2 1 326.488 4.438 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000508722034 1046422930 /nfs/dbraw/zinc/42/29/30/1046422930.db2.gz QUTGCHMSSXOLLZ-NQIIRXRSSA-N 2 1 338.495 4.004 20 0 EIADMP COCc1ccccc1/C=C(/C)CN(C)CC[C@@H]1CCCC[N@H+]1C ZINC000508742998 1046493256 /nfs/dbraw/zinc/49/32/56/1046493256.db2.gz IOKVETOHESQPCX-TXOBRMIJSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000508742998 1046493265 /nfs/dbraw/zinc/49/32/65/1046493265.db2.gz IOKVETOHESQPCX-TXOBRMIJSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000508742998 1046493272 /nfs/dbraw/zinc/49/32/72/1046493272.db2.gz IOKVETOHESQPCX-TXOBRMIJSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(/C)C[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC000508742998 1046493281 /nfs/dbraw/zinc/49/32/81/1046493281.db2.gz IOKVETOHESQPCX-TXOBRMIJSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(/C)C[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC000508742998 1046493287 /nfs/dbraw/zinc/49/32/87/1046493287.db2.gz IOKVETOHESQPCX-TXOBRMIJSA-N 2 1 330.516 4.043 20 0 EIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CCCO2 ZINC000126535976 1046493528 /nfs/dbraw/zinc/49/35/28/1046493528.db2.gz XDDJVTJLBSAVKD-UZLBHIALSA-N 2 1 328.500 4.098 20 0 EIADMP CC[C@@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C1CCCCC1 ZINC000162789179 1046521634 /nfs/dbraw/zinc/52/16/34/1046521634.db2.gz CXHMYIGBACRFHI-HXUWFJFHSA-N 2 1 347.547 4.452 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CC[C@H](c4ccccc4)C3)CC2)[nH+]1 ZINC000127049073 1046596212 /nfs/dbraw/zinc/59/62/12/1046596212.db2.gz PZLNNIRXJVNTCU-FPOVZHCZSA-N 2 1 335.495 4.285 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c3ccccc23)C[C@@H]1C ZINC000536659336 1046608345 /nfs/dbraw/zinc/60/83/45/1046608345.db2.gz WUPZOLPGGRKQMT-WMZOPIPTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OC)c3ccccc23)C[C@@H]1C ZINC000536659336 1046608352 /nfs/dbraw/zinc/60/83/52/1046608352.db2.gz WUPZOLPGGRKQMT-WMZOPIPTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(OC)c3ccccc23)C[C@@H]1C ZINC000536659336 1046608365 /nfs/dbraw/zinc/60/83/65/1046608365.db2.gz WUPZOLPGGRKQMT-WMZOPIPTSA-N 2 1 326.484 4.153 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c3ccccc23)C[C@@H]1C ZINC000536659334 1046608554 /nfs/dbraw/zinc/60/85/54/1046608554.db2.gz WUPZOLPGGRKQMT-FUHWJXTLSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OC)c3ccccc23)C[C@@H]1C ZINC000536659334 1046608564 /nfs/dbraw/zinc/60/85/64/1046608564.db2.gz WUPZOLPGGRKQMT-FUHWJXTLSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(OC)c3ccccc23)C[C@@H]1C ZINC000536659334 1046608579 /nfs/dbraw/zinc/60/85/79/1046608579.db2.gz WUPZOLPGGRKQMT-FUHWJXTLSA-N 2 1 326.484 4.153 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(Br)s2)C[C@@H]1C ZINC000536662004 1046634051 /nfs/dbraw/zinc/63/40/51/1046634051.db2.gz JXYWTJNXUBXDQY-STQMWFEESA-N 2 1 345.350 4.124 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cc(C)c(Br)s2)C[C@@H]1C ZINC000536662004 1046634036 /nfs/dbraw/zinc/63/40/36/1046634036.db2.gz JXYWTJNXUBXDQY-STQMWFEESA-N 2 1 345.350 4.124 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(Br)s2)C[C@@H]1C ZINC000536662004 1046634043 /nfs/dbraw/zinc/63/40/43/1046634043.db2.gz JXYWTJNXUBXDQY-STQMWFEESA-N 2 1 345.350 4.124 20 0 EIADMP Clc1ccc(CCC[NH2+]C2CC[NH+](C3CC3)CC2)c(Cl)c1 ZINC000459420865 1046649217 /nfs/dbraw/zinc/64/92/17/1046649217.db2.gz GQOJDNZZUNUSNB-UHFFFAOYSA-N 2 1 327.299 4.142 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CC[C@H](c4ccccc4)C3)CC2)[nH+]c1 ZINC000127365149 1046656808 /nfs/dbraw/zinc/65/68/08/1046656808.db2.gz GBJCZTRKKSVJRG-PZJWPPBQSA-N 2 1 335.495 4.285 20 0 EIADMP CCOc1ccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000536673519 1046658865 /nfs/dbraw/zinc/65/88/65/1046658865.db2.gz YJVXHBHEQGHSPB-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CCOc1ccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000536673519 1046658869 /nfs/dbraw/zinc/65/88/69/1046658869.db2.gz YJVXHBHEQGHSPB-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP CCOc1ccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000536673519 1046658883 /nfs/dbraw/zinc/65/88/83/1046658883.db2.gz YJVXHBHEQGHSPB-NRFANRHFSA-N 2 1 338.495 4.039 20 0 EIADMP Cc1nc2c(n1[C@@H]1CC[N@@H+](CC3CCC(F)(F)CC3)C1)CCCC2 ZINC000459434143 1046669043 /nfs/dbraw/zinc/66/90/43/1046669043.db2.gz UHTILLHWSDLPDJ-MRXNPFEDSA-N 2 1 337.458 4.143 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@H+](CC3CCC(F)(F)CC3)C1)CCCC2 ZINC000459434143 1046669054 /nfs/dbraw/zinc/66/90/54/1046669054.db2.gz UHTILLHWSDLPDJ-MRXNPFEDSA-N 2 1 337.458 4.143 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@@H+](CC3CCC(F)(F)CC3)C1)CCCC2 ZINC000459434143 1046669064 /nfs/dbraw/zinc/66/90/64/1046669064.db2.gz UHTILLHWSDLPDJ-MRXNPFEDSA-N 2 1 337.458 4.143 20 0 EIADMP C[C@H]1C[C@H](NCc2cc(F)ccc2F)CC[N@H+]1Cc1ccccc1 ZINC000379624357 1046716895 /nfs/dbraw/zinc/71/68/95/1046716895.db2.gz JPDRXTPSILBZSN-HNAYVOBHSA-N 2 1 330.422 4.108 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCSc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379633878 1046731551 /nfs/dbraw/zinc/73/15/51/1046731551.db2.gz URYGALTTXQCGGD-UYAOXDASSA-N 2 1 340.536 4.421 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCSc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379633878 1046731565 /nfs/dbraw/zinc/73/15/65/1046731565.db2.gz URYGALTTXQCGGD-UYAOXDASSA-N 2 1 340.536 4.421 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCSc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379633875 1046731924 /nfs/dbraw/zinc/73/19/24/1046731924.db2.gz URYGALTTXQCGGD-QUCCMNQESA-N 2 1 340.536 4.421 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCSc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379633875 1046731943 /nfs/dbraw/zinc/73/19/43/1046731943.db2.gz URYGALTTXQCGGD-QUCCMNQESA-N 2 1 340.536 4.421 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3c2cccc3O)CC[N@@H+]1Cc1ccccc1 ZINC000379652751 1046743838 /nfs/dbraw/zinc/74/38/38/1046743838.db2.gz XWHZUOBYBCVFGC-BLIXFSHQSA-N 2 1 336.479 4.022 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3c2cccc3O)CC[N@H+]1Cc1ccccc1 ZINC000379652751 1046743852 /nfs/dbraw/zinc/74/38/52/1046743852.db2.gz XWHZUOBYBCVFGC-BLIXFSHQSA-N 2 1 336.479 4.022 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379641551 1046745021 /nfs/dbraw/zinc/74/50/21/1046745021.db2.gz YKEBXQKZHBLVLA-BBTUJRGHSA-N 2 1 338.495 4.399 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000536832776 1046810112 /nfs/dbraw/zinc/81/01/12/1046810112.db2.gz NDZRRNFYLCXKLR-AZUAARDMSA-N 2 1 342.527 4.391 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000536832776 1046810114 /nfs/dbraw/zinc/81/01/14/1046810114.db2.gz NDZRRNFYLCXKLR-AZUAARDMSA-N 2 1 342.527 4.391 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000459723559 1046864524 /nfs/dbraw/zinc/86/45/24/1046864524.db2.gz ADDZODQHPOSTON-APIJFGDWSA-N 2 1 326.937 4.215 20 0 EIADMP COc1ccc([C@H]([NH2+]CCCC[N@H+]2CCC[C@H](C)C2)C2CC2)cc1 ZINC000536946955 1046877024 /nfs/dbraw/zinc/87/70/24/1046877024.db2.gz BRUZMNDYWFAMTK-LAUBAEHRSA-N 2 1 330.516 4.248 20 0 EIADMP COc1ccccc1[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)C1CCCC1 ZINC000537016899 1046887816 /nfs/dbraw/zinc/88/78/16/1046887816.db2.gz ZETMDPSXBMXEPC-HRAATJIYSA-N 2 1 341.499 4.357 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536998058 1046890207 /nfs/dbraw/zinc/89/02/07/1046890207.db2.gz CYABIDFZTKQNEC-PBHICJAKSA-N 2 1 328.422 4.334 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC000537012368 1046895161 /nfs/dbraw/zinc/89/51/61/1046895161.db2.gz NLUPBYLGVCGYIS-UWVAXJGDSA-N 2 1 329.532 4.338 20 0 EIADMP CC[NH+](CC)Cc1cc([C@@H](C)Nc2cc(C)cc[nH+]2)ccc1OC ZINC000537406378 1047199343 /nfs/dbraw/zinc/19/93/43/1047199343.db2.gz GQEHARHOJVPVDG-MRXNPFEDSA-N 2 1 327.472 4.414 20 0 EIADMP c1[nH+]c(C2CC[NH+](C[C@H]3CCc4ccccc43)CC2)n2c1CCCC2 ZINC000789351995 1047402268 /nfs/dbraw/zinc/40/22/68/1047402268.db2.gz BRJGFZOTQJDLQE-LJQANCHMSA-N 2 1 335.495 4.129 20 0 EIADMP CC(C)c1nc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cs1 ZINC000556075644 1047433336 /nfs/dbraw/zinc/43/33/36/1047433336.db2.gz DGGBLIQOHPWMPT-PKOBYXMFSA-N 2 1 343.540 4.234 20 0 EIADMP CC(C)c1nc(CC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cs1 ZINC000556075644 1047433343 /nfs/dbraw/zinc/43/33/43/1047433343.db2.gz DGGBLIQOHPWMPT-PKOBYXMFSA-N 2 1 343.540 4.234 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](Cc1ccccc1Cl)C1CC1 ZINC000556093845 1047443904 /nfs/dbraw/zinc/44/39/04/1047443904.db2.gz NNTQBMAVVMLKHM-LJQANCHMSA-N 2 1 331.891 4.236 20 0 EIADMP Cc1cccc2c(CC[NH2+][C@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)c[nH]c21 ZINC000556094498 1047446001 /nfs/dbraw/zinc/44/60/01/1047446001.db2.gz YIBDYVAFIWUWRI-RBBKRZOGSA-N 2 1 347.506 4.444 20 0 EIADMP Cc1cccc2c(CC[NH2+][C@H]3CC[N@H+](C)[C@@H](c4ccccc4)C3)c[nH]c21 ZINC000556094498 1047446004 /nfs/dbraw/zinc/44/60/04/1047446004.db2.gz YIBDYVAFIWUWRI-RBBKRZOGSA-N 2 1 347.506 4.444 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793518 1047482559 /nfs/dbraw/zinc/48/25/59/1047482559.db2.gz NYKKORCOSLZHGD-RBUKOAKNSA-N 2 1 344.568 4.447 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793518 1047482563 /nfs/dbraw/zinc/48/25/63/1047482563.db2.gz NYKKORCOSLZHGD-RBUKOAKNSA-N 2 1 344.568 4.447 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)C1CCOCC1 ZINC000129873321 1047520298 /nfs/dbraw/zinc/52/02/98/1047520298.db2.gz AHDQUUPDXITJRV-GOSISDBHSA-N 2 1 344.543 4.356 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)[C@H]1CCOC1 ZINC000129871082 1047521749 /nfs/dbraw/zinc/52/17/49/1047521749.db2.gz JVLZYAAJTGNTJR-RBBKRZOGSA-N 2 1 344.543 4.356 20 0 EIADMP COC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCC(C)CC1 ZINC000556178734 1047538555 /nfs/dbraw/zinc/53/85/55/1047538555.db2.gz MYQNURRZZDHKRU-FPGXKEGCSA-N 2 1 330.516 4.007 20 0 EIADMP COC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCC(C)CC1 ZINC000556178734 1047538569 /nfs/dbraw/zinc/53/85/69/1047538569.db2.gz MYQNURRZZDHKRU-FPGXKEGCSA-N 2 1 330.516 4.007 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cn2ccccc2n1 ZINC000556234051 1047598610 /nfs/dbraw/zinc/59/86/10/1047598610.db2.gz MYJKAGIILODOQX-KRWDZBQOSA-N 2 1 336.483 4.025 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cn2ccccc2n1 ZINC000556234051 1047598615 /nfs/dbraw/zinc/59/86/15/1047598615.db2.gz MYJKAGIILODOQX-KRWDZBQOSA-N 2 1 336.483 4.025 20 0 EIADMP 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 1047604428 /nfs/dbraw/zinc/60/44/28/1047604428.db2.gz IJXZORJHTHZLMA-ZIOPUJRMSA-N 2 1 341.326 4.415 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCOC2CCCCC2)C[C@@H]1c1ccccc1 ZINC000550606704 1047757562 /nfs/dbraw/zinc/75/75/62/1047757562.db2.gz JGPMDDKYJJKDPV-TZIWHRDSSA-N 2 1 330.516 4.151 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCCOC2CCCCC2)C[C@@H]1c1ccccc1 ZINC000550606704 1047757578 /nfs/dbraw/zinc/75/75/78/1047757578.db2.gz JGPMDDKYJJKDPV-TZIWHRDSSA-N 2 1 330.516 4.151 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@H]2CC2(Cl)Cl)CC1 ZINC000763435100 1047804947 /nfs/dbraw/zinc/80/49/47/1047804947.db2.gz YZZGPKOSEOTUKB-GDBMZVCRSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556609729 1047840033 /nfs/dbraw/zinc/84/00/33/1047840033.db2.gz ACGYCMVZISSDPG-PBFPGSCMSA-N 2 1 349.931 4.282 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556609729 1047840034 /nfs/dbraw/zinc/84/00/34/1047840034.db2.gz ACGYCMVZISSDPG-PBFPGSCMSA-N 2 1 349.931 4.282 20 0 EIADMP CCSCCC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000814172779 1047865439 /nfs/dbraw/zinc/86/54/39/1047865439.db2.gz CQAKUFGKYMUPOQ-IHWFROFDSA-N 2 1 332.557 4.305 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+]C1(c2ccc(Br)cc2)CCCC1 ZINC000499052322 1048107891 /nfs/dbraw/zinc/10/78/91/1048107891.db2.gz BIEJVKKZGHDTGZ-UHFFFAOYSA-N 2 1 348.288 4.013 20 0 EIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170755458 1048108800 /nfs/dbraw/zinc/10/88/00/1048108800.db2.gz BSVCCCSJIMCBAZ-WKCHPHFGSA-N 2 1 326.528 4.408 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CC(C)(C)OC2(C)C)CC1 ZINC000556893306 1048139383 /nfs/dbraw/zinc/13/93/83/1048139383.db2.gz UEHMAOCQFRSXNY-MHJFOBGBSA-N 2 1 344.543 4.365 20 0 EIADMP COc1cccc(C2([NH2+]C3CC[NH+]([C@@H]4CCC[C@H](C)C4)CC3)CC2)c1 ZINC000556914792 1048212347 /nfs/dbraw/zinc/21/23/47/1048212347.db2.gz CTWZEXFUAISYJR-FXAWDEMLSA-N 2 1 342.527 4.317 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)C[C@@H]3CC3(Cl)Cl)C2)s1 ZINC000844327405 1048285339 /nfs/dbraw/zinc/28/53/39/1048285339.db2.gz CIFRSXNLMBQUAK-KBPBESRZSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)C[C@@H]3CC3(Cl)Cl)C2)s1 ZINC000844327405 1048285350 /nfs/dbraw/zinc/28/53/50/1048285350.db2.gz CIFRSXNLMBQUAK-KBPBESRZSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C[C@@H]3CC3(Cl)Cl)C2)s1 ZINC000844327405 1048285359 /nfs/dbraw/zinc/28/53/59/1048285359.db2.gz CIFRSXNLMBQUAK-KBPBESRZSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)C[C@@H]3CC3(Cl)Cl)C2)s1 ZINC000844327405 1048285369 /nfs/dbraw/zinc/28/53/69/1048285369.db2.gz CIFRSXNLMBQUAK-KBPBESRZSA-N 2 1 347.355 4.004 20 0 EIADMP CC(C)[NH+]1CCC(C[N@H+](C)Cc2c(Cl)ccc(F)c2F)CC1 ZINC001143956777 1048316626 /nfs/dbraw/zinc/31/66/26/1048316626.db2.gz DLCPFMIBRQPTHY-UHFFFAOYSA-N 2 1 330.850 4.170 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2c(Cl)ccc(F)c2F)CC1 ZINC001143956777 1048316640 /nfs/dbraw/zinc/31/66/40/1048316640.db2.gz DLCPFMIBRQPTHY-UHFFFAOYSA-N 2 1 330.850 4.170 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000499149853 1048357960 /nfs/dbraw/zinc/35/79/60/1048357960.db2.gz UXTHIQFBKQPVCX-PKOBYXMFSA-N 2 1 341.886 4.226 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000499149853 1048357969 /nfs/dbraw/zinc/35/79/69/1048357969.db2.gz UXTHIQFBKQPVCX-PKOBYXMFSA-N 2 1 341.886 4.226 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1F ZINC000499159619 1048368912 /nfs/dbraw/zinc/36/89/12/1048368912.db2.gz VTWZZCFEDRGFNC-MZADTFQBSA-N 2 1 338.470 4.419 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@](C)(Cc1ccc(Cl)cc1)C(C)C ZINC001170583013 1048408013 /nfs/dbraw/zinc/40/80/13/1048408013.db2.gz WGKNEJOFYDSAJP-IBGZPJMESA-N 2 1 333.907 4.482 20 0 EIADMP Cc1ccccc1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499247080 1048482186 /nfs/dbraw/zinc/48/21/86/1048482186.db2.gz UZHQWTBPJUPFIE-WBDAEOGXSA-N 2 1 334.507 4.323 20 0 EIADMP CC(C)Cc1ncc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)s1 ZINC000809738134 1048509457 /nfs/dbraw/zinc/50/94/57/1048509457.db2.gz QPZPVPOTJZHLFS-UHFFFAOYSA-N 2 1 331.529 4.035 20 0 EIADMP CC(C)Cc1ncc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)s1 ZINC000809738134 1048509471 /nfs/dbraw/zinc/50/94/71/1048509471.db2.gz QPZPVPOTJZHLFS-UHFFFAOYSA-N 2 1 331.529 4.035 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(-n3cccc3)cc2)CC1 ZINC001144246686 1048534729 /nfs/dbraw/zinc/53/47/29/1048534729.db2.gz FNGBNJFGBZHQMD-UHFFFAOYSA-N 2 1 325.500 4.030 20 0 EIADMP Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000815575486 1048536127 /nfs/dbraw/zinc/53/61/27/1048536127.db2.gz SRZIXWDAOWFUDA-QUCCMNQESA-N 2 1 340.486 4.349 20 0 EIADMP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000815575484 1048537232 /nfs/dbraw/zinc/53/72/32/1048537232.db2.gz SRZIXWDAOWFUDA-AZUAARDMSA-N 2 1 340.486 4.349 20 0 EIADMP C[NH+](C)[C@@H](CNc1cccc(C[NH3+])c1)c1ccc(Cl)cc1Cl ZINC001170587411 1048543945 /nfs/dbraw/zinc/54/39/45/1048543945.db2.gz DPCHVEXNJQRZGC-KRWDZBQOSA-N 2 1 338.282 4.167 20 0 EIADMP Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000815622220 1048548807 /nfs/dbraw/zinc/54/88/07/1048548807.db2.gz PRERQPXJGDLASI-IEBWSBKVSA-N 2 1 326.459 4.307 20 0 EIADMP C[C@H]([NH2+]CC[C@]1(C)C[C@@]1(F)Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000846036813 1048801518 /nfs/dbraw/zinc/80/15/18/1048801518.db2.gz MKEGJTXCXXRTEE-KANFNMMFSA-N 2 1 338.898 4.191 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC[C@]1(C)C[C@@]1(F)Cl ZINC000846188816 1048838372 /nfs/dbraw/zinc/83/83/72/1048838372.db2.gz JTERVABTEPDIAM-LULLPPNCSA-N 2 1 338.898 4.191 20 0 EIADMP c1nc2cc(C[N@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ccc2s1 ZINC001144737125 1048840007 /nfs/dbraw/zinc/84/00/07/1048840007.db2.gz NTQNFMCILWKSIN-QGZVFWFLSA-N 2 1 329.513 4.137 20 0 EIADMP c1nc2cc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ccc2s1 ZINC001144737125 1048840012 /nfs/dbraw/zinc/84/00/12/1048840012.db2.gz NTQNFMCILWKSIN-QGZVFWFLSA-N 2 1 329.513 4.137 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000846796461 1048899225 /nfs/dbraw/zinc/89/92/25/1048899225.db2.gz KILPZZHKQVKCIF-QGZVFWFLSA-N 2 1 337.389 4.209 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000846796461 1048899227 /nfs/dbraw/zinc/89/92/27/1048899227.db2.gz KILPZZHKQVKCIF-QGZVFWFLSA-N 2 1 337.389 4.209 20 0 EIADMP CCCC[C@H](C[NH3+])[NH2+][C@@H](C)c1ccc(SC(F)F)c(OC)c1 ZINC000817963092 1049070128 /nfs/dbraw/zinc/07/01/28/1049070128.db2.gz MXWQOLUDUIVXQQ-WCQYABFASA-N 2 1 332.460 4.178 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170933619 1049353171 /nfs/dbraw/zinc/35/31/71/1049353171.db2.gz IODGJOCXNRQZGZ-SFHVURJKSA-N 2 1 334.935 4.250 20 0 EIADMP C[C@@H](CC[NH2+][C@H]1CCCNc2ccccc21)[N@@H+](C)Cc1ccccc1 ZINC000348097584 1049416841 /nfs/dbraw/zinc/41/68/41/1049416841.db2.gz WQQBUJDVEKAHFB-AVRDEDQJSA-N 2 1 337.511 4.434 20 0 EIADMP CC(C)COC[C@@H]([NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1)c1ccco1 ZINC000820808373 1049554294 /nfs/dbraw/zinc/55/42/94/1049554294.db2.gz DPIXASSLUBGTHB-FXAWDEMLSA-N 2 1 344.499 4.406 20 0 EIADMP Clc1ccccc1C[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccoc1 ZINC000820807864 1049555036 /nfs/dbraw/zinc/55/50/36/1049555036.db2.gz SLJHQHGLYBTXAI-FOIQADDNSA-N 2 1 344.886 4.291 20 0 EIADMP Clc1ccccc1C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccoc1 ZINC000820807864 1049555060 /nfs/dbraw/zinc/55/50/60/1049555060.db2.gz SLJHQHGLYBTXAI-FOIQADDNSA-N 2 1 344.886 4.291 20 0 EIADMP Cc1cc(C[NH+](C)C)cc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1 ZINC000820836050 1049565160 /nfs/dbraw/zinc/56/51/60/1049565160.db2.gz IZFYUQIMOOCFGF-GCJKJVERSA-N 2 1 337.511 4.132 20 0 EIADMP CC(F)(F)C(C)(C)C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716715758 1049704763 /nfs/dbraw/zinc/70/47/63/1049704763.db2.gz DNQATEGATDXOIW-BZSNNMDCSA-N 2 1 336.470 4.311 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc3ccccc3)C[C@@H]1C)C2 ZINC001171563878 1049756876 /nfs/dbraw/zinc/75/68/76/1049756876.db2.gz OISKXLRSWMYDSS-NGYIFUPDSA-N 2 1 348.534 4.353 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)C[C@@H]1C)C2 ZINC001171563878 1049756881 /nfs/dbraw/zinc/75/68/81/1049756881.db2.gz OISKXLRSWMYDSS-NGYIFUPDSA-N 2 1 348.534 4.353 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C)C2 ZINC001171573124 1049759949 /nfs/dbraw/zinc/75/99/49/1049759949.db2.gz GNFQTFOEDBDFRO-PWRODBHTSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C)C2 ZINC001171573124 1049759958 /nfs/dbraw/zinc/75/99/58/1049759958.db2.gz GNFQTFOEDBDFRO-PWRODBHTSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C)C2 ZINC001171573124 1049759966 /nfs/dbraw/zinc/75/99/66/1049759966.db2.gz GNFQTFOEDBDFRO-PWRODBHTSA-N 2 1 326.528 4.191 20 0 EIADMP CC(C)c1noc([C@@H]2CCC[N@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)n1 ZINC001171639728 1049779756 /nfs/dbraw/zinc/77/97/56/1049779756.db2.gz QWVHYFXUQGELIU-OAHLLOKOSA-N 2 1 348.535 4.024 20 0 EIADMP Cc1c(CC[NH3+])c2ccccc2n1[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727253 1049785385 /nfs/dbraw/zinc/78/53/85/1049785385.db2.gz TXZBBCIPFWARSQ-XLIONFOSSA-N 2 1 347.506 4.286 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2cccc(F)c2C1 ZINC001171005854 1049819680 /nfs/dbraw/zinc/81/96/80/1049819680.db2.gz RMTJOBAMWPCHOP-GBESFXJTSA-N 2 1 330.491 4.022 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2cccc(F)c2C1 ZINC001171005856 1049820105 /nfs/dbraw/zinc/82/01/05/1049820105.db2.gz RMTJOBAMWPCHOP-OTWHNJEPSA-N 2 1 330.491 4.022 20 0 EIADMP CC1(C)C[C@H]([NH2+]C2Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001171962351 1049825159 /nfs/dbraw/zinc/82/51/59/1049825159.db2.gz COAWYPCSPPPLFJ-OAQYLSRUSA-N 2 1 334.507 4.187 20 0 EIADMP CC1(C)C[C@H](Nc2cccc(F)c2C[NH3+])CC[N@H+]1Cc1ccccc1 ZINC001171967721 1049828317 /nfs/dbraw/zinc/82/83/17/1049828317.db2.gz MWUVPQVTWSFRPQ-QGZVFWFLSA-N 2 1 341.474 4.140 20 0 EIADMP CC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC(F)(F)C1 ZINC001171970617 1049834700 /nfs/dbraw/zinc/83/47/00/1049834700.db2.gz DQRYNWZWIKRYBA-KRWDZBQOSA-N 2 1 336.470 4.455 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCCc2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC001171972823 1049835735 /nfs/dbraw/zinc/83/57/35/1049835735.db2.gz SRQRDIYIQFTWOL-NRFANRHFSA-N 2 1 337.511 4.047 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCCC(F)(F)F)CC[N@H+]1Cc1ccccc1 ZINC001171974158 1049836143 /nfs/dbraw/zinc/83/61/43/1049836143.db2.gz CLRKUUYUIZJXLX-MRXNPFEDSA-N 2 1 328.422 4.362 20 0 EIADMP CCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CCOCC1 ZINC001171977807 1049837766 /nfs/dbraw/zinc/83/77/66/1049837766.db2.gz HBOXDXFTJDWBIC-HXUWFJFHSA-N 2 1 344.543 4.226 20 0 EIADMP CC1(C)C[C@@H]([NH+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001171982376 1049839161 /nfs/dbraw/zinc/83/91/61/1049839161.db2.gz RHRIFDWWVCSZOK-OTWHNJEPSA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001171982376 1049839163 /nfs/dbraw/zinc/83/91/63/1049839163.db2.gz RHRIFDWWVCSZOK-OTWHNJEPSA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001171982376 1049839164 /nfs/dbraw/zinc/83/91/64/1049839164.db2.gz RHRIFDWWVCSZOK-OTWHNJEPSA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@@H](Nc2ccc(C[NH3+])c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC001171978852 1049839334 /nfs/dbraw/zinc/83/93/34/1049839334.db2.gz MKHUWCKTXUDMJQ-IBGZPJMESA-N 2 1 341.474 4.140 20 0 EIADMP CC(C)[N@H+](CCCCCO)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171986810 1049840475 /nfs/dbraw/zinc/84/04/75/1049840475.db2.gz MNRPQPKHQQCBPA-OAQYLSRUSA-N 2 1 346.559 4.303 20 0 EIADMP CC(C)[N@@H+](CCCCCO)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171986810 1049840476 /nfs/dbraw/zinc/84/04/76/1049840476.db2.gz MNRPQPKHQQCBPA-OAQYLSRUSA-N 2 1 346.559 4.303 20 0 EIADMP CC(C)[NH+](CCCCCO)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171986810 1049840480 /nfs/dbraw/zinc/84/04/80/1049840480.db2.gz MNRPQPKHQQCBPA-OAQYLSRUSA-N 2 1 346.559 4.303 20 0 EIADMP CC(C)[NH+](CCCCCO)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171986810 1049840482 /nfs/dbraw/zinc/84/04/82/1049840482.db2.gz MNRPQPKHQQCBPA-OAQYLSRUSA-N 2 1 346.559 4.303 20 0 EIADMP CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H]2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1 ZINC000245733934 1049842736 /nfs/dbraw/zinc/84/27/36/1049842736.db2.gz JKMZBJHCGZSSOA-SQGPQFPESA-N 2 1 340.515 4.195 20 0 EIADMP CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H]2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1 ZINC000245733934 1049842738 /nfs/dbraw/zinc/84/27/38/1049842738.db2.gz JKMZBJHCGZSSOA-SQGPQFPESA-N 2 1 340.515 4.195 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@@H]2CCc4cccnc42)C3)cc1 ZINC001172073569 1049844849 /nfs/dbraw/zinc/84/48/49/1049844849.db2.gz RZEDLHUXKUKJCE-CIAFKFPVSA-N 2 1 347.506 4.244 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@@H]2CCc4cccnc42)C3)cc1 ZINC001172073569 1049844851 /nfs/dbraw/zinc/84/48/51/1049844851.db2.gz RZEDLHUXKUKJCE-CIAFKFPVSA-N 2 1 347.506 4.244 20 0 EIADMP FC1(F)CC2(C[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)C1 ZINC001172081026 1049846792 /nfs/dbraw/zinc/84/67/92/1049846792.db2.gz ZHKNPLOIFNYULR-BWTSREIZSA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)CC2(C[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4Cc3ccccc3)C2)C1 ZINC001172081026 1049846794 /nfs/dbraw/zinc/84/67/94/1049846794.db2.gz ZHKNPLOIFNYULR-BWTSREIZSA-N 2 1 346.465 4.303 20 0 EIADMP CO[C@@H]1CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H](C)C1 ZINC001172089913 1049849029 /nfs/dbraw/zinc/84/90/29/1049849029.db2.gz SSJAVIZOBKQIMN-MBMVPVEPSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H](C)C1 ZINC001172089913 1049849033 /nfs/dbraw/zinc/84/90/33/1049849033.db2.gz SSJAVIZOBKQIMN-MBMVPVEPSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@H](C)C1 ZINC001172089913 1049849034 /nfs/dbraw/zinc/84/90/34/1049849034.db2.gz SSJAVIZOBKQIMN-MBMVPVEPSA-N 2 1 342.527 4.071 20 0 EIADMP CO[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@H](C)C1 ZINC001172089913 1049849037 /nfs/dbraw/zinc/84/90/37/1049849037.db2.gz SSJAVIZOBKQIMN-MBMVPVEPSA-N 2 1 342.527 4.071 20 0 EIADMP [NH3+]Cc1cccc(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172065756 1049851038 /nfs/dbraw/zinc/85/10/38/1049851038.db2.gz QIUDNHRGKGWTEN-KOUNCHBCSA-N 2 1 335.495 4.143 20 0 EIADMP CC1(F)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172070154 1049852846 /nfs/dbraw/zinc/85/28/46/1049852846.db2.gz XJEQHRUFXQWENX-ACDBMABISA-N 2 1 330.491 4.396 20 0 EIADMP C[C@@]1(F)CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070161 1049853211 /nfs/dbraw/zinc/85/32/11/1049853211.db2.gz XJQQPBWAQDWCRD-PLACYPQZSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@@]1(F)CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070161 1049853215 /nfs/dbraw/zinc/85/32/15/1049853215.db2.gz XJQQPBWAQDWCRD-PLACYPQZSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@@]1(F)CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070161 1049853218 /nfs/dbraw/zinc/85/32/18/1049853218.db2.gz XJQQPBWAQDWCRD-PLACYPQZSA-N 2 1 330.491 4.396 20 0 EIADMP C[C@@]1(F)CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070161 1049853221 /nfs/dbraw/zinc/85/32/21/1049853221.db2.gz XJQQPBWAQDWCRD-PLACYPQZSA-N 2 1 330.491 4.396 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1c(Cl)cccc1Cl)C2 ZINC001172102965 1049855736 /nfs/dbraw/zinc/85/57/36/1049855736.db2.gz RBUCNPBIXQSQLY-BTTYYORXSA-N 2 1 327.299 4.141 20 0 EIADMP CN1[C@@H]2CCC[C@H]1C[C@H]([N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109893 1049856600 /nfs/dbraw/zinc/85/66/00/1049856600.db2.gz GOXCATJJKNDTNZ-HRMJIJJXSA-N 3 1 347.591 4.154 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109893 1049856603 /nfs/dbraw/zinc/85/66/03/1049856603.db2.gz GOXCATJJKNDTNZ-HRMJIJJXSA-N 3 1 347.591 4.154 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109893 1049856605 /nfs/dbraw/zinc/85/66/05/1049856605.db2.gz GOXCATJJKNDTNZ-HRMJIJJXSA-N 3 1 347.591 4.154 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109893 1049856610 /nfs/dbraw/zinc/85/66/10/1049856610.db2.gz GOXCATJJKNDTNZ-HRMJIJJXSA-N 3 1 347.591 4.154 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109893 1049856611 /nfs/dbraw/zinc/85/66/11/1049856611.db2.gz GOXCATJJKNDTNZ-HRMJIJJXSA-N 3 1 347.591 4.154 20 0 EIADMP COc1ccccc1CC1(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CCC1 ZINC001172109955 1049856763 /nfs/dbraw/zinc/85/67/63/1049856763.db2.gz HIXACCNIETZDQW-ACDBMABISA-N 2 1 342.527 4.013 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C[C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172114353 1049858563 /nfs/dbraw/zinc/85/85/63/1049858563.db2.gz QVDJJZHRLFMOAD-IYWMVGAKSA-N 2 1 332.919 4.439 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C[C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172114348 1049858738 /nfs/dbraw/zinc/85/87/38/1049858738.db2.gz QVDJJZHRLFMOAD-HAGHYFMRSA-N 2 1 332.919 4.439 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172320722 1049877623 /nfs/dbraw/zinc/87/76/23/1049877623.db2.gz ZXJMHTGTDVCUPE-VNYTWHDVSA-N 2 1 332.532 4.223 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172320722 1049877625 /nfs/dbraw/zinc/87/76/25/1049877625.db2.gz ZXJMHTGTDVCUPE-VNYTWHDVSA-N 2 1 332.532 4.223 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001172322106 1049878465 /nfs/dbraw/zinc/87/84/65/1049878465.db2.gz RUIJTUXHWIEHBU-DYXWJJEUSA-N 2 1 332.532 4.082 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CCC([NH3+])(c2ccccc2Cl)CC1 ZINC001172338931 1049889137 /nfs/dbraw/zinc/88/91/37/1049889137.db2.gz ZPTRDAJAYKVULU-HOTGVXAUSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172355844 1049894360 /nfs/dbraw/zinc/89/43/60/1049894360.db2.gz WQAJDXWGMKZMFR-WOJBJXKFSA-N 2 1 346.559 4.424 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172355840 1049894736 /nfs/dbraw/zinc/89/47/36/1049894736.db2.gz WQAJDXWGMKZMFR-PMACEKPBSA-N 2 1 346.559 4.424 20 0 EIADMP CC(C)COCC[C@H](C)[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172475937 1049909250 /nfs/dbraw/zinc/90/92/50/1049909250.db2.gz NQPXAQNTCOGMRU-RBBKRZOGSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)COCC[C@H](C)[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172475937 1049909255 /nfs/dbraw/zinc/90/92/55/1049909255.db2.gz NQPXAQNTCOGMRU-RBBKRZOGSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)COCC[C@H](C)[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172475937 1049909264 /nfs/dbraw/zinc/90/92/64/1049909264.db2.gz NQPXAQNTCOGMRU-RBBKRZOGSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)OCC[C@H](C)[N@@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001172451448 1049914404 /nfs/dbraw/zinc/91/44/04/1049914404.db2.gz QASNAHSAYIBWTJ-MQGJPIDWSA-N 2 1 344.543 4.301 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1C[C@H]2c3ccccc3[C@H]([N@H+](C)C(C)C)[C@H]2C1 ZINC001172451448 1049914411 /nfs/dbraw/zinc/91/44/11/1049914411.db2.gz QASNAHSAYIBWTJ-MQGJPIDWSA-N 2 1 344.543 4.301 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1C[C@H]2c3ccccc3[C@H]([N@@H+](C)C(C)C)[C@H]2C1 ZINC001172451448 1049914428 /nfs/dbraw/zinc/91/44/28/1049914428.db2.gz QASNAHSAYIBWTJ-MQGJPIDWSA-N 2 1 344.543 4.301 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172577617 1049950666 /nfs/dbraw/zinc/95/06/66/1049950666.db2.gz VUUXLRPIAUPLKK-LBPRGKRZSA-N 2 1 330.850 4.013 20 0 EIADMP Clc1ccc2c(c1)C[C@@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001172716988 1049964140 /nfs/dbraw/zinc/96/41/40/1049964140.db2.gz CQOYCAKNRKWRDN-UXHICEINSA-N 2 1 332.919 4.148 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@H]2Cc3ccc(Cl)cc3C2)CC1 ZINC001172713688 1049971864 /nfs/dbraw/zinc/97/18/64/1049971864.db2.gz YAEREEJUGRGTMV-IHPCNDPISA-N 2 1 332.919 4.322 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc2c(c1)OCCCO2 ZINC000246856038 1050002621 /nfs/dbraw/zinc/00/26/21/1050002621.db2.gz CTIPVIOBBJWKRF-QZTJIDSGSA-N 2 1 346.515 4.011 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)[C@H](C)c2nc3ccccc3s2)C1 ZINC000247000576 1050009245 /nfs/dbraw/zinc/00/92/45/1050009245.db2.gz KRQPFRGJNKNSJB-ARFHVFGLSA-N 2 1 331.529 4.110 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)C1 ZINC000247121250 1050014624 /nfs/dbraw/zinc/01/46/24/1050014624.db2.gz REBSPULOAJQHLZ-HIFRSBDPSA-N 2 1 347.503 4.250 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)C1 ZINC000247121264 1050015348 /nfs/dbraw/zinc/01/53/48/1050015348.db2.gz REBSPULOAJQHLZ-UKRRQHHQSA-N 2 1 347.503 4.250 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000248172600 1050045560 /nfs/dbraw/zinc/04/55/60/1050045560.db2.gz VBBIDKDMYNBDSN-RDJZCZTQSA-N 2 1 341.524 4.119 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000248172600 1050045566 /nfs/dbraw/zinc/04/55/66/1050045566.db2.gz VBBIDKDMYNBDSN-RDJZCZTQSA-N 2 1 341.524 4.119 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(OC)c1 ZINC000248407653 1050055885 /nfs/dbraw/zinc/05/58/85/1050055885.db2.gz UPVBOQBIQYFPDS-ULQDDVLXSA-N 2 1 346.515 4.007 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(OC)c1 ZINC000248407653 1050055893 /nfs/dbraw/zinc/05/58/93/1050055893.db2.gz UPVBOQBIQYFPDS-ULQDDVLXSA-N 2 1 346.515 4.007 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cnn1C(C)(C)C ZINC000248738784 1050076605 /nfs/dbraw/zinc/07/66/05/1050076605.db2.gz XVXXDQCIOXZNSA-IAGOWNOFSA-N 2 1 334.552 4.109 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828483 1050167226 /nfs/dbraw/zinc/16/72/26/1050167226.db2.gz MOVPGRFNCOBVAM-DNVJHFABSA-N 2 1 349.522 4.019 20 0 EIADMP COC1(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)CCCCC1 ZINC001177266112 1050182495 /nfs/dbraw/zinc/18/24/95/1050182495.db2.gz AMYDVPCMXGDVAZ-IBGZPJMESA-N 2 1 344.543 4.500 20 0 EIADMP CCc1nc2c(s1)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)CCC2 ZINC000090586939 1050190933 /nfs/dbraw/zinc/19/09/33/1050190933.db2.gz RQXDKKINSMBAAX-CVEARBPZSA-N 2 1 335.561 4.041 20 0 EIADMP C[C@H](Cc1ccc(F)cc1Cl)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172858250 1050194933 /nfs/dbraw/zinc/19/49/33/1050194933.db2.gz KZJRDYWHKDVJAT-FSPWUOQZSA-N 2 1 338.898 4.392 20 0 EIADMP C[C@@H](Cc1ccc(F)cc1Cl)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172858253 1050195237 /nfs/dbraw/zinc/19/52/37/1050195237.db2.gz KZJRDYWHKDVJAT-KKXDTOCCSA-N 2 1 338.898 4.392 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CC(C)(C)CC(C)(C)C2)cn1 ZINC001177362672 1050203563 /nfs/dbraw/zinc/20/35/63/1050203563.db2.gz BNONACAZFABQGX-UHFFFAOYSA-N 2 1 326.488 4.270 20 0 EIADMP C[C@H]1C[N@H+](Cc2cccc(C[NH2+]C3CCC4(CCC4)CC3)c2)CCO1 ZINC001177454826 1050212982 /nfs/dbraw/zinc/21/29/82/1050212982.db2.gz ZKTZCJIBIRXSFI-SFHVURJKSA-N 2 1 342.527 4.110 20 0 EIADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH2+]C3CCC4(CCC4)CC3)c2)CCO1 ZINC001177454826 1050212992 /nfs/dbraw/zinc/21/29/92/1050212992.db2.gz ZKTZCJIBIRXSFI-SFHVURJKSA-N 2 1 342.527 4.110 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+]Cc1ccc(-c2cccc(Cl)c2)s1 ZINC001177554441 1050241335 /nfs/dbraw/zinc/24/13/35/1050241335.db2.gz YKIYLJBUZXSWBL-UHFFFAOYSA-N 2 1 331.872 4.363 20 0 EIADMP CC(C)c1ncc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC001177548782 1050251258 /nfs/dbraw/zinc/25/12/58/1050251258.db2.gz RGSPANQTMQINAE-SFHVURJKSA-N 2 1 343.540 4.268 20 0 EIADMP CC(C)c1ncc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC001177548782 1050251275 /nfs/dbraw/zinc/25/12/75/1050251275.db2.gz RGSPANQTMQINAE-SFHVURJKSA-N 2 1 343.540 4.268 20 0 EIADMP CCn1c2ccccc2c2cc(C[N@@H+]3CC[C@@H]([NH3+])[C@@H](F)CC3)ccc21 ZINC001206185068 1050264499 /nfs/dbraw/zinc/26/44/99/1050264499.db2.gz LAUDNWNDVZYORO-RBUKOAKNSA-N 2 1 339.458 4.076 20 0 EIADMP CCn1c2ccccc2c2cc(C[N@H+]3CC[C@@H]([NH3+])[C@@H](F)CC3)ccc21 ZINC001206185068 1050264505 /nfs/dbraw/zinc/26/45/05/1050264505.db2.gz LAUDNWNDVZYORO-RBUKOAKNSA-N 2 1 339.458 4.076 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)c(Cl)c2)C1 ZINC001177795549 1050303571 /nfs/dbraw/zinc/30/35/71/1050303571.db2.gz VPEUZJQTAAUGPX-QGZVFWFLSA-N 2 1 328.887 4.438 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H](Oc3ccccc3)C2)CC1 ZINC001173112377 1050310672 /nfs/dbraw/zinc/31/06/72/1050310672.db2.gz WTITZIIEUCBGQW-GRERDSQWSA-N 2 1 330.516 4.183 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H]2c2ccc(OC)cc2)CC1 ZINC001173111578 1050311009 /nfs/dbraw/zinc/31/10/09/1050311009.db2.gz HQSSXLTYSJTWNY-GRERDSQWSA-N 2 1 330.516 4.485 20 0 EIADMP c1ccc(-c2cccc(C[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)c2)nc1 ZINC000092066758 1050314586 /nfs/dbraw/zinc/31/45/86/1050314586.db2.gz JCHQEAJKRRBCGZ-NFBKMPQASA-N 2 1 347.506 4.197 20 0 EIADMP c1ccc(-c2cccc(C[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)c2)nc1 ZINC000092066758 1050314595 /nfs/dbraw/zinc/31/45/95/1050314595.db2.gz JCHQEAJKRRBCGZ-NFBKMPQASA-N 2 1 347.506 4.197 20 0 EIADMP c1ccc(-c2cccc(C[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2)nc1 ZINC000092066758 1050314599 /nfs/dbraw/zinc/31/45/99/1050314599.db2.gz JCHQEAJKRRBCGZ-NFBKMPQASA-N 2 1 347.506 4.197 20 0 EIADMP c1ccc(-c2cccc(C[N@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)c2)nc1 ZINC000092066760 1050314721 /nfs/dbraw/zinc/31/47/21/1050314721.db2.gz JCHQEAJKRRBCGZ-OFNKIYASSA-N 2 1 347.506 4.197 20 0 EIADMP c1ccc(-c2cccc(C[NH+]3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)c2)nc1 ZINC000092066760 1050314733 /nfs/dbraw/zinc/31/47/33/1050314733.db2.gz JCHQEAJKRRBCGZ-OFNKIYASSA-N 2 1 347.506 4.197 20 0 EIADMP c1ccc(-c2cccc(C[NH+]3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2)nc1 ZINC000092066760 1050314751 /nfs/dbraw/zinc/31/47/51/1050314751.db2.gz JCHQEAJKRRBCGZ-OFNKIYASSA-N 2 1 347.506 4.197 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(OC(F)F)c(Cl)c1 ZINC001177911865 1050323552 /nfs/dbraw/zinc/32/35/52/1050323552.db2.gz LQYBIGLLYMWVLM-UHFFFAOYSA-N 2 1 343.805 4.016 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1F ZINC001177919729 1050330439 /nfs/dbraw/zinc/33/04/39/1050330439.db2.gz PHBBNQCMXZDDBH-BEFAXECRSA-N 2 1 348.487 4.069 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ccc1F ZINC001177919729 1050330451 /nfs/dbraw/zinc/33/04/51/1050330451.db2.gz PHBBNQCMXZDDBH-BEFAXECRSA-N 2 1 348.487 4.069 20 0 EIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001173208752 1050367483 /nfs/dbraw/zinc/36/74/83/1050367483.db2.gz BPZSPRLQBZQCBE-BPUDTRNYSA-N 2 1 348.534 4.481 20 0 EIADMP CCc1ccc(C[C@@H](C)N(c2cccc(C)[nH+]2)C2CC[NH2+]CC2)cc1 ZINC001173249113 1050375597 /nfs/dbraw/zinc/37/55/97/1050375597.db2.gz XWQVIMGZYGGYDC-GOSISDBHSA-N 2 1 337.511 4.142 20 0 EIADMP CCCC[C@H](CC(C)C)[N@@H+]1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1 ZINC001173263854 1050387481 /nfs/dbraw/zinc/38/74/81/1050387481.db2.gz XAUAEHVGKWWTOD-QHAWAJNXSA-N 2 1 329.532 4.050 20 0 EIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2cccc(OC)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173271841 1050391696 /nfs/dbraw/zinc/39/16/96/1050391696.db2.gz RMIPXAIPMTYXTP-AFYVEPGGSA-N 2 1 330.516 4.346 20 0 EIADMP CCSC[C@@H](C)[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001173299050 1050401334 /nfs/dbraw/zinc/40/13/34/1050401334.db2.gz AIIGQEFRPFWKIF-SJLPKXTDSA-N 2 1 336.545 4.098 20 0 EIADMP CC[C@H]1CC[C@H]([NH+]2CCC3(CCC[N@H+]3Cc3c(C)noc3C)CC2)C1 ZINC001173284386 1050410557 /nfs/dbraw/zinc/41/05/57/1050410557.db2.gz ZNLMFJFMJWUCDC-OALUTQOASA-N 2 1 345.531 4.301 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cccc(Cl)n2)CC1)CC(C)C ZINC000773737031 1050430374 /nfs/dbraw/zinc/43/03/74/1050430374.db2.gz YMDAIYWJNPHXDE-UHFFFAOYSA-N 2 1 337.939 4.315 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2ncc(C(C)C)o2)CC1)CC(C)C ZINC000773737578 1050436236 /nfs/dbraw/zinc/43/62/36/1050436236.db2.gz VMUGXXZOFMGPPQ-UHFFFAOYSA-N 2 1 335.536 4.378 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ncc(C(C)C)o2)CC1)CC(C)C ZINC000773737578 1050436239 /nfs/dbraw/zinc/43/62/39/1050436239.db2.gz VMUGXXZOFMGPPQ-UHFFFAOYSA-N 2 1 335.536 4.378 20 0 EIADMP Clc1ccccc1COc1cccc(C[NH2+]CCC[NH+]2CCC2)c1 ZINC001178398585 1050451640 /nfs/dbraw/zinc/45/16/40/1050451640.db2.gz SPLDZJGQAXEZBR-UHFFFAOYSA-N 2 1 344.886 4.104 20 0 EIADMP Cc1ccccc1N(C)c1ccc(C[N@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)cc1 ZINC001206200340 1050454446 /nfs/dbraw/zinc/45/44/46/1050454446.db2.gz RDIFAKHMJAFRJT-VQTJNVASSA-N 2 1 341.474 4.024 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC[C@@H]1CCC[N@H+]1C ZINC001173540378 1050474959 /nfs/dbraw/zinc/47/49/59/1050474959.db2.gz WMLPRIWYNPAOML-HIFRSBDPSA-N 2 1 329.315 4.388 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1CCC[N@@H+](C)CC1 ZINC001173541803 1050475728 /nfs/dbraw/zinc/47/57/28/1050475728.db2.gz DAOQWMZFJIOVAQ-UKRRQHHQSA-N 2 1 329.315 4.388 20 0 EIADMP c1[nH+]cn(C2CCC3(CCc4ccccc43)CC2)c1C1CC[NH2+]CC1 ZINC001173692231 1050546219 /nfs/dbraw/zinc/54/62/19/1050546219.db2.gz SRFXLFTXBVAUKA-UHFFFAOYSA-N 2 1 335.495 4.349 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cccc3c[nH]nc32)CC[N@@H+]1Cc1ccccc1 ZINC000093318225 1050559984 /nfs/dbraw/zinc/55/99/84/1050559984.db2.gz HDEIUPFRWFGURN-UTKZUKDTSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cccc3c[nH]nc32)CC[N@H+]1Cc1ccccc1 ZINC000093318225 1050559998 /nfs/dbraw/zinc/55/99/98/1050559998.db2.gz HDEIUPFRWFGURN-UTKZUKDTSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cccc3c[nH]nc32)CC[NH+]1Cc1ccccc1 ZINC000093318225 1050560014 /nfs/dbraw/zinc/56/00/14/1050560014.db2.gz HDEIUPFRWFGURN-UTKZUKDTSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc3c[nH]nc32)CC[NH+]1Cc1ccccc1 ZINC000093318225 1050560023 /nfs/dbraw/zinc/56/00/23/1050560023.db2.gz HDEIUPFRWFGURN-UTKZUKDTSA-N 2 1 348.494 4.048 20 0 EIADMP CC(C)C[N@@H+](C)CCCNCc1c(Cl)cc(Cl)cc1N(C)C ZINC001179082374 1050627051 /nfs/dbraw/zinc/62/70/51/1050627051.db2.gz YCADUGLGMDIKSN-UHFFFAOYSA-N 2 1 346.346 4.127 20 0 EIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877914 1050815009 /nfs/dbraw/zinc/81/50/09/1050815009.db2.gz KHSXWLHZIFGZMC-GIWCCYDRSA-N 2 1 326.528 4.433 20 0 EIADMP Cc1cc(C)c(/C=C\C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877914 1050815010 /nfs/dbraw/zinc/81/50/10/1050815010.db2.gz KHSXWLHZIFGZMC-GIWCCYDRSA-N 2 1 326.528 4.433 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cc3ccccc3n2C)C1 ZINC001180031067 1050860499 /nfs/dbraw/zinc/86/04/99/1050860499.db2.gz UHHIJGXJULQVSV-RBUKOAKNSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cc3ccccc3n2C)C1 ZINC001180031067 1050860502 /nfs/dbraw/zinc/86/05/02/1050860502.db2.gz UHHIJGXJULQVSV-RBUKOAKNSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cc3ccccc3n2C)C1 ZINC001180031067 1050860506 /nfs/dbraw/zinc/86/05/06/1050860506.db2.gz UHHIJGXJULQVSV-RBUKOAKNSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cc3ccccc3n2C)C1 ZINC001180031067 1050860514 /nfs/dbraw/zinc/86/05/14/1050860514.db2.gz UHHIJGXJULQVSV-RBUKOAKNSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@@H](C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267119 1050942939 /nfs/dbraw/zinc/94/29/39/1050942939.db2.gz OSNQAAMBLHLISM-AZUAARDMSA-N 2 1 340.486 4.383 20 0 EIADMP C[C@@H](C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267119 1050942950 /nfs/dbraw/zinc/94/29/50/1050942950.db2.gz OSNQAAMBLHLISM-AZUAARDMSA-N 2 1 340.486 4.383 20 0 EIADMP C[C@@H](C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267119 1050942973 /nfs/dbraw/zinc/94/29/73/1050942973.db2.gz OSNQAAMBLHLISM-AZUAARDMSA-N 2 1 340.486 4.383 20 0 EIADMP C[C@H](CCOCc1ccccc1)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001181276817 1051195382 /nfs/dbraw/zinc/19/53/82/1051195382.db2.gz RQKBHDJMIWVGDA-DENIHFKCSA-N 2 1 344.543 4.369 20 0 EIADMP CC[N@@H+](CCc1cccs1)Cc1ccc(-n2ccnc2)cc1C ZINC001190572316 1051218293 /nfs/dbraw/zinc/21/82/93/1051218293.db2.gz UXRNQDDNZUVYIB-UHFFFAOYSA-N 2 1 325.481 4.307 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)C1 ZINC000163218043 1051241500 /nfs/dbraw/zinc/24/15/00/1051241500.db2.gz REBSPULOAJQHLZ-DZGCQCFKSA-N 2 1 347.503 4.250 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000163229481 1051289812 /nfs/dbraw/zinc/28/98/12/1051289812.db2.gz NUFZEZZDBLTINP-NVXWUHKLSA-N 2 1 341.524 4.119 20 0 EIADMP CC[N@H+]1CCCC[C@@H]1C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001182001607 1051368309 /nfs/dbraw/zinc/36/83/09/1051368309.db2.gz MGSGDZATHOBDRT-MRXNPFEDSA-N 2 1 342.508 4.446 20 0 EIADMP CCC(CC)(CCO)C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000155356444 1051410549 /nfs/dbraw/zinc/41/05/49/1051410549.db2.gz RYIRXXZCVAXVBY-MRXNPFEDSA-N 2 1 329.488 4.020 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@@H]2CCCC(C)(C)O2)CC1 ZINC001191549315 1051485956 /nfs/dbraw/zinc/48/59/56/1051485956.db2.gz AVAYVDYVVYEWAD-QUCCMNQESA-N 2 1 336.564 4.311 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000774215126 1051516410 /nfs/dbraw/zinc/51/64/10/1051516410.db2.gz VHZWPKWQKMSUPB-OWZKRDHZSA-N 2 1 338.470 4.419 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000774215126 1051516419 /nfs/dbraw/zinc/51/64/19/1051516419.db2.gz VHZWPKWQKMSUPB-OWZKRDHZSA-N 2 1 338.470 4.419 20 0 EIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+]C1CC(c2cccc(Br)c2)C1 ZINC000312516294 1051560960 /nfs/dbraw/zinc/56/09/60/1051560960.db2.gz LCIVTHMDKJNKGL-BZOOQXSSSA-N 2 1 339.321 4.013 20 0 EIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+]C1CC(c2cccc(Br)c2)C1 ZINC000312516294 1051560965 /nfs/dbraw/zinc/56/09/65/1051560965.db2.gz LCIVTHMDKJNKGL-BZOOQXSSSA-N 2 1 339.321 4.013 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1cncs1 ZINC000157012154 1051589029 /nfs/dbraw/zinc/58/90/29/1051589029.db2.gz KTIASLZVAOEJFO-INIZCTEOSA-N 2 1 329.513 4.226 20 0 EIADMP CC(=O)c1c(C)cc(C)c(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1C ZINC000157251069 1051620446 /nfs/dbraw/zinc/62/04/46/1051620446.db2.gz VDFKEBLNPQGWQZ-HXUWFJFHSA-N 2 1 342.527 4.265 20 0 EIADMP CC(=O)c1c(C)cc(C)c(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1C ZINC000157251069 1051620451 /nfs/dbraw/zinc/62/04/51/1051620451.db2.gz VDFKEBLNPQGWQZ-HXUWFJFHSA-N 2 1 342.527 4.265 20 0 EIADMP COc1ccc(-c2csc(C[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@H]3C)c2)cc1 ZINC000157653906 1051661665 /nfs/dbraw/zinc/66/16/65/1051661665.db2.gz NYURUBODSGXAKA-QEEYODRMSA-N 2 1 344.524 4.242 20 0 EIADMP CC(C)COc1cccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192323748 1051691570 /nfs/dbraw/zinc/69/15/70/1051691570.db2.gz FCNKMXJVYXYQAC-SIKLNZKXSA-N 2 1 342.527 4.170 20 0 EIADMP CC(C)COc1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001192323748 1051691578 /nfs/dbraw/zinc/69/15/78/1051691578.db2.gz FCNKMXJVYXYQAC-SIKLNZKXSA-N 2 1 342.527 4.170 20 0 EIADMP CC(C)COc1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001192323748 1051691585 /nfs/dbraw/zinc/69/15/85/1051691585.db2.gz FCNKMXJVYXYQAC-SIKLNZKXSA-N 2 1 342.527 4.170 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccccn1 ZINC000158659765 1051772944 /nfs/dbraw/zinc/77/29/44/1051772944.db2.gz ZDBXKPMCAWAMNK-OTWHNJEPSA-N 2 1 337.511 4.410 20 0 EIADMP C[C@H]1C[N@@H+](CCSc2cccc(Cl)c2)CCN1c1cc[nH+]cc1 ZINC001175775200 1051780255 /nfs/dbraw/zinc/78/02/55/1051780255.db2.gz PKGRPNGWJOMNDR-HNNXBMFYSA-N 2 1 347.915 4.038 20 0 EIADMP CC[NH+]1CCN(c2ccc(Nc3ccc4c[nH+]ccc4c3)cc2)CC1 ZINC001175780380 1051782146 /nfs/dbraw/zinc/78/21/46/1051782146.db2.gz FLHRNGBDMMWXCS-UHFFFAOYSA-N 2 1 332.451 4.120 20 0 EIADMP C[C@@H]1CC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)CC[C@@H]1C[NH3+] ZINC001205604868 1051794649 /nfs/dbraw/zinc/79/46/49/1051794649.db2.gz YIORDIYVIJNARP-UKRRQHHQSA-N 2 1 329.315 4.233 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1CCC(Cc2ccccc2)CC1)c1cccnc1 ZINC001192870390 1051819146 /nfs/dbraw/zinc/81/91/46/1051819146.db2.gz UKEFGYZLCXUSNA-IBGZPJMESA-N 2 1 337.511 4.077 20 0 EIADMP C[N@@H+]1Cc2c(Nc3ccc(C[NH3+])cc3)cccc2[C@H](c2ccccc2)C1 ZINC001175971773 1051853999 /nfs/dbraw/zinc/85/39/99/1051853999.db2.gz OPKOCWNFZZHHKG-NRFANRHFSA-N 2 1 343.474 4.466 20 0 EIADMP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000621768927 1051943886 /nfs/dbraw/zinc/94/38/86/1051943886.db2.gz WRLQDDHEMYHMCH-OKYOBFRVSA-N 2 1 334.454 4.065 20 0 EIADMP FC(F)(F)c1ccc(C2([NH2+]C3CC[NH+](C4CC4)CC3)CCC2)cc1 ZINC000621768346 1051944325 /nfs/dbraw/zinc/94/43/25/1051944325.db2.gz NKAFLGVORBQTAV-UHFFFAOYSA-N 2 1 338.417 4.301 20 0 EIADMP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000621768928 1051944344 /nfs/dbraw/zinc/94/43/44/1051944344.db2.gz WRLQDDHEMYHMCH-WJFTUGDTSA-N 2 1 334.454 4.065 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H]2C[C@H](C)c3c2cccc3Br)CC1 ZINC000159305731 1051973039 /nfs/dbraw/zinc/97/30/39/1051973039.db2.gz YBNNYZJMNOIRLO-LRDDRELGSA-N 2 1 337.305 4.071 20 0 EIADMP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)ccc1C(F)(F)F ZINC001184301171 1051982520 /nfs/dbraw/zinc/98/25/20/1051982520.db2.gz GARQDWZFRRPWTE-GVDBMIGSSA-N 2 1 340.433 4.176 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000166173048 1052087174 /nfs/dbraw/zinc/08/71/74/1052087174.db2.gz QMTQCNBNPDQVNN-URVUXULASA-N 2 1 344.543 4.256 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+]Cc1ccc(C)c(Br)c1 ZINC001177057137 1052222595 /nfs/dbraw/zinc/22/25/95/1052222595.db2.gz NIOQPYPZMCHIDD-UHFFFAOYSA-N 2 1 341.337 4.359 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cc(C)cc(Br)c2)C[C@@H]1C ZINC000774903349 1052269923 /nfs/dbraw/zinc/26/99/23/1052269923.db2.gz MKSNUMMUCOJKBU-YOEHRIQHSA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)cc(Br)c2)C[C@@H]1C ZINC000774903349 1052269934 /nfs/dbraw/zinc/26/99/34/1052269934.db2.gz MKSNUMMUCOJKBU-YOEHRIQHSA-N 2 1 339.321 4.062 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C)cc(Br)c2)C[C@@H]1C ZINC000774903349 1052269941 /nfs/dbraw/zinc/26/99/41/1052269941.db2.gz MKSNUMMUCOJKBU-YOEHRIQHSA-N 2 1 339.321 4.062 20 0 EIADMP CC[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1OC(F)F ZINC000623355779 1052634579 /nfs/dbraw/zinc/63/45/79/1052634579.db2.gz VMTZTEDGFVVVFN-DZGCQCFKSA-N 2 1 326.431 4.202 20 0 EIADMP CC[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1OC(F)F ZINC000623355779 1052634584 /nfs/dbraw/zinc/63/45/84/1052634584.db2.gz VMTZTEDGFVVVFN-DZGCQCFKSA-N 2 1 326.431 4.202 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCOc2ccccc2-c2ccccc2)CC1(C)C ZINC000623378449 1052641879 /nfs/dbraw/zinc/64/18/79/1052641879.db2.gz BERVJTMGFAHYNE-IBGZPJMESA-N 2 1 338.495 4.195 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(F)c(Br)c1 ZINC000623410587 1052649336 /nfs/dbraw/zinc/64/93/36/1052649336.db2.gz WLFVJZLMRKNZCD-DGCLKSJQSA-N 2 1 343.284 4.112 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(F)c(Br)c1 ZINC000623410587 1052649340 /nfs/dbraw/zinc/64/93/40/1052649340.db2.gz WLFVJZLMRKNZCD-DGCLKSJQSA-N 2 1 343.284 4.112 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)cc1 ZINC000623656265 1052698325 /nfs/dbraw/zinc/69/83/25/1052698325.db2.gz QMZCRKWVRIJEII-IBGZPJMESA-N 2 1 338.495 4.184 20 0 EIADMP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2nc(C)cs2)cc1 ZINC000623865489 1052825268 /nfs/dbraw/zinc/82/52/68/1052825268.db2.gz SQLPZRDTOJUTIQ-MRXNPFEDSA-N 2 1 347.528 4.023 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(F)cc1C(F)(F)F ZINC000623886644 1052833098 /nfs/dbraw/zinc/83/30/98/1052833098.db2.gz HRWBXPJOKJCLBM-NEPJUHHUSA-N 2 1 343.368 4.336 20 0 EIADMP COc1ccc2cc([C@@H](C)[NH2+]C[C@H]3CCCC[N@@H+](C)C3)ccc2c1 ZINC000624120025 1052867530 /nfs/dbraw/zinc/86/75/30/1052867530.db2.gz PROHRKJMUXKSMJ-IAGOWNOFSA-N 2 1 326.484 4.231 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]C[C@H]3CCCC[N@H+](C)C3)c(C)c2c1 ZINC000624121120 1052867692 /nfs/dbraw/zinc/86/76/92/1052867692.db2.gz ONPHRCZXDGMQSN-JKSUJKDBSA-N 2 1 330.472 4.132 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]C[C@H]3CCCC[N@@H+](C)C3)c(C)c2c1 ZINC000624121120 1052867696 /nfs/dbraw/zinc/86/76/96/1052867696.db2.gz ONPHRCZXDGMQSN-JKSUJKDBSA-N 2 1 330.472 4.132 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000624124053 1052868199 /nfs/dbraw/zinc/86/81/99/1052868199.db2.gz VZJICWSWENQDBP-ZQDZILKHSA-N 2 1 326.937 4.215 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000381195275 1053057026 /nfs/dbraw/zinc/05/70/26/1053057026.db2.gz ZVBSNEPYWJPDKP-FSSWDIPSSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCC2SCCS2)cc1 ZINC000850570854 1053325542 /nfs/dbraw/zinc/32/55/42/1053325542.db2.gz MYPSIKMFFZQTEH-CYBMUJFWSA-N 2 1 333.526 4.028 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000383365051 1053328787 /nfs/dbraw/zinc/32/87/87/1053328787.db2.gz UXUUVOAWPQDXLT-GHTZIAJQSA-N 2 1 326.459 4.389 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000764963360 1053398723 /nfs/dbraw/zinc/39/87/23/1053398723.db2.gz NRHJYGAQVXGWIT-RBUKOAKNSA-N 2 1 332.532 4.261 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(SC(F)F)cc1 ZINC000764967858 1053401270 /nfs/dbraw/zinc/40/12/70/1053401270.db2.gz XXJRDNBPDPGNII-MAZHCROVSA-N 2 1 326.456 4.279 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(SC(F)F)cc1 ZINC000764967858 1053401276 /nfs/dbraw/zinc/40/12/76/1053401276.db2.gz XXJRDNBPDPGNII-MAZHCROVSA-N 2 1 326.456 4.279 20 0 EIADMP CC[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc2c(c1)CCCO2 ZINC000794834323 1053452312 /nfs/dbraw/zinc/45/23/12/1053452312.db2.gz HALFKTAXJXSMAU-MHJFOBGBSA-N 2 1 328.500 4.069 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)cs1 ZINC000339072179 1053475707 /nfs/dbraw/zinc/47/57/07/1053475707.db2.gz UQOGSYJIWKPCHE-GDIGMMSISA-N 2 1 341.524 4.396 20 0 EIADMP CSCC1CCC([NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000385424950 1053522209 /nfs/dbraw/zinc/52/22/09/1053522209.db2.gz LCMVAGVBCYGMHR-RCKXYERXSA-N 2 1 346.584 4.408 20 0 EIADMP C[C@H]([NH2+]Cc1cnc2c(F)cccc2c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000865523483 1053535290 /nfs/dbraw/zinc/53/52/90/1053535290.db2.gz CFQLRQRFCUOGFV-MAUKXSAKSA-N 2 1 341.474 4.117 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]CC[C@H]3CCCS3)CC23CC3)cc1 ZINC000865725615 1053577809 /nfs/dbraw/zinc/57/78/09/1053577809.db2.gz NCPJRROVXDZHGU-RBUKOAKNSA-N 2 1 330.541 4.059 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CC[C@H]3CCCS3)CC23CC3)cc1 ZINC000865725615 1053577814 /nfs/dbraw/zinc/57/78/14/1053577814.db2.gz NCPJRROVXDZHGU-RBUKOAKNSA-N 2 1 330.541 4.059 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccccc2)cc1 ZINC000120718630 1053578840 /nfs/dbraw/zinc/57/88/40/1053578840.db2.gz NFNMCMJVXLHLRC-HOIFWPIMSA-N 2 1 349.478 4.344 20 0 EIADMP FC(F)Sc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC000853093535 1053643077 /nfs/dbraw/zinc/64/30/77/1053643077.db2.gz MLOHDKVIAFFBGR-INIZCTEOSA-N 2 1 340.483 4.213 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc2c(c1)CCCO2 ZINC000853248803 1053660130 /nfs/dbraw/zinc/66/01/30/1053660130.db2.gz JYYNSFQWTKNIIT-ZLGUVYLKSA-N 2 1 336.479 4.156 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)CCc2cncc3ccccc32)C1 ZINC000866260910 1053667517 /nfs/dbraw/zinc/66/75/17/1053667517.db2.gz PHORDZFIMHHLHA-MOPGFXCFSA-N 2 1 339.527 4.266 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000866272386 1053673326 /nfs/dbraw/zinc/67/33/26/1053673326.db2.gz NQVWOWRJHZLXCP-KPFFTGBYSA-N 2 1 343.540 4.137 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000866272386 1053673334 /nfs/dbraw/zinc/67/33/34/1053673334.db2.gz NQVWOWRJHZLXCP-KPFFTGBYSA-N 2 1 343.540 4.137 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cccc(OC)c1OC ZINC000866289517 1053679117 /nfs/dbraw/zinc/67/91/17/1053679117.db2.gz HOKWLOFJEFMACJ-QGZVFWFLSA-N 2 1 334.504 4.007 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2F)c2ccccc2)CC[N@@H+]1C ZINC000429522086 1053959303 /nfs/dbraw/zinc/95/93/03/1053959303.db2.gz SHSLCSGVHHYLPI-BSIFCXSSSA-N 2 1 326.459 4.182 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2F)c2ccccc2)CC[N@H+]1C ZINC000429522086 1053959317 /nfs/dbraw/zinc/95/93/17/1053959317.db2.gz SHSLCSGVHHYLPI-BSIFCXSSSA-N 2 1 326.459 4.182 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000429533261 1054083232 /nfs/dbraw/zinc/08/32/32/1054083232.db2.gz ZSEZYQLJZXOVFH-NRFANRHFSA-N 2 1 338.495 4.182 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000429533261 1054083244 /nfs/dbraw/zinc/08/32/44/1054083244.db2.gz ZSEZYQLJZXOVFH-NRFANRHFSA-N 2 1 338.495 4.182 20 0 EIADMP CC(C)C[C@H](C)C[N@H+]1CC[C@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856559697 1054085788 /nfs/dbraw/zinc/08/57/88/1054085788.db2.gz SMUOPAJPWAIMNW-RXVVDRJESA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)C[C@H](C)C[NH+]1CC[C@H](Oc2ccnc(C[N@H+](C)C(C)C)c2)C1 ZINC000856559697 1054085791 /nfs/dbraw/zinc/08/57/91/1054085791.db2.gz SMUOPAJPWAIMNW-RXVVDRJESA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)C[C@H](C)C[NH+]1CC[C@H](Oc2ccnc(C[N@@H+](C)C(C)C)c2)C1 ZINC000856559697 1054085799 /nfs/dbraw/zinc/08/57/99/1054085799.db2.gz SMUOPAJPWAIMNW-RXVVDRJESA-N 2 1 347.547 4.057 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000429536767 1054098502 /nfs/dbraw/zinc/09/85/02/1054098502.db2.gz CJFCYFBVXDIHQI-OAQYLSRUSA-N 2 1 338.495 4.182 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000429536767 1054098516 /nfs/dbraw/zinc/09/85/16/1054098516.db2.gz CJFCYFBVXDIHQI-OAQYLSRUSA-N 2 1 338.495 4.182 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccn(C)n1 ZINC000542670294 1054188051 /nfs/dbraw/zinc/18/80/51/1054188051.db2.gz JBWULFXDOAPWJE-YLJYHZDGSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1ccn(C)n1 ZINC000542670294 1054188066 /nfs/dbraw/zinc/18/80/66/1054188066.db2.gz JBWULFXDOAPWJE-YLJYHZDGSA-N 2 1 340.515 4.035 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cccc(O)c1F ZINC000872019330 1054334876 /nfs/dbraw/zinc/33/48/76/1054334876.db2.gz VWDCPAAVGPICKL-OAHLLOKOSA-N 2 1 330.447 4.224 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)CC1 ZINC000872025632 1054341991 /nfs/dbraw/zinc/34/19/91/1054341991.db2.gz QJJOWZGLWOEVQT-SFTDATJTSA-N 2 1 344.543 4.143 20 0 EIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCOC4(CCCC4)C3)C2)c1 ZINC000872029978 1054347736 /nfs/dbraw/zinc/34/77/36/1054347736.db2.gz WWNGNPLBLLIJAM-QZTJIDSGSA-N 2 1 348.556 4.042 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CCOC4(CCCC4)C3)C2)c1 ZINC000872029978 1054347752 /nfs/dbraw/zinc/34/77/52/1054347752.db2.gz WWNGNPLBLLIJAM-QZTJIDSGSA-N 2 1 348.556 4.042 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)CCO1 ZINC001199275049 1054374183 /nfs/dbraw/zinc/37/41/83/1054374183.db2.gz CGUXRPGAJZDKRD-QIJUGHKUSA-N 2 1 344.543 4.354 20 0 EIADMP COc1ccsc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC001199267229 1054377330 /nfs/dbraw/zinc/37/73/30/1054377330.db2.gz NDDGJCMFBDJIEL-INIZCTEOSA-N 2 1 344.524 4.421 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2ccc(SC(F)F)cc2)C1 ZINC001199328860 1054391860 /nfs/dbraw/zinc/39/18/60/1054391860.db2.gz KQMXAJSUEUNRIG-GASCZTMLSA-N 2 1 342.499 4.459 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccc(SC(F)F)cc2)C1 ZINC001199328860 1054391870 /nfs/dbraw/zinc/39/18/70/1054391870.db2.gz KQMXAJSUEUNRIG-GASCZTMLSA-N 2 1 342.499 4.459 20 0 EIADMP Cc1cc(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c2c(n1)CCCC2 ZINC001199336201 1054394813 /nfs/dbraw/zinc/39/48/13/1054394813.db2.gz IZCDXSPYJFSUBS-GOSISDBHSA-N 2 1 329.532 4.013 20 0 EIADMP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2cccc(OC(C)(C)C)c2)C1 ZINC001199329754 1054395397 /nfs/dbraw/zinc/39/53/97/1054395397.db2.gz ZBZLUGVVBUVPRU-QZTJIDSGSA-N 2 1 332.532 4.322 20 0 EIADMP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCO1 ZINC001199630289 1054435995 /nfs/dbraw/zinc/43/59/95/1054435995.db2.gz VKTKJEHVTOKXOB-IFMALSPDSA-N 2 1 344.543 4.498 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+]CC(C)(C)[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001199760311 1054463684 /nfs/dbraw/zinc/46/36/84/1054463684.db2.gz PSZOPWJJRUCZSB-OTWHNJEPSA-N 2 1 346.559 4.362 20 0 EIADMP CCCC[NH+]1CCC([NH2+]Cc2ccc(OC)c(O[C@@H](C)CC)c2)CC1 ZINC001199784157 1054470822 /nfs/dbraw/zinc/47/08/22/1054470822.db2.gz PSTHACWOVPFHQL-KRWDZBQOSA-N 2 1 348.531 4.227 20 0 EIADMP CC(C)c1cccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)c1 ZINC000858365469 1054474699 /nfs/dbraw/zinc/47/46/99/1054474699.db2.gz OFMUCODWACIKCC-UWJYYQICSA-N 2 1 330.516 4.104 20 0 EIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccns1 ZINC000858576980 1054521258 /nfs/dbraw/zinc/52/12/58/1054521258.db2.gz OFEMFFWEPFKHSK-ZLPCBKJTSA-N 2 1 329.513 4.237 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](CCc1ccccc1)CC2 ZINC001201596278 1054847458 /nfs/dbraw/zinc/84/74/58/1054847458.db2.gz BXKURMGJRGDNBA-OAQYLSRUSA-N 2 1 338.495 4.199 20 0 EIADMP C[N@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CCc2ccccc2)CC1 ZINC001201606278 1054862342 /nfs/dbraw/zinc/86/23/42/1054862342.db2.gz UOJIYWWKSBPIHE-UHFFFAOYSA-N 2 1 342.914 4.479 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CCc2ccccc2)CC1 ZINC001201606278 1054862348 /nfs/dbraw/zinc/86/23/48/1054862348.db2.gz UOJIYWWKSBPIHE-UHFFFAOYSA-N 2 1 342.914 4.479 20 0 EIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)cc1C ZINC000064616156 1054867800 /nfs/dbraw/zinc/86/78/00/1054867800.db2.gz BTPKRVIMRGQTLL-LJQANCHMSA-N 2 1 328.525 4.367 20 0 EIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)cc1C ZINC000064616156 1054867808 /nfs/dbraw/zinc/86/78/08/1054867808.db2.gz BTPKRVIMRGQTLL-LJQANCHMSA-N 2 1 328.525 4.367 20 0 EIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](CCCc2ccccc2)CC1 ZINC001201671906 1054872203 /nfs/dbraw/zinc/87/22/03/1054872203.db2.gz OHBXLXZUFRCHKD-UHFFFAOYSA-N 2 1 340.486 4.355 20 0 EIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](CCCc2ccccc2)CC1 ZINC001201671906 1054872207 /nfs/dbraw/zinc/87/22/07/1054872207.db2.gz OHBXLXZUFRCHKD-UHFFFAOYSA-N 2 1 340.486 4.355 20 0 EIADMP C[C@H]([NH2+]Cc1cnc(C(C)(C)C)s1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201947392 1054962750 /nfs/dbraw/zinc/96/27/50/1054962750.db2.gz XFXBOSZVEYFKHJ-GJZGRUSLSA-N 2 1 335.561 4.183 20 0 EIADMP C[C@H]([NH2+]Cc1cnc(C(C)(C)C)s1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001201947392 1054962758 /nfs/dbraw/zinc/96/27/58/1054962758.db2.gz XFXBOSZVEYFKHJ-GJZGRUSLSA-N 2 1 335.561 4.183 20 0 EIADMP C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CC[NH+](CCC(C)(C)C)CC2 ZINC001202072761 1055002275 /nfs/dbraw/zinc/00/22/75/1055002275.db2.gz BJLRWLVUUDRYMJ-HXUWFJFHSA-N 2 1 344.543 4.178 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[NH+](CCC(C)(C)C)C[C@@H]21 ZINC001202079165 1055019357 /nfs/dbraw/zinc/01/93/57/1055019357.db2.gz XUYMFHPOHPYNLZ-YZGWKJHDSA-N 2 1 329.532 4.050 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[NH+](CCC(C)(C)C)C[C@@H]21 ZINC001202079165 1055019370 /nfs/dbraw/zinc/01/93/70/1055019370.db2.gz XUYMFHPOHPYNLZ-YZGWKJHDSA-N 2 1 329.532 4.050 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[N@H+](CCC(C)(C)C)C[C@@H]21 ZINC001202079165 1055019382 /nfs/dbraw/zinc/01/93/82/1055019382.db2.gz XUYMFHPOHPYNLZ-YZGWKJHDSA-N 2 1 329.532 4.050 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@@H]2C[N@@H+](CCC(C)(C)C)C[C@@H]21 ZINC001202079165 1055019402 /nfs/dbraw/zinc/01/94/02/1055019402.db2.gz XUYMFHPOHPYNLZ-YZGWKJHDSA-N 2 1 329.532 4.050 20 0 EIADMP C[C@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000877189855 1055033161 /nfs/dbraw/zinc/03/31/61/1055033161.db2.gz UEKUEJWILVRZRZ-UONOGXRCSA-N 2 1 347.890 4.224 20 0 EIADMP C[C@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000877189855 1055033180 /nfs/dbraw/zinc/03/31/80/1055033180.db2.gz UEKUEJWILVRZRZ-UONOGXRCSA-N 2 1 347.890 4.224 20 0 EIADMP COc1cccc(C[N@H+]2CCC3(C2)CC[NH+](CCC(C)(C)C)CC3)c1 ZINC001202077546 1055038828 /nfs/dbraw/zinc/03/88/28/1055038828.db2.gz IVEMSXVQRVQJKM-UHFFFAOYSA-N 2 1 344.543 4.419 20 0 EIADMP C[C@H](N[C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccns1 ZINC000877659442 1055101426 /nfs/dbraw/zinc/10/14/26/1055101426.db2.gz SCQYPBLABBJNKZ-ZVZYQTTQSA-N 2 1 327.497 4.162 20 0 EIADMP C[C@H]([NH2+][C@H]1CCN(C2CC2)[C@H](c2ccccc2)C1)c1ccns1 ZINC000877659442 1055101428 /nfs/dbraw/zinc/10/14/28/1055101428.db2.gz SCQYPBLABBJNKZ-ZVZYQTTQSA-N 2 1 327.497 4.162 20 0 EIADMP c1ccc([C@@H]2CCC[C@H](C[NH+]3CCC([NH+]4CCCCC4)CC3)O2)cc1 ZINC000877971087 1055165023 /nfs/dbraw/zinc/16/50/23/1055165023.db2.gz GQMIYOLYYKLZLX-YADHBBJMSA-N 2 1 342.527 4.247 20 0 EIADMP FC(F)(F)CCC[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001202441964 1055176711 /nfs/dbraw/zinc/17/67/11/1055176711.db2.gz IVBYZCRDTPIQIV-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCC[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001202441964 1055176719 /nfs/dbraw/zinc/17/67/19/1055176719.db2.gz IVBYZCRDTPIQIV-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCC[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001202441964 1055176724 /nfs/dbraw/zinc/17/67/24/1055176724.db2.gz IVBYZCRDTPIQIV-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCC[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001202441964 1055176732 /nfs/dbraw/zinc/17/67/32/1055176732.db2.gz IVBYZCRDTPIQIV-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC000863546965 1055226395 /nfs/dbraw/zinc/22/63/95/1055226395.db2.gz IHQSPCNWBZKBSZ-RLLQIKCJSA-N 2 1 326.871 4.410 20 0 EIADMP C[C@@H](NCc1cc(C(F)(F)F)co1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000878411519 1055295521 /nfs/dbraw/zinc/29/55/21/1055295521.db2.gz LHUJNKKRVBAIKM-CHWSQXEVSA-N 2 1 330.394 4.041 20 0 EIADMP FC1(F)CCC[C@@H]1CC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000878527659 1055334146 /nfs/dbraw/zinc/33/41/46/1055334146.db2.gz FAZFBSDTWJBOOI-MRXNPFEDSA-N 2 1 337.458 4.224 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC000166407354 1055547388 /nfs/dbraw/zinc/54/73/88/1055547388.db2.gz QYNKIXXWONPCBS-HUUCEWRRSA-N 2 1 341.326 4.487 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CC[C@@H]3COCC[C@H]3C2)CC1 ZINC000921750456 1056413959 /nfs/dbraw/zinc/41/39/59/1056413959.db2.gz WPXSOKDLMYLNAG-UGGKCQTMSA-N 2 1 342.527 4.007 20 0 EIADMP COc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000392742273 1060306864 /nfs/dbraw/zinc/30/68/64/1060306864.db2.gz SWMYUUHESBRBFL-KCZVDYSFSA-N 2 1 336.479 4.001 20 0 EIADMP COc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000392742273 1060306888 /nfs/dbraw/zinc/30/68/88/1060306888.db2.gz SWMYUUHESBRBFL-KCZVDYSFSA-N 2 1 336.479 4.001 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C2 ZINC001169092639 1060632499 /nfs/dbraw/zinc/63/24/99/1060632499.db2.gz BYPCNYVCMSFGNR-CLLJXQQHSA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C2 ZINC001169092639 1060632510 /nfs/dbraw/zinc/63/25/10/1060632510.db2.gz BYPCNYVCMSFGNR-CLLJXQQHSA-N 2 1 332.797 4.074 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccccc1Oc1ccc(F)cc1)C2 ZINC001169099699 1060636140 /nfs/dbraw/zinc/63/61/40/1060636140.db2.gz DWVRQYACQCMQBR-REPLKXPHSA-N 2 1 340.442 4.333 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccccc1Oc1ccc(F)cc1)C2 ZINC001169099699 1060636152 /nfs/dbraw/zinc/63/61/52/1060636152.db2.gz DWVRQYACQCMQBR-REPLKXPHSA-N 2 1 340.442 4.333 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccccc1Oc1ccc(F)cc1)C2 ZINC001169099698 1060637275 /nfs/dbraw/zinc/63/72/75/1060637275.db2.gz DWVRQYACQCMQBR-LDLYASANSA-N 2 1 340.442 4.333 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccccc1Oc1ccc(F)cc1)C2 ZINC001169099698 1060637284 /nfs/dbraw/zinc/63/72/84/1060637284.db2.gz DWVRQYACQCMQBR-LDLYASANSA-N 2 1 340.442 4.333 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)c1cc(Cl)cc(Cl)c1)C2 ZINC001169101337 1060637547 /nfs/dbraw/zinc/63/75/47/1060637547.db2.gz RESCQYXJMXCGIH-PHZGNYQRSA-N 2 1 327.299 4.443 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3ccccc3)CCC(F)(F)CC1)C2 ZINC001169117106 1060647139 /nfs/dbraw/zinc/64/71/39/1060647139.db2.gz VSZJLUQWIRYCCG-BCDXTJNWSA-N 2 1 334.454 4.306 20 0 EIADMP Cc1ccc(Cl)c(O[C@@H]2CCC[NH+]([C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4C)C2)c1 ZINC001169142747 1060662661 /nfs/dbraw/zinc/66/26/61/1060662661.db2.gz VEGFRBAJIJUTDW-XMTFNYHQSA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@@H]2CCC[NH+]([C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4C)C2)c1 ZINC001169142747 1060662677 /nfs/dbraw/zinc/66/26/77/1060662677.db2.gz VEGFRBAJIJUTDW-XMTFNYHQSA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@@H]2CCC[N@@H+]([C@@H]3C[C@H]4CC[C@@H](C3)[NH+]4C)C2)c1 ZINC001169142747 1060662683 /nfs/dbraw/zinc/66/26/83/1060662683.db2.gz VEGFRBAJIJUTDW-XMTFNYHQSA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@@H]2CCC[N@H+]([C@@H]3C[C@H]4CC[C@@H](C3)[NH+]4C)C2)c1 ZINC001169142747 1060662693 /nfs/dbraw/zinc/66/26/93/1060662693.db2.gz VEGFRBAJIJUTDW-XMTFNYHQSA-N 2 1 348.918 4.117 20 0 EIADMP C[NH+](C)CCC(C)(C)Nc1ccc2c(c1)C[N@H+](Cc1ccccc1)C2 ZINC001169717652 1060915794 /nfs/dbraw/zinc/91/57/94/1060915794.db2.gz HICLPRHJGFFQDZ-UHFFFAOYSA-N 2 1 337.511 4.345 20 0 EIADMP CC[C@@H](c1ccc(F)cc1)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000078847300 217134485 /nfs/dbraw/zinc/13/44/85/217134485.db2.gz RMNSWSDTZCVFLZ-FVJLSDCUSA-N 2 1 348.506 4.098 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(Br)cc2)C1 ZINC000532214760 1032094781 /nfs/dbraw/zinc/09/47/81/1032094781.db2.gz LCFFWJGJKWZARJ-HUUCEWRRSA-N 2 1 339.321 4.220 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2c(F)cccc2F)CCCC1 ZINC000532219072 1032098535 /nfs/dbraw/zinc/09/85/35/1032098535.db2.gz KVGJJKXGTVTGDY-IIDMSEBBSA-N 2 1 336.470 4.095 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cccc2cc[nH]c21 ZINC000532374316 1032213548 /nfs/dbraw/zinc/21/35/48/1032213548.db2.gz FPAPDCFIMMKZTG-OEWRPIJISA-N 2 1 347.506 4.414 20 0 EIADMP C[C@@H](NCc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1nccs1 ZINC000245544158 1032297013 /nfs/dbraw/zinc/29/70/13/1032297013.db2.gz UFFZWDWDZDWJQF-HZPDHXFCSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1nccs1 ZINC000245544158 1032297028 /nfs/dbraw/zinc/29/70/28/1032297028.db2.gz UFFZWDWDZDWJQF-HZPDHXFCSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1nccs1 ZINC000245544158 1032297039 /nfs/dbraw/zinc/29/70/39/1032297039.db2.gz UFFZWDWDZDWJQF-HZPDHXFCSA-N 2 1 329.513 4.226 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]CC2Cc3ccccc3C2)[C@@H]1c1cccs1 ZINC000514697958 1032419597 /nfs/dbraw/zinc/41/95/97/1032419597.db2.gz VIKVHLRRXBLMLW-PZJWPPBQSA-N 2 1 340.536 4.136 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]CC2Cc3ccccc3C2)[C@@H]1c1cccs1 ZINC000514697958 1032419599 /nfs/dbraw/zinc/41/95/99/1032419599.db2.gz VIKVHLRRXBLMLW-PZJWPPBQSA-N 2 1 340.536 4.136 20 0 EIADMP C[C@H](c1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1)C(F)(F)F ZINC000450504322 1032534212 /nfs/dbraw/zinc/53/42/12/1032534212.db2.gz UMSHESASPLNLOZ-OLMNPRSZSA-N 2 1 340.433 4.269 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1)C(F)(F)F ZINC000450504322 1032534216 /nfs/dbraw/zinc/53/42/16/1032534216.db2.gz UMSHESASPLNLOZ-OLMNPRSZSA-N 2 1 340.433 4.269 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1)C(F)(F)F ZINC000450504322 1032534219 /nfs/dbraw/zinc/53/42/19/1032534219.db2.gz UMSHESASPLNLOZ-OLMNPRSZSA-N 2 1 340.433 4.269 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(Br)s1 ZINC000178698022 1032544462 /nfs/dbraw/zinc/54/44/62/1032544462.db2.gz CHVVFXNGTQOMDL-WDEREUQCSA-N 2 1 342.306 4.002 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccccc1C(F)(F)F ZINC000178701905 1032544683 /nfs/dbraw/zinc/54/46/83/1032544683.db2.gz SZDLDEBVUAHDKI-CHWSQXEVSA-N 2 1 325.378 4.197 20 0 EIADMP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1 ZINC000533354618 1032689680 /nfs/dbraw/zinc/68/96/80/1032689680.db2.gz IIMUUOJAXYCSMY-GOSISDBHSA-N 2 1 341.474 4.271 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1 ZINC000533354618 1032689687 /nfs/dbraw/zinc/68/96/87/1032689687.db2.gz IIMUUOJAXYCSMY-GOSISDBHSA-N 2 1 341.474 4.271 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1 ZINC000533354618 1032689700 /nfs/dbraw/zinc/68/97/00/1032689700.db2.gz IIMUUOJAXYCSMY-GOSISDBHSA-N 2 1 341.474 4.271 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1 ZINC000533354618 1032689705 /nfs/dbraw/zinc/68/97/05/1032689705.db2.gz IIMUUOJAXYCSMY-GOSISDBHSA-N 2 1 341.474 4.271 20 0 EIADMP CCC[C@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619758 1032726599 /nfs/dbraw/zinc/72/65/99/1032726599.db2.gz UQRIWIGODPXZCC-QUCCMNQESA-N 2 1 325.500 4.423 20 0 EIADMP CCC[C@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619758 1032726606 /nfs/dbraw/zinc/72/66/06/1032726606.db2.gz UQRIWIGODPXZCC-QUCCMNQESA-N 2 1 325.500 4.423 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCCO2 ZINC000643545833 1018892761 /nfs/dbraw/zinc/89/27/61/1018892761.db2.gz CWRVWNJJMULTJC-IEBWSBKVSA-N 2 1 328.500 4.288 20 0 EIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000430163196 1018934492 /nfs/dbraw/zinc/93/44/92/1018934492.db2.gz LDBWNLWXCLRQRV-LJQANCHMSA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000430163196 1018934508 /nfs/dbraw/zinc/93/45/08/1018934508.db2.gz LDBWNLWXCLRQRV-LJQANCHMSA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000430163196 1018934517 /nfs/dbraw/zinc/93/45/17/1018934517.db2.gz LDBWNLWXCLRQRV-LJQANCHMSA-N 2 1 330.472 4.082 20 0 EIADMP Clc1cc2c(c(Cl)c1)[C@@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CC2 ZINC000643548722 1018935567 /nfs/dbraw/zinc/93/55/67/1018935567.db2.gz UGEKDKYELZGSIK-ZFWWWQNUSA-N 2 1 325.283 4.245 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000432791264 1032812603 /nfs/dbraw/zinc/81/26/03/1032812603.db2.gz ZGEZQCSHNQVDCI-CQSZACIVSA-N 2 1 334.410 4.141 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000432791264 1032812609 /nfs/dbraw/zinc/81/26/09/1032812609.db2.gz ZGEZQCSHNQVDCI-CQSZACIVSA-N 2 1 334.410 4.141 20 0 EIADMP CCc1nc(C)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000183196239 1019802133 /nfs/dbraw/zinc/80/21/33/1019802133.db2.gz PUNVBVCRHVONDB-OFQRWUPVSA-N 2 1 335.561 4.318 20 0 EIADMP COC1CCC(C)(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000530522684 1020046228 /nfs/dbraw/zinc/04/62/28/1020046228.db2.gz QCRUQZHTKDGISV-GRTSPXDGSA-N 2 1 344.543 4.082 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc(C)c(Br)s2)CC1 ZINC000510171450 1020373823 /nfs/dbraw/zinc/37/38/23/1020373823.db2.gz YWZVSRWICPHBMP-LBPRGKRZSA-N 2 1 345.350 4.344 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cc(C)c(Br)s2)CC1 ZINC000510171449 1020373982 /nfs/dbraw/zinc/37/39/82/1020373982.db2.gz YWZVSRWICPHBMP-GFCCVEGCSA-N 2 1 345.350 4.344 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000398107405 1020463568 /nfs/dbraw/zinc/46/35/68/1020463568.db2.gz BYHHGMZJGWHUQN-HVETUWLQSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000398107405 1020463588 /nfs/dbraw/zinc/46/35/88/1020463588.db2.gz BYHHGMZJGWHUQN-HVETUWLQSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccncc1F ZINC000340185063 1020588143 /nfs/dbraw/zinc/58/81/43/1020588143.db2.gz PBOOEJZDMOVUKB-KRWDZBQOSA-N 2 1 341.474 4.303 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](CC[C@@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255607 1020679050 /nfs/dbraw/zinc/67/90/50/1020679050.db2.gz JSZUAJWRNLHXIF-HZPDHXFCSA-N 2 1 333.347 4.014 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CC[C@@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255607 1020679057 /nfs/dbraw/zinc/67/90/57/1020679057.db2.gz JSZUAJWRNLHXIF-HZPDHXFCSA-N 2 1 333.347 4.014 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000683472273 1020848898 /nfs/dbraw/zinc/84/88/98/1020848898.db2.gz KEKPDQXLXKAYGQ-QGZVFWFLSA-N 2 1 328.431 4.049 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)s2)cc1C ZINC000655717123 1020913478 /nfs/dbraw/zinc/91/34/78/1020913478.db2.gz VFLOFFGMZJDQPE-INIZCTEOSA-N 2 1 341.524 4.001 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)s2)cc1C ZINC000655717123 1020913481 /nfs/dbraw/zinc/91/34/81/1020913481.db2.gz VFLOFFGMZJDQPE-INIZCTEOSA-N 2 1 341.524 4.001 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)[C@H]1CCCCO1 ZINC000655847159 1021012794 /nfs/dbraw/zinc/01/27/94/1021012794.db2.gz RLQTXFOCKCXWMK-QHAWAJNXSA-N 2 1 342.527 4.121 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)[C@H]1CCCCO1 ZINC000655847159 1021012802 /nfs/dbraw/zinc/01/28/02/1021012802.db2.gz RLQTXFOCKCXWMK-QHAWAJNXSA-N 2 1 342.527 4.121 20 0 EIADMP CC[C@H]([NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)[C@H]1CCCCO1 ZINC000655850375 1021015158 /nfs/dbraw/zinc/01/51/58/1021015158.db2.gz VKMOHPZIUZDGNB-RYGJVYDSSA-N 2 1 327.472 4.179 20 0 EIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CCCCO1 ZINC000655850680 1021016587 /nfs/dbraw/zinc/01/65/87/1021016587.db2.gz YJJVKOVFKAMJNS-WIYBCGNWSA-N 2 1 342.527 4.119 20 0 EIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000579969498 1021041841 /nfs/dbraw/zinc/04/18/41/1021041841.db2.gz JCUOYXLJVOBPOR-QGZVFWFLSA-N 2 1 338.282 4.400 20 0 EIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3csc(-c4ccsc4)n3)C2)CC1 ZINC000376001535 1021185201 /nfs/dbraw/zinc/18/52/01/1021185201.db2.gz VDYLHVYXHFYWFD-UHFFFAOYSA-N 2 1 347.553 4.179 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc3cnccc3c2)CC1 ZINC000683825905 1021720594 /nfs/dbraw/zinc/72/05/94/1021720594.db2.gz ZVGQZZWWDNSGKA-UHFFFAOYSA-N 2 1 325.500 4.179 20 0 EIADMP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179093 1021740995 /nfs/dbraw/zinc/74/09/95/1021740995.db2.gz CKWMODOIKKCNBH-WMZOPIPTSA-N 2 1 333.545 4.107 20 0 EIADMP C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179093 1021741012 /nfs/dbraw/zinc/74/10/12/1021741012.db2.gz CKWMODOIKKCNBH-WMZOPIPTSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179093 1021741031 /nfs/dbraw/zinc/74/10/31/1021741031.db2.gz CKWMODOIKKCNBH-WMZOPIPTSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2cnc(C3CCCCC3)s2)C1 ZINC000580179093 1021741048 /nfs/dbraw/zinc/74/10/48/1021741048.db2.gz CKWMODOIKKCNBH-WMZOPIPTSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+](C/C=C\C[N@@H+](C)Cc1ccccc1F)Cc1ccccc1F ZINC000613378817 1021913183 /nfs/dbraw/zinc/91/31/83/1021913183.db2.gz UKGMIEOQCPPHPE-FPLPWBNLSA-N 2 1 330.422 4.085 20 0 EIADMP C[NH+](C/C=C\C[N@H+](C)Cc1ccccc1F)Cc1ccccc1F ZINC000613378817 1021913208 /nfs/dbraw/zinc/91/32/08/1021913208.db2.gz UKGMIEOQCPPHPE-FPLPWBNLSA-N 2 1 330.422 4.085 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cc3ccccc3[nH]2)[C@@H]1c1cccs1 ZINC000683930268 1022000511 /nfs/dbraw/zinc/00/05/11/1022000511.db2.gz YITXFXZDCDRIGH-OXQOHEQNSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cc3ccccc3[nH]2)[C@@H]1c1cccs1 ZINC000683930268 1022000522 /nfs/dbraw/zinc/00/05/22/1022000522.db2.gz YITXFXZDCDRIGH-OXQOHEQNSA-N 2 1 339.508 4.402 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2Cc4ccccc42)C3)cc1 ZINC000245731161 1033031808 /nfs/dbraw/zinc/03/18/08/1033031808.db2.gz QFHAFYNRQRYZEP-KJJMTIBFSA-N 2 1 332.491 4.112 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@H]2Cc4ccccc42)C3)cc1 ZINC000245731167 1033033067 /nfs/dbraw/zinc/03/30/67/1033033067.db2.gz QFHAFYNRQRYZEP-YSFYHYPLSA-N 2 1 332.491 4.112 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(F)cc2Cl)CC1 ZINC000613491887 1022166233 /nfs/dbraw/zinc/16/62/33/1022166233.db2.gz CQBKXPZIIPLBLL-UHFFFAOYSA-N 2 1 326.887 4.423 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H](C)CC(F)(F)F)cc1 ZINC000414256347 1022325615 /nfs/dbraw/zinc/32/56/15/1022325615.db2.gz COEIHSVXDMFOIP-QWHCGFSZSA-N 2 1 325.378 4.420 20 0 EIADMP Cc1cc(C[NH2+]C2CC[NH+](C3CCC3)CC2)ccc1C(F)(F)F ZINC000414310621 1022483341 /nfs/dbraw/zinc/48/33/41/1022483341.db2.gz WNDYERISRPFMQF-UHFFFAOYSA-N 2 1 326.406 4.120 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310858208 1022522997 /nfs/dbraw/zinc/52/29/97/1022522997.db2.gz BYMOXHZFKZYYNU-XMSQKQJNSA-N 2 1 338.495 4.258 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310891193 1022680455 /nfs/dbraw/zinc/68/04/55/1022680455.db2.gz KPYVCGHXNWWOMP-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[N@@H+](C)CCC[NH3+] ZINC000317109977 1022790754 /nfs/dbraw/zinc/79/07/54/1022790754.db2.gz CVWPZRVLZFVCNC-SECBINFHSA-N 2 1 328.300 4.066 20 0 EIADMP [NH3+]C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000581005977 1022792126 /nfs/dbraw/zinc/79/21/26/1022792126.db2.gz LLXMZVULGLUTLH-IMJJTQAJSA-N 2 1 345.487 4.044 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cnn(-c3ccccc3)c2)c1 ZINC000065976563 1022873235 /nfs/dbraw/zinc/87/32/35/1022873235.db2.gz SHQNLVQFICJMAZ-UHFFFAOYSA-N 2 1 348.494 4.002 20 0 EIADMP C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548154387 1022873632 /nfs/dbraw/zinc/87/36/32/1022873632.db2.gz NZNDNIVPHMBIEU-MTNREXPMSA-N 2 1 335.495 4.033 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H]4CCC[C@H]43)cc2)cs1 ZINC000581326324 1023025452 /nfs/dbraw/zinc/02/54/52/1023025452.db2.gz TWKUHOPVVGUNGE-NLWGTHIKSA-N 2 1 341.524 4.081 20 0 EIADMP C[C@@]1(C[NH2+]Cc2ccc3ncccc3c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000311410434 1023157932 /nfs/dbraw/zinc/15/79/32/1023157932.db2.gz BUIIHIBKCVSXQC-QHCPKHFHSA-N 2 1 345.490 4.237 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417347039 1023273948 /nfs/dbraw/zinc/27/39/48/1023273948.db2.gz VOFFRVCFZYDUPB-BGJMDTOESA-N 2 1 332.557 4.483 20 0 EIADMP Brc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000415075701 1023423540 /nfs/dbraw/zinc/42/35/40/1023423540.db2.gz BYFPQVJZYXVDJI-ROUUACIJSA-N 2 1 345.284 4.032 20 0 EIADMP Cn1cc[nH+]c1CC1CC[NH+](CCc2ccc3ccccc3c2)CC1 ZINC000511640426 1023425594 /nfs/dbraw/zinc/42/55/94/1023425594.db2.gz POHUEDLGOXLAAL-UHFFFAOYSA-N 2 1 333.479 4.071 20 0 EIADMP Fc1ccc(CC[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c(Cl)c1 ZINC000415087942 1023437889 /nfs/dbraw/zinc/43/78/89/1023437889.db2.gz LITWYURKOBCUMJ-IEBWSBKVSA-N 2 1 332.850 4.105 20 0 EIADMP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@@H]([NH3+])CC(C)C)s2)cc1 ZINC000415096615 1023441467 /nfs/dbraw/zinc/44/14/67/1023441467.db2.gz BTOWOFXXGQXBIL-BBRMVZONSA-N 2 1 347.528 4.151 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500077004 1023484868 /nfs/dbraw/zinc/48/48/68/1023484868.db2.gz VVPQDPXBAIKMFR-HOTGVXAUSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125067 1023513563 /nfs/dbraw/zinc/51/35/63/1023513563.db2.gz OZSFSCZNMILEBA-HOTGVXAUSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125067 1023513576 /nfs/dbraw/zinc/51/35/76/1023513576.db2.gz OZSFSCZNMILEBA-HOTGVXAUSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125067 1023513592 /nfs/dbraw/zinc/51/35/92/1023513592.db2.gz OZSFSCZNMILEBA-HOTGVXAUSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125068 1023514941 /nfs/dbraw/zinc/51/49/41/1023514941.db2.gz OZSFSCZNMILEBA-HZPDHXFCSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125068 1023514954 /nfs/dbraw/zinc/51/49/54/1023514954.db2.gz OZSFSCZNMILEBA-HZPDHXFCSA-N 2 1 342.449 4.473 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125068 1023514963 /nfs/dbraw/zinc/51/49/63/1023514963.db2.gz OZSFSCZNMILEBA-HZPDHXFCSA-N 2 1 342.449 4.473 20 0 EIADMP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@H+]2Cc2cccc(C3CCCC3)c2)C1 ZINC000656785851 1023529441 /nfs/dbraw/zinc/52/94/41/1023529441.db2.gz KEENGOPTWCDCCA-YPAWHYETSA-N 2 1 342.527 4.205 20 0 EIADMP Clc1ccc2cccnc2c1C[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656784135 1023530006 /nfs/dbraw/zinc/53/00/06/1023530006.db2.gz YWPQMKMRWWNJGL-QGZVFWFLSA-N 2 1 343.902 4.100 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)c(C(F)(F)F)c1)C[C@@H]1CCC[NH+](C)C1 ZINC001167477548 1023566836 /nfs/dbraw/zinc/56/68/36/1023566836.db2.gz GGWJWSVDWAFPHM-CYBMUJFWSA-N 2 1 334.813 4.132 20 0 EIADMP C[N@H+](Cc1ccc(Cl)c(C(F)(F)F)c1)C[C@@H]1CCC[NH+](C)C1 ZINC001167477548 1023566844 /nfs/dbraw/zinc/56/68/44/1023566844.db2.gz GGWJWSVDWAFPHM-CYBMUJFWSA-N 2 1 334.813 4.132 20 0 EIADMP C[NH+](Cc1ccc(Cl)c(C(F)(F)F)c1)C[C@@H]1CCC[N@H+](C)C1 ZINC001167477548 1023566854 /nfs/dbraw/zinc/56/68/54/1023566854.db2.gz GGWJWSVDWAFPHM-CYBMUJFWSA-N 2 1 334.813 4.132 20 0 EIADMP C[NH+](Cc1ccc(Cl)c(C(F)(F)F)c1)C[C@@H]1CCC[N@@H+](C)C1 ZINC001167477548 1023566864 /nfs/dbraw/zinc/56/68/64/1023566864.db2.gz GGWJWSVDWAFPHM-CYBMUJFWSA-N 2 1 334.813 4.132 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000311123372 1023577426 /nfs/dbraw/zinc/57/74/26/1023577426.db2.gz HPZJHEKDDHEXNG-GCJKJVERSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2[nH]ccc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311138182 1023584050 /nfs/dbraw/zinc/58/40/50/1023584050.db2.gz YESBTBOHVFOTRS-UWJYYQICSA-N 2 1 333.479 4.168 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000364312264 1023604641 /nfs/dbraw/zinc/60/46/41/1023604641.db2.gz BTBQEGLLVHVWBE-LESCRADOSA-N 2 1 330.497 4.100 20 0 EIADMP Cc1ccn(C2CC[NH+]([C@H](C)c3ccc(-n4cc[nH+]c4C)cc3)CC2)n1 ZINC000377632328 1023644414 /nfs/dbraw/zinc/64/44/14/1023644414.db2.gz UPOBDHMEFCGDAR-QGZVFWFLSA-N 2 1 349.482 4.084 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398028272 1023651923 /nfs/dbraw/zinc/65/19/23/1023651923.db2.gz DEHRFTWRIWFEMI-JBYIUTFZSA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398028272 1023651932 /nfs/dbraw/zinc/65/19/32/1023651932.db2.gz DEHRFTWRIWFEMI-JBYIUTFZSA-N 2 1 340.486 4.257 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[N@@H+]2CCC[C@H]2c2cnn(C)c2C)cc1 ZINC000377694837 1023687424 /nfs/dbraw/zinc/68/74/24/1023687424.db2.gz FJIRYSDDHXCGJB-VFNWGFHPSA-N 2 1 349.482 4.121 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[N@H+]2CCC[C@H]2c2cnn(C)c2C)cc1 ZINC000377694837 1023687427 /nfs/dbraw/zinc/68/74/27/1023687427.db2.gz FJIRYSDDHXCGJB-VFNWGFHPSA-N 2 1 349.482 4.121 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[NH+]([C@H]2CCc3ccccc32)CC1 ZINC000377699658 1023695153 /nfs/dbraw/zinc/69/51/53/1023695153.db2.gz QIAUNHSTPBERPR-IRLDBZIGSA-N 2 1 335.495 4.055 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[NH+]([C@H]2CCc3ccccc32)CC1 ZINC000377699658 1023695155 /nfs/dbraw/zinc/69/51/55/1023695155.db2.gz QIAUNHSTPBERPR-IRLDBZIGSA-N 2 1 335.495 4.055 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)CC1 ZINC000377699658 1023695157 /nfs/dbraw/zinc/69/51/57/1023695157.db2.gz QIAUNHSTPBERPR-IRLDBZIGSA-N 2 1 335.495 4.055 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@H+]([C@H]2CCc3ccccc32)CC1 ZINC000377699658 1023695159 /nfs/dbraw/zinc/69/51/59/1023695159.db2.gz QIAUNHSTPBERPR-IRLDBZIGSA-N 2 1 335.495 4.055 20 0 EIADMP CC(C)=CCC[C@H](C)CC[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000377705696 1023699491 /nfs/dbraw/zinc/69/94/91/1023699491.db2.gz XUIFIVFLNYDGDL-CCDCCJRHSA-N 2 1 347.591 4.002 20 0 EIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390744203 1023819997 /nfs/dbraw/zinc/81/99/97/1023819997.db2.gz OMYRZDVLVWTWEV-DOTOQJQBSA-N 2 1 328.422 4.219 20 0 EIADMP Cc1cccc(COc2ccc([C@@H](C)[NH2+]CCc3c[nH+]cn3C)cc2)c1 ZINC000471772168 1023822850 /nfs/dbraw/zinc/82/28/50/1023822850.db2.gz OXDISABRBYBNDP-GOSISDBHSA-N 2 1 349.478 4.201 20 0 EIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000471775577 1023833114 /nfs/dbraw/zinc/83/31/14/1023833114.db2.gz XMMHFIPTDKFXNU-OAHLLOKOSA-N 2 1 339.414 4.245 20 0 EIADMP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000430718145 1023977580 /nfs/dbraw/zinc/97/75/80/1023977580.db2.gz CFGUGCOAVKURKM-BEVDRBHNSA-N 2 1 347.547 4.308 20 0 EIADMP FC(F)(F)c1ccc2c(c1)[nH+]ccc2N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000549526917 1024200003 /nfs/dbraw/zinc/20/00/03/1024200003.db2.gz YRTSSKBBSPYKKJ-CQSZACIVSA-N 2 1 349.400 4.176 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cccc3ccsc32)[C@@H](C)C1 ZINC000652219680 1024390498 /nfs/dbraw/zinc/39/04/98/1024390498.db2.gz IJVSXDVMIVFHGP-LPHOPBHVSA-N 2 1 346.540 4.128 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cccc3ccsc32)[C@@H](C)C1 ZINC000652219681 1024391487 /nfs/dbraw/zinc/39/14/87/1024391487.db2.gz IJVSXDVMIVFHGP-QFBILLFUSA-N 2 1 346.540 4.128 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCC[C@H]2CCCF)CC1 ZINC000510756708 1024404266 /nfs/dbraw/zinc/40/42/66/1024404266.db2.gz SGXWXNMYNUTMPD-RXVVDRJESA-N 2 1 332.507 4.467 20 0 EIADMP COc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1OC ZINC000090586758 1024446385 /nfs/dbraw/zinc/44/63/85/1024446385.db2.gz JFAXXFWUQAMPBR-ROUUACIJSA-N 2 1 348.531 4.031 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCc2cc(Br)ccc21 ZINC000164599264 1024677392 /nfs/dbraw/zinc/67/73/92/1024677392.db2.gz ZGOCZTKUBIZUJE-KRWDZBQOSA-N 2 1 348.288 4.011 20 0 EIADMP C[C@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000511909682 1024743831 /nfs/dbraw/zinc/74/38/31/1024743831.db2.gz FRJMJEVRSDFNCZ-VFYPNZCPSA-N 2 1 334.454 4.221 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)c1 ZINC000432258176 1024792475 /nfs/dbraw/zinc/79/24/75/1024792475.db2.gz YFKMAOIYZUJCBO-UHFFFAOYSA-N 2 1 341.257 4.484 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCSCC1 ZINC000510944325 1024858857 /nfs/dbraw/zinc/85/88/57/1024858857.db2.gz JDFXHTQPWZAQRX-PXNSSMCTSA-N 2 1 346.584 4.408 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCSCC1 ZINC000510944325 1024858861 /nfs/dbraw/zinc/85/88/61/1024858861.db2.gz JDFXHTQPWZAQRX-PXNSSMCTSA-N 2 1 346.584 4.408 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCSCC1 ZINC000510944327 1024859232 /nfs/dbraw/zinc/85/92/32/1024859232.db2.gz JDFXHTQPWZAQRX-XLIONFOSSA-N 2 1 346.584 4.408 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCSCC1 ZINC000510944327 1024859235 /nfs/dbraw/zinc/85/92/35/1024859235.db2.gz JDFXHTQPWZAQRX-XLIONFOSSA-N 2 1 346.584 4.408 20 0 EIADMP C[C@H](CC1CCOCC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510954631 1024865293 /nfs/dbraw/zinc/86/52/93/1024865293.db2.gz YIBMAARKOBCDLS-WIYYLYMNSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H](CC1CCOCC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510954631 1024865297 /nfs/dbraw/zinc/86/52/97/1024865297.db2.gz YIBMAARKOBCDLS-WIYYLYMNSA-N 2 1 344.543 4.082 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2OC(F)(F)F)CC1 ZINC000535811514 1024957998 /nfs/dbraw/zinc/95/79/98/1024957998.db2.gz WIKSDDCPHKLECI-UHFFFAOYSA-N 2 1 344.421 4.137 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ncc(-c3cccc(Cl)c3)o2)[C@@H]1CCC[NH3+] ZINC000662312464 1025066867 /nfs/dbraw/zinc/06/68/67/1025066867.db2.gz GOZNJHGRYUAXHH-RHSMWYFYSA-N 2 1 347.890 4.334 20 0 EIADMP c1nc(C2CCCC2)sc1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663345877 1025143218 /nfs/dbraw/zinc/14/32/18/1025143218.db2.gz NLUNHBLLUXUIEG-INIZCTEOSA-N 2 1 333.545 4.012 20 0 EIADMP c1nc(C2CCCC2)sc1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663345877 1025143231 /nfs/dbraw/zinc/14/32/31/1025143231.db2.gz NLUNHBLLUXUIEG-INIZCTEOSA-N 2 1 333.545 4.012 20 0 EIADMP COCCC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1 ZINC000663465244 1025389058 /nfs/dbraw/zinc/38/90/58/1025389058.db2.gz IUTILJYPQAACOD-GHTZIAJQSA-N 2 1 348.506 4.005 20 0 EIADMP C[C@H]1C[C@@H](NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469479 1025416365 /nfs/dbraw/zinc/41/63/65/1025416365.db2.gz PRZWXLCTGPLFCM-JLJPHGGASA-N 2 1 336.570 4.385 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469479 1025416370 /nfs/dbraw/zinc/41/63/70/1025416370.db2.gz PRZWXLCTGPLFCM-JLJPHGGASA-N 2 1 336.570 4.385 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469479 1025416380 /nfs/dbraw/zinc/41/63/80/1025416380.db2.gz PRZWXLCTGPLFCM-JLJPHGGASA-N 2 1 336.570 4.385 20 0 EIADMP Cc1ccc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1F ZINC001167505552 1025539532 /nfs/dbraw/zinc/53/95/32/1025539532.db2.gz UIQRYNRAPBHQBI-FQEVSTJZSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1F ZINC001167505552 1025539553 /nfs/dbraw/zinc/53/95/53/1025539553.db2.gz UIQRYNRAPBHQBI-FQEVSTJZSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC001167505552 1025539567 /nfs/dbraw/zinc/53/95/67/1025539567.db2.gz UIQRYNRAPBHQBI-FQEVSTJZSA-N 2 1 326.459 4.088 20 0 EIADMP Cc1ccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC001167505552 1025539589 /nfs/dbraw/zinc/53/95/89/1025539589.db2.gz UIQRYNRAPBHQBI-FQEVSTJZSA-N 2 1 326.459 4.088 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCSC[C@@H]1c1ccc(F)cc1 ZINC001167833330 1025788531 /nfs/dbraw/zinc/78/85/31/1025788531.db2.gz AFRDRCNGTCXCIM-VQIMIIECSA-N 2 1 338.536 4.426 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](CC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001167838966 1025851333 /nfs/dbraw/zinc/85/13/33/1025851333.db2.gz XGONZEJYRFVWEM-RBBKRZOGSA-N 2 1 345.575 4.093 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]C2CC[NH+](CC(C)C)CC2)cc1 ZINC000657305479 1025851982 /nfs/dbraw/zinc/85/19/82/1025851982.db2.gz YOKMGZDZOODJHI-UHFFFAOYSA-N 2 1 343.540 4.329 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H](c2cccc(OC)c2)C1 ZINC001167839554 1025854159 /nfs/dbraw/zinc/85/41/59/1025854159.db2.gz ABJCKCYVLTVXBF-ICSRJNTNSA-N 2 1 332.532 4.385 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000431328329 1025874930 /nfs/dbraw/zinc/87/49/30/1025874930.db2.gz MLXYJIGVUBRWJJ-LJQANCHMSA-N 2 1 348.918 4.326 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(Cl)cc1Cl ZINC000344089059 1025994821 /nfs/dbraw/zinc/99/48/21/1025994821.db2.gz LKGRBGSUKLPBPM-MLGOLLRUSA-N 2 1 338.282 4.493 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(Oc2cccnc2)cc1 ZINC000344090898 1025999822 /nfs/dbraw/zinc/99/98/22/1025999822.db2.gz JPIJOTDWBMGIDZ-AEFFLSMTSA-N 2 1 325.456 4.009 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000432447186 1026027160 /nfs/dbraw/zinc/02/71/60/1026027160.db2.gz OKURUDITGZEMKQ-KGLIPLIRSA-N 2 1 345.314 4.145 20 0 EIADMP C[N@H+]1CCC[C@H](CNc2[nH+]ccc3[nH]ccc32)[C@@H]1c1cccs1 ZINC000663660327 1026062994 /nfs/dbraw/zinc/06/29/94/1026062994.db2.gz MBTLFTLPVWLIHX-CXAGYDPISA-N 2 1 326.469 4.119 20 0 EIADMP Fc1ccccc1[C@H](F)C1CC[NH+](CCC[NH+]2CCCCC2)CC1 ZINC000511066131 1026081469 /nfs/dbraw/zinc/08/14/69/1026081469.db2.gz QMHPCFAQKSQRET-HXUWFJFHSA-N 2 1 336.470 4.424 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(OC)cc1 ZINC001167971586 1026090181 /nfs/dbraw/zinc/09/01/81/1026090181.db2.gz ZRDQXSVQITYATR-SMLSOGCJSA-N 2 1 328.500 4.141 20 0 EIADMP C[C@H](C[NH2+]Cc1cc(Cl)ccc1OC(F)F)C[NH+]1CCCCC1 ZINC000390946613 1026165223 /nfs/dbraw/zinc/16/52/23/1026165223.db2.gz NAPWZZUGQBPWSP-CYBMUJFWSA-N 2 1 346.849 4.153 20 0 EIADMP Fc1ccc2c(c1)CCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167975121 1026222843 /nfs/dbraw/zinc/22/28/43/1026222843.db2.gz HWAZKHWRQNKKDQ-SMLSOGCJSA-N 2 1 328.475 4.198 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccc(F)cc1 ZINC000163523183 1026377555 /nfs/dbraw/zinc/37/75/55/1026377555.db2.gz CSVVXRCNXPNOON-IBGZPJMESA-N 2 1 327.447 4.239 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(OCC)c(OC)c2)CC1 ZINC000506896618 1026508992 /nfs/dbraw/zinc/50/89/92/1026508992.db2.gz NQEYLRFGJCNWQE-UHFFFAOYSA-N 2 1 348.531 4.038 20 0 EIADMP Cc1cccc2[nH]c(C[NH2+][C@@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)cc21 ZINC000657428872 1026628967 /nfs/dbraw/zinc/62/89/67/1026628967.db2.gz CQLSRBFZCNQMFZ-IRXDYDNUSA-N 2 1 325.500 4.219 20 0 EIADMP FC(F)(F)CCCC[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512287910 1026654996 /nfs/dbraw/zinc/65/49/96/1026654996.db2.gz WNCTWFYKKOUFTO-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCCC[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512287910 1026655004 /nfs/dbraw/zinc/65/50/04/1026655004.db2.gz WNCTWFYKKOUFTO-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCCC[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000512287910 1026655012 /nfs/dbraw/zinc/65/50/12/1026655012.db2.gz WNCTWFYKKOUFTO-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCCC[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000512287910 1026655020 /nfs/dbraw/zinc/65/50/20/1026655020.db2.gz WNCTWFYKKOUFTO-SFHVURJKSA-N 2 1 340.433 4.317 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]CC(Cc2ccccc2)Cc2ccccc2)C1 ZINC000582457711 1026666423 /nfs/dbraw/zinc/66/64/23/1026666423.db2.gz BHZWWKYVCGKOFB-JOCHJYFZSA-N 2 1 336.523 4.019 20 0 EIADMP Fc1ccc2c(c1)[nH+]ccc2N1CCC[N@H+](Cc2ccccc2)CC1 ZINC000500468455 1026778228 /nfs/dbraw/zinc/77/82/28/1026778228.db2.gz CLAZNJUGCBIRBE-UHFFFAOYSA-N 2 1 335.426 4.086 20 0 EIADMP Fc1ccc2c(c1)[nH+]ccc2N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000500468455 1026778241 /nfs/dbraw/zinc/77/82/41/1026778241.db2.gz CLAZNJUGCBIRBE-UHFFFAOYSA-N 2 1 335.426 4.086 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000507447447 1026797528 /nfs/dbraw/zinc/79/75/28/1026797528.db2.gz HUIWZBCSJJATQT-LVCYWYKZSA-N 2 1 337.511 4.205 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000507447447 1026797540 /nfs/dbraw/zinc/79/75/40/1026797540.db2.gz HUIWZBCSJJATQT-LVCYWYKZSA-N 2 1 337.511 4.205 20 0 EIADMP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000560249292 1026821845 /nfs/dbraw/zinc/82/18/45/1026821845.db2.gz HQXGPUOZLSQWFP-GMQQQROESA-N 2 1 344.543 4.431 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCCOC1 ZINC000507513043 1026822403 /nfs/dbraw/zinc/82/24/03/1026822403.db2.gz QNKHQFOOXBDKMS-LMVRJCEZSA-N 2 1 344.543 4.069 20 0 EIADMP Cc1ccccc1SC[C@@H](C)C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC001167599044 1026943365 /nfs/dbraw/zinc/94/33/65/1026943365.db2.gz NWSPWVTUTKYFDW-FXAWDEMLSA-N 2 1 346.584 4.387 20 0 EIADMP Cc1ccccc1SC[C@@H](C)C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC001167599044 1026943375 /nfs/dbraw/zinc/94/33/75/1026943375.db2.gz NWSPWVTUTKYFDW-FXAWDEMLSA-N 2 1 346.584 4.387 20 0 EIADMP Cc1ccccc1SC[C@@H](C)C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC001167599044 1026943388 /nfs/dbraw/zinc/94/33/88/1026943388.db2.gz NWSPWVTUTKYFDW-FXAWDEMLSA-N 2 1 346.584 4.387 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2noc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000657534229 1026988183 /nfs/dbraw/zinc/98/81/83/1026988183.db2.gz UTBJKTNWFAJNQO-PKOBYXMFSA-N 2 1 349.478 4.013 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2noc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000657534229 1026988189 /nfs/dbraw/zinc/98/81/89/1026988189.db2.gz UTBJKTNWFAJNQO-PKOBYXMFSA-N 2 1 349.478 4.013 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]CC2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000117950837 1027028156 /nfs/dbraw/zinc/02/81/56/1027028156.db2.gz GSAPYNXEZCALMP-WBVHZDCISA-N 2 1 326.406 4.088 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]CC2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000117950837 1027028164 /nfs/dbraw/zinc/02/81/64/1027028164.db2.gz GSAPYNXEZCALMP-WBVHZDCISA-N 2 1 326.406 4.088 20 0 EIADMP CS[C@@H]1CCCC[NH+]([C@H](C)CC[N@@H+]2CCCC[C@@H](SC)C2)C1 ZINC000441107027 1027302581 /nfs/dbraw/zinc/30/25/81/1027302581.db2.gz WNMUZKYXZQAXDA-KZNAEPCWSA-N 2 1 344.634 4.200 20 0 EIADMP CS[C@@H]1CCCC[NH+](CC[C@@H](C)[N@@H+]2CCCC[C@@H](SC)C2)C1 ZINC000441107027 1027302605 /nfs/dbraw/zinc/30/26/05/1027302605.db2.gz WNMUZKYXZQAXDA-KZNAEPCWSA-N 2 1 344.634 4.200 20 0 EIADMP CS[C@@H]1CCCC[NH+](CC[C@@H](C)[N@H+]2CCCC[C@@H](SC)C2)C1 ZINC000441107027 1027302627 /nfs/dbraw/zinc/30/26/27/1027302627.db2.gz WNMUZKYXZQAXDA-KZNAEPCWSA-N 2 1 344.634 4.200 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC1 ZINC000204973679 1027304491 /nfs/dbraw/zinc/30/44/91/1027304491.db2.gz LTOCAPWSJFNHRR-SFHVURJKSA-N 2 1 331.891 4.273 20 0 EIADMP C[C@@H]1CC([N@H+]2CCC(F)(F)[C@@H](C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168041209 1027432701 /nfs/dbraw/zinc/43/27/01/1027432701.db2.gz QZIAUKFOONSEBV-GVDBMIGSSA-N 2 1 336.470 4.405 20 0 EIADMP CCOC[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000474724648 1027441606 /nfs/dbraw/zinc/44/16/06/1027441606.db2.gz CLKJQMIZHQUYAM-SLYNCCJLSA-N 2 1 330.516 4.007 20 0 EIADMP CCOC[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000474724645 1027441861 /nfs/dbraw/zinc/44/18/61/1027441861.db2.gz CLKJQMIZHQUYAM-CUWPLCDZSA-N 2 1 330.516 4.007 20 0 EIADMP CCOC[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000474724647 1027442351 /nfs/dbraw/zinc/44/23/51/1027442351.db2.gz CLKJQMIZHQUYAM-LMNJBCLMSA-N 2 1 330.516 4.007 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000320915252 1027563040 /nfs/dbraw/zinc/56/30/40/1027563040.db2.gz DOOGLPPWFUVPDY-FRFSOERESA-N 2 1 326.406 4.230 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)cc1F ZINC000112524259 1027580297 /nfs/dbraw/zinc/58/02/97/1027580297.db2.gz DGOORUVECOMIGP-OAHLLOKOSA-N 2 1 330.422 4.411 20 0 EIADMP COc1cccc([C@@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167995087 1027739144 /nfs/dbraw/zinc/73/91/44/1027739144.db2.gz VOKSIDVKSHPBSP-CZJMCEMMSA-N 2 1 340.511 4.238 20 0 EIADMP COc1cccc([C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167995087 1027739165 /nfs/dbraw/zinc/73/91/65/1027739165.db2.gz VOKSIDVKSHPBSP-CZJMCEMMSA-N 2 1 340.511 4.238 20 0 EIADMP COc1cccc([C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167995087 1027739182 /nfs/dbraw/zinc/73/91/82/1027739182.db2.gz VOKSIDVKSHPBSP-CZJMCEMMSA-N 2 1 340.511 4.238 20 0 EIADMP c1cncc([C@@H]2CCCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167995325 1027767881 /nfs/dbraw/zinc/76/78/81/1027767881.db2.gz ARBDEPPVANFRDH-JKWVGCSGSA-N 2 1 325.500 4.014 20 0 EIADMP c1cncc([C@@H]2CCCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167995325 1027767899 /nfs/dbraw/zinc/76/78/99/1027767899.db2.gz ARBDEPPVANFRDH-JKWVGCSGSA-N 2 1 325.500 4.014 20 0 EIADMP c1cncc([C@@H]2CCCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167995325 1027767920 /nfs/dbraw/zinc/76/79/20/1027767920.db2.gz ARBDEPPVANFRDH-JKWVGCSGSA-N 2 1 325.500 4.014 20 0 EIADMP Cc1ccc2c(c1)c1c(n2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC[NH2+]C1 ZINC001167995764 1027801498 /nfs/dbraw/zinc/80/14/98/1027801498.db2.gz PYGHMNQAOZCMDY-DFNIBXOVSA-N 2 1 349.522 4.173 20 0 EIADMP C[N@@H+](CCc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995739 1027808561 /nfs/dbraw/zinc/80/85/61/1027808561.db2.gz PHKCILUYTBYYDR-YOFSQIOKSA-N 2 1 332.919 4.220 20 0 EIADMP C[NH+](CCc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167995739 1027808566 /nfs/dbraw/zinc/80/85/66/1027808566.db2.gz PHKCILUYTBYYDR-YOFSQIOKSA-N 2 1 332.919 4.220 20 0 EIADMP C[NH+](CCc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167995739 1027808572 /nfs/dbraw/zinc/80/85/72/1027808572.db2.gz PHKCILUYTBYYDR-YOFSQIOKSA-N 2 1 332.919 4.220 20 0 EIADMP C[C@H]([NH2+][C@@H](C)C1CCSCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000474942045 1027809233 /nfs/dbraw/zinc/80/92/33/1027809233.db2.gz KKSJKFHPEWBXPL-ZWOKBUDYSA-N 2 1 332.557 4.018 20 0 EIADMP c1ccc([C@@H]2CSCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167995834 1027812054 /nfs/dbraw/zinc/81/20/54/1027812054.db2.gz RJUWSKKWXGFWSR-JKWVGCSGSA-N 2 1 342.552 4.182 20 0 EIADMP c1ccc([C@@H]2CSCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167995834 1027812058 /nfs/dbraw/zinc/81/20/58/1027812058.db2.gz RJUWSKKWXGFWSR-JKWVGCSGSA-N 2 1 342.552 4.182 20 0 EIADMP c1ccc([C@@H]2CSCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995834 1027812060 /nfs/dbraw/zinc/81/20/60/1027812060.db2.gz RJUWSKKWXGFWSR-JKWVGCSGSA-N 2 1 342.552 4.182 20 0 EIADMP c1ccc([C@@H]2CSCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995834 1027812064 /nfs/dbraw/zinc/81/20/64/1027812064.db2.gz RJUWSKKWXGFWSR-JKWVGCSGSA-N 2 1 342.552 4.182 20 0 EIADMP Cc1nccn1-c1ccc(CN[C@@H](C)c2ccccc2F)cc1F ZINC000153683654 1027872309 /nfs/dbraw/zinc/87/23/09/1027872309.db2.gz JARDMPQMJCAEBW-ZDUSSCGKSA-N 2 1 327.378 4.310 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H](C)CCc2cccc(C(F)(F)F)c2)C1 ZINC000583052206 1027903487 /nfs/dbraw/zinc/90/34/87/1027903487.db2.gz XZOKBYUPMBPEDD-NVXWUHKLSA-N 2 1 342.449 4.346 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1cc(F)cc(F)c1 ZINC000648068311 1027954840 /nfs/dbraw/zinc/95/48/40/1027954840.db2.gz QAONFGZFXCFFHL-FPDPHYFHSA-N 2 1 344.449 4.003 20 0 EIADMP Cc1ccc(OCCC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1C ZINC000523450341 1028125521 /nfs/dbraw/zinc/12/55/21/1028125521.db2.gz RTSWSMIGSDNZJH-FQEVSTJZSA-N 2 1 330.516 4.023 20 0 EIADMP CCCNc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000193151177 1028135203 /nfs/dbraw/zinc/13/52/03/1028135203.db2.gz PJONQHNZWIJCQP-UHFFFAOYSA-N 2 1 337.511 4.263 20 0 EIADMP CC1(C)[C@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1(F)F ZINC000657738984 1028183760 /nfs/dbraw/zinc/18/37/60/1028183760.db2.gz PBHUWWVZDZJIRN-SJORKVTESA-N 2 1 334.454 4.065 20 0 EIADMP CC1(C)[C@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1(F)F ZINC000657738984 1028183767 /nfs/dbraw/zinc/18/37/67/1028183767.db2.gz PBHUWWVZDZJIRN-SJORKVTESA-N 2 1 334.454 4.065 20 0 EIADMP CC[C@@H](C)[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1ccccc1 ZINC000346152055 1028284779 /nfs/dbraw/zinc/28/47/79/1028284779.db2.gz OMOXVTFVFXUVPH-QGZVFWFLSA-N 2 1 334.467 4.376 20 0 EIADMP Cc1nn(-c2ccncc2)cc1CN(C)[C@H](C)c1ccccc1Cl ZINC000346160432 1028297101 /nfs/dbraw/zinc/29/71/01/1028297101.db2.gz WQRBORBOXXWDFF-OAHLLOKOSA-N 2 1 340.858 4.422 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC[N@@H+]1C ZINC000280948333 1028298355 /nfs/dbraw/zinc/29/83/55/1028298355.db2.gz XCUBHQRGRDSTPW-QIJZBDPFSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC[N@H+]1C ZINC000280948333 1028298374 /nfs/dbraw/zinc/29/83/74/1028298374.db2.gz XCUBHQRGRDSTPW-QIJZBDPFSA-N 2 1 326.406 4.024 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000346167433 1028301901 /nfs/dbraw/zinc/30/19/01/1028301901.db2.gz KIIBVDIJZRESEY-HNAYVOBHSA-N 2 1 336.439 4.142 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000346178417 1028309470 /nfs/dbraw/zinc/30/94/70/1028309470.db2.gz PRNARHNAGNXDDS-OAQYLSRUSA-N 2 1 334.467 4.405 20 0 EIADMP Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc(-n3ccnc3)cs1)CCC2 ZINC000346194455 1028318501 /nfs/dbraw/zinc/31/85/01/1028318501.db2.gz GSBJTGGPNOHMJZ-INIZCTEOSA-N 2 1 344.509 4.208 20 0 EIADMP CC(C)=CCC[C@@H](C)[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000162740098 1028321830 /nfs/dbraw/zinc/32/18/30/1028321830.db2.gz RCEHILKCGSFJQL-MRXNPFEDSA-N 2 1 333.520 4.228 20 0 EIADMP Cc1[nH+]ccn1CC[NH+]1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000346302257 1028377163 /nfs/dbraw/zinc/37/71/63/1028377163.db2.gz BCGJXRJXCKFWBC-UHFFFAOYSA-N 2 1 335.904 4.102 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000346350244 1028385045 /nfs/dbraw/zinc/38/50/45/1028385045.db2.gz JTRFTWXYTDLOFE-VFCOFNOGSA-N 2 1 344.462 4.254 20 0 EIADMP C[N@@H+](CCCCOC(C)(C)C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000475048592 1028456861 /nfs/dbraw/zinc/45/68/61/1028456861.db2.gz IDKRSYOXVRRCRN-HXUWFJFHSA-N 2 1 332.532 4.036 20 0 EIADMP C[NH+](CCCCOC(C)(C)C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475048592 1028456865 /nfs/dbraw/zinc/45/68/65/1028456865.db2.gz IDKRSYOXVRRCRN-HXUWFJFHSA-N 2 1 332.532 4.036 20 0 EIADMP C[NH+](CCCCOC(C)(C)C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475048592 1028456872 /nfs/dbraw/zinc/45/68/72/1028456872.db2.gz IDKRSYOXVRRCRN-HXUWFJFHSA-N 2 1 332.532 4.036 20 0 EIADMP COCc1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)o1 ZINC000126334787 1028586169 /nfs/dbraw/zinc/58/61/69/1028586169.db2.gz ZRXJXCSIIPMAPQ-UHFFFAOYSA-N 2 1 342.483 4.092 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000583395822 1028656615 /nfs/dbraw/zinc/65/66/15/1028656615.db2.gz NZPPOTNBWWOBQX-DJZPMSPPSA-N 2 1 327.299 4.027 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CCC12CCOCC2 ZINC000548794487 1028695326 /nfs/dbraw/zinc/69/53/26/1028695326.db2.gz HYECITHUGVEMOS-GHTZIAJQSA-N 2 1 342.527 4.110 20 0 EIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1cnc(C(F)(F)F)s1 ZINC000444003986 1028724932 /nfs/dbraw/zinc/72/49/32/1028724932.db2.gz PLORCEVWLPETJA-GXTWGEPZSA-N 2 1 349.466 4.152 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(Cl)ccc1OC ZINC000650753399 1029159788 /nfs/dbraw/zinc/15/97/88/1029159788.db2.gz MPGFDCGGFBKQEO-KRWDZBQOSA-N 2 1 336.838 4.187 20 0 EIADMP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000511244937 1029253595 /nfs/dbraw/zinc/25/35/95/1029253595.db2.gz XDDLYRHBZQWAPK-MDYRTPRTSA-N 2 1 344.524 4.057 20 0 EIADMP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000511244937 1029253609 /nfs/dbraw/zinc/25/36/09/1029253609.db2.gz XDDLYRHBZQWAPK-MDYRTPRTSA-N 2 1 344.524 4.057 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)CCS2 ZINC000343493595 1029357064 /nfs/dbraw/zinc/35/70/64/1029357064.db2.gz DCBDPCXJCHHLIS-QFBILLFUSA-N 2 1 348.556 4.476 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@@H](C)c2ncc(-c3ccccc3)o2)CC1 ZINC000524991500 1029386158 /nfs/dbraw/zinc/38/61/58/1029386158.db2.gz ZRVDTETYGCHDMI-KRWDZBQOSA-N 2 1 341.499 4.455 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@H]3c3ccccc3)C2)cc1 ZINC000475274037 1029479886 /nfs/dbraw/zinc/47/98/86/1029479886.db2.gz HKAOSXPXPKMLRO-AKIFATBCSA-N 2 1 334.507 4.434 20 0 EIADMP CC(C)(C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)Oc1ccccc1 ZINC000525182874 1029498979 /nfs/dbraw/zinc/49/89/79/1029498979.db2.gz YQXIEIYUJRFJLY-UHFFFAOYSA-N 2 1 338.495 4.098 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCCCOC(C)(C)C ZINC000475321683 1029516726 /nfs/dbraw/zinc/51/67/26/1029516726.db2.gz ZXGVUHSGOBYDSG-KXTWHKPSSA-N 2 1 346.559 4.328 20 0 EIADMP CC(C)COc1ccc(C(C)(C)C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000166534760 1029533569 /nfs/dbraw/zinc/53/35/69/1029533569.db2.gz GKTMFPVRUSMESE-VQTJNVASSA-N 2 1 344.543 4.215 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCCOC(C)(C)C ZINC000475335715 1029549869 /nfs/dbraw/zinc/54/98/69/1029549869.db2.gz SEHXHDOTZXENLO-QUCCMNQESA-N 2 1 332.532 4.082 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCCOC(C)(C)C ZINC000475335715 1029549875 /nfs/dbraw/zinc/54/98/75/1029549875.db2.gz SEHXHDOTZXENLO-QUCCMNQESA-N 2 1 332.532 4.082 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCC[NH+]1CCCCC1)CCCS2 ZINC000446747915 1029555901 /nfs/dbraw/zinc/55/59/01/1029555901.db2.gz JNGDQYUCTLWVOH-GOSISDBHSA-N 2 1 334.529 4.088 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cc2ccccc2s1 ZINC000446817219 1029580420 /nfs/dbraw/zinc/58/04/20/1029580420.db2.gz GYDWWPGMKKJUJB-BBWFWOEESA-N 2 1 346.540 4.441 20 0 EIADMP COC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000347319968 1029618744 /nfs/dbraw/zinc/61/87/44/1029618744.db2.gz JGINQJRPRMRSIJ-DYESRHJHSA-N 2 1 349.478 4.089 20 0 EIADMP C[C@@H](c1ccccc1F)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278746386 1029792646 /nfs/dbraw/zinc/79/26/46/1029792646.db2.gz AMOUYPVYAXMFTH-HNNXBMFYSA-N 2 1 327.447 4.299 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(F)cc1Cl ZINC000708523247 1029814191 /nfs/dbraw/zinc/81/41/91/1029814191.db2.gz LNYFQECPRRPPNA-MAUKXSAKSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(F)cc1Cl ZINC000708523247 1029814192 /nfs/dbraw/zinc/81/41/92/1029814192.db2.gz LNYFQECPRRPPNA-MAUKXSAKSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657859389 1029845783 /nfs/dbraw/zinc/84/57/83/1029845783.db2.gz TVMMZSVJNQWDIS-PKOBYXMFSA-N 2 1 349.478 4.391 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657859389 1029845785 /nfs/dbraw/zinc/84/57/85/1029845785.db2.gz TVMMZSVJNQWDIS-PKOBYXMFSA-N 2 1 349.478 4.391 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2COc3ccc(C)cc32)cc1 ZINC000090452400 1029860839 /nfs/dbraw/zinc/86/08/39/1029860839.db2.gz CFPQSIQHAQRLES-QRWLVFNGSA-N 2 1 333.435 4.273 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCC[C@@H]2CCCC[C@@H]2O)cc1 ZINC000090544567 1029867012 /nfs/dbraw/zinc/86/70/12/1029867012.db2.gz ZJDDILXRFKYGTD-LRQRDZAKSA-N 2 1 341.499 4.163 20 0 EIADMP Cc1cc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)c(OC(F)F)cc1C ZINC000092073659 1029899119 /nfs/dbraw/zinc/89/91/19/1029899119.db2.gz WDZLPKXJLDKUBJ-CQSZACIVSA-N 2 1 335.398 4.008 20 0 EIADMP Cc1cc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc(C)c1OC(F)F ZINC000092072040 1029900376 /nfs/dbraw/zinc/90/03/76/1029900376.db2.gz JKJSBAIZTOTIMU-OAHLLOKOSA-N 2 1 335.398 4.008 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@H+](CC/C=C\c3ccccc3)C1)CCCC2 ZINC000450788527 1029980313 /nfs/dbraw/zinc/98/03/13/1029980313.db2.gz UKMLICDVMODECS-QRGKHIHXSA-N 2 1 335.495 4.421 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@@H+](CC/C=C\c3ccccc3)C1)CCCC2 ZINC000450788527 1029980336 /nfs/dbraw/zinc/98/03/36/1029980336.db2.gz UKMLICDVMODECS-QRGKHIHXSA-N 2 1 335.495 4.421 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@H+](CC/C=C/c3ccccc3)C1)CCCC2 ZINC000450788531 1029983878 /nfs/dbraw/zinc/98/38/78/1029983878.db2.gz UKMLICDVMODECS-WUTDNEBXSA-N 2 1 335.495 4.421 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@@H+](CC/C=C/c3ccccc3)C1)CCCC2 ZINC000450788531 1029983885 /nfs/dbraw/zinc/98/38/85/1029983885.db2.gz UKMLICDVMODECS-WUTDNEBXSA-N 2 1 335.495 4.421 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1nccs1 ZINC000093397946 1030001936 /nfs/dbraw/zinc/00/19/36/1030001936.db2.gz WXESLDYTSITHHC-HOTGVXAUSA-N 2 1 329.513 4.368 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1nccs1 ZINC000093397946 1030001956 /nfs/dbraw/zinc/00/19/56/1030001956.db2.gz WXESLDYTSITHHC-HOTGVXAUSA-N 2 1 329.513 4.368 20 0 EIADMP CC[NH2+]CC1CC[NH+](Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000470002952 1030006137 /nfs/dbraw/zinc/00/61/37/1030006137.db2.gz IZNUPWYYPGGRNL-UHFFFAOYSA-N 2 1 334.813 4.180 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(Cl)c(OC)c1 ZINC000450854831 1030071684 /nfs/dbraw/zinc/07/16/84/1030071684.db2.gz LCDBBDPRUBKHNJ-UHFFFAOYSA-N 2 1 335.879 4.020 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(Cl)c(OC)c1 ZINC000450854831 1030071698 /nfs/dbraw/zinc/07/16/98/1030071698.db2.gz LCDBBDPRUBKHNJ-UHFFFAOYSA-N 2 1 335.879 4.020 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC000525860284 1030083051 /nfs/dbraw/zinc/08/30/51/1030083051.db2.gz REHZEMRASDYTNT-NMIHRBCNSA-N 2 1 344.543 4.049 20 0 EIADMP FC1(F)CC[C@H](C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC000450981577 1030157177 /nfs/dbraw/zinc/15/71/77/1030157177.db2.gz IYLQQWYUBYFUKN-OALUTQOASA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC[C@H](C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC000450981577 1030157185 /nfs/dbraw/zinc/15/71/85/1030157185.db2.gz IYLQQWYUBYFUKN-OALUTQOASA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC[C@H](C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC000450981577 1030157208 /nfs/dbraw/zinc/15/72/08/1030157208.db2.gz IYLQQWYUBYFUKN-OALUTQOASA-N 2 1 334.454 4.020 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC[N@H+]1C ZINC000447563832 1030170930 /nfs/dbraw/zinc/17/09/30/1030170930.db2.gz FWOBGAWISJEGNH-KGLIPLIRSA-N 2 1 341.326 4.487 20 0 EIADMP C[C@H](CC(F)(F)F)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447601973 1030218599 /nfs/dbraw/zinc/21/85/99/1030218599.db2.gz RBPKUHFFCRJILV-DZUCGIPZSA-N 2 1 326.406 4.113 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@@H]2CCCCS2)C3)cc1 ZINC000447601363 1030222841 /nfs/dbraw/zinc/22/28/41/1030222841.db2.gz PKMPQMPGHGZDEZ-HAGHYFMRSA-N 2 1 330.541 4.057 20 0 EIADMP Clc1ccc2c(c1)CC[C@H]2[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000530217934 1030225704 /nfs/dbraw/zinc/22/57/04/1030225704.db2.gz CUYJBJOIXGCIRF-SXLOBPIMSA-N 2 1 326.871 4.410 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+]Cc1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000186125405 1030252684 /nfs/dbraw/zinc/25/26/84/1030252684.db2.gz RHSIXVASQLOVET-LBPRGKRZSA-N 2 1 345.443 4.241 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000392489847 1030302578 /nfs/dbraw/zinc/30/25/78/1030302578.db2.gz SRUINYLMAVODCI-IRXDYDNUSA-N 2 1 326.484 4.492 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000392489847 1030302592 /nfs/dbraw/zinc/30/25/92/1030302592.db2.gz SRUINYLMAVODCI-IRXDYDNUSA-N 2 1 326.484 4.492 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1OCCC ZINC000392288460 1030330041 /nfs/dbraw/zinc/33/00/41/1030330041.db2.gz LVVVXZRTGJHRKV-KRWDZBQOSA-N 2 1 346.515 4.177 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc2cnccc2c1 ZINC000685456448 1030335659 /nfs/dbraw/zinc/33/56/59/1030335659.db2.gz QTQMCPQZGBQKKF-UHFFFAOYSA-N 2 1 333.479 4.319 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000657892735 1030375026 /nfs/dbraw/zinc/37/50/26/1030375026.db2.gz XSQDDSYCGVBMMO-IAOVAPTHSA-N 2 1 328.422 4.099 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000657892735 1030375044 /nfs/dbraw/zinc/37/50/44/1030375044.db2.gz XSQDDSYCGVBMMO-IAOVAPTHSA-N 2 1 328.422 4.099 20 0 EIADMP CC[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)CCO1 ZINC000648423715 1030435066 /nfs/dbraw/zinc/43/50/66/1030435066.db2.gz WUALTKPMLVBRDW-JRGCBEDISA-N 2 1 330.516 4.108 20 0 EIADMP Cc1ccc2cc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)ccc2n1 ZINC000527106302 1030484715 /nfs/dbraw/zinc/48/47/15/1030484715.db2.gz JJAQDEKFWIZZQV-UHFFFAOYSA-N 2 1 325.500 4.095 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000530522687 1030497648 /nfs/dbraw/zinc/49/76/48/1030497648.db2.gz QCRUQZHTKDGISV-UREXAPBRSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(SC2CCCC2)cc1 ZINC000530513344 1030504169 /nfs/dbraw/zinc/50/41/69/1030504169.db2.gz KTTQZBSUDMGVNK-OAHLLOKOSA-N 2 1 329.513 4.348 20 0 EIADMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cnn1C(C)(C)C ZINC000191328343 1030618823 /nfs/dbraw/zinc/61/88/23/1030618823.db2.gz ZZVPANPSRNECTO-OAHLLOKOSA-N 2 1 332.536 4.004 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000548851785 1030634591 /nfs/dbraw/zinc/63/45/91/1030634591.db2.gz FHCPGEDZZOCZAD-YVGNARHYSA-N 2 1 326.406 4.040 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3ccncc3s2)C1 ZINC000657932153 1030636825 /nfs/dbraw/zinc/63/68/25/1030636825.db2.gz UQPQMHBWDDNADY-HZPDHXFCSA-N 2 1 331.529 4.315 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000398133003 1030713069 /nfs/dbraw/zinc/71/30/69/1030713069.db2.gz KDLIBUYHNUNNGB-DYESRHJHSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000398141014 1030713648 /nfs/dbraw/zinc/71/36/48/1030713648.db2.gz MKDMZWFOSIQGRI-DYESRHJHSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000398141014 1030713668 /nfs/dbraw/zinc/71/36/68/1030713668.db2.gz MKDMZWFOSIQGRI-DYESRHJHSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H](Oc1ccc([C@H](C)[NH2+]CCc2c[nH+]cn2C)cc1)c1ccccc1 ZINC000657982953 1030742040 /nfs/dbraw/zinc/74/20/40/1030742040.db2.gz PCPDHLYGPYKHJB-ZWKOTPCHSA-N 2 1 349.478 4.453 20 0 EIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@H](C)Cc2ccc(Cl)cc2)CC1 ZINC001168176717 1030745617 /nfs/dbraw/zinc/74/56/17/1030745617.db2.gz IRWGYOBWNXQMIC-OAHLLOKOSA-N 2 1 343.902 4.213 20 0 EIADMP Clc1cnccc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000527647586 1030800004 /nfs/dbraw/zinc/80/00/04/1030800004.db2.gz MERBMOLYALFVGU-UHFFFAOYSA-N 2 1 343.902 4.401 20 0 EIADMP c1nc([C@@H]2CCC[N@H+](Cc3ccnc4ccccc34)C2)n2c1CCCC2 ZINC000548859326 1030837034 /nfs/dbraw/zinc/83/70/34/1030837034.db2.gz ZJIIAKOYXPMNLV-GOSISDBHSA-N 2 1 346.478 4.147 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc3cc(Cl)cnc3o2)C1 ZINC000648424300 1030865493 /nfs/dbraw/zinc/86/54/93/1030865493.db2.gz WZYBAPKHGCMZKI-AWEZNQCLSA-N 2 1 335.879 4.083 20 0 EIADMP CC[C@H](CCc1ccccc1)[NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1 ZINC000527853424 1030877756 /nfs/dbraw/zinc/87/77/56/1030877756.db2.gz UKIORBXCPOYYIJ-HXUWFJFHSA-N 2 1 334.467 4.077 20 0 EIADMP C[C@]1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)CC1(F)F ZINC000658219633 1030885948 /nfs/dbraw/zinc/88/59/48/1030885948.db2.gz CJANBTSUOQPLGU-AKHDSKFASA-N 2 1 334.454 4.065 20 0 EIADMP Oc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CC2 ZINC000658240093 1030897876 /nfs/dbraw/zinc/89/78/76/1030897876.db2.gz XSYQYZFFSBKZDS-VLVHOKLOSA-N 2 1 348.490 4.165 20 0 EIADMP Oc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3Cc1ccccc1)CC2 ZINC000658240093 1030897879 /nfs/dbraw/zinc/89/78/79/1030897879.db2.gz XSYQYZFFSBKZDS-VLVHOKLOSA-N 2 1 348.490 4.165 20 0 EIADMP Oc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CC2 ZINC000658240090 1030898137 /nfs/dbraw/zinc/89/81/37/1030898137.db2.gz XSYQYZFFSBKZDS-ISHFTEKXSA-N 2 1 348.490 4.165 20 0 EIADMP Oc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3Cc1ccccc1)CC2 ZINC000658240090 1030898149 /nfs/dbraw/zinc/89/81/49/1030898149.db2.gz XSYQYZFFSBKZDS-ISHFTEKXSA-N 2 1 348.490 4.165 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)CC[N@@H+]1C ZINC000658252952 1030925985 /nfs/dbraw/zinc/92/59/85/1030925985.db2.gz GEVRCDSEBYWXLR-JQWIXIFHSA-N 2 1 334.348 4.112 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)CC[N@H+]1C ZINC000658252952 1030926001 /nfs/dbraw/zinc/92/60/01/1030926001.db2.gz GEVRCDSEBYWXLR-JQWIXIFHSA-N 2 1 334.348 4.112 20 0 EIADMP COc1cccc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1C ZINC000658353656 1031024078 /nfs/dbraw/zinc/02/40/78/1031024078.db2.gz OXLGCIXRWOGMMJ-INIZCTEOSA-N 2 1 335.451 4.349 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCC[C@H]3CC)CC2)cs1 ZINC000532505320 1031226376 /nfs/dbraw/zinc/22/63/76/1031226376.db2.gz CUAFRHDOQQLNHE-AEFFLSMTSA-N 2 1 335.561 4.086 20 0 EIADMP COc1cccc2c(C[N@H+]3CC[C@@H](C[NH+](C)CC4CC4)C3)cccc12 ZINC000449035687 1031368289 /nfs/dbraw/zinc/36/82/89/1031368289.db2.gz HRDWMIDBRJOJSB-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cccc2c(C[NH+]3CC[C@@H](C[N@H+](C)CC4CC4)C3)cccc12 ZINC000449035687 1031368298 /nfs/dbraw/zinc/36/82/98/1031368298.db2.gz HRDWMIDBRJOJSB-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cccc2c(C[NH+]3CC[C@@H](C[N@@H+](C)CC4CC4)C3)cccc12 ZINC000449035687 1031368310 /nfs/dbraw/zinc/36/83/10/1031368310.db2.gz HRDWMIDBRJOJSB-SFHVURJKSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc2ccccc21 ZINC000449036433 1031370551 /nfs/dbraw/zinc/37/05/51/1031370551.db2.gz JZHMHIJIEFCHPE-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc2ccccc21 ZINC000449036433 1031370562 /nfs/dbraw/zinc/37/05/62/1031370562.db2.gz JZHMHIJIEFCHPE-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc2ccccc21 ZINC000449036433 1031370579 /nfs/dbraw/zinc/37/05/79/1031370579.db2.gz JZHMHIJIEFCHPE-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cc(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc2ccccc21 ZINC000449036433 1031370598 /nfs/dbraw/zinc/37/05/98/1031370598.db2.gz JZHMHIJIEFCHPE-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCOC4(CCC4)C3)cc2)C1 ZINC000449074132 1031426946 /nfs/dbraw/zinc/42/69/46/1031426946.db2.gz BLRAZDRQHRYDEV-GHTZIAJQSA-N 2 1 342.527 4.110 20 0 EIADMP C[C@@H]([NH2+]C1(C[NH2+][C@@H]2CCOC3(CCC3)C2)CCCC1)c1ccccc1 ZINC000449154733 1031484705 /nfs/dbraw/zinc/48/47/05/1031484705.db2.gz JJLDQHRMQUNESO-UYAOXDASSA-N 2 1 342.527 4.341 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](CN[C@H](C)c2sccc2Br)C1 ZINC000531702762 1031489072 /nfs/dbraw/zinc/48/90/72/1031489072.db2.gz WGUHFPFAIGUXIU-CHWSQXEVSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2sccc2Br)C1 ZINC000531702762 1031489080 /nfs/dbraw/zinc/48/90/80/1031489080.db2.gz WGUHFPFAIGUXIU-CHWSQXEVSA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2sccc2Br)C1 ZINC000531702762 1031489089 /nfs/dbraw/zinc/48/90/89/1031489089.db2.gz WGUHFPFAIGUXIU-CHWSQXEVSA-N 2 1 345.350 4.282 20 0 EIADMP CC[C@H]([NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1)C1CCOCC1 ZINC000531722653 1031523384 /nfs/dbraw/zinc/52/33/84/1031523384.db2.gz IUQRRDUXWZBYJE-RXVVDRJESA-N 2 1 344.543 4.445 20 0 EIADMP CC[C@H]([NH2+]CC1([NH2+][C@H](C)c2ccccc2)CCCC1)C1CCOCC1 ZINC000531722652 1031524005 /nfs/dbraw/zinc/52/40/05/1031524005.db2.gz IUQRRDUXWZBYJE-NQIIRXRSSA-N 2 1 344.543 4.445 20 0 EIADMP C[C@H](NCCC[N@H+]1CCCC[C@@H]1C)c1ncc(-c2ccccc2)n1C ZINC000453093399 1031585314 /nfs/dbraw/zinc/58/53/14/1031585314.db2.gz RCJUIOYTVFWRDU-ROUUACIJSA-N 2 1 340.515 4.002 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2cc(-c3ccccc3)ccc2OC)CC1 ZINC000531789743 1031607404 /nfs/dbraw/zinc/60/74/04/1031607404.db2.gz VUQJTGAGUYEBMF-UHFFFAOYSA-N 2 1 338.495 4.326 20 0 EIADMP C[C@@H](Cc1ccoc1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000449307328 1031615184 /nfs/dbraw/zinc/61/51/84/1031615184.db2.gz OVJRKERVUWOMJD-FXAWDEMLSA-N 2 1 326.484 4.101 20 0 EIADMP C[C@@H](Cc1ccoc1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000449307328 1031615190 /nfs/dbraw/zinc/61/51/90/1031615190.db2.gz OVJRKERVUWOMJD-FXAWDEMLSA-N 2 1 326.484 4.101 20 0 EIADMP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000449307336 1031615433 /nfs/dbraw/zinc/61/54/33/1031615433.db2.gz OVJRKERVUWOMJD-YLJYHZDGSA-N 2 1 326.484 4.101 20 0 EIADMP C[C@H](Cc1ccoc1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000449307336 1031615449 /nfs/dbraw/zinc/61/54/49/1031615449.db2.gz OVJRKERVUWOMJD-YLJYHZDGSA-N 2 1 326.484 4.101 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000453122037 1031616275 /nfs/dbraw/zinc/61/62/75/1031616275.db2.gz DYKKGSXCDRARBX-BZSNNMDCSA-N 2 1 339.483 4.397 20 0 EIADMP CC[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453184467 1031687695 /nfs/dbraw/zinc/68/76/95/1031687695.db2.gz ZZHTURGNDMOUHT-VCOUNFBDSA-N 2 1 337.511 4.423 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000453193669 1031703543 /nfs/dbraw/zinc/70/35/43/1031703543.db2.gz GKZLQYYKLZPGLB-HBFSDRIKSA-N 2 1 329.532 4.035 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccc(F)cc1 ZINC000128214282 1031729079 /nfs/dbraw/zinc/72/90/79/1031729079.db2.gz JXGDPBQYMBIPGJ-IBGZPJMESA-N 2 1 327.447 4.239 20 0 EIADMP CSCC1CCC([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000453268491 1031793036 /nfs/dbraw/zinc/79/30/36/1031793036.db2.gz KJOZAAPVMYVJLJ-HFPIOELMSA-N 2 1 332.557 4.333 20 0 EIADMP CSCC1CCC([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000453268491 1031793049 /nfs/dbraw/zinc/79/30/49/1031793049.db2.gz KJOZAAPVMYVJLJ-HFPIOELMSA-N 2 1 332.557 4.333 20 0 EIADMP CC(C)Oc1ccc([C@H]2CCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000449560109 1031848000 /nfs/dbraw/zinc/84/80/00/1031848000.db2.gz GEUWPKXYXNJYOZ-QBCYDMNMSA-N 2 1 342.527 4.325 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cccc(COc2ccccc2)c1 ZINC000531939387 1031850178 /nfs/dbraw/zinc/85/01/78/1031850178.db2.gz DMTRBAVYMWBLFY-JBYIUTFZSA-N 2 1 338.495 4.084 20 0 EIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCCO2 ZINC000453335185 1031861144 /nfs/dbraw/zinc/86/11/44/1031861144.db2.gz DCPGHNOQYOZINF-AQDPXUSMSA-N 2 1 328.500 4.239 20 0 EIADMP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]CCn1cc[nH+]c1C ZINC000531964509 1031885418 /nfs/dbraw/zinc/88/54/18/1031885418.db2.gz WJSCWXDEGAPHOO-GOSISDBHSA-N 2 1 325.481 4.135 20 0 EIADMP C[C@H]([C@@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@]2(CCSC2)C1 ZINC000453356546 1031885497 /nfs/dbraw/zinc/88/54/97/1031885497.db2.gz KWGXOJFLWIXNKH-NRSPTQNISA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]([C@@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000453356546 1031885503 /nfs/dbraw/zinc/88/55/03/1031885503.db2.gz KWGXOJFLWIXNKH-NRSPTQNISA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]([C@@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000453356546 1031885505 /nfs/dbraw/zinc/88/55/05/1031885505.db2.gz KWGXOJFLWIXNKH-NRSPTQNISA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]1C[C@@H](NCc2ccc(Oc3ccccc3F)c(F)c2)CC[N@H+]1C ZINC000531980817 1031925632 /nfs/dbraw/zinc/92/56/32/1031925632.db2.gz SJRBQFYSZUUVNW-HOCLYGCPSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CCN1C ZINC000531980817 1031925638 /nfs/dbraw/zinc/92/56/38/1031925638.db2.gz SJRBQFYSZUUVNW-HOCLYGCPSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CC[N@@H+]1C ZINC000531980817 1031925643 /nfs/dbraw/zinc/92/56/43/1031925643.db2.gz SJRBQFYSZUUVNW-HOCLYGCPSA-N 2 1 346.421 4.329 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CC[N@H+]1C ZINC000531980817 1031925646 /nfs/dbraw/zinc/92/56/46/1031925646.db2.gz SJRBQFYSZUUVNW-HOCLYGCPSA-N 2 1 346.421 4.329 20 0 EIADMP COc1ccc(C[N@H+](CCCCn2cc[nH+]c2C)[C@H](C)C2CC2)cc1 ZINC000119417985 1031930482 /nfs/dbraw/zinc/93/04/82/1031930482.db2.gz SFXMTKQZPVBTNG-QGZVFWFLSA-N 2 1 341.499 4.281 20 0 EIADMP COc1ccc(C[N@@H+](CCCCn2cc[nH+]c2C)[C@H](C)C2CC2)cc1 ZINC000119417985 1031930488 /nfs/dbraw/zinc/93/04/88/1031930488.db2.gz SFXMTKQZPVBTNG-QGZVFWFLSA-N 2 1 341.499 4.281 20 0 EIADMP Cc1cc([C@H]([NH2+]CCCC[N@H+](C)C2CC2)c2cccnc2)ccc1F ZINC000453405919 1031942378 /nfs/dbraw/zinc/94/23/78/1031942378.db2.gz QVPWEBAUPKUTRR-NRFANRHFSA-N 2 1 341.474 4.083 20 0 EIADMP Cc1cc(C[NH2+]CCCC[N@H+](C)C2CC2)ccc1Oc1cccnc1 ZINC000453604263 1032038732 /nfs/dbraw/zinc/03/87/32/1032038732.db2.gz YNVBHHWVVKDNKM-UHFFFAOYSA-N 2 1 339.483 4.146 20 0 EIADMP FC1(F)CCC([NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000512632313 1033555510 /nfs/dbraw/zinc/55/55/10/1033555510.db2.gz YZSBOIQZBGAPKD-YSIASYRMSA-N 2 1 348.481 4.455 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCCc2cccc(C(F)(F)F)c2)CCN1C ZINC000429846697 1033768725 /nfs/dbraw/zinc/76/87/25/1033768725.db2.gz DLVVMNASUPBZMS-CRAIPNDOSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCCc2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000429846697 1033768743 /nfs/dbraw/zinc/76/87/43/1033768743.db2.gz DLVVMNASUPBZMS-CRAIPNDOSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCCc2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000429846697 1033768760 /nfs/dbraw/zinc/76/87/60/1033768760.db2.gz DLVVMNASUPBZMS-CRAIPNDOSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)CCCCc2cccc(C(F)(F)F)c2)CC[NH+]1C ZINC000429846697 1033768774 /nfs/dbraw/zinc/76/87/74/1033768774.db2.gz DLVVMNASUPBZMS-CRAIPNDOSA-N 2 1 342.449 4.443 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCCc2cccc(C(F)(F)F)c2)CC[NH+]1C ZINC000429846697 1033768789 /nfs/dbraw/zinc/76/87/89/1033768789.db2.gz DLVVMNASUPBZMS-CRAIPNDOSA-N 2 1 342.449 4.443 20 0 EIADMP CCCOc1cccc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)c1 ZINC000512804524 1033981427 /nfs/dbraw/zinc/98/14/27/1033981427.db2.gz PVLPLVPTLWZHOZ-UHFFFAOYSA-N 2 1 338.495 4.013 20 0 EIADMP CCCOc1cccc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)c1 ZINC000512804524 1033981442 /nfs/dbraw/zinc/98/14/42/1033981442.db2.gz PVLPLVPTLWZHOZ-UHFFFAOYSA-N 2 1 338.495 4.013 20 0 EIADMP c1cc2cccc(C[N@@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)c2[nH]1 ZINC000513425171 1034926738 /nfs/dbraw/zinc/92/67/38/1034926738.db2.gz QNJNNRMDJGNJHA-SFHVURJKSA-N 2 1 325.500 4.256 20 0 EIADMP Cc1nc(C)c(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)s1 ZINC000513493696 1034985010 /nfs/dbraw/zinc/98/50/10/1034985010.db2.gz CDCMRPVIUGMDNV-BEFAXECRSA-N 2 1 343.540 4.150 20 0 EIADMP C[C@H](c1cc(F)ccc1F)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501017327 1035351288 /nfs/dbraw/zinc/35/12/88/1035351288.db2.gz AZRDQTGDYCVLSY-OAHLLOKOSA-N 2 1 345.437 4.269 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000501419517 1035442329 /nfs/dbraw/zinc/44/23/29/1035442329.db2.gz GZYHKHYRHXXEET-LTBFUDJGSA-N 2 1 326.406 4.040 20 0 EIADMP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000420307241 1035504142 /nfs/dbraw/zinc/50/41/42/1035504142.db2.gz BILYTKVVPVAZCR-PXNSSMCTSA-N 2 1 340.515 4.144 20 0 EIADMP Cc1nc([C@@H](C)[N@H+]2CCC[C@@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420319107 1035512372 /nfs/dbraw/zinc/51/23/72/1035512372.db2.gz XDBOUXCEDPHRDM-CABCVRRESA-N 2 1 347.890 4.425 20 0 EIADMP Cc1c(Cl)c(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)nc2ccccc12 ZINC000420413037 1035570407 /nfs/dbraw/zinc/57/04/07/1035570407.db2.gz ZKTGYKCENZBJNV-DNVCBOLYSA-N 2 1 343.902 4.161 20 0 EIADMP Cc1c(Cl)c(C[N@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)nc2ccccc12 ZINC000420413037 1035570438 /nfs/dbraw/zinc/57/04/38/1035570438.db2.gz ZKTGYKCENZBJNV-DNVCBOLYSA-N 2 1 343.902 4.161 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000485257799 1035801016 /nfs/dbraw/zinc/80/10/16/1035801016.db2.gz HADPKMFKABLZFO-XWFZLUIHSA-N 2 1 338.470 4.313 20 0 EIADMP C[C@@H]([NH2+]C1(C[NH2+][C@H]2C[C@@H](C)O[C@@H](C)C2)CCCC1)c1ccccc1 ZINC000571492438 1036054266 /nfs/dbraw/zinc/05/42/66/1036054266.db2.gz XOSHOUYOPBKZCY-RMJJICAUSA-N 2 1 330.516 4.196 20 0 EIADMP CCOCC(C)(C)C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000571598267 1036090918 /nfs/dbraw/zinc/09/09/18/1036090918.db2.gz OJULJZOTECWFRS-UHFFFAOYSA-N 2 1 332.532 4.082 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)s1 ZINC000414505840 1036189961 /nfs/dbraw/zinc/18/99/61/1036189961.db2.gz VLOXQWUEKYYQFG-GDBMZVCRSA-N 2 1 349.931 4.284 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000513746457 1036234245 /nfs/dbraw/zinc/23/42/45/1036234245.db2.gz XJIQAXJSSVDVQF-UHFFFAOYSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1cc(C)c(C)o1 ZINC000502707939 1036546625 /nfs/dbraw/zinc/54/66/25/1036546625.db2.gz OLTNFWSZNKLYGT-KRWDZBQOSA-N 2 1 344.499 4.468 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502729034 1036590381 /nfs/dbraw/zinc/59/03/81/1036590381.db2.gz VICITSWNRADEPX-ROUUACIJSA-N 2 1 332.536 4.161 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccncc1Cl ZINC000421823454 1036780023 /nfs/dbraw/zinc/78/00/23/1036780023.db2.gz ZRILSZVKLKUJSY-OAHLLOKOSA-N 2 1 329.875 4.182 20 0 EIADMP COc1ccc([C@@H]([NH2+]C2CC[NH+](C(C)(C)C)CC2)C2CC2)c(F)c1 ZINC000421847157 1036824845 /nfs/dbraw/zinc/82/48/45/1036824845.db2.gz WFQQBUPVNKOUIV-IBGZPJMESA-N 2 1 334.479 4.138 20 0 EIADMP c1nc2ccc(C[NH2+]Cc3cccc(C[NH+]4CCCCCC4)c3)cc2[nH]1 ZINC000589647210 1036858656 /nfs/dbraw/zinc/85/86/56/1036858656.db2.gz NQCOYVPJMMWRIA-UHFFFAOYSA-N 2 1 348.494 4.229 20 0 EIADMP Clc1csc(C[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000486928361 1036894544 /nfs/dbraw/zinc/89/45/44/1036894544.db2.gz UZDWHGQMYZMKPL-CYBMUJFWSA-N 2 1 340.945 4.465 20 0 EIADMP Clc1csc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000486928361 1036894550 /nfs/dbraw/zinc/89/45/50/1036894550.db2.gz UZDWHGQMYZMKPL-CYBMUJFWSA-N 2 1 340.945 4.465 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1CCCc1ccccc1 ZINC000503076775 1036894948 /nfs/dbraw/zinc/89/49/48/1036894948.db2.gz ZFNAQLTYOCAQHN-OAQYLSRUSA-N 2 1 325.500 4.459 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1CCCc1ccccc1 ZINC000503076775 1036894950 /nfs/dbraw/zinc/89/49/50/1036894950.db2.gz ZFNAQLTYOCAQHN-OAQYLSRUSA-N 2 1 325.500 4.459 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]C/C=C/c3ccncc3)cc2)C1 ZINC000486943616 1036897728 /nfs/dbraw/zinc/89/77/28/1036897728.db2.gz OBKWRIRGHWCTDJ-KPUAHBEZSA-N 2 1 335.495 4.117 20 0 EIADMP C[C@@H]([NH2+]CCCc1c[nH+]cn1C)[C@H](C)c1ccccc1C(F)(F)F ZINC000569738794 1037021814 /nfs/dbraw/zinc/02/18/14/1037021814.db2.gz ZTOPYDQGYBTPBA-UONOGXRCSA-N 2 1 339.405 4.153 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C3CC[NH+](C4CCC4)CC3)oc21 ZINC000271854485 1037033925 /nfs/dbraw/zinc/03/39/25/1037033925.db2.gz JELDBBCMLNJMAT-CQSZACIVSA-N 2 1 328.456 4.109 20 0 EIADMP C[C@@H]1CC2(C[N@H+]1Cc1cccc(C[NH+]3CCCCC3)c1)CCOCC2 ZINC000646097542 1037069537 /nfs/dbraw/zinc/06/95/37/1037069537.db2.gz XLIXXUQNFBYVJU-LJQANCHMSA-N 2 1 342.527 4.064 20 0 EIADMP Clc1ccc(C2([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)cc1Cl ZINC000272025617 1037083709 /nfs/dbraw/zinc/08/37/09/1037083709.db2.gz YRSFKTINSHIBJO-UONOGXRCSA-N 2 1 325.283 4.199 20 0 EIADMP Clc1ccc(C2([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1Cl ZINC000272025617 1037083728 /nfs/dbraw/zinc/08/37/28/1037083728.db2.gz YRSFKTINSHIBJO-UONOGXRCSA-N 2 1 325.283 4.199 20 0 EIADMP [NH3+][C@H](C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)C1CC1 ZINC000573082397 1037345538 /nfs/dbraw/zinc/34/55/38/1037345538.db2.gz AFPGXLCZCACSDB-HUUCEWRRSA-N 2 1 347.915 4.168 20 0 EIADMP FC(F)(F)c1ccc(C[NH2+]C2CC[NH+]([C@@H]3C[C@H]4C[C@H]4C3)CC2)cc1 ZINC001167948346 1037428390 /nfs/dbraw/zinc/42/83/90/1037428390.db2.gz MIKGEOSNROBENV-JLVBRIDZSA-N 2 1 338.417 4.058 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(SC(F)(F)F)cc2)C1 ZINC000058061060 1037463238 /nfs/dbraw/zinc/46/32/38/1037463238.db2.gz XAYLOGREIHODJS-CQSZACIVSA-N 2 1 332.435 4.118 20 0 EIADMP Cc1csc([C@H](C)C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000273470303 1037473689 /nfs/dbraw/zinc/47/36/89/1037473689.db2.gz RXDDCUHYKATPNV-GJYPPUQNSA-N 2 1 343.540 4.055 20 0 EIADMP CSc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000573528410 1037562986 /nfs/dbraw/zinc/56/29/86/1037562986.db2.gz AFVFOLAHOFNOGB-MAUKXSAKSA-N 2 1 346.565 4.470 20 0 EIADMP CSc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000573528410 1037563002 /nfs/dbraw/zinc/56/30/02/1037563002.db2.gz AFVFOLAHOFNOGB-MAUKXSAKSA-N 2 1 346.565 4.470 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1 ZINC000488423511 1037576679 /nfs/dbraw/zinc/57/66/79/1037576679.db2.gz AZEDIPMECBQYMP-GTAWCEEGSA-N 2 1 346.584 4.407 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1 ZINC000488423511 1037576694 /nfs/dbraw/zinc/57/66/94/1037576694.db2.gz AZEDIPMECBQYMP-GTAWCEEGSA-N 2 1 346.584 4.407 20 0 EIADMP CC(C)[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CS1 ZINC000488436639 1037592684 /nfs/dbraw/zinc/59/26/84/1037592684.db2.gz YAGQONXUJIIPBB-VCDOQTMRSA-N 2 1 344.568 4.302 20 0 EIADMP C[C@@H]1C[C@@H]1c1ccc(CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)o1 ZINC000488513687 1037642995 /nfs/dbraw/zinc/64/29/95/1037642995.db2.gz LMQRTQDPUWGUKD-QFUCXCTJSA-N 2 1 338.495 4.057 20 0 EIADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)o1 ZINC000488513687 1037643025 /nfs/dbraw/zinc/64/30/25/1037643025.db2.gz LMQRTQDPUWGUKD-QFUCXCTJSA-N 2 1 338.495 4.057 20 0 EIADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)o1 ZINC000488513687 1037643053 /nfs/dbraw/zinc/64/30/53/1037643053.db2.gz LMQRTQDPUWGUKD-QFUCXCTJSA-N 2 1 338.495 4.057 20 0 EIADMP C[C@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(C(F)(F)F)cc1 ZINC000414654314 1037670532 /nfs/dbraw/zinc/67/05/32/1037670532.db2.gz ITXDZNKXGOJOFZ-AJSFGMTHSA-N 2 1 326.406 4.024 20 0 EIADMP CCC[N@@H+](Cc1ccc(-c2ccccc2OC)cc1)C1CC[NH2+]CC1 ZINC000414659102 1037698971 /nfs/dbraw/zinc/69/89/71/1037698971.db2.gz RTSQSLBPGVFUMI-UHFFFAOYSA-N 2 1 338.495 4.326 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)Cc1c(Cl)cccc1Cl ZINC000513787389 1037719359 /nfs/dbraw/zinc/71/93/59/1037719359.db2.gz YDPBDOSTEAXBAW-OLZOCXBDSA-N 2 1 340.298 4.355 20 0 EIADMP CC[C@@H]1C[C@H](C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000503572729 1037823238 /nfs/dbraw/zinc/82/32/38/1037823238.db2.gz HHKMJPMHYLVUCB-ZHHKINOHSA-N 2 1 344.543 4.082 20 0 EIADMP COc1cccc([C@H]([NH2+][C@H](C)C[C@@H](C)[NH3+])c2ccccc2Cl)c1 ZINC000422783217 1037831892 /nfs/dbraw/zinc/83/18/92/1037831892.db2.gz NTIHPEXMOXJJGU-LPMFXHHGSA-N 2 1 332.875 4.153 20 0 EIADMP COc1cccc([C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])c2ccccc2Cl)c1 ZINC000422783219 1037832586 /nfs/dbraw/zinc/83/25/86/1037832586.db2.gz NTIHPEXMOXJJGU-TYILLQQXSA-N 2 1 332.875 4.153 20 0 EIADMP COc1ccc([C@H]([NH2+][C@@H](C)C[C@@H](C)[NH3+])c2ccccc2Cl)cc1 ZINC000422920425 1037880925 /nfs/dbraw/zinc/88/09/25/1037880925.db2.gz LYSLNFKLKZVEED-TYILLQQXSA-N 2 1 332.875 4.153 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC000423007216 1037899455 /nfs/dbraw/zinc/89/94/55/1037899455.db2.gz XCIZUZMXZAGSDI-HIIFVVRCSA-N 3 1 349.522 4.022 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2C[C@H](N)c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC000423007216 1037899456 /nfs/dbraw/zinc/89/94/56/1037899456.db2.gz XCIZUZMXZAGSDI-HIIFVVRCSA-N 2 1 349.522 4.022 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2C[C@H](N)c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC000423007216 1037899460 /nfs/dbraw/zinc/89/94/60/1037899460.db2.gz XCIZUZMXZAGSDI-HIIFVVRCSA-N 2 1 349.522 4.022 20 0 EIADMP Fc1ccc(CCCC[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1F ZINC000423045287 1037923836 /nfs/dbraw/zinc/92/38/36/1037923836.db2.gz BXLISVLCYHSWJM-RXVVDRJESA-N 2 1 344.449 4.370 20 0 EIADMP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423125917 1037977080 /nfs/dbraw/zinc/97/70/80/1037977080.db2.gz IMMHZPPTEPZQCR-AQNXPRMDSA-N 2 1 344.886 4.067 20 0 EIADMP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cc(Cl)cc(Cl)c1 ZINC000423180336 1038033559 /nfs/dbraw/zinc/03/35/59/1038033559.db2.gz ATWGMOIMBLNKLM-CYBMUJFWSA-N 2 1 338.282 4.219 20 0 EIADMP Fc1cccc([C@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2cccc(Cl)c2)c1 ZINC000423209298 1038037346 /nfs/dbraw/zinc/03/73/46/1038037346.db2.gz IYYZMIWEJYJLQH-IFXJQAMLSA-N 2 1 332.850 4.158 20 0 EIADMP Fc1cccc([C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2cccc(Cl)c2)c1 ZINC000423209297 1038039470 /nfs/dbraw/zinc/03/94/70/1038039470.db2.gz IYYZMIWEJYJLQH-AUUYWEPGSA-N 2 1 332.850 4.158 20 0 EIADMP CS[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000593653871 1038118079 /nfs/dbraw/zinc/11/80/79/1038118079.db2.gz CKLMUMWQRIWYIL-XUVXKRRUSA-N 2 1 344.568 4.447 20 0 EIADMP CS[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000593653871 1038118150 /nfs/dbraw/zinc/11/81/50/1038118150.db2.gz CKLMUMWQRIWYIL-XUVXKRRUSA-N 2 1 344.568 4.447 20 0 EIADMP CS[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000593717200 1038135246 /nfs/dbraw/zinc/13/52/46/1038135246.db2.gz ZEHWZGGUOMCWNJ-YMQHIKHWSA-N 2 1 344.568 4.446 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423374379 1038157057 /nfs/dbraw/zinc/15/70/57/1038157057.db2.gz JVXIMSJXLCFBIW-HLLBOEOZSA-N 2 1 328.431 4.409 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc2ccccc2c1OC(F)F ZINC000423362017 1038174521 /nfs/dbraw/zinc/17/45/21/1038174521.db2.gz AQVPRANJCCDASJ-GDZNZVCISA-N 2 1 334.410 4.090 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc2ccccc2c1OC(F)F ZINC000423362016 1038179112 /nfs/dbraw/zinc/17/91/12/1038179112.db2.gz AQVPRANJCCDASJ-DCGLDWPTSA-N 2 1 334.410 4.090 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1csc(-c2ccccc2)n1 ZINC000423391694 1038199043 /nfs/dbraw/zinc/19/90/43/1038199043.db2.gz POQSKGVADZRXDB-CQSZACIVSA-N 2 1 335.476 4.264 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccc(F)c1F ZINC000423476254 1038248747 /nfs/dbraw/zinc/24/87/47/1038248747.db2.gz RAFHFCIHNXWJNU-QIIPPGSGSA-N 2 1 348.412 4.148 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1F ZINC000423477309 1038249951 /nfs/dbraw/zinc/24/99/51/1038249951.db2.gz SJTJBDUPSVBDSG-ZUEVXXBESA-N 2 1 348.412 4.148 20 0 EIADMP CC[C@@H]([NH3+])C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423478950 1038250490 /nfs/dbraw/zinc/25/04/90/1038250490.db2.gz UYKHXSSPDUXXCQ-ZIAGYGMSSA-N 2 1 335.904 4.168 20 0 EIADMP C[C@@H]([NH2+]CC1([NH3+])C2CC3CC(C2)CC1C3)c1ccc2ccccc2n1 ZINC000423524671 1038279137 /nfs/dbraw/zinc/27/91/37/1038279137.db2.gz JTSZSYIEVIEDNL-QRTQRDKQSA-N 2 1 335.495 4.039 20 0 EIADMP Cc1ccc(COc2ccc(C[NH2+][C@H]3CC[N@@H+](C)[C@H](C)C3)cc2)cc1 ZINC000608061369 1038453534 /nfs/dbraw/zinc/45/35/34/1038453534.db2.gz RGXOILJNFWAARJ-NQIIRXRSSA-N 2 1 338.495 4.146 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CCN(c3ccc(C(C)(C)C)cc3)CC2)CC[N@@H+]1C ZINC000151078337 1038635541 /nfs/dbraw/zinc/63/55/41/1038635541.db2.gz CLVGUPCZOWJHMD-PXNSSMCTSA-N 2 1 343.559 4.025 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]C2CCN(c3ccc(C(C)(C)C)cc3)CC2)CC[N@H+]1C ZINC000151078337 1038635545 /nfs/dbraw/zinc/63/55/45/1038635545.db2.gz CLVGUPCZOWJHMD-PXNSSMCTSA-N 2 1 343.559 4.025 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CCN(c3ccc(C(C)(C)C)cc3)CC2)CC[N@@H+]1C ZINC000151078237 1038635968 /nfs/dbraw/zinc/63/59/68/1038635968.db2.gz CLVGUPCZOWJHMD-FXAWDEMLSA-N 2 1 343.559 4.025 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CCN(c3ccc(C(C)(C)C)cc3)CC2)CC[N@H+]1C ZINC000151078237 1038635973 /nfs/dbraw/zinc/63/59/73/1038635973.db2.gz CLVGUPCZOWJHMD-FXAWDEMLSA-N 2 1 343.559 4.025 20 0 EIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000480770558 1038808129 /nfs/dbraw/zinc/80/81/29/1038808129.db2.gz OOVQGMGCPSIRMN-PXNSSMCTSA-N 2 1 334.935 4.371 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@H+](C)C[C@H](C[NH3+])c1ccc(F)cc1 ZINC000424306881 1038814651 /nfs/dbraw/zinc/81/46/51/1038814651.db2.gz WESBYVAKFLBRDK-ZFWWWQNUSA-N 2 1 343.471 4.171 20 0 EIADMP C[C@@H](c1nc2ccccc2s1)[N@@H+](C)C[C@H](C[NH3+])c1ccc(F)cc1 ZINC000424306881 1038814655 /nfs/dbraw/zinc/81/46/55/1038814655.db2.gz WESBYVAKFLBRDK-ZFWWWQNUSA-N 2 1 343.471 4.171 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000539080390 1038825769 /nfs/dbraw/zinc/82/57/69/1038825769.db2.gz TZPXPGUIHXGXPZ-RYUDHWBXSA-N 2 1 326.271 4.485 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@@H]1Cc1ccccc1 ZINC000539088418 1038830227 /nfs/dbraw/zinc/83/02/27/1038830227.db2.gz SHKGEYDSSOOHOU-HGSOSGBHSA-N 2 1 334.507 4.118 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@@H]1Cc1ccccc1 ZINC000539088418 1038830230 /nfs/dbraw/zinc/83/02/30/1038830230.db2.gz SHKGEYDSSOOHOU-HGSOSGBHSA-N 2 1 334.507 4.118 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@@H](C)C1 ZINC000539093779 1038834604 /nfs/dbraw/zinc/83/46/04/1038834604.db2.gz TWODIFIATSLHCX-GHTZIAJQSA-N 2 1 338.495 4.052 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424377215 1038837450 /nfs/dbraw/zinc/83/74/50/1038837450.db2.gz QQHGIWILRYIAQF-IUIKQTSFSA-N 2 1 333.476 4.178 20 0 EIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cc(Cl)cc2cccnc21 ZINC000608500902 1038839127 /nfs/dbraw/zinc/83/91/27/1038839127.db2.gz DBQRCHASLZRYAY-SFHVURJKSA-N 2 1 331.891 4.194 20 0 EIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cc(Cl)cc2cccnc21 ZINC000608500902 1038839128 /nfs/dbraw/zinc/83/91/28/1038839128.db2.gz DBQRCHASLZRYAY-SFHVURJKSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1cc(Cl)cc2cccnc21 ZINC000608500902 1038839129 /nfs/dbraw/zinc/83/91/29/1038839129.db2.gz DBQRCHASLZRYAY-SFHVURJKSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1cc(Cl)cc2cccnc21 ZINC000608500902 1038839133 /nfs/dbraw/zinc/83/91/33/1038839133.db2.gz DBQRCHASLZRYAY-SFHVURJKSA-N 2 1 331.891 4.194 20 0 EIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1cc(Cl)cc2cccnc21 ZINC000608500901 1038839703 /nfs/dbraw/zinc/83/97/03/1038839703.db2.gz DBQRCHASLZRYAY-GOSISDBHSA-N 2 1 331.891 4.194 20 0 EIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1cc(Cl)cc2cccnc21 ZINC000608500901 1038839704 /nfs/dbraw/zinc/83/97/04/1038839704.db2.gz DBQRCHASLZRYAY-GOSISDBHSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1cc(Cl)cc2cccnc21 ZINC000608500901 1038839705 /nfs/dbraw/zinc/83/97/05/1038839705.db2.gz DBQRCHASLZRYAY-GOSISDBHSA-N 2 1 331.891 4.194 20 0 EIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1cc(Cl)cc2cccnc21 ZINC000608500901 1038839707 /nfs/dbraw/zinc/83/97/07/1038839707.db2.gz DBQRCHASLZRYAY-GOSISDBHSA-N 2 1 331.891 4.194 20 0 EIADMP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000504906337 1038846557 /nfs/dbraw/zinc/84/65/57/1038846557.db2.gz WVCDQJSVIWMDGP-FTEYMNFISA-N 2 1 330.516 4.022 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 ZINC000462120570 1038938758 /nfs/dbraw/zinc/93/87/58/1038938758.db2.gz UKPSHLOKUJQFIP-JAXLGGSGSA-N 2 1 326.528 4.252 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2OC(F)F)C1 ZINC000481017568 1038948414 /nfs/dbraw/zinc/94/84/14/1038948414.db2.gz CJLCLPALLKLFND-STQMWFEESA-N 2 1 346.849 4.324 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2OC(F)F)C1 ZINC000481017568 1038948442 /nfs/dbraw/zinc/94/84/42/1038948442.db2.gz CJLCLPALLKLFND-STQMWFEESA-N 2 1 346.849 4.324 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccccc2Br)C1 ZINC000481042584 1038974657 /nfs/dbraw/zinc/97/46/57/1038974657.db2.gz TUIWILSVCXFCBL-RHSMWYFYSA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccccc2Br)C1 ZINC000481042584 1038974661 /nfs/dbraw/zinc/97/46/61/1038974661.db2.gz TUIWILSVCXFCBL-RHSMWYFYSA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537620904 1038975828 /nfs/dbraw/zinc/97/58/28/1038975828.db2.gz ITTHKUMTCAMYAX-IBGZPJMESA-N 2 1 330.516 4.172 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537620904 1038975850 /nfs/dbraw/zinc/97/58/50/1038975850.db2.gz ITTHKUMTCAMYAX-IBGZPJMESA-N 2 1 330.516 4.172 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537620904 1038975888 /nfs/dbraw/zinc/97/58/88/1038975888.db2.gz ITTHKUMTCAMYAX-IBGZPJMESA-N 2 1 330.516 4.172 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537620904 1038975918 /nfs/dbraw/zinc/97/59/18/1038975918.db2.gz ITTHKUMTCAMYAX-IBGZPJMESA-N 2 1 330.516 4.172 20 0 EIADMP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000119679023 1038984915 /nfs/dbraw/zinc/98/49/15/1038984915.db2.gz NBYNAJRFZCUCNX-WHLIDYPQSA-N 2 1 342.527 4.179 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(C2CCCCC2)cc1 ZINC000481177801 1039079715 /nfs/dbraw/zinc/07/97/15/1039079715.db2.gz VFWKOPQCCVRFLF-SFHVURJKSA-N 2 1 344.543 4.232 20 0 EIADMP COc1ccc(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000537629482 1039087016 /nfs/dbraw/zinc/08/70/16/1039087016.db2.gz IVOBBHDREQHQQH-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000537629482 1039087025 /nfs/dbraw/zinc/08/70/25/1039087025.db2.gz IVOBBHDREQHQQH-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000537629482 1039087040 /nfs/dbraw/zinc/08/70/40/1039087040.db2.gz IVOBBHDREQHQQH-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP COc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000537629482 1039087059 /nfs/dbraw/zinc/08/70/59/1039087059.db2.gz IVOBBHDREQHQQH-GHTZIAJQSA-N 2 1 338.495 4.180 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCC[C@@H]1Cc1ccccc1 ZINC000481191181 1039101492 /nfs/dbraw/zinc/10/14/92/1039101492.db2.gz MUMCXAFGBHDGHO-NHCUHLMSSA-N 2 1 325.500 4.363 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC[N@H+]1C ZINC000477855749 1039136465 /nfs/dbraw/zinc/13/64/65/1039136465.db2.gz IIFFFLGGDGYIIG-RISCZKNCSA-N 2 1 340.298 4.090 20 0 EIADMP COc1ccc(CC[N@H+](CCCn2cc[nH+]c2C)CC(C)(C)C)cc1 ZINC000534220024 1039223550 /nfs/dbraw/zinc/22/35/50/1039223550.db2.gz TZBIKXAQGCRKAT-UHFFFAOYSA-N 2 1 343.515 4.181 20 0 EIADMP COc1ccc(CC[N@@H+](CCCn2cc[nH+]c2C)CC(C)(C)C)cc1 ZINC000534220024 1039223573 /nfs/dbraw/zinc/22/35/73/1039223573.db2.gz TZBIKXAQGCRKAT-UHFFFAOYSA-N 2 1 343.515 4.181 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)s1 ZINC000090419090 1039225510 /nfs/dbraw/zinc/22/55/10/1039225510.db2.gz FXRVOJNZYUJRES-QWHCGFSZSA-N 2 1 326.469 4.357 20 0 EIADMP CCOCCC1(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCC1 ZINC000090457090 1039233051 /nfs/dbraw/zinc/23/30/51/1039233051.db2.gz GCQLCFUFOGKIAR-KRWDZBQOSA-N 2 1 341.499 4.428 20 0 EIADMP CSCc1cccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550795723 1039302214 /nfs/dbraw/zinc/30/22/14/1039302214.db2.gz XBCGODVDJSZLJG-NHCUHLMSSA-N 2 1 340.536 4.475 20 0 EIADMP CSCc1cccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550795723 1039302231 /nfs/dbraw/zinc/30/22/31/1039302231.db2.gz XBCGODVDJSZLJG-NHCUHLMSSA-N 2 1 340.536 4.475 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000122163992 1039604265 /nfs/dbraw/zinc/60/42/65/1039604265.db2.gz VDDUFOJCKWMKQL-PBHICJAKSA-N 2 1 340.433 4.057 20 0 EIADMP C[N@@H+](CC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1CCCC(F)(F)C1 ZINC000514145210 1039655810 /nfs/dbraw/zinc/65/58/10/1039655810.db2.gz LQLODPYZYOTTRC-QGZVFWFLSA-N 2 1 337.458 4.055 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCOc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000429781289 1039734394 /nfs/dbraw/zinc/73/43/94/1039734394.db2.gz SLHKRVDIHLAAPB-CZUORRHYSA-N 2 1 345.314 4.034 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCOc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000429781289 1039734426 /nfs/dbraw/zinc/73/44/26/1039734426.db2.gz SLHKRVDIHLAAPB-CZUORRHYSA-N 2 1 345.314 4.034 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCOc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000429781289 1039734461 /nfs/dbraw/zinc/73/44/61/1039734461.db2.gz SLHKRVDIHLAAPB-CZUORRHYSA-N 2 1 345.314 4.034 20 0 EIADMP Cc1cc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c(C)s1 ZINC000434680927 1039800084 /nfs/dbraw/zinc/80/00/84/1039800084.db2.gz LRFUJJDCJHHHKL-UHFFFAOYSA-N 2 1 329.513 4.277 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3cc(F)c(OC)cc32)c1 ZINC000281088737 1039800858 /nfs/dbraw/zinc/80/08/58/1039800858.db2.gz AGCFFFBCBCPGFW-FQEVSTJZSA-N 2 1 342.458 4.063 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000537647235 1039807858 /nfs/dbraw/zinc/80/78/58/1039807858.db2.gz IEQRTQVFPGOIIX-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000537647235 1039807863 /nfs/dbraw/zinc/80/78/63/1039807863.db2.gz IEQRTQVFPGOIIX-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000537647235 1039807868 /nfs/dbraw/zinc/80/78/68/1039807868.db2.gz IEQRTQVFPGOIIX-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2OC)C1 ZINC000537647235 1039807871 /nfs/dbraw/zinc/80/78/71/1039807871.db2.gz IEQRTQVFPGOIIX-GOSISDBHSA-N 2 1 338.495 4.136 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1cn2ccccc2n1 ZINC000550885492 1039809274 /nfs/dbraw/zinc/80/92/74/1039809274.db2.gz FMTXDCTUWLYEBS-GOSISDBHSA-N 2 1 348.494 4.171 20 0 EIADMP CSc1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000434692043 1039812932 /nfs/dbraw/zinc/81/29/32/1039812932.db2.gz VXOWZJMWWFOYTN-UHFFFAOYSA-N 2 1 341.524 4.321 20 0 EIADMP Cc1cccc2oc(CC[NH2+][C@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)nc21 ZINC000551038889 1039896206 /nfs/dbraw/zinc/89/62/06/1039896206.db2.gz HAAJWKBZIUBWCU-OALUTQOASA-N 2 1 349.478 4.104 20 0 EIADMP Cc1cccc2oc(CC[NH2+][C@H]3CC[N@H+](C)[C@H](c4ccccc4)C3)nc21 ZINC000551038889 1039896208 /nfs/dbraw/zinc/89/62/08/1039896208.db2.gz HAAJWKBZIUBWCU-OALUTQOASA-N 2 1 349.478 4.104 20 0 EIADMP Cc1cc(C[NH+](C)C)cc(N[C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551147673 1040006017 /nfs/dbraw/zinc/00/60/17/1040006017.db2.gz HNIDGWRGKPLORZ-UNMCSNQZSA-N 2 1 337.511 4.304 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)c2ccc(Cl)c(Cl)c2)CC[N@H+]1C ZINC000482135992 1040029689 /nfs/dbraw/zinc/02/96/89/1040029689.db2.gz FYLHBZACXHUDHK-GXTWGEPZSA-N 2 1 329.315 4.343 20 0 EIADMP Clc1csc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000435059916 1040041135 /nfs/dbraw/zinc/04/11/35/1040041135.db2.gz RHYLXFYMKCFXKZ-UHFFFAOYSA-N 2 1 335.904 4.314 20 0 EIADMP Clc1ccc(-c2ncc(C[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)s2)cc1 ZINC000551225985 1040081805 /nfs/dbraw/zinc/08/18/05/1040081805.db2.gz YLYMHFIJBJTBRQ-ZDUSSCGKSA-N 2 1 347.915 4.037 20 0 EIADMP Clc1ccc(-c2ncc(C[NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)s2)cc1 ZINC000551225985 1040081813 /nfs/dbraw/zinc/08/18/13/1040081813.db2.gz YLYMHFIJBJTBRQ-ZDUSSCGKSA-N 2 1 347.915 4.037 20 0 EIADMP C[N@H+]1CC[C@]2(CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)C2)C1 ZINC000430135326 1040119514 /nfs/dbraw/zinc/11/95/14/1040119514.db2.gz SWGKBQVAHAFYBJ-DEOSSOPVSA-N 2 1 348.534 4.116 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@H+](CC(Cc3ccccc3)Cc3ccccc3)C2)C1 ZINC000430135326 1040119537 /nfs/dbraw/zinc/11/95/37/1040119537.db2.gz SWGKBQVAHAFYBJ-DEOSSOPVSA-N 2 1 348.534 4.116 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@@H+](CC(Cc3ccccc3)Cc3ccccc3)C2)C1 ZINC000430135326 1040119555 /nfs/dbraw/zinc/11/95/55/1040119555.db2.gz SWGKBQVAHAFYBJ-DEOSSOPVSA-N 2 1 348.534 4.116 20 0 EIADMP C[C@H](NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441687 1040247502 /nfs/dbraw/zinc/24/75/02/1040247502.db2.gz VPIMHNQDQPTRNK-WMZOPIPTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441687 1040247519 /nfs/dbraw/zinc/24/75/19/1040247519.db2.gz VPIMHNQDQPTRNK-WMZOPIPTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441687 1040247536 /nfs/dbraw/zinc/24/75/36/1040247536.db2.gz VPIMHNQDQPTRNK-WMZOPIPTSA-N 2 1 344.449 4.180 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)o1 ZINC000482448903 1040259424 /nfs/dbraw/zinc/25/94/24/1040259424.db2.gz GQIXKWCNAKXNBD-PKOBYXMFSA-N 2 1 326.484 4.057 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)o1 ZINC000482448903 1040259443 /nfs/dbraw/zinc/25/94/43/1040259443.db2.gz GQIXKWCNAKXNBD-PKOBYXMFSA-N 2 1 326.484 4.057 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000514812799 1040263782 /nfs/dbraw/zinc/26/37/82/1040263782.db2.gz UEQQHFQKQQGNJF-XBNGYDHASA-N 2 1 340.433 4.430 20 0 EIADMP Cc1cc(N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)nc(C2CC2)n1 ZINC000477167094 1040274113 /nfs/dbraw/zinc/27/41/13/1040274113.db2.gz NKTVPUOVRNDZLA-KRWDZBQOSA-N 2 1 342.531 4.143 20 0 EIADMP c1ccc(N2CCCCCC2)c(C[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC001168356659 1040355666 /nfs/dbraw/zinc/35/56/66/1040355666.db2.gz SEIFACCSRJZENI-UHFFFAOYSA-N 2 1 341.543 4.031 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(OC)c1 ZINC000479461736 1040366710 /nfs/dbraw/zinc/36/67/10/1040366710.db2.gz DLJDMMGEBSUECV-UGKGYDQZSA-N 2 1 338.495 4.258 20 0 EIADMP Cc1cccc2[nH]c(C[NH+]3CCC(c4[nH+]cc5n4CCCC5)CC3)cc21 ZINC000668084264 1040374722 /nfs/dbraw/zinc/37/47/22/1040374722.db2.gz FRMAWIXEHCRJFN-UHFFFAOYSA-N 2 1 348.494 4.389 20 0 EIADMP c1ccc(CSCCC[NH+]2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000535582074 1040383944 /nfs/dbraw/zinc/38/39/44/1040383944.db2.gz DQERIHHLYJBVHI-UHFFFAOYSA-N 2 1 332.557 4.260 20 0 EIADMP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000479466320 1040390442 /nfs/dbraw/zinc/39/04/42/1040390442.db2.gz RNJJXZYXLKYOIR-NRJQMVOHSA-N 2 1 338.470 4.171 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1 ZINC000479468653 1040392769 /nfs/dbraw/zinc/39/27/69/1040392769.db2.gz ZFMWULRPQZTNRE-HOCLYGCPSA-N 2 1 348.412 4.277 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1 ZINC000479468653 1040392788 /nfs/dbraw/zinc/39/27/88/1040392788.db2.gz ZFMWULRPQZTNRE-HOCLYGCPSA-N 2 1 348.412 4.277 20 0 EIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(OC(F)(F)F)c1 ZINC000479522015 1040422387 /nfs/dbraw/zinc/42/23/87/1040422387.db2.gz AYGKXURPGXQGHP-JEYLPNPQSA-N 2 1 342.405 4.253 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CCc4ccc(Cl)cc43)CC2)[nH+]1 ZINC000479545676 1040451101 /nfs/dbraw/zinc/45/11/01/1040451101.db2.gz WKNFNWQFIAHQPB-LJQANCHMSA-N 2 1 341.886 4.289 20 0 EIADMP CC(C)[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000539509582 1040502629 /nfs/dbraw/zinc/50/26/29/1040502629.db2.gz HFUSDOHKLFOCMF-QGZVFWFLSA-N 2 1 326.406 4.254 20 0 EIADMP CC[NH+](CC)CCC[NH2+][C@H](C)c1sc(Cc2ccccc2)nc1C ZINC000479765936 1040639284 /nfs/dbraw/zinc/63/92/84/1040639284.db2.gz DNKBBGGCOXCVAE-MRXNPFEDSA-N 2 1 345.556 4.425 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cccc(C)c2C)[C@@H](C)C1 ZINC000483124216 1040719697 /nfs/dbraw/zinc/71/96/97/1040719697.db2.gz GJCOTELRKQFGFP-DSKINZAPSA-N 2 1 332.532 4.091 20 0 EIADMP CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000483258618 1040795932 /nfs/dbraw/zinc/79/59/32/1040795932.db2.gz NJGSIKZABLLINO-XLIONFOSSA-N 2 1 345.531 4.166 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1ccc(OCC(F)F)cc1)C1CCCCC1 ZINC000462677979 1040835640 /nfs/dbraw/zinc/83/56/40/1040835640.db2.gz PZEFZXVUYCOMDL-UHFFFAOYSA-N 2 1 340.458 4.075 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1ccc(OCC(F)F)cc1)C1CCCCC1 ZINC000462677979 1040835644 /nfs/dbraw/zinc/83/56/44/1040835644.db2.gz PZEFZXVUYCOMDL-UHFFFAOYSA-N 2 1 340.458 4.075 20 0 EIADMP CC[C@@H](c1ccccc1)[N@@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1 ZINC000436056710 1040844003 /nfs/dbraw/zinc/84/40/03/1040844003.db2.gz TXHQPRQSDBGMBU-WMZOPIPTSA-N 2 1 329.513 4.014 20 0 EIADMP CC[C@@H](c1ccccc1)[N@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1 ZINC000436056710 1040844014 /nfs/dbraw/zinc/84/40/14/1040844014.db2.gz TXHQPRQSDBGMBU-WMZOPIPTSA-N 2 1 329.513 4.014 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000480007610 1040850061 /nfs/dbraw/zinc/85/00/61/1040850061.db2.gz KSZYCRIKOKMRPD-VQTJNVASSA-N 2 1 346.559 4.328 20 0 EIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(F)cc1OC(F)F ZINC000480039409 1040880802 /nfs/dbraw/zinc/88/08/02/1040880802.db2.gz NDTYCZKJTMHUPJ-NSHDSACASA-N 2 1 344.421 4.387 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@@H]3C[C@@H](C)CC(C)(C)C3)CCCC2)CC1 ZINC000462744753 1040892649 /nfs/dbraw/zinc/89/26/49/1040892649.db2.gz MOFXANNMQGYQSW-QZTJIDSGSA-N 2 1 336.564 4.214 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@H]1CCc1ccccc1 ZINC000537966070 1040970296 /nfs/dbraw/zinc/97/02/96/1040970296.db2.gz SXIUWNXFIJJYDL-JRGCBEDISA-N 2 1 325.500 4.219 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH2+][C@@H]4CCCSCC4)C[C@@H]3C2)cc1 ZINC000898519250 1040971587 /nfs/dbraw/zinc/97/15/87/1040971587.db2.gz OBFQDPVLDUINKF-DOIPELPJSA-N 2 1 344.568 4.162 20 0 EIADMP COc1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000537968844 1040972195 /nfs/dbraw/zinc/97/21/95/1040972195.db2.gz ZOBLZEISBXJOGS-NRFANRHFSA-N 2 1 338.495 4.313 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000462818068 1040994716 /nfs/dbraw/zinc/99/47/16/1040994716.db2.gz ITRNJCCWGJAPIA-IXDOHACOSA-N 2 1 327.516 4.296 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000462818068 1040994739 /nfs/dbraw/zinc/99/47/39/1040994739.db2.gz ITRNJCCWGJAPIA-IXDOHACOSA-N 2 1 327.516 4.296 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C(C)C ZINC000538100541 1041038812 /nfs/dbraw/zinc/03/88/12/1041038812.db2.gz PLJUIPWOLMNEMT-MRXNPFEDSA-N 2 1 326.271 4.485 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@H](c3ccccc3)C3CC3)C2)cc1 ZINC000538103098 1041058393 /nfs/dbraw/zinc/05/83/93/1041058393.db2.gz UCVDGXKNAXNMFA-NFBKMPQASA-N 2 1 334.507 4.292 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@@H](C)C1 ZINC000436293351 1041058911 /nfs/dbraw/zinc/05/89/11/1041058911.db2.gz CWRYXMKBPIFSNM-IKICRFKJSA-N 2 1 340.433 4.271 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@@H](C)C1 ZINC000436293354 1041060656 /nfs/dbraw/zinc/06/06/56/1041060656.db2.gz CWRYXMKBPIFSNM-QXRTWZOPSA-N 2 1 340.433 4.271 20 0 EIADMP CC(C)[C@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1cccnc1 ZINC000538115701 1041066564 /nfs/dbraw/zinc/06/65/64/1041066564.db2.gz AWLKXZWBWGWDFY-NQIIRXRSSA-N 2 1 325.500 4.279 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CC(C)(C)c4ccccc43)CC2)[nH+]c1 ZINC000484147754 1041137893 /nfs/dbraw/zinc/13/78/93/1041137893.db2.gz QTIPHUSLITVYGW-HXUWFJFHSA-N 2 1 335.495 4.371 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@H]3C)cc2)cs1 ZINC000480272827 1041151967 /nfs/dbraw/zinc/15/19/67/1041151967.db2.gz DYRDXGVCGBITEV-MMMWYMCRSA-N 2 1 343.540 4.498 20 0 EIADMP Cc1cc(C)cc(OC[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167960763 1041191905 /nfs/dbraw/zinc/19/19/05/1041191905.db2.gz BURNLQVMBHECDN-LBFURVHYSA-N 2 1 342.527 4.066 20 0 EIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000480300838 1041198424 /nfs/dbraw/zinc/19/84/24/1041198424.db2.gz LKEALWGXUNJSTI-AWEZNQCLSA-N 2 1 334.410 4.046 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000480300838 1041198428 /nfs/dbraw/zinc/19/84/28/1041198428.db2.gz LKEALWGXUNJSTI-AWEZNQCLSA-N 2 1 334.410 4.046 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2cccnc2)C2CC2)CC1 ZINC000540151495 1041199121 /nfs/dbraw/zinc/19/91/21/1041199121.db2.gz QAGIFJWOQSSAST-TYCQWZJGSA-N 2 1 327.516 4.165 20 0 EIADMP C[C@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000436399881 1041204910 /nfs/dbraw/zinc/20/49/10/1041204910.db2.gz GUVWAWGODCBOAG-GJZGRUSLSA-N 2 1 329.463 4.050 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@@H](c2ccccc2)C(C)C)[C@@H](C)C1 ZINC000480331513 1041216272 /nfs/dbraw/zinc/21/62/72/1041216272.db2.gz HBIHUOZWCJGSGI-NNWRFLSQSA-N 2 1 346.559 4.153 20 0 EIADMP COc1ccccc1-c1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+]2C)cc1 ZINC000538259733 1041219481 /nfs/dbraw/zinc/21/94/81/1041219481.db2.gz NEMQVUHNXZRIPY-PXNSSMCTSA-N 2 1 338.495 4.497 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H](C)Oc2ccccc2)cc1 ZINC000540183723 1041246984 /nfs/dbraw/zinc/24/69/84/1041246984.db2.gz SWAUZAVGCZOJRE-IAGOWNOFSA-N 2 1 335.451 4.299 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1cc(Br)ccc1F ZINC000484464526 1041253840 /nfs/dbraw/zinc/25/38/40/1041253840.db2.gz DUJFLMUTKXAJPU-UBHSHLNASA-N 2 1 343.284 4.112 20 0 EIADMP Fc1ccc2c(c1)CC[C@H]2[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463113426 1041341389 /nfs/dbraw/zinc/34/13/89/1041341389.db2.gz OVJUJRJWQFYDIA-JOCHJYFZSA-N 2 1 338.470 4.110 20 0 EIADMP Cc1[nH+]ccn1CC[NH+]1CCC(c2ccc(Cl)cc2Cl)CC1 ZINC000428719572 1041346680 /nfs/dbraw/zinc/34/66/80/1041346680.db2.gz JWKITQIPUXCXTI-UHFFFAOYSA-N 2 1 338.282 4.378 20 0 EIADMP C[C@@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314576 1041360125 /nfs/dbraw/zinc/36/01/25/1041360125.db2.gz QCMNEYBSHUVOFM-QWFCFKBJSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314576 1041360147 /nfs/dbraw/zinc/36/01/47/1041360147.db2.gz QCMNEYBSHUVOFM-QWFCFKBJSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314576 1041360159 /nfs/dbraw/zinc/36/01/59/1041360159.db2.gz QCMNEYBSHUVOFM-QWFCFKBJSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314576 1041360177 /nfs/dbraw/zinc/36/01/77/1041360177.db2.gz QCMNEYBSHUVOFM-QWFCFKBJSA-N 2 1 338.495 4.399 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12)C(F)(F)F ZINC000554722032 1041364335 /nfs/dbraw/zinc/36/43/35/1041364335.db2.gz DJVVFMKVCLMZRO-IXDOHACOSA-N 2 1 340.433 4.075 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCc4ccccc43)CC2)cc1 ZINC000463136251 1041371084 /nfs/dbraw/zinc/37/10/84/1041371084.db2.gz CWNIANHHDKXNRR-JOCHJYFZSA-N 2 1 338.470 4.110 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463138083 1041372462 /nfs/dbraw/zinc/37/24/62/1041372462.db2.gz UNOZMODIRBJRIK-DYESRHJHSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463138083 1041372470 /nfs/dbraw/zinc/37/24/70/1041372470.db2.gz UNOZMODIRBJRIK-DYESRHJHSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463137451 1041372562 /nfs/dbraw/zinc/37/25/62/1041372562.db2.gz QZDDPCOHFMNSSW-YLJYHZDGSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463137451 1041372575 /nfs/dbraw/zinc/37/25/75/1041372575.db2.gz QZDDPCOHFMNSSW-YLJYHZDGSA-N 2 1 326.459 4.011 20 0 EIADMP Cc1cccc([C@@H](C)C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000463191783 1041408062 /nfs/dbraw/zinc/40/80/62/1041408062.db2.gz QCPYYDADTHBNSC-FQEVSTJZSA-N 2 1 336.523 4.395 20 0 EIADMP C[C@H](c1ccccc1)[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463194920 1041411060 /nfs/dbraw/zinc/41/10/60/1041411060.db2.gz XBPCBQVNYBGVGH-PMACEKPBSA-N 2 1 336.523 4.475 20 0 EIADMP CCc1nc(C)c([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000480601800 1041412054 /nfs/dbraw/zinc/41/20/54/1041412054.db2.gz BOBDJYXHAHISHN-OWCLPIDISA-N 2 1 337.577 4.423 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2ccccc2n1 ZINC000480601915 1041412482 /nfs/dbraw/zinc/41/24/82/1041412482.db2.gz OMGXDUFGIPQFLD-KZNAEPCWSA-N 2 1 325.500 4.253 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2ccccc2n1 ZINC000480601910 1041415999 /nfs/dbraw/zinc/41/59/99/1041415999.db2.gz OMGXDUFGIPQFLD-FGTMMUONSA-N 2 1 325.500 4.253 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2ccccc2n1 ZINC000480601910 1041416004 /nfs/dbraw/zinc/41/60/04/1041416004.db2.gz OMGXDUFGIPQFLD-FGTMMUONSA-N 2 1 325.500 4.253 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12)c1ccc(SCC(F)F)cc1 ZINC000480615334 1041425096 /nfs/dbraw/zinc/42/50/96/1041425096.db2.gz RWGWYGULZVYRMM-IAOVAPTHSA-N 2 1 340.483 4.321 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(SCC(F)F)cc1 ZINC000480615334 1041425100 /nfs/dbraw/zinc/42/51/00/1041425100.db2.gz RWGWYGULZVYRMM-IAOVAPTHSA-N 2 1 340.483 4.321 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccc(OC(F)F)c1 ZINC000480622502 1041437075 /nfs/dbraw/zinc/43/70/75/1041437075.db2.gz YNWFIJDBFSTDKB-HOTGVXAUSA-N 2 1 340.458 4.451 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(-n2cccn2)cc1 ZINC000480631813 1041444995 /nfs/dbraw/zinc/44/49/95/1041444995.db2.gz QXAXBFPIROSAGF-OALUTQOASA-N 2 1 340.515 4.178 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCSc4ccccc43)C2)cc1 ZINC000195134368 1041487029 /nfs/dbraw/zinc/48/70/29/1041487029.db2.gz UIUPMCIFKFYCKM-UYAOXDASSA-N 2 1 338.520 4.335 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c(OC)ccc3ccccc32)C[C@@H]1C ZINC000538717252 1041488001 /nfs/dbraw/zinc/48/80/01/1041488001.db2.gz NWMOKQDDPBYJLK-FUHWJXTLSA-N 2 1 326.484 4.153 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c(OC)ccc3ccccc32)C[C@@H]1C ZINC000538717252 1041488011 /nfs/dbraw/zinc/48/80/11/1041488011.db2.gz NWMOKQDDPBYJLK-FUHWJXTLSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c(OC)ccc3ccccc32)C[C@@H]1C ZINC000538717252 1041488016 /nfs/dbraw/zinc/48/80/16/1041488016.db2.gz NWMOKQDDPBYJLK-FUHWJXTLSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c(OC)ccc3ccccc32)C[C@@H]1C ZINC000538717252 1041488024 /nfs/dbraw/zinc/48/80/24/1041488024.db2.gz NWMOKQDDPBYJLK-FUHWJXTLSA-N 2 1 326.484 4.153 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc3c[nH]nc3c2)CC1 ZINC000538725054 1041516824 /nfs/dbraw/zinc/51/68/24/1041516824.db2.gz RMLQDPQPABXLPQ-KRWDZBQOSA-N 2 1 340.515 4.039 20 0 EIADMP c1sc2ccccc2c1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000538799444 1041539278 /nfs/dbraw/zinc/53/92/78/1041539278.db2.gz GDYBWSBGAIJXDZ-BEFAXECRSA-N 2 1 326.509 4.350 20 0 EIADMP c1sc2ccccc2c1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000538799444 1041539289 /nfs/dbraw/zinc/53/92/89/1041539289.db2.gz GDYBWSBGAIJXDZ-BEFAXECRSA-N 2 1 326.509 4.350 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@@H]21 ZINC000538799215 1041540114 /nfs/dbraw/zinc/54/01/14/1041540114.db2.gz URBUTZRBHMMBOC-APWZRJJASA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@@H]21 ZINC000538799215 1041540118 /nfs/dbraw/zinc/54/01/18/1041540118.db2.gz URBUTZRBHMMBOC-APWZRJJASA-N 2 1 328.431 4.002 20 0 EIADMP Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000924673419 1041545776 /nfs/dbraw/zinc/54/57/76/1041545776.db2.gz IXTPBENGCGJCPO-MRXNPFEDSA-N 2 1 341.499 4.374 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccns1 ZINC000924678304 1041582072 /nfs/dbraw/zinc/58/20/72/1041582072.db2.gz BIYDGQXHOSKPQB-JKSUJKDBSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccns1 ZINC000924678304 1041582074 /nfs/dbraw/zinc/58/20/74/1041582074.db2.gz BIYDGQXHOSKPQB-JKSUJKDBSA-N 2 1 329.513 4.226 20 0 EIADMP C[N@@H+](CCCc1ccccc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538945282 1041586986 /nfs/dbraw/zinc/58/69/86/1041586986.db2.gz YLGPSWRZRFMDLF-UHFFFAOYSA-N 2 1 337.511 4.253 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]C[C@@H]3CCCCS3)CC23CC3)cc1 ZINC000516768835 1041745624 /nfs/dbraw/zinc/74/56/24/1041745624.db2.gz ACYRYYNFDMBVDW-OALUTQOASA-N 2 1 330.541 4.059 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]C[C@@H]3CCCCS3)CC23CC3)cc1 ZINC000516768835 1041745641 /nfs/dbraw/zinc/74/56/41/1041745641.db2.gz ACYRYYNFDMBVDW-OALUTQOASA-N 2 1 330.541 4.059 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](c2cnn(C)c2)C(C)(C)C)CC1 ZINC000540984051 1041767190 /nfs/dbraw/zinc/76/71/90/1041767190.db2.gz CMSPVPUVYRLHKF-NSISKUIASA-N 2 1 346.563 4.140 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000425922579 1041942203 /nfs/dbraw/zinc/94/22/03/1041942203.db2.gz SPRBYFMUTZFZJA-FQEVSTJZSA-N 2 1 345.918 4.339 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000425922579 1041942213 /nfs/dbraw/zinc/94/22/13/1041942213.db2.gz SPRBYFMUTZFZJA-FQEVSTJZSA-N 2 1 345.918 4.339 20 0 EIADMP C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cc(-n2ccnc2)cs1 ZINC000541537121 1041999685 /nfs/dbraw/zinc/99/96/85/1041999685.db2.gz JUYVNUGDSYWPNH-GFCCVEGCSA-N 2 1 333.407 4.405 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402757737 1042004835 /nfs/dbraw/zinc/00/48/35/1042004835.db2.gz GDVVHUYJVJMJAI-YQQAZPJKSA-N 2 1 328.422 4.075 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCc2ccccc2C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603542 1042038934 /nfs/dbraw/zinc/03/89/34/1042038934.db2.gz WICIHGNPRGVDDH-WFXMLNOXSA-N 2 1 326.528 4.034 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000438206036 1042088345 /nfs/dbraw/zinc/08/83/45/1042088345.db2.gz ZRTQPOIYRIIRPG-IAGOWNOFSA-N 2 1 346.515 4.320 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000438206036 1042088352 /nfs/dbraw/zinc/08/83/52/1042088352.db2.gz ZRTQPOIYRIIRPG-IAGOWNOFSA-N 2 1 346.515 4.320 20 0 EIADMP C[C@@H]1[N@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)CCC12CCOCC2 ZINC000541779804 1042102286 /nfs/dbraw/zinc/10/22/86/1042102286.db2.gz KAECZXIUBFYZIJ-IBGZPJMESA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1[N@@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)CCC12CCOCC2 ZINC000541779804 1042102289 /nfs/dbraw/zinc/10/22/89/1042102289.db2.gz KAECZXIUBFYZIJ-IBGZPJMESA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)CCC12CCOCC2 ZINC000541779804 1042102295 /nfs/dbraw/zinc/10/22/95/1042102295.db2.gz KAECZXIUBFYZIJ-IBGZPJMESA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CCC12CCOCC2 ZINC000541779804 1042102301 /nfs/dbraw/zinc/10/23/01/1042102301.db2.gz KAECZXIUBFYZIJ-IBGZPJMESA-N 2 1 344.543 4.036 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000541908759 1042165295 /nfs/dbraw/zinc/16/52/95/1042165295.db2.gz NXOMZCBKWHEMJA-AWEZNQCLSA-N 2 1 334.916 4.452 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000541908759 1042165300 /nfs/dbraw/zinc/16/53/00/1042165300.db2.gz NXOMZCBKWHEMJA-AWEZNQCLSA-N 2 1 334.916 4.452 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000541909515 1042166895 /nfs/dbraw/zinc/16/68/95/1042166895.db2.gz ZBRIOAJLPPVCRQ-AWEZNQCLSA-N 2 1 334.916 4.452 20 0 EIADMP CSC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000541915438 1042169420 /nfs/dbraw/zinc/16/94/20/1042169420.db2.gz MJLOMSYDHFPVGA-CJNGLKHVSA-N 2 1 346.462 4.041 20 0 EIADMP CSC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000541915438 1042169423 /nfs/dbraw/zinc/16/94/23/1042169423.db2.gz MJLOMSYDHFPVGA-CJNGLKHVSA-N 2 1 346.462 4.041 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](CCCSc2ccccc2Cl)C1 ZINC000464792245 1042169847 /nfs/dbraw/zinc/16/98/47/1042169847.db2.gz WCRXDXGUHJTXFC-OAHLLOKOSA-N 2 1 326.937 4.096 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](CCCSc2ccccc2Cl)C1 ZINC000464792245 1042169854 /nfs/dbraw/zinc/16/98/54/1042169854.db2.gz WCRXDXGUHJTXFC-OAHLLOKOSA-N 2 1 326.937 4.096 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](CCCSc2ccccc2Cl)C1 ZINC000464792245 1042169861 /nfs/dbraw/zinc/16/98/61/1042169861.db2.gz WCRXDXGUHJTXFC-OAHLLOKOSA-N 2 1 326.937 4.096 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464843660 1042192775 /nfs/dbraw/zinc/19/27/75/1042192775.db2.gz XJVNPTYLVZGIGO-IBGZPJMESA-N 2 1 328.887 4.294 20 0 EIADMP C[N@H+](Cc1ccc(Cl)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464843660 1042192780 /nfs/dbraw/zinc/19/27/80/1042192780.db2.gz XJVNPTYLVZGIGO-IBGZPJMESA-N 2 1 328.887 4.294 20 0 EIADMP C[NH+](Cc1ccc(Cl)cc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464843660 1042192781 /nfs/dbraw/zinc/19/27/81/1042192781.db2.gz XJVNPTYLVZGIGO-IBGZPJMESA-N 2 1 328.887 4.294 20 0 EIADMP C[NH+](Cc1ccc(Cl)cc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464843660 1042192784 /nfs/dbraw/zinc/19/27/84/1042192784.db2.gz XJVNPTYLVZGIGO-IBGZPJMESA-N 2 1 328.887 4.294 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3cc(N)ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000414937352 1042285427 /nfs/dbraw/zinc/28/54/27/1042285427.db2.gz VMTFYKCDXCIJNY-FRGLQRNOSA-N 2 1 349.522 4.289 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3cc(N)ccc32)CC[N@H+]1Cc1ccccc1 ZINC000414937352 1042285430 /nfs/dbraw/zinc/28/54/30/1042285430.db2.gz VMTFYKCDXCIJNY-FRGLQRNOSA-N 2 1 349.522 4.289 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CC[C@H]3[C@H](CCCN3C3CC3)C1)CC2 ZINC000542212124 1042338665 /nfs/dbraw/zinc/33/86/65/1042338665.db2.gz FQGRZSJWVBXBRT-UIAACRFSSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@@H+]1CC[C@H]3[C@H](CCC[NH+]3C3CC3)C1)CC2 ZINC000542212124 1042338669 /nfs/dbraw/zinc/33/86/69/1042338669.db2.gz FQGRZSJWVBXBRT-UIAACRFSSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CC[C@H]3[C@H](CCC[NH+]3C3CC3)C1)CC2 ZINC000542212124 1042338672 /nfs/dbraw/zinc/33/86/72/1042338672.db2.gz FQGRZSJWVBXBRT-UIAACRFSSA-N 2 1 330.903 4.276 20 0 EIADMP Fc1cccc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)s2)c1 ZINC000509573144 1042385128 /nfs/dbraw/zinc/38/51/28/1042385128.db2.gz ZAKVTVPFASGJLJ-IRXDYDNUSA-N 2 1 330.472 4.271 20 0 EIADMP Fc1cccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)s2)c1 ZINC000509573146 1042385232 /nfs/dbraw/zinc/38/52/32/1042385232.db2.gz ZAKVTVPFASGJLJ-SJORKVTESA-N 2 1 330.472 4.271 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccc(F)c(F)c2)cc1F ZINC000173350702 1042567093 /nfs/dbraw/zinc/56/70/93/1042567093.db2.gz HMTNEBBGYVSRLK-LBPRGKRZSA-N 2 1 345.368 4.449 20 0 EIADMP C[C@@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492427285 1042648691 /nfs/dbraw/zinc/64/86/91/1042648691.db2.gz YRWKSXRUOHNWSJ-WKDRNLAYSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccc2[nH]cnc2c1 ZINC000518765608 1042674437 /nfs/dbraw/zinc/67/44/37/1042674437.db2.gz QCKCQNXWVRMDBT-KRWDZBQOSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccc2nc[nH]c2c1 ZINC000518765608 1042674453 /nfs/dbraw/zinc/67/44/53/1042674453.db2.gz QCKCQNXWVRMDBT-KRWDZBQOSA-N 2 1 348.494 4.227 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccc2nc[nH]c2c1 ZINC000518765608 1042674467 /nfs/dbraw/zinc/67/44/67/1042674467.db2.gz QCKCQNXWVRMDBT-KRWDZBQOSA-N 2 1 348.494 4.227 20 0 EIADMP CCc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000309707877 1042818812 /nfs/dbraw/zinc/81/88/12/1042818812.db2.gz IMPNKUCFLQEITC-FUHWJXTLSA-N 2 1 328.525 4.311 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(Cl)cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309875646 1042823335 /nfs/dbraw/zinc/82/33/35/1042823335.db2.gz SYKBHBQASWVKIU-LPHOPBHVSA-N 2 1 328.887 4.340 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000310591415 1042840851 /nfs/dbraw/zinc/84/08/51/1042840851.db2.gz OPYBISDIEXOZAY-WFXMLNOXSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000310591415 1042840854 /nfs/dbraw/zinc/84/08/54/1042840854.db2.gz OPYBISDIEXOZAY-WFXMLNOXSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000311016329 1042850787 /nfs/dbraw/zinc/85/07/87/1042850787.db2.gz NADWJIPWPYTHFU-JBYIUTFZSA-N 2 1 338.495 4.084 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000311107644 1042853278 /nfs/dbraw/zinc/85/32/78/1042853278.db2.gz DNOGWAUZWYLNOY-QUCCMNQESA-N 2 1 338.495 4.345 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000311107644 1042853281 /nfs/dbraw/zinc/85/32/81/1042853281.db2.gz DNOGWAUZWYLNOY-QUCCMNQESA-N 2 1 338.495 4.345 20 0 EIADMP Cc1ccsc1[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000177969228 1042855303 /nfs/dbraw/zinc/85/53/03/1042855303.db2.gz UDRFHPYKEYSSFJ-QGZVFWFLSA-N 2 1 328.525 4.414 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2cccnc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311609393 1042862698 /nfs/dbraw/zinc/86/26/98/1042862698.db2.gz DZEDYWIJGNPCND-AVRDEDQJSA-N 2 1 345.490 4.235 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000178413547 1042866064 /nfs/dbraw/zinc/86/60/64/1042866064.db2.gz UUGHTDINXHYBOD-MRXNPFEDSA-N 2 1 343.540 4.179 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000507784919 1042934996 /nfs/dbraw/zinc/93/49/96/1042934996.db2.gz UERKNUIPWHBCQB-FGZHOGPDSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000493978306 1042990922 /nfs/dbraw/zinc/99/09/22/1042990922.db2.gz RMCJMPHOFFAYNX-PGRDOPGGSA-N 2 1 340.511 4.393 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](CCc1ccccc1F)C1CCCC1 ZINC000536476938 1043035329 /nfs/dbraw/zinc/03/53/29/1043035329.db2.gz VFJUVSYRBCNFPG-UHFFFAOYSA-N 2 1 329.463 4.208 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](CCc1ccccc1F)C1CCCC1 ZINC000536476938 1043035333 /nfs/dbraw/zinc/03/53/33/1043035333.db2.gz VFJUVSYRBCNFPG-UHFFFAOYSA-N 2 1 329.463 4.208 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1N(C)C ZINC000183198568 1043040108 /nfs/dbraw/zinc/04/01/08/1043040108.db2.gz FPTWWGJFYBMTKI-YESZJQIVSA-N 2 1 347.522 4.195 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000183185694 1043040307 /nfs/dbraw/zinc/04/03/07/1043040307.db2.gz ILTAOIGWUOPEKF-YQVWRLOYSA-N 2 1 330.516 4.389 20 0 EIADMP Fc1ccc(F)c2c1CC[C@H]2[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000507820775 1043100022 /nfs/dbraw/zinc/10/00/22/1043100022.db2.gz INIRZIOKHPFJML-HXUWFJFHSA-N 2 1 342.433 4.338 20 0 EIADMP Cc1cnc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)cn1 ZINC000427837926 1043233373 /nfs/dbraw/zinc/23/33/73/1043233373.db2.gz AOBPAXNUMZCXQF-GOSISDBHSA-N 2 1 338.499 4.012 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCc3nc(C)ncc32)cc1 ZINC000766046658 1043245927 /nfs/dbraw/zinc/24/59/27/1043245927.db2.gz ZKYGAVPZZAUIKX-VBKZILBWSA-N 2 1 347.466 4.007 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccc(F)cc3Cl)CCCC2)CC[N@H+]1C ZINC000427882720 1043247371 /nfs/dbraw/zinc/24/73/71/1043247371.db2.gz ANQQNIRAJHNZNV-ZBFHGGJFSA-N 2 1 338.898 4.363 20 0 EIADMP CCSc1cc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)ccn1 ZINC000427885466 1043251243 /nfs/dbraw/zinc/25/12/43/1043251243.db2.gz MDTGMMPZMZJPIS-LPHOPBHVSA-N 2 1 347.572 4.326 20 0 EIADMP COc1cccc2cc(C[NH2+]CCCC[N@@H+]3C[C@H](C)C[C@H](C)C3)oc21 ZINC000727643565 1043255732 /nfs/dbraw/zinc/25/57/32/1043255732.db2.gz BNHXCXDIECWQRZ-CALCHBBNSA-N 2 1 344.499 4.289 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000338785103 1043272738 /nfs/dbraw/zinc/27/27/38/1043272738.db2.gz ADYSTIJFJYSLNK-GOSISDBHSA-N 2 1 349.316 4.068 20 0 EIADMP Fc1ccccc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166677429 1043307419 /nfs/dbraw/zinc/30/74/19/1043307419.db2.gz RDBCEPHTBGAHDP-KNKQGSTJSA-N 2 1 338.470 4.326 20 0 EIADMP Fc1ccccc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000166677429 1043307435 /nfs/dbraw/zinc/30/74/35/1043307435.db2.gz RDBCEPHTBGAHDP-KNKQGSTJSA-N 2 1 338.470 4.326 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1cccc2ccccc21 ZINC000674048909 1043349918 /nfs/dbraw/zinc/34/99/18/1043349918.db2.gz FUMCKJDZLJBPNB-FXAWDEMLSA-N 2 1 338.495 4.134 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC000520833245 1043395710 /nfs/dbraw/zinc/39/57/10/1043395710.db2.gz RWLDDCHDTLNYRC-UHFFFAOYSA-N 2 1 333.426 4.076 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC000520833245 1043395716 /nfs/dbraw/zinc/39/57/16/1043395716.db2.gz RWLDDCHDTLNYRC-UHFFFAOYSA-N 2 1 333.426 4.076 20 0 EIADMP CC[NH+](CC)CCCC[NH2+]C1C[C@@H](C)N(Cc2ccccc2)[C@H](C)C1 ZINC001168012058 1043421923 /nfs/dbraw/zinc/42/19/23/1043421923.db2.gz VIRBCXOXTHATHH-WOJBJXKFSA-N 2 1 345.575 4.140 20 0 EIADMP CN(c1ccccc1C[N@@H+](C)C[C@H]1CC=CCC1)C1CC[NH+](C)CC1 ZINC000542483080 1043478840 /nfs/dbraw/zinc/47/88/40/1043478840.db2.gz VFDJGZRXLWJLNQ-IBGZPJMESA-N 2 1 341.543 4.005 20 0 EIADMP C(=C/C[N@H+]1CCC[C@H]1c1ccccn1)\C[NH+]1CCC[C@@H]1c1ccccn1 ZINC000674371434 1043647334 /nfs/dbraw/zinc/64/73/34/1043647334.db2.gz QRCNTDULJDXPFL-WKEQBZBWSA-N 2 1 348.494 4.007 20 0 EIADMP C(=C/C[N@@H+]1CCC[C@@H]1c1ccccn1)\C[NH+]1CCC[C@H]1c1ccccn1 ZINC000674371434 1043647341 /nfs/dbraw/zinc/64/73/41/1043647341.db2.gz QRCNTDULJDXPFL-WKEQBZBWSA-N 2 1 348.494 4.007 20 0 EIADMP C(=C/C[N@H+]1CCC[C@@H]1c1ccccn1)\C[NH+]1CCC[C@H]1c1ccccn1 ZINC000674371434 1043647349 /nfs/dbraw/zinc/64/73/49/1043647349.db2.gz QRCNTDULJDXPFL-WKEQBZBWSA-N 2 1 348.494 4.007 20 0 EIADMP CC(C)O[C@@H](C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000428251061 1043695872 /nfs/dbraw/zinc/69/58/72/1043695872.db2.gz YALIBPCCQYJKHA-RTWAWAEBSA-N 2 1 330.516 4.103 20 0 EIADMP C[C@H](CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000223216529 1043702268 /nfs/dbraw/zinc/70/22/68/1043702268.db2.gz WCNUDIHWHNYIMP-HXUWFJFHSA-N 2 1 336.523 4.477 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1csc(-c2ccc(C)cc2)n1 ZINC000172118890 1043719285 /nfs/dbraw/zinc/71/92/85/1043719285.db2.gz JZMWPJULXUMJBK-HNNXBMFYSA-N 2 1 340.496 4.049 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000681394481 1043733459 /nfs/dbraw/zinc/73/34/59/1043733459.db2.gz SHHQWXJWQPWNHM-JBACZVJFSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cnn1C(C)C ZINC000191179519 1043793922 /nfs/dbraw/zinc/79/39/22/1043793922.db2.gz CLDQIXNBMIJRJN-KSZLIROESA-N 2 1 334.552 4.181 20 0 EIADMP Cc1c([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cnn1C(C)C ZINC000191325088 1043808954 /nfs/dbraw/zinc/80/89/54/1043808954.db2.gz OOSJFIPDGVCXJN-MSOLQXFVSA-N 2 1 342.531 4.334 20 0 EIADMP Cc1c([C@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)cnn1C(C)C ZINC000191325088 1043808956 /nfs/dbraw/zinc/80/89/56/1043808956.db2.gz OOSJFIPDGVCXJN-MSOLQXFVSA-N 2 1 342.531 4.334 20 0 EIADMP FC(F)C1CCC([NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000442777195 1043830827 /nfs/dbraw/zinc/83/08/27/1043830827.db2.gz IMCAQWDCJMDXAM-QQFBHYJXSA-N 2 1 342.499 4.374 20 0 EIADMP FC(F)C1CCC([NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000442777195 1043830842 /nfs/dbraw/zinc/83/08/42/1043830842.db2.gz IMCAQWDCJMDXAM-QQFBHYJXSA-N 2 1 342.499 4.374 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCCc1ccc(Cl)cc1 ZINC000429239675 1043841502 /nfs/dbraw/zinc/84/15/02/1043841502.db2.gz VRSLPIGUHMPKAL-UHFFFAOYSA-N 2 1 333.907 4.444 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCCc1ccc(Cl)cc1 ZINC000429239675 1043841508 /nfs/dbraw/zinc/84/15/08/1043841508.db2.gz VRSLPIGUHMPKAL-UHFFFAOYSA-N 2 1 333.907 4.444 20 0 EIADMP COc1ccc([C@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@H]2CCC[NH2+]2)cc1 ZINC000665300687 1043927001 /nfs/dbraw/zinc/92/70/01/1043927001.db2.gz HRCMLPPHLWLDJI-CVEARBPZSA-N 2 1 344.421 4.057 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCOC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000674910096 1043935086 /nfs/dbraw/zinc/93/50/86/1043935086.db2.gz ZVYMRMPLJIOGFN-UYAOXDASSA-N 2 1 332.532 4.177 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)CCCOC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC000674910096 1043935092 /nfs/dbraw/zinc/93/50/92/1043935092.db2.gz ZVYMRMPLJIOGFN-UYAOXDASSA-N 2 1 332.532 4.177 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)CCCOC(C)(C)C)CC[NH+]1Cc1ccccc1 ZINC000674910096 1043935097 /nfs/dbraw/zinc/93/50/97/1043935097.db2.gz ZVYMRMPLJIOGFN-UYAOXDASSA-N 2 1 332.532 4.177 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCOC(C)(C)C)CC[NH+]1Cc1ccccc1 ZINC000674910096 1043935102 /nfs/dbraw/zinc/93/51/02/1043935102.db2.gz ZVYMRMPLJIOGFN-UYAOXDASSA-N 2 1 332.532 4.177 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc(Br)cs2)CC1 ZINC000226391425 1044171184 /nfs/dbraw/zinc/17/11/84/1044171184.db2.gz NJAQHIXUKARDDD-NSHDSACASA-N 2 1 331.323 4.036 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3cccs3)C1)CC2 ZINC000479387550 1044242400 /nfs/dbraw/zinc/24/24/00/1044242400.db2.gz HNOCFDRZQQUZSS-YWZLYKJASA-N 2 1 344.499 4.376 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc3cccs3)C1)CC2 ZINC000479387550 1044242421 /nfs/dbraw/zinc/24/24/21/1044242421.db2.gz HNOCFDRZQQUZSS-YWZLYKJASA-N 2 1 344.499 4.376 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cc(Br)cs1 ZINC000194025921 1044245173 /nfs/dbraw/zinc/24/51/73/1044245173.db2.gz UAXIMWRROPMYSE-GHMZBOCLSA-N 2 1 342.306 4.002 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCCNc2ccccc2)cc1 ZINC000347955415 1044339824 /nfs/dbraw/zinc/33/98/24/1044339824.db2.gz MNFDMZFANHTKFJ-QGZVFWFLSA-N 2 1 334.467 4.334 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000675489077 1044360361 /nfs/dbraw/zinc/36/03/61/1044360361.db2.gz FTWITTOWMBUAKI-MOPGFXCFSA-N 2 1 325.500 4.222 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000675489077 1044360379 /nfs/dbraw/zinc/36/03/79/1044360379.db2.gz FTWITTOWMBUAKI-MOPGFXCFSA-N 2 1 325.500 4.222 20 0 EIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000675489077 1044360395 /nfs/dbraw/zinc/36/03/95/1044360395.db2.gz FTWITTOWMBUAKI-MOPGFXCFSA-N 2 1 325.500 4.222 20 0 EIADMP Cc1cccc2c1OCC[C@H]2[NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1 ZINC000474090863 1044452902 /nfs/dbraw/zinc/45/29/02/1044452902.db2.gz UVLFWPAXNINBND-LDQXTDLNSA-N 2 1 342.527 4.451 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCC(C)(C)c2ccccc2)[C@@H](C)C1 ZINC000675770733 1044485873 /nfs/dbraw/zinc/48/58/73/1044485873.db2.gz YLVAVAKSBPVVMV-PZJWPPBQSA-N 2 1 346.559 4.081 20 0 EIADMP CCc1cnc(C[NH+]2CCC(CC[N@@H+](CC)CC3CC3)CC2)s1 ZINC000543396775 1044511236 /nfs/dbraw/zinc/51/12/36/1044511236.db2.gz NUNOAQJWYGAKEI-UHFFFAOYSA-N 2 1 335.561 4.040 20 0 EIADMP CCc1cnc(C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)s1 ZINC000543396775 1044511249 /nfs/dbraw/zinc/51/12/49/1044511249.db2.gz NUNOAQJWYGAKEI-UHFFFAOYSA-N 2 1 335.561 4.040 20 0 EIADMP Cc1nc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)c(C)s1 ZINC000443609698 1044540096 /nfs/dbraw/zinc/54/00/96/1044540096.db2.gz MOFZGKYGDXVETP-OAHLLOKOSA-N 2 1 335.561 4.236 20 0 EIADMP Cc1nc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c(C)s1 ZINC000443609698 1044540114 /nfs/dbraw/zinc/54/01/14/1044540114.db2.gz MOFZGKYGDXVETP-OAHLLOKOSA-N 2 1 335.561 4.236 20 0 EIADMP CCC(CC)(C[NH2+][C@H](C)C1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000675894941 1044544178 /nfs/dbraw/zinc/54/41/78/1044544178.db2.gz WFGUGAQOFCUOOK-RTBURBONSA-N 3 1 345.575 4.216 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542529913 1044567844 /nfs/dbraw/zinc/56/78/44/1044567844.db2.gz XPSMZAWWEFGTRQ-HKUYNNGSSA-N 2 1 330.516 4.216 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000542529913 1044567865 /nfs/dbraw/zinc/56/78/65/1044567865.db2.gz XPSMZAWWEFGTRQ-HKUYNNGSSA-N 2 1 330.516 4.216 20 0 EIADMP c1ccc(C[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCCC2)cc1 ZINC000480742557 1044572502 /nfs/dbraw/zinc/57/25/02/1044572502.db2.gz CKUDWWFRSXWQEU-BDTNDASRSA-N 2 1 326.528 4.394 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCSc1ccccc1F ZINC000191476935 1044618500 /nfs/dbraw/zinc/61/85/00/1044618500.db2.gz ZIHAAFKEPGYLHY-UHFFFAOYSA-N 2 1 335.492 4.089 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCSc1ccccc1F ZINC000191476935 1044618502 /nfs/dbraw/zinc/61/85/02/1044618502.db2.gz ZIHAAFKEPGYLHY-UHFFFAOYSA-N 2 1 335.492 4.089 20 0 EIADMP COc1ccc2nc(C[NH2+]CCCC[N@H+]3CCCC[C@H]3C)sc2c1 ZINC000474346091 1044872263 /nfs/dbraw/zinc/87/22/63/1044872263.db2.gz CLGDAFMYVCVCMB-OAHLLOKOSA-N 2 1 347.528 4.049 20 0 EIADMP CCC(C)(C)c1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)cc1 ZINC000509022460 1044944221 /nfs/dbraw/zinc/94/42/21/1044944221.db2.gz PUPVVBJVJQUNND-PCCBWWKXSA-N 2 1 344.543 4.058 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cnc(-c2ccc(C)cc2)s1 ZINC000115616389 1044963591 /nfs/dbraw/zinc/96/35/91/1044963591.db2.gz QBTMOIQWXKANKE-OAHLLOKOSA-N 2 1 340.496 4.049 20 0 EIADMP Fc1ccc2occ(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c2c1 ZINC001141852496 1044968246 /nfs/dbraw/zinc/96/82/46/1044968246.db2.gz GHUKMWTVFOQHOT-GOSISDBHSA-N 2 1 330.447 4.412 20 0 EIADMP Fc1ccc2occ(C[N@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c2c1 ZINC001141852496 1044968257 /nfs/dbraw/zinc/96/82/57/1044968257.db2.gz GHUKMWTVFOQHOT-GOSISDBHSA-N 2 1 330.447 4.412 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(C(F)(F)F)c1 ZINC000166464013 1044976286 /nfs/dbraw/zinc/97/62/86/1044976286.db2.gz RPAJFLJHLSUMIE-DLBZAZTESA-N 2 1 340.433 4.199 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CCSC4(CCC4)C3)CC2)cc1 ZINC000922841720 1044988209 /nfs/dbraw/zinc/98/82/09/1044988209.db2.gz FROUWRKQVZBJLA-LJQANCHMSA-N 2 1 330.541 4.059 20 0 EIADMP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000347913510 1044999514 /nfs/dbraw/zinc/99/95/14/1044999514.db2.gz AEMWYYDXMLOGKU-MSOLQXFVSA-N 2 1 340.515 4.096 20 0 EIADMP Clc1ccc(CCCC[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1Cl ZINC000474458782 1045006887 /nfs/dbraw/zinc/00/68/87/1045006887.db2.gz JBKKYJGSBCWODQ-HNNXBMFYSA-N 2 1 341.326 4.390 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cn2ccc(=S)c3ccccc32)CC1 ZINC000738091388 1045031736 /nfs/dbraw/zinc/03/17/36/1045031736.db2.gz YMZFBAMZSSZTMY-UHFFFAOYSA-N 2 1 343.540 4.380 20 0 EIADMP FC(F)Sc1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000738335972 1045053876 /nfs/dbraw/zinc/05/38/76/1045053876.db2.gz WWIHKIHWOYMEKW-MRXNPFEDSA-N 2 1 340.483 4.452 20 0 EIADMP FC(F)Sc1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000738335972 1045053889 /nfs/dbraw/zinc/05/38/89/1045053889.db2.gz WWIHKIHWOYMEKW-MRXNPFEDSA-N 2 1 340.483 4.452 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000923480066 1045132072 /nfs/dbraw/zinc/13/20/72/1045132072.db2.gz DULRNROEFBNKEI-KBPBESRZSA-N 2 1 333.863 4.035 20 0 EIADMP COC1(C[C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000429443343 1045143215 /nfs/dbraw/zinc/14/32/15/1045143215.db2.gz CQKFREACEJJMMX-ZJOUEHCJSA-N 2 1 344.543 4.224 20 0 EIADMP CC[N@H+](Cc1ccn(C2CCCC2)n1)Cc1ccc(C[NH+](C)C)cc1 ZINC000626062954 1045165337 /nfs/dbraw/zinc/16/53/37/1045165337.db2.gz MKTVLMVRHVQLKE-UHFFFAOYSA-N 2 1 340.515 4.082 20 0 EIADMP CC[N@@H+](Cc1ccn(C2CCCC2)n1)Cc1ccc(C[NH+](C)C)cc1 ZINC000626062954 1045165342 /nfs/dbraw/zinc/16/53/42/1045165342.db2.gz MKTVLMVRHVQLKE-UHFFFAOYSA-N 2 1 340.515 4.082 20 0 EIADMP CC(C)OCC[NH+]1CCC([NH2+]C2CCC3(CCCCC3)CC2)CC1 ZINC000466743051 1045168667 /nfs/dbraw/zinc/16/86/67/1045168667.db2.gz JACHJPLHLUTUJD-UHFFFAOYSA-N 2 1 336.564 4.359 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+]Cc1ccc(OCc2ccccc2F)cc1 ZINC000915227041 1045196208 /nfs/dbraw/zinc/19/62/08/1045196208.db2.gz ZEHXYRLJEHYETQ-UHFFFAOYSA-N 2 1 344.474 4.225 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1ccc(OCc2ccccc2F)cc1 ZINC000915227041 1045196217 /nfs/dbraw/zinc/19/62/17/1045196217.db2.gz ZEHXYRLJEHYETQ-UHFFFAOYSA-N 2 1 344.474 4.225 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2scnc2C2CC2)c1 ZINC000486991669 1045221160 /nfs/dbraw/zinc/22/11/60/1045221160.db2.gz XONGLYAXZBZSJP-UHFFFAOYSA-N 2 1 329.513 4.151 20 0 EIADMP Cl/C=C(\Cl)C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000762926568 1045416875 /nfs/dbraw/zinc/41/68/75/1045416875.db2.gz LENOOGVQPKXRCY-ATVHPVEESA-N 2 1 339.310 4.294 20 0 EIADMP CCCc1cc(N2CCC[C@H](c3[nH+]ccn3C)C2)c2ccccc2[nH+]1 ZINC000443963324 1045449267 /nfs/dbraw/zinc/44/92/67/1045449267.db2.gz UHNBCVPYZJRCCM-INIZCTEOSA-N 2 1 334.467 4.305 20 0 EIADMP C([C@@H]1CCCO1)[NH+]1CCC([NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000767691801 1045615974 /nfs/dbraw/zinc/61/59/74/1045615974.db2.gz VSTQPNABBOZKAZ-AOMIVXANSA-N 2 1 348.575 4.359 20 0 EIADMP FC1(F)CCCC[C@H]1C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170206011 1045925094 /nfs/dbraw/zinc/92/50/94/1045925094.db2.gz QGMUZIFQPJXYFS-VQTJNVASSA-N 2 1 348.481 4.410 20 0 EIADMP FC1(F)CCCC[C@H]1C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001170206011 1045925103 /nfs/dbraw/zinc/92/51/03/1045925103.db2.gz QGMUZIFQPJXYFS-VQTJNVASSA-N 2 1 348.481 4.410 20 0 EIADMP FC1(F)CCCC[C@H]1C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001170206011 1045925123 /nfs/dbraw/zinc/92/51/23/1045925123.db2.gz QGMUZIFQPJXYFS-VQTJNVASSA-N 2 1 348.481 4.410 20 0 EIADMP CCCCCC[N@@H+](C)CC(=O)Nc1cc(C[NH+]2CCCC2)ccc1C ZINC000769364354 1045937444 /nfs/dbraw/zinc/93/74/44/1045937444.db2.gz DFMBOEJZWVRTSI-UHFFFAOYSA-N 2 1 345.531 4.041 20 0 EIADMP CC[C@@H]1C[C@@H]([N@@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222649 1045949649 /nfs/dbraw/zinc/94/96/49/1045949649.db2.gz OMOUBGBLPIMZCG-OHJZQYHNSA-N 2 1 342.527 4.055 20 0 EIADMP CC[C@@H]1C[C@@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@H+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222649 1045949659 /nfs/dbraw/zinc/94/96/59/1045949659.db2.gz OMOUBGBLPIMZCG-OHJZQYHNSA-N 2 1 342.527 4.055 20 0 EIADMP CC[C@@H]1C[C@@H]([NH+]2C[C@H]3c4ccccc4[C@H]([N@@H+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222649 1045949669 /nfs/dbraw/zinc/94/96/69/1045949669.db2.gz OMOUBGBLPIMZCG-OHJZQYHNSA-N 2 1 342.527 4.055 20 0 EIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@@H](C)Cc2ccccc2Cl)CC1 ZINC001170253922 1045975136 /nfs/dbraw/zinc/97/51/36/1045975136.db2.gz CXSMEXFUDBONMN-INIZCTEOSA-N 2 1 343.902 4.233 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCC[C@@H](CC(C)C)C2)cn1 ZINC000792922670 1046109226 /nfs/dbraw/zinc/10/92/26/1046109226.db2.gz QFESFQGRSSYWFI-PKOBYXMFSA-N 2 1 326.488 4.270 20 0 EIADMP CC(C)C[C@@H](C[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccccc1 ZINC000792979129 1046115745 /nfs/dbraw/zinc/11/57/45/1046115745.db2.gz YEAZNKOMKANVHH-RBBKRZOGSA-N 2 1 344.543 4.049 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000261754439 1046143937 /nfs/dbraw/zinc/14/39/37/1046143937.db2.gz KKPOEVDPLISGBH-BEFAXECRSA-N 2 1 329.513 4.111 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@H+](C)C[C@@]1(C)CC[NH2+]C1 ZINC000261754439 1046143930 /nfs/dbraw/zinc/14/39/30/1046143930.db2.gz KKPOEVDPLISGBH-BEFAXECRSA-N 2 1 329.513 4.111 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc3c[nH]nc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000124056280 1046213880 /nfs/dbraw/zinc/21/38/80/1046213880.db2.gz NFIPLXHZFKSXIP-LAUBAEHRSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc3c[nH]nc3c2)CC[N@H+]1Cc1ccccc1 ZINC000124056280 1046213897 /nfs/dbraw/zinc/21/38/97/1046213897.db2.gz NFIPLXHZFKSXIP-LAUBAEHRSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc3c[nH]nc3c2)CC[NH+]1Cc1ccccc1 ZINC000124056280 1046213913 /nfs/dbraw/zinc/21/39/13/1046213913.db2.gz NFIPLXHZFKSXIP-LAUBAEHRSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc3c[nH]nc3c2)CC[NH+]1Cc1ccccc1 ZINC000124056280 1046213928 /nfs/dbraw/zinc/21/39/28/1046213928.db2.gz NFIPLXHZFKSXIP-LAUBAEHRSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@@H]1Cc1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508709191 1046358234 /nfs/dbraw/zinc/35/82/34/1046358234.db2.gz GMDXFVKHFKIQPO-FDTGPBLFSA-N 2 1 334.507 4.118 20 0 EIADMP C[C@@H]([NH2+]CCc1cc(F)cc(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508712201 1046370141 /nfs/dbraw/zinc/37/01/41/1046370141.db2.gz CHGFJHWTZUOCLR-VQIMIIECSA-N 2 1 344.449 4.008 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1OCC ZINC000125985333 1046407378 /nfs/dbraw/zinc/40/73/78/1046407378.db2.gz VVTYGTIODRYDLR-ROUUACIJSA-N 2 1 348.531 4.255 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)cc1 ZINC000126875989 1046576885 /nfs/dbraw/zinc/57/68/85/1046576885.db2.gz BGHQYWRUORUJCS-DLBZAZTESA-N 2 1 344.524 4.320 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)cc1 ZINC000126875989 1046576898 /nfs/dbraw/zinc/57/68/98/1046576898.db2.gz BGHQYWRUORUJCS-DLBZAZTESA-N 2 1 344.524 4.320 20 0 EIADMP COc1ccc2cc(C[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000536659492 1046606948 /nfs/dbraw/zinc/60/69/48/1046606948.db2.gz IHFCBYNRXBMBLV-OAQYLSRUSA-N 2 1 338.495 4.299 20 0 EIADMP C[C@@H]1C[C@@H](NCc2cc(F)ccc2F)CC[N@H+]1Cc1ccccc1 ZINC000379624355 1046713786 /nfs/dbraw/zinc/71/37/86/1046713786.db2.gz JPDRXTPSILBZSN-BEFAXECRSA-N 2 1 330.422 4.108 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](CCc1cccc(F)c1)C1CCCC1 ZINC000536730377 1046727826 /nfs/dbraw/zinc/72/78/26/1046727826.db2.gz BTTIKDVYURVHGD-UHFFFAOYSA-N 2 1 329.463 4.208 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](CCc1cccc(F)c1)C1CCCC1 ZINC000536730377 1046727840 /nfs/dbraw/zinc/72/78/40/1046727840.db2.gz BTTIKDVYURVHGD-UHFFFAOYSA-N 2 1 329.463 4.208 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC000379647795 1046741658 /nfs/dbraw/zinc/74/16/58/1046741658.db2.gz LDHKQHFRDZSORX-SXSPYAJSSA-N 2 1 334.507 4.187 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC000379647795 1046741672 /nfs/dbraw/zinc/74/16/72/1046741672.db2.gz LDHKQHFRDZSORX-SXSPYAJSSA-N 2 1 334.507 4.187 20 0 EIADMP CCOc1ccccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379654654 1046755314 /nfs/dbraw/zinc/75/53/14/1046755314.db2.gz JFZDKHAWMFWDKU-WIYYLYMNSA-N 2 1 338.495 4.228 20 0 EIADMP CCOc1ccccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379654654 1046755327 /nfs/dbraw/zinc/75/53/27/1046755327.db2.gz JFZDKHAWMFWDKU-WIYYLYMNSA-N 2 1 338.495 4.228 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CCc4cc(Cl)ccc43)CC2)[nH+]1 ZINC000128219573 1046782325 /nfs/dbraw/zinc/78/23/25/1046782325.db2.gz GIRKWVSHERXPNT-IBGZPJMESA-N 2 1 341.886 4.289 20 0 EIADMP COc1ccc([C@H](C)[C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000536833504 1046809737 /nfs/dbraw/zinc/80/97/37/1046809737.db2.gz PTOCXSMJNMKQNP-QRVBRYPASA-N 2 1 332.532 4.145 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(F)c(F)c(F)c2)C1 ZINC000536838977 1046813549 /nfs/dbraw/zinc/81/35/49/1046813549.db2.gz MVCZNDXVEQTOME-UONOGXRCSA-N 2 1 328.422 4.123 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(F)c(F)c(F)c2)C1 ZINC000536838977 1046813552 /nfs/dbraw/zinc/81/35/52/1046813552.db2.gz MVCZNDXVEQTOME-UONOGXRCSA-N 2 1 328.422 4.123 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC000536856458 1046825659 /nfs/dbraw/zinc/82/56/59/1046825659.db2.gz FCSLNQZRVWZAJA-QWHCGFSZSA-N 2 1 325.909 4.153 20 0 EIADMP COc1ccc(C2CCC([NH2+]CC[C@H]3CCC[N@@H+](C)C3)CC2)cc1 ZINC000459725079 1046865976 /nfs/dbraw/zinc/86/59/76/1046865976.db2.gz AYOLLYISDSTCGB-PGYGNJIDSA-N 2 1 330.516 4.043 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000459790963 1046891510 /nfs/dbraw/zinc/89/15/10/1046891510.db2.gz RECVULUJFYGGDU-AWEZNQCLSA-N 2 1 349.931 4.285 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000537012367 1046894729 /nfs/dbraw/zinc/89/47/29/1046894729.db2.gz NLUPBYLGVCGYIS-FUHIMQAGSA-N 2 1 329.532 4.338 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@H]3CC[C@@H]3C3CC3)cc2)CC1 ZINC000806158299 1047182144 /nfs/dbraw/zinc/18/21/44/1047182144.db2.gz WXYBOPZUGBCVRH-RTWAWAEBSA-N 2 1 327.516 4.065 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1cccc(C)c1)Cc1ccccn1 ZINC000128935716 1047185010 /nfs/dbraw/zinc/18/50/10/1047185010.db2.gz UCGASNGHURVPMG-UHFFFAOYSA-N 2 1 348.494 4.378 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1cccc(C)c1)Cc1ccccn1 ZINC000128935716 1047185028 /nfs/dbraw/zinc/18/50/28/1047185028.db2.gz UCGASNGHURVPMG-UHFFFAOYSA-N 2 1 348.494 4.378 20 0 EIADMP CCc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000789363096 1047410069 /nfs/dbraw/zinc/41/00/69/1047410069.db2.gz RZLCJOKAFNLNHH-KSFYIVLOSA-N 2 1 349.478 4.127 20 0 EIADMP CCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1F ZINC000556077759 1047433186 /nfs/dbraw/zinc/43/31/86/1047433186.db2.gz ZXROQWKXCYGVHG-QUCCMNQESA-N 2 1 342.458 4.150 20 0 EIADMP CCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1F ZINC000556077759 1047433191 /nfs/dbraw/zinc/43/31/91/1047433191.db2.gz ZXROQWKXCYGVHG-QUCCMNQESA-N 2 1 342.458 4.150 20 0 EIADMP CCS[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556104879 1047456209 /nfs/dbraw/zinc/45/62/09/1047456209.db2.gz MYKWVCTVYZPANO-FUMNGEBKSA-N 2 1 332.557 4.476 20 0 EIADMP CCS[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556104879 1047456218 /nfs/dbraw/zinc/45/62/18/1047456218.db2.gz MYKWVCTVYZPANO-FUMNGEBKSA-N 2 1 332.557 4.476 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC23CC3)cc1 ZINC000897746466 1047481497 /nfs/dbraw/zinc/48/14/97/1047481497.db2.gz KLMSQLZLNSAWDZ-XUBOLADHSA-N 2 1 342.552 4.200 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC23CC3)cc1 ZINC000897746466 1047481499 /nfs/dbraw/zinc/48/14/99/1047481499.db2.gz KLMSQLZLNSAWDZ-XUBOLADHSA-N 2 1 342.552 4.200 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000129754995 1047500763 /nfs/dbraw/zinc/50/07/63/1047500763.db2.gz ZVDGAYLDCXNRIA-XLIONFOSSA-N 2 1 340.511 4.287 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2cc(F)c(F)c(F)c2)C[C@H]1c1ccccc1 ZINC000556167964 1047523875 /nfs/dbraw/zinc/52/38/75/1047523875.db2.gz ZLJOYEUSEKNBJO-LPHOPBHVSA-N 2 1 348.412 4.072 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2cc(F)c(F)c(F)c2)C[C@H]1c1ccccc1 ZINC000556167964 1047523898 /nfs/dbraw/zinc/52/38/98/1047523898.db2.gz ZLJOYEUSEKNBJO-LPHOPBHVSA-N 2 1 348.412 4.072 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2cccc3[nH]ccc32)C[C@@H]1c1ccccc1 ZINC000556179700 1047539627 /nfs/dbraw/zinc/53/96/27/1047539627.db2.gz WELFNQHLHCGYMI-SIKLNZKXSA-N 2 1 333.479 4.136 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2cccc3[nH]ccc32)C[C@@H]1c1ccccc1 ZINC000556179700 1047539644 /nfs/dbraw/zinc/53/96/44/1047539644.db2.gz WELFNQHLHCGYMI-SIKLNZKXSA-N 2 1 333.479 4.136 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccnc(Cl)c2)CC1 ZINC000763430860 1047590763 /nfs/dbraw/zinc/59/07/63/1047590763.db2.gz FWMICTZSFKLAQH-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccnc(Cl)c2)CC1 ZINC000763430860 1047590792 /nfs/dbraw/zinc/59/07/92/1047590792.db2.gz FWMICTZSFKLAQH-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000556236386 1047601995 /nfs/dbraw/zinc/60/19/95/1047601995.db2.gz KNHMRNYAOJZMIQ-MAODMQOUSA-N 2 1 339.527 4.441 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000556236386 1047602003 /nfs/dbraw/zinc/60/20/03/1047602003.db2.gz KNHMRNYAOJZMIQ-MAODMQOUSA-N 2 1 339.527 4.441 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)cc1 ZINC000898319485 1047610287 /nfs/dbraw/zinc/61/02/87/1047610287.db2.gz GLOODLNQEZTNMK-YCRPNKLZSA-N 2 1 332.451 4.378 20 0 EIADMP C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000898322421 1047614185 /nfs/dbraw/zinc/61/41/85/1047614185.db2.gz KZRGPLZIMLCPAU-BULFRSBZSA-N 2 1 335.495 4.033 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(Cl)nc2)CC1 ZINC000763430263 1047629150 /nfs/dbraw/zinc/62/91/50/1047629150.db2.gz CQCYOBIPRLDFGO-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(Cl)nc2)CC1 ZINC000763430263 1047629163 /nfs/dbraw/zinc/62/91/63/1047629163.db2.gz CQCYOBIPRLDFGO-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP CC(C)[NH2+]C1CC[NH+](CCCOc2cccc3ccccc32)CC1 ZINC000108369858 1047798650 /nfs/dbraw/zinc/79/86/50/1047798650.db2.gz ZMGYBYNGISZLPT-UHFFFAOYSA-N 2 1 326.484 4.071 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665021 1047810241 /nfs/dbraw/zinc/81/02/41/1047810241.db2.gz CMRGHDSDGSEBPD-YWMUFLPLSA-N 2 1 344.449 4.493 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665021 1047810242 /nfs/dbraw/zinc/81/02/42/1047810242.db2.gz CMRGHDSDGSEBPD-YWMUFLPLSA-N 2 1 344.449 4.493 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171058831 1047882040 /nfs/dbraw/zinc/88/20/40/1047882040.db2.gz LVMLFHUDLQKYRA-GOSISDBHSA-N 2 1 334.935 4.394 20 0 EIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001171064630 1047923690 /nfs/dbraw/zinc/92/36/90/1047923690.db2.gz SFSZBVLJPHMJNX-BBRMVZONSA-N 2 1 341.326 4.172 20 0 EIADMP CN1CCC([N@@H+](C)Cc2ccc3ccc(-c4ccccc4)nc3c2)CC1 ZINC001136943362 1047967938 /nfs/dbraw/zinc/96/79/38/1047967938.db2.gz DMIGDXQEYVXLSQ-UHFFFAOYSA-N 2 1 345.490 4.428 20 0 EIADMP CC1(C)[C@@H]2C[C@H]([NH2+][C@H]3CC[N@H+](Cc4ccccc4)CC3(C)C)C[C@@H]21 ZINC001170738864 1047971685 /nfs/dbraw/zinc/97/16/85/1047971685.db2.gz PUMGACMYGWQSJW-YRPNKDGESA-N 2 1 326.528 4.311 20 0 EIADMP CC1(C)[C@@H]2C[C@H]([NH2+][C@H]3CC[N@@H+](Cc4ccccc4)CC3(C)C)C[C@@H]21 ZINC001170738864 1047971707 /nfs/dbraw/zinc/97/17/07/1047971707.db2.gz PUMGACMYGWQSJW-YRPNKDGESA-N 2 1 326.528 4.311 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CC[C@H](O)c2ccccc2)CC1 ZINC000808734391 1048094299 /nfs/dbraw/zinc/09/42/99/1048094299.db2.gz VAPVNPFNPWHYNX-KNQAVFIVSA-N 2 1 344.543 4.087 20 0 EIADMP C[NH+]1CCC(C2CC[NH+](Cc3ccc(F)c(Cl)c3F)CC2)CC1 ZINC001143626051 1048131935 /nfs/dbraw/zinc/13/19/35/1048131935.db2.gz FOPBYYPHJKLNNI-UHFFFAOYSA-N 2 1 342.861 4.172 20 0 EIADMP C[NH+](C)CCCCC(=O)Nc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000556937903 1048258007 /nfs/dbraw/zinc/25/80/07/1048258007.db2.gz CBVMTXYHZKCQDV-UHFFFAOYSA-N 2 1 345.531 4.122 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)C[C@H]3CC3(Cl)Cl)C2)s1 ZINC000844327414 1048285712 /nfs/dbraw/zinc/28/57/12/1048285712.db2.gz CIFRSXNLMBQUAK-UONOGXRCSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)C[C@H]3CC3(Cl)Cl)C2)s1 ZINC000844327414 1048285722 /nfs/dbraw/zinc/28/57/22/1048285722.db2.gz CIFRSXNLMBQUAK-UONOGXRCSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C[C@H]3CC3(Cl)Cl)C2)s1 ZINC000844327414 1048285738 /nfs/dbraw/zinc/28/57/38/1048285738.db2.gz CIFRSXNLMBQUAK-UONOGXRCSA-N 2 1 347.355 4.004 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)C[C@H]3CC3(Cl)Cl)C2)s1 ZINC000844327414 1048285746 /nfs/dbraw/zinc/28/57/46/1048285746.db2.gz CIFRSXNLMBQUAK-UONOGXRCSA-N 2 1 347.355 4.004 20 0 EIADMP CC(C)CSCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499194644 1048394789 /nfs/dbraw/zinc/39/47/89/1048394789.db2.gz SCPHGIWHVNKROO-ACDBMABISA-N 2 1 332.557 4.161 20 0 EIADMP CCc1cc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)cc(CC)c1O ZINC001144148188 1048458942 /nfs/dbraw/zinc/45/89/42/1048458942.db2.gz OGDIBDRPAHZHRU-UHFFFAOYSA-N 2 1 332.532 4.069 20 0 EIADMP Cc1cc(F)ccc1[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000815559193 1048507816 /nfs/dbraw/zinc/50/78/16/1048507816.db2.gz ZXEPMIFVUBLPQV-SFHVURJKSA-N 2 1 340.486 4.492 20 0 EIADMP Cc1cccc(-c2n[nH]cc2C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC000809738172 1048510035 /nfs/dbraw/zinc/51/00/35/1048510035.db2.gz SHFBDUDNICXYPQ-UHFFFAOYSA-N 2 1 348.494 4.079 20 0 EIADMP C[N@@H+](CC1CC[NH+](C)CC1)[C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171163041 1048600492 /nfs/dbraw/zinc/60/04/92/1048600492.db2.gz MFYPSUXROBIXCN-INIZCTEOSA-N 2 1 341.326 4.124 20 0 EIADMP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc([C@H]4CC[N@@H+](C)C4)cc3)c2c1 ZINC001171167780 1048614812 /nfs/dbraw/zinc/61/48/12/1048614812.db2.gz MQQKKLQDVXNWPC-HKUYNNGSSA-N 2 1 347.506 4.248 20 0 EIADMP CCCCCC[C@@H](CC)[N@@H+]1CCc2ncc(C[NH+]3CCCC3)n2CC1 ZINC001170598324 1048659977 /nfs/dbraw/zinc/65/99/77/1048659977.db2.gz GYHLANQZVWOCSW-LJQANCHMSA-N 2 1 346.563 4.086 20 0 EIADMP CCC[NH+](CCC)CCC[NH2+][C@@H](C)c1ccc(Br)nc1 ZINC000810215431 1048684265 /nfs/dbraw/zinc/68/42/65/1048684265.db2.gz FHLHMWFVXMVGKT-AWEZNQCLSA-N 2 1 342.325 4.007 20 0 EIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cccc(Cl)c2C1 ZINC001170916752 1049216783 /nfs/dbraw/zinc/21/67/83/1049216783.db2.gz PEJQYIPSDZAWRY-KZNAEPCWSA-N 2 1 334.935 4.425 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C[C@H](O)c1cccc2ccccc21 ZINC000818959515 1049227130 /nfs/dbraw/zinc/22/71/30/1049227130.db2.gz NCSDLOIGDCRBRU-AVRDEDQJSA-N 2 1 340.511 4.117 20 0 EIADMP [NH3+]C1CCC(N(c2[nH+]ccc3cc[nH]c32)[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC001170646391 1049303031 /nfs/dbraw/zinc/30/30/31/1049303031.db2.gz AZWUNLSEUTZIHX-GHBBCFCZSA-N 2 1 346.478 4.195 20 0 EIADMP C[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1cccc(C[NH+](C)C)c1 ZINC000820808786 1049554659 /nfs/dbraw/zinc/55/46/59/1049554659.db2.gz NNGBBIXZONLDCS-AWEZNQCLSA-N 2 1 341.480 4.316 20 0 EIADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(Cl)c(Br)c2)CC1 ZINC000137071498 1049572381 /nfs/dbraw/zinc/57/23/81/1049572381.db2.gz WHFYXVLGKBASMV-UHFFFAOYSA-N 2 1 345.712 4.065 20 0 EIADMP CCC(CC)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2c(F)cccc2C1 ZINC001171414155 1049644615 /nfs/dbraw/zinc/64/46/15/1049644615.db2.gz NQKOXKYZILIEFM-WDSOQIARSA-N 2 1 332.507 4.444 20 0 EIADMP FC1(F)CCC[C@@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)C1 ZINC000716629316 1049702049 /nfs/dbraw/zinc/70/20/49/1049702049.db2.gz YFYJBWDGYJSGDB-RDGPPVDQSA-N 2 1 334.454 4.207 20 0 EIADMP Fc1cc(F)c2c(c1)CC[C@@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001170701564 1049736578 /nfs/dbraw/zinc/73/65/78/1049736578.db2.gz PQEJIBXULGSKRW-RTBURBONSA-N 2 1 348.481 4.163 20 0 EIADMP Fc1cc(F)c2c(c1)CC[C@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001170701562 1049737194 /nfs/dbraw/zinc/73/71/94/1049737194.db2.gz PQEJIBXULGSKRW-OALUTQOASA-N 2 1 348.481 4.163 20 0 EIADMP Fc1cc(F)c2c(c1)CC[C@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001170701561 1049737611 /nfs/dbraw/zinc/73/76/11/1049737611.db2.gz PQEJIBXULGSKRW-MOPGFXCFSA-N 2 1 348.481 4.163 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc3ccccc3)C1)C2 ZINC001171551554 1049753920 /nfs/dbraw/zinc/75/39/20/1049753920.db2.gz QEMPQVNZFGECDU-GGAORHGYSA-N 2 1 348.534 4.354 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001171570848 1049758185 /nfs/dbraw/zinc/75/81/85/1049758185.db2.gz PAUANLCZQMZWKG-RTWAWAEBSA-N 2 1 326.528 4.193 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C)C2 ZINC001171573119 1049760377 /nfs/dbraw/zinc/76/03/77/1049760377.db2.gz GNFQTFOEDBDFRO-PCCBWWKXSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C)C2 ZINC001171573119 1049760380 /nfs/dbraw/zinc/76/03/80/1049760380.db2.gz GNFQTFOEDBDFRO-PCCBWWKXSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C)C2 ZINC001171573119 1049760388 /nfs/dbraw/zinc/76/03/88/1049760388.db2.gz GNFQTFOEDBDFRO-PCCBWWKXSA-N 2 1 326.528 4.191 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2cccc(OC(F)F)c2)CC1(C)C ZINC001171613463 1049765721 /nfs/dbraw/zinc/76/57/21/1049765721.db2.gz KQWDSKLYAVEMCW-UHFFFAOYSA-N 2 1 326.431 4.029 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@@H](CCO)c2ccc(Cl)cc2)CC1(C)C ZINC001171621883 1049767197 /nfs/dbraw/zinc/76/71/97/1049767197.db2.gz RKPCBBFMPOQGNL-KRWDZBQOSA-N 2 1 338.923 4.005 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(Br)s2)CC1(C)C ZINC001171623445 1049768692 /nfs/dbraw/zinc/76/86/92/1049768692.db2.gz ZGPXVXWAMMROQV-UHFFFAOYSA-N 2 1 345.350 4.252 20 0 EIADMP COc1ccc2c(c1)C[N@@H+](C1CC(C)(C)[NH+](C)C(C)(C)C1)CCC2 ZINC001171641683 1049778518 /nfs/dbraw/zinc/77/85/18/1049778518.db2.gz SZBRQGPZPFDDJM-UHFFFAOYSA-N 2 1 330.516 4.095 20 0 EIADMP Cc1ccc([C@@]2(C)C[N@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)CCO2)cc1 ZINC001171639471 1049778888 /nfs/dbraw/zinc/77/88/88/1049778888.db2.gz LAGYASBLBOIDLC-JOCHJYFZSA-N 2 1 344.543 4.194 20 0 EIADMP Cc1ccc([C@@]2(C)C[N@@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)CCO2)cc1 ZINC001171639471 1049778892 /nfs/dbraw/zinc/77/88/92/1049778892.db2.gz LAGYASBLBOIDLC-JOCHJYFZSA-N 2 1 344.543 4.194 20 0 EIADMP Cc1cc2cc(C[NH3+])ccc2n1[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727136 1049785112 /nfs/dbraw/zinc/78/51/12/1049785112.db2.gz QCDLNLPDTIOJRR-KKSFZXQISA-N 2 1 333.479 4.244 20 0 EIADMP C[C@H]([NH3+])c1cn([C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171740728 1049801540 /nfs/dbraw/zinc/80/15/40/1049801540.db2.gz LEFBZQQWOYYPFO-JENIJYKNSA-N 2 1 333.479 4.497 20 0 EIADMP C[C@@H]1C[C@@H](NC(=[NH2+])c2ccc(F)c(Cl)c2)C[N@@H+]1Cc1ccccc1 ZINC001171740572 1049801896 /nfs/dbraw/zinc/80/18/96/1049801896.db2.gz SKBOCVISIOQFFA-CZUORRHYSA-N 2 1 345.849 4.057 20 0 EIADMP C[C@@H]1C[C@@H](NC(=[NH2+])c2ccc(F)c(Cl)c2)C[N@H+]1Cc1ccccc1 ZINC001171740572 1049801898 /nfs/dbraw/zinc/80/18/98/1049801898.db2.gz SKBOCVISIOQFFA-CZUORRHYSA-N 2 1 345.849 4.057 20 0 EIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC001171961721 1049825739 /nfs/dbraw/zinc/82/57/39/1049825739.db2.gz BGGPRKUOGFDREG-RKVPGOIHSA-N 2 1 342.449 4.345 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001171966412 1049826455 /nfs/dbraw/zinc/82/64/55/1049826455.db2.gz VBEFQJBELLSBHQ-WBVHZDCISA-N 2 1 342.449 4.477 20 0 EIADMP CCCC[N@@H+](CC)CCN[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171967844 1049828044 /nfs/dbraw/zinc/82/80/44/1049828044.db2.gz NOUADJDYHAGQCJ-NRFANRHFSA-N 2 1 345.575 4.141 20 0 EIADMP CCCC[NH+](CC)CCN[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171967844 1049828045 /nfs/dbraw/zinc/82/80/45/1049828045.db2.gz NOUADJDYHAGQCJ-NRFANRHFSA-N 2 1 345.575 4.141 20 0 EIADMP CCCC[NH+](CC)CCN[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171967844 1049828047 /nfs/dbraw/zinc/82/80/47/1049828047.db2.gz NOUADJDYHAGQCJ-NRFANRHFSA-N 2 1 345.575 4.141 20 0 EIADMP CC(C)[NH+](CCN[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C(C)C ZINC001171969095 1049833885 /nfs/dbraw/zinc/83/38/85/1049833885.db2.gz TUKRJUZSORFGIB-OAQYLSRUSA-N 2 1 345.575 4.138 20 0 EIADMP CC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC(F)(F)C1 ZINC001171970619 1049834435 /nfs/dbraw/zinc/83/44/35/1049834435.db2.gz DQRYNWZWIKRYBA-QGZVFWFLSA-N 2 1 336.470 4.455 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2cncc(Cl)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171974217 1049835884 /nfs/dbraw/zinc/83/58/84/1049835884.db2.gz DWCHIYSJTBPXCQ-IBGZPJMESA-N 2 1 343.902 4.268 20 0 EIADMP CC1(C)C[C@@H]([NH2+]Cc2cncc(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC001171974217 1049835887 /nfs/dbraw/zinc/83/58/87/1049835887.db2.gz DWCHIYSJTBPXCQ-IBGZPJMESA-N 2 1 343.902 4.268 20 0 EIADMP CC1(C)C[C@@H](n2nc(C[NH3+])c3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC001171973399 1049835911 /nfs/dbraw/zinc/83/59/11/1049835911.db2.gz YMRCMNORKMWCGW-SFHVURJKSA-N 2 1 348.494 4.111 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccc(N)cc1 ZINC001171977190 1049837809 /nfs/dbraw/zinc/83/78/09/1049837809.db2.gz YCKPOFSKWIREJF-DYESRHJHSA-N 2 1 337.511 4.363 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170717254 1049839006 /nfs/dbraw/zinc/83/90/06/1049839006.db2.gz URWWURVVBLBJFN-GOSISDBHSA-N 2 1 336.470 4.018 20 0 EIADMP Cc1cc2c(cn1)[C@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)C(C)(C)C1)CC2 ZINC001171980593 1049839082 /nfs/dbraw/zinc/83/90/82/1049839082.db2.gz RTFVZJFWPPLRQZ-RBBKRZOGSA-N 2 1 349.522 4.410 20 0 EIADMP CC1(C)C[C@@H](Nc2cccc(CC[NH3+])c2)CC[N@H+]1Cc1ccccc1 ZINC001171979058 1049839094 /nfs/dbraw/zinc/83/90/94/1049839094.db2.gz KVTTVQUTANDYLM-NRFANRHFSA-N 2 1 337.511 4.043 20 0 EIADMP CC(C)OC1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980382 1049839248 /nfs/dbraw/zinc/83/92/48/1049839248.db2.gz DZYYRLCIRDPVHH-FQEVSTJZSA-N 2 1 344.543 4.319 20 0 EIADMP CC1(C)C[C@H]([NH2+]CC2CCSCC2)CC[N@H+]1Cc1ccccc1 ZINC001171981224 1049839314 /nfs/dbraw/zinc/83/93/14/1049839314.db2.gz ZSNBOCLLDLQNOK-LJQANCHMSA-N 2 1 332.557 4.162 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CC[C@H](c3cccnc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171985388 1049839855 /nfs/dbraw/zinc/83/98/55/1049839855.db2.gz WAWRLKIWNLBWIJ-VXKWHMMOSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CC[C@H](c3cccnc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171985388 1049839858 /nfs/dbraw/zinc/83/98/58/1049839858.db2.gz WAWRLKIWNLBWIJ-VXKWHMMOSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CC[C@H](c3cccnc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171985388 1049839862 /nfs/dbraw/zinc/83/98/62/1049839862.db2.gz WAWRLKIWNLBWIJ-VXKWHMMOSA-N 2 1 349.522 4.314 20 0 EIADMP COC(C)(C)[C@@H]1CCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987835 1049840947 /nfs/dbraw/zinc/84/09/47/1049840947.db2.gz KJTYTZZLFJIPIK-PMACEKPBSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@@H]1CCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987835 1049840948 /nfs/dbraw/zinc/84/09/48/1049840948.db2.gz KJTYTZZLFJIPIK-PMACEKPBSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@@H]1CCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987835 1049840949 /nfs/dbraw/zinc/84/09/49/1049840949.db2.gz KJTYTZZLFJIPIK-PMACEKPBSA-N 2 1 344.543 4.319 20 0 EIADMP COC(C)(C)[C@@H]1CCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987835 1049840953 /nfs/dbraw/zinc/84/09/53/1049840953.db2.gz KJTYTZZLFJIPIK-PMACEKPBSA-N 2 1 344.543 4.319 20 0 EIADMP C[NH2+]Cc1ccc(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001172072165 1049844025 /nfs/dbraw/zinc/84/40/25/1049844025.db2.gz HTMBRPPMARGUSW-NUNAXRQHSA-N 2 1 349.522 4.404 20 0 EIADMP Cc1ccnc(CC[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172073441 1049844083 /nfs/dbraw/zinc/84/40/83/1049844083.db2.gz QYQZTXKQRYITSZ-WBDAEOGXSA-N 2 1 349.522 4.108 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]CCCc2ccccn2)C3)cc1 ZINC001172074493 1049844335 /nfs/dbraw/zinc/84/43/35/1049844335.db2.gz VZZQPWWXDFVICF-NUNAXRQHSA-N 2 1 349.522 4.190 20 0 EIADMP CS[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000245738960 1049844685 /nfs/dbraw/zinc/84/46/85/1049844685.db2.gz RFUHKMZCLCDMOQ-YMQHIKHWSA-N 2 1 344.568 4.446 20 0 EIADMP CO[C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172079703 1049846532 /nfs/dbraw/zinc/84/65/32/1049846532.db2.gz PNLAWCDBHLJPNS-YXIAPDDASA-N 2 1 342.527 4.119 20 0 EIADMP C[C@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062340 1049850127 /nfs/dbraw/zinc/85/01/27/1049850127.db2.gz NELUWNOIFSTXJW-ZIBCJSCZSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062340 1049850134 /nfs/dbraw/zinc/85/01/34/1049850134.db2.gz NELUWNOIFSTXJW-ZIBCJSCZSA-N 2 1 335.495 4.318 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC(c1ccccc1)c1ccccc1)C2 ZINC001172101361 1049850158 /nfs/dbraw/zinc/85/01/58/1049850158.db2.gz ZHQAVWTVTQJPKF-KOUNCHBCSA-N 2 1 334.507 4.423 20 0 EIADMP Cc1ncccc1CN[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172062005 1049850341 /nfs/dbraw/zinc/85/03/41/1049850341.db2.gz KQSLYPZDXVNEIY-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ncccc1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172062005 1049850346 /nfs/dbraw/zinc/85/03/46/1049850346.db2.gz KQSLYPZDXVNEIY-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2CCSCC2)C3)cc1 ZINC001172066168 1049850853 /nfs/dbraw/zinc/85/08/53/1049850853.db2.gz UMJWVUCPADZOCV-ACDBMABISA-N 2 1 330.541 4.057 20 0 EIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)n1C ZINC001172063935 1049851710 /nfs/dbraw/zinc/85/17/10/1049851710.db2.gz FCVXAMZXCIUHEX-WKCHPHFGSA-N 2 1 337.511 4.009 20 0 EIADMP c1csc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172068445 1049853712 /nfs/dbraw/zinc/85/37/12/1049853712.db2.gz QUDDMHQPDZYSJR-LDLYASANSA-N 2 1 326.509 4.423 20 0 EIADMP C[N@H+](CCc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131985 1049854537 /nfs/dbraw/zinc/85/45/37/1049854537.db2.gz IPYMCVXGYKWBCM-BCDXTJNWSA-N 2 1 340.433 4.195 20 0 EIADMP C[N@@H+](CCc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131985 1049854542 /nfs/dbraw/zinc/85/45/42/1049854542.db2.gz IPYMCVXGYKWBCM-BCDXTJNWSA-N 2 1 340.433 4.195 20 0 EIADMP C[NH+](CCc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172131985 1049854548 /nfs/dbraw/zinc/85/45/48/1049854548.db2.gz IPYMCVXGYKWBCM-BCDXTJNWSA-N 2 1 340.433 4.195 20 0 EIADMP C[NH+](CCc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172131985 1049854550 /nfs/dbraw/zinc/85/45/50/1049854550.db2.gz IPYMCVXGYKWBCM-BCDXTJNWSA-N 2 1 340.433 4.195 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1c(Cl)cccc1C(F)(F)F)C2 ZINC001172104153 1049856557 /nfs/dbraw/zinc/85/65/57/1049856557.db2.gz AHZGMZGDMVKYTC-XYYAHUGASA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1c(Cl)cccc1C(F)(F)F)C2 ZINC001172104153 1049856561 /nfs/dbraw/zinc/85/65/61/1049856561.db2.gz AHZGMZGDMVKYTC-XYYAHUGASA-N 2 1 346.824 4.464 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1Br ZINC001172105057 1049856815 /nfs/dbraw/zinc/85/68/15/1049856815.db2.gz FSDXXQABBADJTD-XQLPTFJDSA-N 2 1 337.305 4.115 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1Br ZINC001172105057 1049856821 /nfs/dbraw/zinc/85/68/21/1049856821.db2.gz FSDXXQABBADJTD-XQLPTFJDSA-N 2 1 337.305 4.115 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1Cl)C2 ZINC001172103757 1049857051 /nfs/dbraw/zinc/85/70/51/1049857051.db2.gz XKQKCSIXMZCRRB-QKDCVEJESA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1Cl)C2 ZINC001172103757 1049857053 /nfs/dbraw/zinc/85/70/53/1049857053.db2.gz XKQKCSIXMZCRRB-QKDCVEJESA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCSCc1ccccc1Cl)C2 ZINC001172108153 1049857124 /nfs/dbraw/zinc/85/71/24/1049857124.db2.gz QHXHCNJNKVCHOD-BJWYYQGGSA-N 2 1 338.948 4.178 20 0 EIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172104258 1049857397 /nfs/dbraw/zinc/85/73/97/1049857397.db2.gz DPOHXJWNGOOLIQ-QKDCVEJESA-N 2 1 327.299 4.407 20 0 EIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172104258 1049857402 /nfs/dbraw/zinc/85/74/02/1049857402.db2.gz DPOHXJWNGOOLIQ-QKDCVEJESA-N 2 1 327.299 4.407 20 0 EIADMP Cc1ccc2c(C[C@H](C)[NH3+])cn([C@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)c2c1 ZINC001172113278 1049858019 /nfs/dbraw/zinc/85/80/19/1049858019.db2.gz BTLIXCVKTDMHAZ-GDAAHCPNSA-N 2 1 325.500 4.027 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cccc(OC3CCCC3)c1)C2 ZINC001172117854 1049858302 /nfs/dbraw/zinc/85/83/02/1049858302.db2.gz NOQCVCUBCZNJOV-LDLYASANSA-N 2 1 328.500 4.113 20 0 EIADMP COCCC[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccccc2SC)CC1 ZINC001172254484 1049871953 /nfs/dbraw/zinc/87/19/53/1049871953.db2.gz NRFOFDXLPUISLP-IBGZPJMESA-N 2 1 348.556 4.046 20 0 EIADMP COCCC[NH+]1CCC([N@H+]2CCC[C@H]2c2ccccc2SC)CC1 ZINC001172254484 1049871954 /nfs/dbraw/zinc/87/19/54/1049871954.db2.gz NRFOFDXLPUISLP-IBGZPJMESA-N 2 1 348.556 4.046 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171030500 1049875437 /nfs/dbraw/zinc/87/54/37/1049875437.db2.gz MEGFNTRBVUJQJA-BZSNNMDCSA-N 2 1 332.919 4.179 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172315281 1049875909 /nfs/dbraw/zinc/87/59/09/1049875909.db2.gz BLJRQWGABSLJAU-WQIFRTTPSA-N 2 1 344.543 4.365 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172317326 1049876304 /nfs/dbraw/zinc/87/63/04/1049876304.db2.gz BLJRQWGABSLJAU-OOOLTRJPSA-N 2 1 344.543 4.365 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001172322107 1049878064 /nfs/dbraw/zinc/87/80/64/1049878064.db2.gz RUIJTUXHWIEHBU-IRFCIJBXSA-N 2 1 332.532 4.082 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001172339789 1049889002 /nfs/dbraw/zinc/88/90/02/1049889002.db2.gz QQODUWZMEHHNIH-MOPGFXCFSA-N 2 1 348.531 4.161 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC([NH3+])(c2cccc(Cl)c2)CC1 ZINC001172340937 1049889469 /nfs/dbraw/zinc/88/94/69/1049889469.db2.gz YAYCFRPGNUFRJJ-JKSUJKDBSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001172344326 1049890398 /nfs/dbraw/zinc/89/03/98/1049890398.db2.gz AOXQDIUGAREQQK-MPJJRAAHSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001172344326 1049890401 /nfs/dbraw/zinc/89/04/01/1049890401.db2.gz AOXQDIUGAREQQK-MPJJRAAHSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001172344326 1049890402 /nfs/dbraw/zinc/89/04/02/1049890402.db2.gz AOXQDIUGAREQQK-MPJJRAAHSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001172355735 1049894671 /nfs/dbraw/zinc/89/46/71/1049894671.db2.gz VVIGZIMKPNJNIS-DYXWJJEUSA-N 2 1 332.532 4.034 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001172355735 1049894672 /nfs/dbraw/zinc/89/46/72/1049894672.db2.gz VVIGZIMKPNJNIS-DYXWJJEUSA-N 2 1 332.532 4.034 20 0 EIADMP CC(C)OCC[C@@H](C)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172444485 1049913207 /nfs/dbraw/zinc/91/32/07/1049913207.db2.gz LEXHEBVHWJASHY-NSISKUIASA-N 2 1 336.495 4.101 20 0 EIADMP CC(C)OCC[C@H](C)[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172453243 1049915484 /nfs/dbraw/zinc/91/54/84/1049915484.db2.gz FRPUHDBNGXOMTI-UNMCSNQZSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172453243 1049915493 /nfs/dbraw/zinc/91/54/93/1049915493.db2.gz FRPUHDBNGXOMTI-UNMCSNQZSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172453243 1049915499 /nfs/dbraw/zinc/91/54/99/1049915499.db2.gz FRPUHDBNGXOMTI-UNMCSNQZSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@H](C)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001172459671 1049917618 /nfs/dbraw/zinc/91/76/18/1049917618.db2.gz KPSHRPILUNLAIX-KSEOMHKRSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001172459671 1049917620 /nfs/dbraw/zinc/91/76/20/1049917620.db2.gz KPSHRPILUNLAIX-KSEOMHKRSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001172459671 1049917622 /nfs/dbraw/zinc/91/76/22/1049917622.db2.gz KPSHRPILUNLAIX-KSEOMHKRSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)COCC[C@H](C)[NH+]1CCC([NH3+])(c2ccccc2Cl)CC1 ZINC001172467589 1049919859 /nfs/dbraw/zinc/91/98/59/1049919859.db2.gz MEMKWDZOXROLLM-INIZCTEOSA-N 2 1 338.923 4.041 20 0 EIADMP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1CCC[N@@H+](C)CC1 ZINC001172576994 1049931460 /nfs/dbraw/zinc/93/14/60/1049931460.db2.gz QLAKXGGTKDLWKQ-JSGCOSHPSA-N 2 1 330.850 4.013 20 0 EIADMP Clc1ccc2c(c1)C[C@@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001172716987 1049963575 /nfs/dbraw/zinc/96/35/75/1049963575.db2.gz CQOYCAKNRKWRDN-PMACEKPBSA-N 2 1 332.919 4.148 20 0 EIADMP CC(C)N1CCOC[C@@]2(CCC[N@H+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727174 1049967380 /nfs/dbraw/zinc/96/73/80/1049967380.db2.gz UWMJYHYTYAGFGO-QFIPXVFZSA-N 2 1 348.575 4.312 20 0 EIADMP CC(C)[N@@H+]1CCOC[C@@]2(CCC[NH+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727174 1049967384 /nfs/dbraw/zinc/96/73/84/1049967384.db2.gz UWMJYHYTYAGFGO-QFIPXVFZSA-N 2 1 348.575 4.312 20 0 EIADMP CC(C)[N@H+]1CCOC[C@@]2(CCC[NH+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727174 1049967386 /nfs/dbraw/zinc/96/73/86/1049967386.db2.gz UWMJYHYTYAGFGO-QFIPXVFZSA-N 2 1 348.575 4.312 20 0 EIADMP CC(C)[NH+]1CCOC[C@@]2(CCC[N@@H+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727174 1049967389 /nfs/dbraw/zinc/96/73/89/1049967389.db2.gz UWMJYHYTYAGFGO-QFIPXVFZSA-N 2 1 348.575 4.312 20 0 EIADMP CC(C)[NH+]1CCOC[C@@]2(CCC[N@H+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727174 1049967392 /nfs/dbraw/zinc/96/73/92/1049967392.db2.gz UWMJYHYTYAGFGO-QFIPXVFZSA-N 2 1 348.575 4.312 20 0 EIADMP Clc1ccc2c(c1)C[C@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001172712288 1049972265 /nfs/dbraw/zinc/97/22/65/1049972265.db2.gz ATJHLFXRNBUUDC-HXUWFJFHSA-N 2 1 344.930 4.148 20 0 EIADMP Clc1ccc2c(c1)C[C@H]([NH+]1CCC3(CCC[N@H+]3CC3CC3)CC1)C2 ZINC001172712288 1049972270 /nfs/dbraw/zinc/97/22/70/1049972270.db2.gz ATJHLFXRNBUUDC-HXUWFJFHSA-N 2 1 344.930 4.148 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)[C@H](C)c2nc3ccccc3s2)C1 ZINC000246968541 1050007422 /nfs/dbraw/zinc/00/74/22/1050007422.db2.gz JGIVLSNKGKSIEI-YESZJQIVSA-N 2 1 345.556 4.498 20 0 EIADMP Cc1cccc2[nH]cc(CC[NH2+][C@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)c21 ZINC000519719059 1050020701 /nfs/dbraw/zinc/02/07/01/1050020701.db2.gz XFBPGBSBBOODBB-UNMCSNQZSA-N 2 1 347.506 4.444 20 0 EIADMP Cc1cccc2[nH]cc(CC[NH2+][C@H]3CC[N@H+](C)[C@H](c4ccccc4)C3)c21 ZINC000519719059 1050020711 /nfs/dbraw/zinc/02/07/11/1050020711.db2.gz XFBPGBSBBOODBB-UNMCSNQZSA-N 2 1 347.506 4.444 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1Cl ZINC000248862592 1050082041 /nfs/dbraw/zinc/08/20/41/1050082041.db2.gz SFSDQAODMFBFJI-SJORKVTESA-N 2 1 336.907 4.235 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1Cl ZINC000248862592 1050082045 /nfs/dbraw/zinc/08/20/45/1050082045.db2.gz SFSDQAODMFBFJI-SJORKVTESA-N 2 1 336.907 4.235 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]C[C@H](C)c2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000249137880 1050093735 /nfs/dbraw/zinc/09/37/35/1050093735.db2.gz XENCLJLFTDPAAX-VBQJREDUSA-N 2 1 328.422 4.129 20 0 EIADMP CCC[N@@H+]1C[C@@H]2C[NH+](C3CCC(Cc4ccccc4)CC3)C[C@@H]2C1 ZINC001172825532 1050165736 /nfs/dbraw/zinc/16/57/36/1050165736.db2.gz WXAKQMCGQOLUEA-KJMNDRGOSA-N 2 1 326.528 4.062 20 0 EIADMP CCC[NH+]1C[C@@H]2C[N@H+](C3CCC(Cc4ccccc4)CC3)C[C@@H]2C1 ZINC001172825532 1050165744 /nfs/dbraw/zinc/16/57/44/1050165744.db2.gz WXAKQMCGQOLUEA-KJMNDRGOSA-N 2 1 326.528 4.062 20 0 EIADMP CCC[NH+]1C[C@@H]2C[N@@H+](C3CCC(Cc4ccccc4)CC3)C[C@@H]2C1 ZINC001172825532 1050165750 /nfs/dbraw/zinc/16/57/50/1050165750.db2.gz WXAKQMCGQOLUEA-KJMNDRGOSA-N 2 1 326.528 4.062 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)C[C@H]1C)CC2 ZINC001172837771 1050172848 /nfs/dbraw/zinc/17/28/48/1050172848.db2.gz MWUAHBKSJWLZRK-FOVJLYNBSA-N 2 1 348.534 4.353 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)C[C@H]1C)CC2 ZINC001172837771 1050172850 /nfs/dbraw/zinc/17/28/50/1050172850.db2.gz MWUAHBKSJWLZRK-FOVJLYNBSA-N 2 1 348.534 4.353 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cccnc1Cl ZINC001177256656 1050175524 /nfs/dbraw/zinc/17/55/24/1050175524.db2.gz LCNCAWMUYCEION-INIZCTEOSA-N 2 1 343.902 4.399 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cccnc1Cl ZINC001177256656 1050175531 /nfs/dbraw/zinc/17/55/31/1050175531.db2.gz LCNCAWMUYCEION-INIZCTEOSA-N 2 1 343.902 4.399 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001177268449 1050182827 /nfs/dbraw/zinc/18/28/27/1050182827.db2.gz ZBYIBISSYQCFGE-WKDRNLAYSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001177268449 1050182831 /nfs/dbraw/zinc/18/28/31/1050182831.db2.gz ZBYIBISSYQCFGE-WKDRNLAYSA-N 2 1 344.543 4.224 20 0 EIADMP COc1cc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)ccc1C ZINC001177582287 1050258015 /nfs/dbraw/zinc/25/80/15/1050258015.db2.gz WMWIJNVKZLJSHU-UHFFFAOYSA-N 2 1 330.516 4.138 20 0 EIADMP CCn1c2ccccc2c2cc(C[N@@H+]3CC[C@H]([NH3+])[C@@H](F)CC3)ccc21 ZINC001206185067 1050262782 /nfs/dbraw/zinc/26/27/82/1050262782.db2.gz LAUDNWNDVZYORO-OALUTQOASA-N 2 1 339.458 4.076 20 0 EIADMP CCn1c2ccccc2c2cc(C[N@H+]3CC[C@H]([NH3+])[C@@H](F)CC3)ccc21 ZINC001206185067 1050262796 /nfs/dbraw/zinc/26/27/96/1050262796.db2.gz LAUDNWNDVZYORO-OALUTQOASA-N 2 1 339.458 4.076 20 0 EIADMP CCCOC1CCC([N@@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173096200 1050288088 /nfs/dbraw/zinc/28/80/88/1050288088.db2.gz WTPRCLRWBPFEMX-GOHCJOFJSA-N 2 1 336.564 4.486 20 0 EIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC001177741692 1050292400 /nfs/dbraw/zinc/29/24/00/1050292400.db2.gz BUGDTWNNTRZNJW-SESVDKBCSA-N 2 1 329.532 4.352 20 0 EIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC001177741692 1050292409 /nfs/dbraw/zinc/29/24/09/1050292409.db2.gz BUGDTWNNTRZNJW-SESVDKBCSA-N 2 1 329.532 4.352 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCCc3ccc(OC)cc3C2)CC1 ZINC001173114201 1050310019 /nfs/dbraw/zinc/31/00/19/1050310019.db2.gz ZXASYGVVNBENBS-UHFFFAOYSA-N 2 1 330.516 4.096 20 0 EIADMP CC(C)[NH+](CCC[NH2+]Cc1ccccc1CC(F)(F)F)C(C)C ZINC001177948345 1050345805 /nfs/dbraw/zinc/34/58/05/1050345805.db2.gz HSICAHWAVFALEB-UHFFFAOYSA-N 2 1 330.438 4.390 20 0 EIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Cl)c(Br)c2)CC1 ZINC001206317556 1050383838 /nfs/dbraw/zinc/38/38/38/1050383838.db2.gz HGAJZGHKHAZGKE-HNNXBMFYSA-N 2 1 345.712 4.053 20 0 EIADMP CC[N@@H+]1C[C@@H]2C[NH+]([C@@H](C)CC(c3ccccc3)c3ccccc3)C[C@@H]2C1 ZINC001173213747 1050373260 /nfs/dbraw/zinc/37/32/60/1050373260.db2.gz HONRGJXYNZYDOQ-AJSBUHFISA-N 2 1 348.534 4.481 20 0 EIADMP CC[NH+]1C[C@@H]2C[N@H+]([C@@H](C)CC(c3ccccc3)c3ccccc3)C[C@@H]2C1 ZINC001173213747 1050373271 /nfs/dbraw/zinc/37/32/71/1050373271.db2.gz HONRGJXYNZYDOQ-AJSBUHFISA-N 2 1 348.534 4.481 20 0 EIADMP CC[NH+]1C[C@@H]2C[N@@H+]([C@@H](C)CC(c3ccccc3)c3ccccc3)C[C@@H]2C1 ZINC001173213747 1050373282 /nfs/dbraw/zinc/37/32/82/1050373282.db2.gz HONRGJXYNZYDOQ-AJSBUHFISA-N 2 1 348.534 4.481 20 0 EIADMP CC[C@H]1CC[C@@H]([NH2+][C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2[NH3+])C1 ZINC001173270945 1050391080 /nfs/dbraw/zinc/39/10/80/1050391080.db2.gz DKFCHGOVZLZWIE-SBEYASLNSA-N 2 1 332.491 4.142 20 0 EIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2OC)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272789 1050392068 /nfs/dbraw/zinc/39/20/68/1050392068.db2.gz WWCPNVZHRMSPLC-VBSBHUPXSA-N 2 1 330.516 4.346 20 0 EIADMP CC[C@@H]1CC[C@H]([NH+]2CCC3(CCC[N@H+]3Cc3c(C)noc3C)CC2)C1 ZINC001173284381 1050410797 /nfs/dbraw/zinc/41/07/97/1050410797.db2.gz ZNLMFJFMJWUCDC-MOPGFXCFSA-N 2 1 345.531 4.301 20 0 EIADMP CN(C)C1=[NH+]OC2(C1)CC[NH+]([C@@H]1CCCC3(CCCCC3)C1)CC2 ZINC001173346560 1050436183 /nfs/dbraw/zinc/43/61/83/1050436183.db2.gz ZOJLUJSOIRULGZ-QGZVFWFLSA-N 2 1 333.520 4.010 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+]Cc2ccc(-c3cccs3)cc2)CCCO1 ZINC001178473531 1050478340 /nfs/dbraw/zinc/47/83/40/1050478340.db2.gz SKMRVSJCRVTKSX-QGZVFWFLSA-N 2 1 344.524 4.006 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H]2[C@H](C1)CCCN2C ZINC001173551667 1050487816 /nfs/dbraw/zinc/48/78/16/1050487816.db2.gz UQGOASXYAXMGKB-XUWXXGDYSA-N 2 1 341.326 4.341 20 0 EIADMP C[C@@H]1CCC[C@@H](C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)[C@H]1C ZINC001178595460 1050504559 /nfs/dbraw/zinc/50/45/59/1050504559.db2.gz PNOOEISKIODRQO-HBFSDRIKSA-N 2 1 346.534 4.495 20 0 EIADMP CC[C@@H]1CCC[C@@H]1C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001178748942 1050543181 /nfs/dbraw/zinc/54/31/81/1050543181.db2.gz XLBDKKXEAVXVIK-RTBURBONSA-N 2 1 332.507 4.249 20 0 EIADMP CC(C)(C)[C@H]1CCC[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001178932288 1050583348 /nfs/dbraw/zinc/58/33/48/1050583348.db2.gz YHIUAQCCBZWWJF-LEWJYISDSA-N 2 1 328.544 4.498 20 0 EIADMP C[C@@H](CCc1ccccc1)C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001179015469 1050611021 /nfs/dbraw/zinc/61/10/21/1050611021.db2.gz BFXNBSAUVWDFFI-PMOQBDJRSA-N 2 1 336.523 4.190 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@H]3CC34CCCCC4)CC2)cc1 ZINC001179259761 1050662405 /nfs/dbraw/zinc/66/24/05/1050662405.db2.gz XWWAYMNCBAAQTK-FQEVSTJZSA-N 2 1 330.491 4.145 20 0 EIADMP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000093945083 1050725886 /nfs/dbraw/zinc/72/58/86/1050725886.db2.gz WPOSIRPPBIMXRY-YSGRDPCXSA-N 2 1 347.547 4.308 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)c1 ZINC001179816792 1050786709 /nfs/dbraw/zinc/78/67/09/1050786709.db2.gz NTXGFHPXNHPHEP-CEWLAPEOSA-N 2 1 330.516 4.076 20 0 EIADMP FC(F)(F)CCC[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001179864168 1050809752 /nfs/dbraw/zinc/80/97/52/1050809752.db2.gz UNNOHOGNSPZZFI-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001179864168 1050809757 /nfs/dbraw/zinc/80/97/57/1050809757.db2.gz UNNOHOGNSPZZFI-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001179864168 1050809763 /nfs/dbraw/zinc/80/97/63/1050809763.db2.gz UNNOHOGNSPZZFI-GOSISDBHSA-N 2 1 340.433 4.317 20 0 EIADMP C[C@]1(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CCCS1 ZINC001179918984 1050834006 /nfs/dbraw/zinc/83/40/06/1050834006.db2.gz GEQHTJJWHJCDFZ-QHAWAJNXSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@]1(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)CCCS1 ZINC001179918984 1050834009 /nfs/dbraw/zinc/83/40/09/1050834009.db2.gz GEQHTJJWHJCDFZ-QHAWAJNXSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@]1(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)CCCS1 ZINC001179918984 1050834011 /nfs/dbraw/zinc/83/40/11/1050834011.db2.gz GEQHTJJWHJCDFZ-QHAWAJNXSA-N 2 1 344.568 4.259 20 0 EIADMP C[C@@H]1Cc2cc(C[N@@H+]3CCC[C@@H](C[NH+]4CCCC[C@@H]4C)C3)ccc2O1 ZINC001180030181 1050856856 /nfs/dbraw/zinc/85/68/56/1050856856.db2.gz JPMBHSUROZMPTK-NLWGTHIKSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[N@H+]3CCC[C@@H](C[NH+]4CCCC[C@@H]4C)C3)ccc2O1 ZINC001180030181 1050856860 /nfs/dbraw/zinc/85/68/60/1050856860.db2.gz JPMBHSUROZMPTK-NLWGTHIKSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[NH+]3CCC[C@@H](C[N@@H+]4CCCC[C@@H]4C)C3)ccc2O1 ZINC001180030181 1050856864 /nfs/dbraw/zinc/85/68/64/1050856864.db2.gz JPMBHSUROZMPTK-NLWGTHIKSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1Cc2cc(C[NH+]3CCC[C@@H](C[N@H+]4CCCC[C@@H]4C)C3)ccc2O1 ZINC001180030181 1050856867 /nfs/dbraw/zinc/85/68/67/1050856867.db2.gz JPMBHSUROZMPTK-NLWGTHIKSA-N 2 1 342.527 4.096 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CCc3ccccc32)C1 ZINC001180030504 1050859447 /nfs/dbraw/zinc/85/94/47/1050859447.db2.gz NRWHHXKGZPBBNS-SBHAEUEKSA-N 2 1 326.528 4.303 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@@H]2CCc3ccccc32)C1 ZINC001180030504 1050859451 /nfs/dbraw/zinc/85/94/51/1050859451.db2.gz NRWHHXKGZPBBNS-SBHAEUEKSA-N 2 1 326.528 4.303 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@@H]2CCc3ccccc32)C1 ZINC001180030504 1050859455 /nfs/dbraw/zinc/85/94/55/1050859455.db2.gz NRWHHXKGZPBBNS-SBHAEUEKSA-N 2 1 326.528 4.303 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccccc2CC(F)(F)F)CC1 ZINC001180161757 1050906755 /nfs/dbraw/zinc/90/67/55/1050906755.db2.gz PAZIZGIMVNASLG-UHFFFAOYSA-N 2 1 328.422 4.098 20 0 EIADMP Cc1cc(C)cc(CC[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001180350254 1050965127 /nfs/dbraw/zinc/96/51/27/1050965127.db2.gz WYNODVIKEGDCLT-OFNKIYASSA-N 2 1 336.523 4.346 20 0 EIADMP CC[NH+]1CCC(C[N@@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)CC1 ZINC001180378850 1050974163 /nfs/dbraw/zinc/97/41/63/1050974163.db2.gz JXETTWVQPQVUOC-UHFFFAOYSA-N 2 1 337.511 4.297 20 0 EIADMP C[C@@H]1Cc2[nH+]cn(Cc3ccc(C[NH+]4CCCCC4)cc3)c2C[C@H]1C ZINC001189407652 1050983360 /nfs/dbraw/zinc/98/33/60/1050983360.db2.gz GSCOJZRYHVDWNN-QZTJIDSGSA-N 2 1 337.511 4.288 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCO[C@H](C)C3)c2)cc1 ZINC000153500791 1051059985 /nfs/dbraw/zinc/05/99/85/1051059985.db2.gz XJIZVPYKWWMANL-MOPGFXCFSA-N 2 1 338.495 4.067 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCO[C@H](C)C3)c2)cc1 ZINC000153500791 1051059995 /nfs/dbraw/zinc/05/99/95/1051059995.db2.gz XJIZVPYKWWMANL-MOPGFXCFSA-N 2 1 338.495 4.067 20 0 EIADMP Cc1cc(Nc2cccc3c2C[N@@H+](C)C[C@H]3c2ccccc2)cc[nH+]1 ZINC001174656996 1051129387 /nfs/dbraw/zinc/12/93/87/1051129387.db2.gz YKAMZAMXGIXLNO-FQEVSTJZSA-N 2 1 329.447 4.133 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775378987 1051171117 /nfs/dbraw/zinc/17/11/17/1051171117.db2.gz OTMRNVPXJFQJPN-GUYCJALGSA-N 2 1 340.483 4.310 20 0 EIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1)c1cc(F)cc(F)c1 ZINC001181276059 1051196350 /nfs/dbraw/zinc/19/63/50/1051196350.db2.gz IKTYXRWDARYOQY-FOIQADDNSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@H](CCOCc1ccccc1)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001181276818 1051196631 /nfs/dbraw/zinc/19/66/31/1051196631.db2.gz RQKBHDJMIWVGDA-KNQAVFIVSA-N 2 1 344.543 4.369 20 0 EIADMP COC1(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)CCCCCC1 ZINC001181254612 1051200032 /nfs/dbraw/zinc/20/00/32/1051200032.db2.gz JFMGMIFIGIDTQY-UHFFFAOYSA-N 2 1 345.531 4.138 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)c(OC)c2)c1 ZINC000153596882 1051201781 /nfs/dbraw/zinc/20/17/81/1051201781.db2.gz YNECNRLQPPUNHT-HNNXBMFYSA-N 2 1 330.447 4.137 20 0 EIADMP C[C@@H]([NH2+]C1(C[NH2+][C@H](C)C2CCOCC2)CCCC1)c1ccccc1 ZINC000153859731 1051239481 /nfs/dbraw/zinc/23/94/81/1051239481.db2.gz UUVXUARTHPRJJI-QZTJIDSGSA-N 2 1 330.516 4.055 20 0 EIADMP CCC(CC)(C[NH2+][C@H](C)C1CCOCC1)[NH2+][C@@H](C)c1ccccc1 ZINC000153896158 1051244393 /nfs/dbraw/zinc/24/43/93/1051244393.db2.gz XXUHAYGVUQGQQE-MSOLQXFVSA-N 2 1 332.532 4.301 20 0 EIADMP COc1ccccc1CCC[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC001190652080 1051245079 /nfs/dbraw/zinc/24/50/79/1051245079.db2.gz VPDOHUCAEBVNTD-HXUWFJFHSA-N 2 1 344.543 4.072 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(C)cc1OC ZINC001181487003 1051246508 /nfs/dbraw/zinc/24/65/08/1051246508.db2.gz OMOCMJSEVBDGMV-UHFFFAOYSA-N 2 1 326.484 4.087 20 0 EIADMP CCCC[N@@H+](CCc1cccc(C)n1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001174983227 1051304542 /nfs/dbraw/zinc/30/45/42/1051304542.db2.gz FWXUTXMFEDFGMB-UHFFFAOYSA-N 2 1 331.548 4.344 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(OC)c(Cl)c1 ZINC001175062403 1051314599 /nfs/dbraw/zinc/31/45/99/1051314599.db2.gz PBOBRFBGYJSDFM-UHFFFAOYSA-N 2 1 346.902 4.432 20 0 EIADMP CO[C@H](C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)CC(C)C ZINC001182020671 1051383317 /nfs/dbraw/zinc/38/33/17/1051383317.db2.gz MCDUZBXUXMKYDG-KBRMVUAJSA-N 2 1 344.543 4.223 20 0 EIADMP CCCOc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310872748 1051442695 /nfs/dbraw/zinc/44/26/95/1051442695.db2.gz GDZBVCWGXQJSPF-NRFANRHFSA-N 2 1 338.495 4.087 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCOC2CCCCC2)CC1 ZINC001191551561 1051485802 /nfs/dbraw/zinc/48/58/02/1051485802.db2.gz RADWJIYNAWKWTJ-LJQANCHMSA-N 2 1 336.564 4.312 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@H]2CCCC(C)(C)O2)CC1 ZINC001191549313 1051486622 /nfs/dbraw/zinc/48/66/22/1051486622.db2.gz AVAYVDYVVYEWAD-AZUAARDMSA-N 2 1 336.564 4.311 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)c2ccccc21 ZINC000774184603 1051507421 /nfs/dbraw/zinc/50/74/21/1051507421.db2.gz DEDDZYXLPOGKMX-BVYCBKJFSA-N 2 1 342.527 4.104 20 0 EIADMP Cc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(OCCC(C)C)c1 ZINC000774225269 1051518276 /nfs/dbraw/zinc/51/82/76/1051518276.db2.gz PIPMXTAQOIKNFI-IHWFROFDSA-N 2 1 330.516 4.135 20 0 EIADMP Cc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(OCCC(C)C)c1 ZINC000774225269 1051518293 /nfs/dbraw/zinc/51/82/93/1051518293.db2.gz PIPMXTAQOIKNFI-IHWFROFDSA-N 2 1 330.516 4.135 20 0 EIADMP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC1 ZINC001205571012 1051548630 /nfs/dbraw/zinc/54/86/30/1051548630.db2.gz RRFIKNOGXFYMBT-CQSZACIVSA-N 2 1 339.669 4.300 20 0 EIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC1 ZINC001205571012 1051548640 /nfs/dbraw/zinc/54/86/40/1051548640.db2.gz RRFIKNOGXFYMBT-CQSZACIVSA-N 2 1 339.669 4.300 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@]1(C)Cc1ccc(Cl)c(F)c1 ZINC001175419008 1051582476 /nfs/dbraw/zinc/58/24/76/1051582476.db2.gz REMZFHYFIGQIBX-IBGZPJMESA-N 2 1 349.881 4.471 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@]1(C)Cc1ccc(Cl)c(F)c1 ZINC001175419008 1051582483 /nfs/dbraw/zinc/58/24/83/1051582483.db2.gz REMZFHYFIGQIBX-IBGZPJMESA-N 2 1 349.881 4.471 20 0 EIADMP CCc1nc(CC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cs1 ZINC000157100872 1051595903 /nfs/dbraw/zinc/59/59/03/1051595903.db2.gz BOGBBOKYEPJILH-AWEZNQCLSA-N 2 1 340.496 4.093 20 0 EIADMP C[N@H+]1C[C@@H](C[NH2+][C@H]2CC[C@](C)(c3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC001182542188 1051635916 /nfs/dbraw/zinc/63/59/16/1051635916.db2.gz CKLFNZKYPJBNHJ-KAMZKSLDSA-N 2 1 348.534 4.432 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cnc2ccsc2c1 ZINC000157942299 1051687762 /nfs/dbraw/zinc/68/77/62/1051687762.db2.gz VBHCNGHWZKVUEC-HOTGVXAUSA-N 2 1 331.529 4.459 20 0 EIADMP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@@H]3CCC[N@@H+](C)C3)cs2)cs1 ZINC000158172722 1051721692 /nfs/dbraw/zinc/72/16/92/1051721692.db2.gz QRAPHEGZORWBNI-JSGCOSHPSA-N 2 1 335.542 4.172 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158196335 1051724008 /nfs/dbraw/zinc/72/40/08/1051724008.db2.gz GRRPLLLPXRNGFU-YJBOKZPZSA-N 2 1 343.540 4.035 20 0 EIADMP CC1([NH+]2CCC2)CC[NH+](CCCOc2ccc3ccccc3c2)CC1 ZINC001175669887 1051724152 /nfs/dbraw/zinc/72/41/52/1051724152.db2.gz VKVLRTGUFGIDCI-UHFFFAOYSA-N 2 1 338.495 4.169 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000158196335 1051724016 /nfs/dbraw/zinc/72/40/16/1051724016.db2.gz GRRPLLLPXRNGFU-YJBOKZPZSA-N 2 1 343.540 4.035 20 0 EIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1cc(Cl)nc(Cl)c1 ZINC001175690521 1051731586 /nfs/dbraw/zinc/73/15/86/1051731586.db2.gz ZBQZNSIWQQGOPV-UHFFFAOYSA-N 2 1 330.303 4.086 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cncc(Cl)c2)CC1)CC(C)C ZINC001192489315 1051756878 /nfs/dbraw/zinc/75/68/78/1051756878.db2.gz DFKBTNLWJPOJCL-UHFFFAOYSA-N 2 1 337.939 4.315 20 0 EIADMP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@@H+]1Cc1c(Cl)ccc2cccnc21 ZINC001183065556 1051781599 /nfs/dbraw/zinc/78/15/99/1051781599.db2.gz MBDFCQKDQJJFBW-BEFAXECRSA-N 2 1 345.918 4.440 20 0 EIADMP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1Cc1c(Cl)ccc2cccnc21 ZINC001183065556 1051781614 /nfs/dbraw/zinc/78/16/14/1051781614.db2.gz MBDFCQKDQJJFBW-BEFAXECRSA-N 2 1 345.918 4.440 20 0 EIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+][C@H](CCc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC001184389486 1052002568 /nfs/dbraw/zinc/00/25/68/1052002568.db2.gz XKFWUXZHWNYIKD-KIHHCIJBSA-N 2 1 348.534 4.160 20 0 EIADMP CCC[C@]1(COC)CCC[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001193872399 1052022377 /nfs/dbraw/zinc/02/23/77/1052022377.db2.gz NEFJWJSOJMWSDT-JOCHJYFZSA-N 2 1 344.543 4.454 20 0 EIADMP COc1ccc2cc([C@@H](C)[NH2+]CCCCn3cc[nH+]c3C)ccc2c1 ZINC000164701725 1052037708 /nfs/dbraw/zinc/03/77/08/1052037708.db2.gz CFTSDEZQNFPNPE-MRXNPFEDSA-N 2 1 337.467 4.484 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000164969969 1052047417 /nfs/dbraw/zinc/04/74/17/1052047417.db2.gz XTWIDUMWLIBJAB-FTRWYGJKSA-N 2 1 344.524 4.490 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000164969969 1052047434 /nfs/dbraw/zinc/04/74/34/1052047434.db2.gz XTWIDUMWLIBJAB-FTRWYGJKSA-N 2 1 344.524 4.490 20 0 EIADMP Cn1cc(C[NH2+]CCC[N@H+](C)C2CCCCC2)c(C2CCCCC2)n1 ZINC001177066321 1052224573 /nfs/dbraw/zinc/22/45/73/1052224573.db2.gz SFRWNJZVAISWIA-UHFFFAOYSA-N 2 1 346.563 4.212 20 0 EIADMP Cn1cc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)c(C2CCCCC2)n1 ZINC001177066321 1052224579 /nfs/dbraw/zinc/22/45/79/1052224579.db2.gz SFRWNJZVAISWIA-UHFFFAOYSA-N 2 1 346.563 4.212 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000339068805 1052552442 /nfs/dbraw/zinc/55/24/42/1052552442.db2.gz QJXPYHUQLBFOPO-SFHLNBCPSA-N 2 1 330.516 4.008 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000174514877 1052569043 /nfs/dbraw/zinc/56/90/43/1052569043.db2.gz NXPRJIXUDMOWLL-SJLPKXTDSA-N 2 1 326.484 4.199 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000174514877 1052569050 /nfs/dbraw/zinc/56/90/50/1052569050.db2.gz NXPRJIXUDMOWLL-SJLPKXTDSA-N 2 1 326.484 4.199 20 0 EIADMP Cc1ccc(C[C@@H](N[C@@H]2CC[N@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420811 1052652617 /nfs/dbraw/zinc/65/26/17/1052652617.db2.gz PDUDXHPIRNJCFA-TZIWHRDSSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@@H]([NH2+][C@@H]2CCN(C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420811 1052652620 /nfs/dbraw/zinc/65/26/20/1052652620.db2.gz PDUDXHPIRNJCFA-TZIWHRDSSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@@H]([NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420811 1052652621 /nfs/dbraw/zinc/65/26/21/1052652621.db2.gz PDUDXHPIRNJCFA-TZIWHRDSSA-N 2 1 337.511 4.136 20 0 EIADMP Cc1ccc(C[C@@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)c2ccccn2)cc1 ZINC000623420811 1052652624 /nfs/dbraw/zinc/65/26/24/1052652624.db2.gz PDUDXHPIRNJCFA-TZIWHRDSSA-N 2 1 337.511 4.136 20 0 EIADMP COc1cc([C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)ccc1OCC(C)C ZINC000177869439 1052693471 /nfs/dbraw/zinc/69/34/71/1052693471.db2.gz OSLMKRHYLCZAMG-KRWDZBQOSA-N 2 1 348.531 4.253 20 0 EIADMP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000623657294 1052697948 /nfs/dbraw/zinc/69/79/48/1052697948.db2.gz MWEOBFASKINHLG-AWEZNQCLSA-N 2 1 349.931 4.285 20 0 EIADMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000623657294 1052697951 /nfs/dbraw/zinc/69/79/51/1052697951.db2.gz MWEOBFASKINHLG-AWEZNQCLSA-N 2 1 349.931 4.285 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623855150 1052826639 /nfs/dbraw/zinc/82/66/39/1052826639.db2.gz RFSWLMUTRJQTCO-KRWDZBQOSA-N 2 1 329.513 4.152 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000623999525 1052850130 /nfs/dbraw/zinc/85/01/30/1052850130.db2.gz SXFVBWIXIZANPC-OLZOCXBDSA-N 2 1 332.385 4.227 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000624120224 1052867787 /nfs/dbraw/zinc/86/77/87/1052867787.db2.gz UPLSCUDDTUKNME-WMLDXEAASA-N 2 1 326.431 4.061 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@@H]3CCC[N@@H+](C(C)C)C3)oc21 ZINC000181700185 1052893503 /nfs/dbraw/zinc/89/35/03/1052893503.db2.gz QJNCDQYCENMTDK-HOTGVXAUSA-N 2 1 330.472 4.212 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@@H]3CCC[N@H+](C(C)C)C3)oc21 ZINC000181700185 1052893506 /nfs/dbraw/zinc/89/35/06/1052893506.db2.gz QJNCDQYCENMTDK-HOTGVXAUSA-N 2 1 330.472 4.212 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381391042 1053073493 /nfs/dbraw/zinc/07/34/93/1053073493.db2.gz URPXJTRJDKKNLJ-ZJSJBZJDSA-N 2 1 338.495 4.403 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381391042 1053073501 /nfs/dbraw/zinc/07/35/01/1053073501.db2.gz URPXJTRJDKKNLJ-ZJSJBZJDSA-N 2 1 338.495 4.403 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381391041 1053073998 /nfs/dbraw/zinc/07/39/98/1053073998.db2.gz URPXJTRJDKKNLJ-REHHDOPLSA-N 2 1 338.495 4.403 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381391041 1053074012 /nfs/dbraw/zinc/07/40/12/1053074012.db2.gz URPXJTRJDKKNLJ-REHHDOPLSA-N 2 1 338.495 4.403 20 0 EIADMP CO[C@@H](C)C[N@H+]1CCCCC[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001194940900 1053189594 /nfs/dbraw/zinc/18/95/94/1053189594.db2.gz CZCUHPVLRNEPBN-UGKGYDQZSA-N 2 1 344.543 4.178 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000383365053 1053330265 /nfs/dbraw/zinc/33/02/65/1053330265.db2.gz UXUUVOAWPQDXLT-NQIIRXRSSA-N 2 1 326.459 4.389 20 0 EIADMP CSc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000383677406 1053374034 /nfs/dbraw/zinc/37/40/34/1053374034.db2.gz NSCKIMJFFTYGOC-PXNSSMCTSA-N 2 1 340.536 4.409 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cnn(-c2ccccc2)c1 ZINC000764965143 1053402331 /nfs/dbraw/zinc/40/23/31/1053402331.db2.gz URPKBSGTXBHZTN-RTBURBONSA-N 2 1 340.515 4.178 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12)c1ccc(SC(F)F)cc1 ZINC000764967861 1053402520 /nfs/dbraw/zinc/40/25/20/1053402520.db2.gz XXJRDNBPDPGNII-VBNZEHGJSA-N 2 1 326.456 4.279 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(SC(F)F)cc1 ZINC000764967861 1053402529 /nfs/dbraw/zinc/40/25/29/1053402529.db2.gz XXJRDNBPDPGNII-VBNZEHGJSA-N 2 1 326.456 4.279 20 0 EIADMP CCOc1cccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000794829646 1053441684 /nfs/dbraw/zinc/44/16/84/1053441684.db2.gz VOZNHRGEJZUUDX-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1C(F)(F)F ZINC000765140796 1053453907 /nfs/dbraw/zinc/45/39/07/1053453907.db2.gz FMLUGRGDIWVZAG-ZDUSSCGKSA-N 2 1 326.406 4.230 20 0 EIADMP CCOc1cccc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000385805305 1053551170 /nfs/dbraw/zinc/55/11/70/1053551170.db2.gz NHLNJVUOKPDENL-GHTZIAJQSA-N 2 1 338.495 4.086 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]CCCc1c(Cl)cccc1Cl ZINC000338952998 1053610640 /nfs/dbraw/zinc/61/06/40/1053610640.db2.gz AHCYUYOTHGHPAS-UHFFFAOYSA-N 2 1 326.271 4.111 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc2c(c1)CCCO2 ZINC000853248800 1053660488 /nfs/dbraw/zinc/66/04/88/1053660488.db2.gz JYYNSFQWTKNIIT-DQLDELGASA-N 2 1 336.479 4.156 20 0 EIADMP C[C@@H](CCc1cncc2ccccc21)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000866368857 1053707016 /nfs/dbraw/zinc/70/70/16/1053707016.db2.gz FEQKURPPEVUXQO-KRWDZBQOSA-N 2 1 325.500 4.020 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2ccccc2C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386546139 1053773322 /nfs/dbraw/zinc/77/33/22/1053773322.db2.gz SFZXELNJKSBGRT-TZYHBYERSA-N 2 1 334.507 4.044 20 0 EIADMP CC(F)(F)C(C)(C)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000866543974 1053778711 /nfs/dbraw/zinc/77/87/11/1053778711.db2.gz CHJZQISPFGRNGJ-BCDXTJNWSA-N 2 1 336.470 4.453 20 0 EIADMP CC1CC[NH+](CC[C@H]2CCC[N@H+]2C[C@@H]2CCCCC2(F)F)CC1 ZINC001196934747 1053803929 /nfs/dbraw/zinc/80/39/29/1053803929.db2.gz CGTGAMPUFTWTLY-ZWKOTPCHSA-N 2 1 328.491 4.398 20 0 EIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2C[C@@H]2CCCCC2(F)F)CC1 ZINC001196934746 1053804828 /nfs/dbraw/zinc/80/48/28/1053804828.db2.gz CGTGAMPUFTWTLY-ROUUACIJSA-N 2 1 328.491 4.398 20 0 EIADMP C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866705976 1053819032 /nfs/dbraw/zinc/81/90/32/1053819032.db2.gz DIKSJQPYWGWZOK-QRWLVFNGSA-N 2 1 327.472 4.100 20 0 EIADMP C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866705976 1053819033 /nfs/dbraw/zinc/81/90/33/1053819033.db2.gz DIKSJQPYWGWZOK-QRWLVFNGSA-N 2 1 327.472 4.100 20 0 EIADMP C[N@H+]1CC[C@H]2CN(CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031944 1053828273 /nfs/dbraw/zinc/82/82/73/1053828273.db2.gz NFLNZDJNOSRVLI-MAUKXSAKSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@@H+]1CC[C@H]2C[NH+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031944 1053828277 /nfs/dbraw/zinc/82/82/77/1053828277.db2.gz NFLNZDJNOSRVLI-MAUKXSAKSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CC[C@H]2C[NH+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031944 1053828280 /nfs/dbraw/zinc/82/82/80/1053828280.db2.gz NFLNZDJNOSRVLI-MAUKXSAKSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2C[N@H+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031944 1053828288 /nfs/dbraw/zinc/82/82/88/1053828288.db2.gz NFLNZDJNOSRVLI-MAUKXSAKSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CC[C@H]2C[N@@H+](CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031944 1053828290 /nfs/dbraw/zinc/82/82/90/1053828290.db2.gz NFLNZDJNOSRVLI-MAUKXSAKSA-N 2 1 341.326 4.342 20 0 EIADMP C[C@@]1(C2CCCCC2)CC[N@H+]1Cc1ccc(CN2CCOCC2)cc1 ZINC001197239251 1053858544 /nfs/dbraw/zinc/85/85/44/1053858544.db2.gz MZYBMVQPGADPEY-QFIPXVFZSA-N 2 1 342.527 4.064 20 0 EIADMP C[C@@]1(C2CCCCC2)CC[N@@H+]1Cc1ccc(C[NH+]2CCOCC2)cc1 ZINC001197239251 1053858550 /nfs/dbraw/zinc/85/85/50/1053858550.db2.gz MZYBMVQPGADPEY-QFIPXVFZSA-N 2 1 342.527 4.064 20 0 EIADMP C[C@@]1(C2CCCCC2)CC[N@H+]1Cc1ccc(C[NH+]2CCOCC2)cc1 ZINC001197239251 1053858552 /nfs/dbraw/zinc/85/85/52/1053858552.db2.gz MZYBMVQPGADPEY-QFIPXVFZSA-N 2 1 342.527 4.064 20 0 EIADMP CC[C@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C(C)(C)CC ZINC000872036488 1054352501 /nfs/dbraw/zinc/35/25/01/1054352501.db2.gz SOUKHKDRJNREFY-SFHVURJKSA-N 2 1 335.536 4.308 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001199197848 1054362443 /nfs/dbraw/zinc/36/24/43/1054362443.db2.gz KIQHFATWCUYHLE-MJGOQNOKSA-N 2 1 328.544 4.237 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+]Cc1cccc(Oc2ccc(F)cc2)c1 ZINC001199208203 1054364401 /nfs/dbraw/zinc/36/44/01/1054364401.db2.gz MLQAMPDOGWABEK-UHFFFAOYSA-N 2 1 330.447 4.438 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1cccc(Oc2ccc(F)cc2)c1 ZINC001199208203 1054364414 /nfs/dbraw/zinc/36/44/14/1054364414.db2.gz MLQAMPDOGWABEK-UHFFFAOYSA-N 2 1 330.447 4.438 20 0 EIADMP Fc1cc(CNCCC[N@@H+]2CCc3ccccc3C2)ccc1C(F)F ZINC001199238487 1054369653 /nfs/dbraw/zinc/36/96/53/1054369653.db2.gz QJPFBQLMPOTXNB-UHFFFAOYSA-N 2 1 348.412 4.301 20 0 EIADMP Fc1cc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)ccc1C(F)F ZINC001199238487 1054369672 /nfs/dbraw/zinc/36/96/72/1054369672.db2.gz QJPFBQLMPOTXNB-UHFFFAOYSA-N 2 1 348.412 4.301 20 0 EIADMP Fc1cc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)ccc1C(F)F ZINC001199238487 1054369679 /nfs/dbraw/zinc/36/96/79/1054369679.db2.gz QJPFBQLMPOTXNB-UHFFFAOYSA-N 2 1 348.412 4.301 20 0 EIADMP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)CC1 ZINC001199265542 1054376685 /nfs/dbraw/zinc/37/66/85/1054376685.db2.gz BJYQTINGSNXSEQ-VLCRHTCISA-N 2 1 344.543 4.356 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)[C@@H]1CCCOC1 ZINC000872068493 1054377380 /nfs/dbraw/zinc/37/73/80/1054377380.db2.gz GVBHATRFRANPIW-HKBOAZHASA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)[C@@H]1CCCOC1 ZINC000872068493 1054377387 /nfs/dbraw/zinc/37/73/87/1054377387.db2.gz GVBHATRFRANPIW-HKBOAZHASA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cnc2c(F)cccc2c1 ZINC001199336604 1054386103 /nfs/dbraw/zinc/38/61/03/1054386103.db2.gz SPYIPINMRUAGEI-MRXNPFEDSA-N 2 1 329.463 4.118 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)C1 ZINC001199344129 1054388020 /nfs/dbraw/zinc/38/80/20/1054388020.db2.gz FWHNGVHMZMHIBR-GOSISDBHSA-N 2 1 344.543 4.392 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1cccc(OC(F)(F)F)c1 ZINC000858149780 1054425191 /nfs/dbraw/zinc/42/51/91/1054425191.db2.gz UVDUKTQWYMWGNL-GXTWGEPZSA-N 2 1 330.394 4.109 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1cccc(OC(F)(F)F)c1 ZINC000858149780 1054425196 /nfs/dbraw/zinc/42/51/96/1054425196.db2.gz UVDUKTQWYMWGNL-GXTWGEPZSA-N 2 1 330.394 4.109 20 0 EIADMP COc1cccc2c1CCC[C@H]([NH2+]C[C@]1([NH+](C)C)CCC[C@@H](C)C1)C2 ZINC001199638610 1054437514 /nfs/dbraw/zinc/43/75/14/1054437514.db2.gz FCYCDUPTSRFTDT-LZNRXBQRSA-N 2 1 344.543 4.043 20 0 EIADMP CC(C)c1cccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)c1 ZINC000858365465 1054475507 /nfs/dbraw/zinc/47/55/07/1054475507.db2.gz OFMUCODWACIKCC-LAUBAEHRSA-N 2 1 330.516 4.104 20 0 EIADMP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@@H](C)c1ccc(C(F)(F)F)nc1 ZINC000873297499 1054525118 /nfs/dbraw/zinc/52/51/18/1054525118.db2.gz XSGMZSVDXOPNFI-KCQAQPDRSA-N 2 1 329.410 4.062 20 0 EIADMP C[NH+](C)Cc1ccc(NC2=C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001201475569 1054829215 /nfs/dbraw/zinc/82/92/15/1054829215.db2.gz WJIGUKPSPOSJCG-PKTZIBPZSA-N 2 1 347.506 4.481 20 0 EIADMP CCC[C@H](C)C[NH+]1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201544394 1054838272 /nfs/dbraw/zinc/83/82/72/1054838272.db2.gz PNPPYTVQIIHOSQ-PZJWPPBQSA-N 2 1 344.543 4.178 20 0 EIADMP CCC[C@H](C)C[NH+]1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201544393 1054838315 /nfs/dbraw/zinc/83/83/15/1054838315.db2.gz PNPPYTVQIIHOSQ-FPOVZHCZSA-N 2 1 344.543 4.178 20 0 EIADMP CCC[C@H](C)C[N@@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201549388 1054839199 /nfs/dbraw/zinc/83/91/99/1054839199.db2.gz AWHIVGAWEUMRSI-QIJZPMMNSA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201549388 1054839201 /nfs/dbraw/zinc/83/92/01/1054839201.db2.gz AWHIVGAWEUMRSI-QIJZPMMNSA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201549388 1054839208 /nfs/dbraw/zinc/83/92/08/1054839208.db2.gz AWHIVGAWEUMRSI-QIJZPMMNSA-N 2 1 329.532 4.050 20 0 EIADMP CCC[C@H](C)C[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201549388 1054839209 /nfs/dbraw/zinc/83/92/09/1054839209.db2.gz AWHIVGAWEUMRSI-QIJZPMMNSA-N 2 1 329.532 4.050 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cnn(-c3ccccc3)c2)c1 ZINC000765774533 1054903119 /nfs/dbraw/zinc/90/31/19/1054903119.db2.gz DVXGFPHUSDYIQV-SFHVURJKSA-N 2 1 348.494 4.175 20 0 EIADMP COc1cc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)ccc1Cl ZINC001201857457 1054923748 /nfs/dbraw/zinc/92/37/48/1054923748.db2.gz MWJPKODXOXHBJN-UHFFFAOYSA-N 2 1 336.907 4.093 20 0 EIADMP C[N@@H+](Cc1ncc(Cl)s1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001137110396 1054944664 /nfs/dbraw/zinc/94/46/64/1054944664.db2.gz STWOFYLIISXFFF-UHFFFAOYSA-N 2 1 349.931 4.141 20 0 EIADMP C[N@H+](Cc1ncc(Cl)s1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001137110396 1054944675 /nfs/dbraw/zinc/94/46/75/1054944675.db2.gz STWOFYLIISXFFF-UHFFFAOYSA-N 2 1 349.931 4.141 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCCCS2)CC1 ZINC000671760238 1055044971 /nfs/dbraw/zinc/04/49/71/1055044971.db2.gz MHQUVAODBFZCTQ-SOAGJPPSSA-N 2 1 332.557 4.305 20 0 EIADMP Cc1cccc2[nH]c(C[NH2+]C[C@@]3(C)CC[N@@H+](Cc4ccccc4)C3)cc21 ZINC001202220116 1055092888 /nfs/dbraw/zinc/09/28/88/1055092888.db2.gz MPMOIWXWVIETCR-HSZRJFAPSA-N 2 1 347.506 4.478 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(-n3ccnc3)cc2)c1 ZINC000126736630 1055129338 /nfs/dbraw/zinc/12/93/38/1055129338.db2.gz FFHWWNDCXJYMBY-UHFFFAOYSA-N 2 1 348.494 4.002 20 0 EIADMP FC(F)(F)CCC[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001202444049 1055176277 /nfs/dbraw/zinc/17/62/77/1055176277.db2.gz COAPXRUNKSPPMH-QZTJIDSGSA-N 2 1 340.433 4.173 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001202444049 1055176280 /nfs/dbraw/zinc/17/62/80/1055176280.db2.gz COAPXRUNKSPPMH-QZTJIDSGSA-N 2 1 340.433 4.173 20 0 EIADMP FC(F)(F)CCC[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001202444049 1055176283 /nfs/dbraw/zinc/17/62/83/1055176283.db2.gz COAPXRUNKSPPMH-QZTJIDSGSA-N 2 1 340.433 4.173 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC000863546963 1055228231 /nfs/dbraw/zinc/22/82/31/1055228231.db2.gz IHQSPCNWBZKBSZ-DFQSSKMNSA-N 2 1 326.871 4.410 20 0 EIADMP CSC[C@H]([NH2+][C@H](C)CC[NH+](C)C)c1ccc(C(F)(F)F)cc1 ZINC000542847824 1056227491 /nfs/dbraw/zinc/22/74/91/1056227491.db2.gz UKYVTNSBJPPPDZ-DOMZBBRYSA-N 2 1 334.451 4.039 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cnn(CC3CCC3)c2)cc1 ZINC000921823847 1056654221 /nfs/dbraw/zinc/65/42/21/1056654221.db2.gz APILRTKNQIFSFA-INIZCTEOSA-N 2 1 349.482 4.028 20 0 EIADMP S=c1ccn(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c2ccccc12 ZINC000742169643 1058528008 /nfs/dbraw/zinc/52/80/08/1058528008.db2.gz FHXFYZAWNQJYBT-KRWDZBQOSA-N 2 1 341.524 4.136 20 0 EIADMP CCCC[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccccc1 ZINC000746047698 1059982010 /nfs/dbraw/zinc/98/20/10/1059982010.db2.gz PUIXKIYAYAQADY-NHCUHLMSSA-N 2 1 330.516 4.151 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3ccc(Br)cc3)CCC1)C2 ZINC001169092141 1060647868 /nfs/dbraw/zinc/64/78/68/1060647868.db2.gz YKHIEHGREMMBFO-OSYLJGHBSA-N 2 1 349.316 4.043 20 0 EIADMP Cc1ccc2c(c1)c(C1CC[NH2+]CC1)cn2[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169152678 1060670825 /nfs/dbraw/zinc/67/08/25/1060670825.db2.gz DFTOVYDWPSHTDL-REPLKXPHSA-N 2 1 337.511 4.214 20 0 EIADMP 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 1060673247 /nfs/dbraw/zinc/67/32/47/1060673247.db2.gz FBUZOQODHKRDRY-VNTMZGSJSA-N 2 1 342.527 4.278 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1CCC(Cc2ccccc2)CC1)c1ccccn1 ZINC001169188649 1060681024 /nfs/dbraw/zinc/68/10/24/1060681024.db2.gz ZZGIZBPEOVMQIW-LJQANCHMSA-N 2 1 337.511 4.077 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cccnc32)C1 ZINC000078704630 217106190 /nfs/dbraw/zinc/10/61/90/217106190.db2.gz BRTAYIONMNVZOM-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cccc3cccnc32)C1 ZINC000078704630 217106193 /nfs/dbraw/zinc/10/61/93/217106193.db2.gz BRTAYIONMNVZOM-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cccc3cccnc32)C1 ZINC000078704630 217106195 /nfs/dbraw/zinc/10/61/95/217106195.db2.gz BRTAYIONMNVZOM-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2c(F)cccc2F)CCCC1 ZINC000532219075 1032098318 /nfs/dbraw/zinc/09/83/18/1032098318.db2.gz KVGJJKXGTVTGDY-VKJFTORMSA-N 2 1 336.470 4.095 20 0 EIADMP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000532226266 1032107032 /nfs/dbraw/zinc/10/70/32/1032107032.db2.gz RQZGUQQWKHFPKP-RBUKOAKNSA-N 2 1 328.525 4.272 20 0 EIADMP FC(F)(F)c1sccc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000529523500 1032425110 /nfs/dbraw/zinc/42/51/10/1032425110.db2.gz SGZMLFZSXMKGNC-UHFFFAOYSA-N 2 1 332.435 4.075 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529543742 1032433572 /nfs/dbraw/zinc/43/35/72/1032433572.db2.gz NDWNDUSWBSNAGA-XYJFISCASA-N 2 1 336.470 4.311 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)C1 ZINC000760161694 1032484364 /nfs/dbraw/zinc/48/43/64/1032484364.db2.gz ZDVFOMBJNWWUQH-QWHCGFSZSA-N 2 1 344.330 4.347 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000178451634 1032530787 /nfs/dbraw/zinc/53/07/87/1032530787.db2.gz WYCGSUKCIHBLJE-SFHVURJKSA-N 2 1 328.500 4.285 20 0 EIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000178704073 1032544287 /nfs/dbraw/zinc/54/42/87/1032544287.db2.gz MAJNGMHTKGTTQP-QWHCGFSZSA-N 2 1 334.533 4.241 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000178706638 1032544523 /nfs/dbraw/zinc/54/45/23/1032544523.db2.gz ZBLQDNLEHAOINM-GJZGRUSLSA-N 2 1 340.496 4.302 20 0 EIADMP Cc1nccn1CCCC[N@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000179266921 1032556887 /nfs/dbraw/zinc/55/68/87/1032556887.db2.gz IAGFELJMGSGEEU-CQSZACIVSA-N 2 1 328.485 4.274 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000179266921 1032556895 /nfs/dbraw/zinc/55/68/95/1032556895.db2.gz IAGFELJMGSGEEU-CQSZACIVSA-N 2 1 328.485 4.274 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc([C@H](C)C(F)(F)F)cc1 ZINC000450596367 1032574623 /nfs/dbraw/zinc/57/46/23/1032574623.db2.gz GBBRFDWPVGCXDQ-AWEZNQCLSA-N 2 1 339.405 4.379 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc([C@H](C)C(F)(F)F)cc1 ZINC000450596367 1032574641 /nfs/dbraw/zinc/57/46/41/1032574641.db2.gz GBBRFDWPVGCXDQ-AWEZNQCLSA-N 2 1 339.405 4.379 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(-c2cccnc2)cc1 ZINC000181278089 1032651825 /nfs/dbraw/zinc/65/18/25/1032651825.db2.gz FXAAUONXRSZLGH-QGZVFWFLSA-N 2 1 334.467 4.385 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000512431538 1032752680 /nfs/dbraw/zinc/75/26/80/1032752680.db2.gz FRRFSOJGORFCNI-KRWDZBQOSA-N 2 1 349.478 4.293 20 0 EIADMP FC(F)(F)CCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000579709778 1018806748 /nfs/dbraw/zinc/80/67/48/1018806748.db2.gz GUUZLDRQCSRGIA-INIZCTEOSA-N 2 1 326.406 4.116 20 0 EIADMP FC(F)(F)CCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000579709778 1018806752 /nfs/dbraw/zinc/80/67/52/1018806752.db2.gz GUUZLDRQCSRGIA-INIZCTEOSA-N 2 1 326.406 4.116 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CCN(Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469884 1032787572 /nfs/dbraw/zinc/78/75/72/1032787572.db2.gz MPIVYTSXCKPHGO-SFHVURJKSA-N 2 1 340.511 4.401 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469884 1032787587 /nfs/dbraw/zinc/78/75/87/1032787587.db2.gz MPIVYTSXCKPHGO-SFHVURJKSA-N 2 1 340.511 4.401 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469884 1032787605 /nfs/dbraw/zinc/78/76/05/1032787605.db2.gz MPIVYTSXCKPHGO-SFHVURJKSA-N 2 1 340.511 4.401 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469884 1032787616 /nfs/dbraw/zinc/78/76/16/1032787616.db2.gz MPIVYTSXCKPHGO-SFHVURJKSA-N 2 1 340.511 4.401 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469884 1032787626 /nfs/dbraw/zinc/78/76/26/1032787626.db2.gz MPIVYTSXCKPHGO-SFHVURJKSA-N 2 1 340.511 4.401 20 0 EIADMP CC[N@@H+](Cc1ccc(-c2nc([C@H]([NH3+])CC(C)C)no2)cc1)C(C)C ZINC000339394861 1018836011 /nfs/dbraw/zinc/83/60/11/1018836011.db2.gz PLDABSMVLYNPDR-QGZVFWFLSA-N 2 1 330.476 4.013 20 0 EIADMP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccccc4Cl)o3)C2)C1 ZINC000430150471 1018877216 /nfs/dbraw/zinc/87/72/16/1018877216.db2.gz SEKBTCFOVFCBIY-LJQANCHMSA-N 2 1 330.859 4.128 20 0 EIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccccc4Cl)o3)C2)C1 ZINC000430150471 1018877220 /nfs/dbraw/zinc/87/72/20/1018877220.db2.gz SEKBTCFOVFCBIY-LJQANCHMSA-N 2 1 330.859 4.128 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(-c4ccccc4Cl)o3)C2)C1 ZINC000430150471 1018877221 /nfs/dbraw/zinc/87/72/21/1018877221.db2.gz SEKBTCFOVFCBIY-LJQANCHMSA-N 2 1 330.859 4.128 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(-c4ccccc4Cl)o3)C2)C1 ZINC000430150471 1018877223 /nfs/dbraw/zinc/87/72/23/1018877223.db2.gz SEKBTCFOVFCBIY-LJQANCHMSA-N 2 1 330.859 4.128 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)oc21 ZINC000643547886 1018930049 /nfs/dbraw/zinc/93/00/49/1018930049.db2.gz KGTZSWXJQMKMJK-ZBFHGGJFSA-N 2 1 328.456 4.157 20 0 EIADMP Cc1csc([C@H](C)C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000274735594 1019086215 /nfs/dbraw/zinc/08/62/15/1019086215.db2.gz DAOHAAWPIFJESE-SZVBFZGTSA-N 2 1 343.540 4.055 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000432792863 1032812519 /nfs/dbraw/zinc/81/25/19/1032812519.db2.gz MYXWFJYZZIPHFQ-OAQYLSRUSA-N 2 1 338.495 4.278 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000432792863 1032812525 /nfs/dbraw/zinc/81/25/25/1032812525.db2.gz MYXWFJYZZIPHFQ-OAQYLSRUSA-N 2 1 338.495 4.278 20 0 EIADMP CN(Cc1cc(Cl)cc(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000579893286 1020512213 /nfs/dbraw/zinc/51/22/13/1020512213.db2.gz ZQZYEQJLXQXAKP-XYPWUTKMSA-N 2 1 346.824 4.416 20 0 EIADMP C[N@H+](Cc1cc(Cl)cc(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000579893286 1020512221 /nfs/dbraw/zinc/51/22/21/1020512221.db2.gz ZQZYEQJLXQXAKP-XYPWUTKMSA-N 2 1 346.824 4.416 20 0 EIADMP C[N@@H+](Cc1cc(Cl)cc(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000579893286 1020512241 /nfs/dbraw/zinc/51/22/41/1020512241.db2.gz ZQZYEQJLXQXAKP-XYPWUTKMSA-N 2 1 346.824 4.416 20 0 EIADMP C[NH+](Cc1cc(Cl)cc(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000579893286 1020512248 /nfs/dbraw/zinc/51/22/48/1020512248.db2.gz ZQZYEQJLXQXAKP-XYPWUTKMSA-N 2 1 346.824 4.416 20 0 EIADMP CC(C)(C)[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(F)cc1 ZINC000655703332 1020907174 /nfs/dbraw/zinc/90/71/74/1020907174.db2.gz OJQHVDXPWNBQAW-PMACEKPBSA-N 2 1 348.506 4.146 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1cnc(-c2ccc(C)c(C)c2)s1 ZINC000655711384 1020907197 /nfs/dbraw/zinc/90/71/97/1020907197.db2.gz IYGZHOQUPQECOG-UHFFFAOYSA-N 2 1 340.496 4.112 20 0 EIADMP CC(C)(C)[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(F)cc1 ZINC000655703337 1020907433 /nfs/dbraw/zinc/90/74/33/1020907433.db2.gz OJQHVDXPWNBQAW-VQTJNVASSA-N 2 1 348.506 4.146 20 0 EIADMP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)CS1 ZINC000655714694 1020912462 /nfs/dbraw/zinc/91/24/62/1020912462.db2.gz AMQNEZATMXAVIC-VQIMIIECSA-N 2 1 344.524 4.285 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3c(O)cccc32)c1 ZINC000340519547 1021188099 /nfs/dbraw/zinc/18/80/99/1021188099.db2.gz MPXVEPCQBHKTHE-OAQYLSRUSA-N 2 1 338.495 4.400 20 0 EIADMP Oc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CCC2 ZINC000340523987 1021189623 /nfs/dbraw/zinc/18/96/23/1021189623.db2.gz JEZYBWHUFBTJCZ-NRFANRHFSA-N 2 1 328.500 4.156 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)ccc1OCC(C)C ZINC000892509665 1021310306 /nfs/dbraw/zinc/31/03/06/1021310306.db2.gz AEHSIOMRCUGANN-BPIHKTFHSA-N 2 1 346.515 4.006 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000472468661 1021389944 /nfs/dbraw/zinc/38/99/44/1021389944.db2.gz UFXMFZNGXWYSNS-GDBMZVCRSA-N 2 1 340.433 4.430 20 0 EIADMP C(C[NH+]1CCCCC1)C[N@@H+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000161645817 1021612902 /nfs/dbraw/zinc/61/29/02/1021612902.db2.gz OSSNUBVSBSKOHX-QGZVFWFLSA-N 2 1 347.572 4.077 20 0 EIADMP C(C[NH+]1CCCCC1)C[N@H+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000161645817 1021612917 /nfs/dbraw/zinc/61/29/17/1021612917.db2.gz OSSNUBVSBSKOHX-QGZVFWFLSA-N 2 1 347.572 4.077 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3[nH]ccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379632387 1021845599 /nfs/dbraw/zinc/84/55/99/1021845599.db2.gz SLGCWNOGMCOFDO-DYESRHJHSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3[nH]ccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379632387 1021845605 /nfs/dbraw/zinc/84/56/05/1021845605.db2.gz SLGCWNOGMCOFDO-DYESRHJHSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3[nH]ccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379632397 1021845979 /nfs/dbraw/zinc/84/59/79/1021845979.db2.gz SLGCWNOGMCOFDO-UWJYYQICSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3[nH]ccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379632397 1021845982 /nfs/dbraw/zinc/84/59/82/1021845982.db2.gz SLGCWNOGMCOFDO-UWJYYQICSA-N 2 1 333.479 4.311 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]CC[C@@H]3CCC[N@@H+](C)C3)c(C)c2c1 ZINC000414169284 1022018935 /nfs/dbraw/zinc/01/89/35/1022018935.db2.gz BAVQPIYAIUVMGJ-CVEARBPZSA-N 2 1 330.472 4.132 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000414170383 1022021059 /nfs/dbraw/zinc/02/10/59/1022021059.db2.gz BYYWSLMPMFOGJZ-VGSWGCGISA-N 2 1 349.478 4.239 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000414182581 1022055173 /nfs/dbraw/zinc/05/51/73/1022055173.db2.gz MWVJOXUYTMBSTE-ROUUACIJSA-N 2 1 339.483 4.256 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1csc(-c2ccccc2F)n1 ZINC000414193963 1022088706 /nfs/dbraw/zinc/08/87/06/1022088706.db2.gz UCIIGDPNIDCMKY-LSDHHAIUSA-N 2 1 347.503 4.332 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CC[C@H]3CCC[N@@H+](C)C3)oc21 ZINC000414199448 1022106212 /nfs/dbraw/zinc/10/62/12/1022106212.db2.gz XBBOVPBWQIZPGU-HZPDHXFCSA-N 2 1 330.472 4.214 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCOc2ccc(F)cc2)CC1 ZINC000613491445 1022158042 /nfs/dbraw/zinc/15/80/42/1022158042.db2.gz SBHNLSQDPNVSJX-UHFFFAOYSA-N 2 1 336.495 4.039 20 0 EIADMP c1ccc(CC2(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCCCC2)cc1 ZINC000471592359 1022200941 /nfs/dbraw/zinc/20/09/41/1022200941.db2.gz DJPQTPURGMURLR-LEWJYISDSA-N 2 1 326.528 4.396 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)cnc1F ZINC000892574869 1022275384 /nfs/dbraw/zinc/27/53/84/1022275384.db2.gz OTAJSXGKRIWZPV-INIZCTEOSA-N 2 1 341.474 4.051 20 0 EIADMP CO[C@@](C)([C@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000414249798 1022311066 /nfs/dbraw/zinc/31/10/66/1022311066.db2.gz XINUBNHKNBESPJ-WGJNNHPISA-N 2 1 344.543 4.223 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H](C)CC(F)(F)F)cc1 ZINC000414256349 1022324902 /nfs/dbraw/zinc/32/49/02/1022324902.db2.gz COEIHSVXDMFOIP-STQMWFEESA-N 2 1 325.378 4.420 20 0 EIADMP CC(C)(C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)c1ccccc1 ZINC000684026895 1022372738 /nfs/dbraw/zinc/37/27/38/1022372738.db2.gz XKUXULZVNXAVSQ-UHFFFAOYSA-N 2 1 337.511 4.377 20 0 EIADMP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)C1 ZINC000651300802 1022400761 /nfs/dbraw/zinc/40/07/61/1022400761.db2.gz GENWZPIAOBJHOG-MANSERQUSA-N 2 1 334.454 4.207 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@@H+]2CCCC23CC[NH+](C)CC3)o1 ZINC000472597087 1022739765 /nfs/dbraw/zinc/73/97/65/1022739765.db2.gz JJOPIVZHKLJPRY-UHFFFAOYSA-N 2 1 342.458 4.454 20 0 EIADMP C[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[N@@H+](C)CCC[NH3+] ZINC000317109980 1022790471 /nfs/dbraw/zinc/79/04/71/1022790471.db2.gz CVWPZRVLZFVCNC-VIFPVBQESA-N 2 1 328.300 4.066 20 0 EIADMP C[N@@H+](Cc1ccc(-c2ccccc2)s1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000581004341 1022793795 /nfs/dbraw/zinc/79/37/95/1022793795.db2.gz DKGDKIKZFOVCIR-JWTNVVGKSA-N 2 1 326.509 4.472 20 0 EIADMP C[NH+](Cc1ccc(-c2ccccc2)s1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000581004341 1022793819 /nfs/dbraw/zinc/79/38/19/1022793819.db2.gz DKGDKIKZFOVCIR-JWTNVVGKSA-N 2 1 326.509 4.472 20 0 EIADMP C[NH+](Cc1ccc(-c2ccccc2)s1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000581004341 1022793841 /nfs/dbraw/zinc/79/38/41/1022793841.db2.gz DKGDKIKZFOVCIR-JWTNVVGKSA-N 2 1 326.509 4.472 20 0 EIADMP CC[C@H](NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022520 1022813994 /nfs/dbraw/zinc/81/39/94/1022813994.db2.gz OMNLSDIEGRCWDH-QUCCMNQESA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022520 1022814001 /nfs/dbraw/zinc/81/40/01/1022814001.db2.gz OMNLSDIEGRCWDH-QUCCMNQESA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022520 1022814005 /nfs/dbraw/zinc/81/40/05/1022814005.db2.gz OMNLSDIEGRCWDH-QUCCMNQESA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000311022520 1022814007 /nfs/dbraw/zinc/81/40/07/1022814007.db2.gz OMNLSDIEGRCWDH-QUCCMNQESA-N 2 1 341.474 4.174 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1)c1ccc(Cl)nc1 ZINC000378513143 1022853409 /nfs/dbraw/zinc/85/34/09/1022853409.db2.gz AGOMEDHCRQTWOU-POZUXBRTSA-N 2 1 329.875 4.079 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cc(C3CC3)no2)CC1 ZINC000660006658 1022853593 /nfs/dbraw/zinc/85/35/93/1022853593.db2.gz RAMZUYLLDVTOFV-MRXNPFEDSA-N 2 1 331.504 4.029 20 0 EIADMP CSC1(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)CCC1 ZINC000581162714 1022860366 /nfs/dbraw/zinc/86/03/66/1022860366.db2.gz ANTFHTUVIQPQCG-UHFFFAOYSA-N 2 1 344.568 4.260 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@H+](C)[C@H]1c1cccs1)c1cccnc1 ZINC000363863294 1022866519 /nfs/dbraw/zinc/86/65/19/1022866519.db2.gz KJAFPAAPZLAYFW-ZIFCJYIRSA-N 2 1 329.513 4.267 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@H]1c1cccs1)c1cccnc1 ZINC000363863294 1022866523 /nfs/dbraw/zinc/86/65/23/1022866523.db2.gz KJAFPAAPZLAYFW-ZIFCJYIRSA-N 2 1 329.513 4.267 20 0 EIADMP C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548154386 1022871788 /nfs/dbraw/zinc/87/17/88/1022871788.db2.gz NZNDNIVPHMBIEU-HSQYWUDLSA-N 2 1 335.495 4.033 20 0 EIADMP CC(C)(C)[C@@H]([NH2+]Cc1cc(C2CC[NH2+]CC2)no1)c1cccc(F)c1 ZINC000425893707 1022970593 /nfs/dbraw/zinc/97/05/93/1022970593.db2.gz DWYCKNMHGSOYAP-IBGZPJMESA-N 2 1 345.462 4.158 20 0 EIADMP CCn1cc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)cn1 ZINC000156181365 1023092038 /nfs/dbraw/zinc/09/20/38/1023092038.db2.gz HVBCAFDYUAKRLT-ROUUACIJSA-N 2 1 340.515 4.128 20 0 EIADMP C[C@H]([NH2+]CCCOC1CCCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548162959 1023097256 /nfs/dbraw/zinc/09/72/56/1023097256.db2.gz GGJHBQXIDWBDBC-FPOVZHCZSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@@H]([NH2+]CCCOC1CCCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548162958 1023097898 /nfs/dbraw/zinc/09/78/98/1023097898.db2.gz GGJHBQXIDWBDBC-CTNGQTDRSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(-c2ccncc2)c1 ZINC000376595326 1023151375 /nfs/dbraw/zinc/15/13/75/1023151375.db2.gz MMNICNXREUKKAQ-YTXWROIDSA-N 2 1 335.495 4.416 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000376612311 1023235209 /nfs/dbraw/zinc/23/52/09/1023235209.db2.gz VAXVXLAEDOSKRV-SIXWZSSISA-N 2 1 345.462 4.176 20 0 EIADMP C[C@]1(C[NH2+]Cc2cnc3ccccc3c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000311774214 1023256607 /nfs/dbraw/zinc/25/66/07/1023256607.db2.gz JUORDUDQWAULLH-HSZRJFAPSA-N 2 1 345.490 4.237 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417338814 1023271793 /nfs/dbraw/zinc/27/17/93/1023271793.db2.gz ZFWHXMSZUDDDLK-FRYIKTPZSA-N 2 1 340.536 4.352 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417338810 1023272044 /nfs/dbraw/zinc/27/20/44/1023272044.db2.gz ZFWHXMSZUDDDLK-BTHPGYMESA-N 2 1 340.536 4.352 20 0 EIADMP COc1cccc(SCC[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000660257463 1023396851 /nfs/dbraw/zinc/39/68/51/1023396851.db2.gz TZZSCRKNKKBFNG-IAGOWNOFSA-N 2 1 348.556 4.030 20 0 EIADMP CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001167473937 1023425523 /nfs/dbraw/zinc/42/55/23/1023425523.db2.gz NOZIBWOICQMNIT-RTWAWAEBSA-N 2 1 344.543 4.308 20 0 EIADMP FC(F)(F)c1ccccc1C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415090229 1023435475 /nfs/dbraw/zinc/43/54/75/1023435475.db2.gz XRRFONWZUVSFFI-SJLPKXTDSA-N 2 1 334.385 4.288 20 0 EIADMP Cc1sc([C@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)nc1-c1ccc(Cl)cc1 ZINC000415088843 1023439334 /nfs/dbraw/zinc/43/93/34/1023439334.db2.gz VSTVZXKMXCAMNQ-GXTWGEPZSA-N 2 1 349.931 4.422 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)CCCC1 ZINC000415094468 1023439519 /nfs/dbraw/zinc/43/95/19/1023439519.db2.gz XPJQTGISCNYBGH-WOJBJXKFSA-N 2 1 330.516 4.056 20 0 EIADMP CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000415100264 1023444605 /nfs/dbraw/zinc/44/46/05/1023444605.db2.gz HUMIFGBOZKTVKT-IXDOHACOSA-N 2 1 328.504 4.018 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)sc1C ZINC000893326000 1023454159 /nfs/dbraw/zinc/45/41/59/1023454159.db2.gz AFSODCBXYCMHPY-UHFFFAOYSA-N 2 1 343.540 4.282 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000892945145 1023555983 /nfs/dbraw/zinc/55/59/83/1023555983.db2.gz YNQLXJOLIGHIEO-UHFFFAOYSA-N 2 1 341.499 4.067 20 0 EIADMP COc1ccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CCCCC2)cc1 ZINC000192734500 1023640600 /nfs/dbraw/zinc/64/06/00/1023640600.db2.gz FXOZXUYVSJFSHS-IHWFROFDSA-N 2 1 342.527 4.112 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccc(Cl)cc1F ZINC000398038056 1023659070 /nfs/dbraw/zinc/65/90/70/1023659070.db2.gz QQPCJQZBGFWZKF-MGPUTAFESA-N 2 1 346.877 4.479 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000390625720 1023736046 /nfs/dbraw/zinc/73/60/46/1023736046.db2.gz HXFSLUXDESUTEZ-VSKRKVRLSA-N 2 1 349.522 4.022 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](CCCc1ccccc1)c1ccccc1 ZINC000471763868 1023818223 /nfs/dbraw/zinc/81/82/23/1023818223.db2.gz XTXFGUUBAVCISG-QFIPXVFZSA-N 2 1 333.479 4.316 20 0 EIADMP CC[C@H](CC(F)F)C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC000660496231 1023868735 /nfs/dbraw/zinc/86/87/35/1023868735.db2.gz FSTHSQXEIAAZCJ-HZPDHXFCSA-N 2 1 344.515 4.492 20 0 EIADMP CC[C@H](CC(F)F)C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(C)s2)C1 ZINC000660496231 1023868738 /nfs/dbraw/zinc/86/87/38/1023868738.db2.gz FSTHSQXEIAAZCJ-HZPDHXFCSA-N 2 1 344.515 4.492 20 0 EIADMP CC[C@H](CC(F)F)C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(C)s2)C1 ZINC000660496231 1023868742 /nfs/dbraw/zinc/86/87/42/1023868742.db2.gz FSTHSQXEIAAZCJ-HZPDHXFCSA-N 2 1 344.515 4.492 20 0 EIADMP CC(C)c1nc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c2ccccn21 ZINC000651621579 1024045631 /nfs/dbraw/zinc/04/56/31/1024045631.db2.gz WPFBXQNFABFRBI-UHFFFAOYSA-N 2 1 342.531 4.010 20 0 EIADMP CC(C)c1[nH+]c(CN2CCC(C[N@@H+](C)C(C)C)CC2)c2ccccn21 ZINC000651621579 1024045648 /nfs/dbraw/zinc/04/56/48/1024045648.db2.gz WPFBXQNFABFRBI-UHFFFAOYSA-N 2 1 342.531 4.010 20 0 EIADMP CC(C)c1[nH+]c(CN2CCC(C[N@H+](C)C(C)C)CC2)c2ccccn21 ZINC000651621579 1024045664 /nfs/dbraw/zinc/04/56/64/1024045664.db2.gz WPFBXQNFABFRBI-UHFFFAOYSA-N 2 1 342.531 4.010 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cc3cnccc3o2)CC[N@@H+]1Cc1ccccc1 ZINC000651637991 1024063720 /nfs/dbraw/zinc/06/37/20/1024063720.db2.gz HEEBYAABMNNZDA-YLJYHZDGSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cc3cnccc3o2)CC[N@H+]1Cc1ccccc1 ZINC000651637991 1024063738 /nfs/dbraw/zinc/06/37/38/1024063738.db2.gz HEEBYAABMNNZDA-YLJYHZDGSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2cc3cnccc3o2)CC[NH+]1Cc1ccccc1 ZINC000651637991 1024063750 /nfs/dbraw/zinc/06/37/50/1024063750.db2.gz HEEBYAABMNNZDA-YLJYHZDGSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cc3cnccc3o2)CC[NH+]1Cc1ccccc1 ZINC000651637991 1024063770 /nfs/dbraw/zinc/06/37/70/1024063770.db2.gz HEEBYAABMNNZDA-YLJYHZDGSA-N 2 1 349.478 4.313 20 0 EIADMP Fc1ccccc1Oc1cccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000651864448 1024117941 /nfs/dbraw/zinc/11/79/41/1024117941.db2.gz UKNSQBRUIZTJEY-MSOLQXFVSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1ccccc1Oc1cccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000651864448 1024117992 /nfs/dbraw/zinc/11/79/92/1024117992.db2.gz UKNSQBRUIZTJEY-MSOLQXFVSA-N 2 1 340.442 4.334 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C2CC2)C2CCOCC2)cc1 ZINC000651930267 1024274763 /nfs/dbraw/zinc/27/47/63/1024274763.db2.gz MZICRICFKFRBAJ-QVKFZJNVSA-N 2 1 339.483 4.037 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000510735625 1024372006 /nfs/dbraw/zinc/37/20/06/1024372006.db2.gz ONUHUSMTAVQWHW-JLSDUUJJSA-N 2 1 340.433 4.243 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)ccc1Cl ZINC000510738272 1024380117 /nfs/dbraw/zinc/38/01/17/1024380117.db2.gz VGMPBVKTDJRKKI-BBWFWOEESA-N 2 1 338.923 4.268 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1Cl ZINC000510738272 1024380124 /nfs/dbraw/zinc/38/01/24/1024380124.db2.gz VGMPBVKTDJRKKI-BBWFWOEESA-N 2 1 338.923 4.268 20 0 EIADMP CCSc1cccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000473138878 1024381749 /nfs/dbraw/zinc/38/17/49/1024381749.db2.gz HGCCRADDZDMVMT-YLJYHZDGSA-N 2 1 330.541 4.247 20 0 EIADMP CCSc1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000473138878 1024381761 /nfs/dbraw/zinc/38/17/61/1024381761.db2.gz HGCCRADDZDMVMT-YLJYHZDGSA-N 2 1 330.541 4.247 20 0 EIADMP CCSc1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000473138878 1024381775 /nfs/dbraw/zinc/38/17/75/1024381775.db2.gz HGCCRADDZDMVMT-YLJYHZDGSA-N 2 1 330.541 4.247 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccccc1C(F)(F)F ZINC000510793381 1024482032 /nfs/dbraw/zinc/48/20/32/1024482032.db2.gz CPBXDRSYKVMBCJ-UHFFFAOYSA-N 2 1 339.405 4.377 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000510793381 1024482044 /nfs/dbraw/zinc/48/20/44/1024482044.db2.gz CPBXDRSYKVMBCJ-UHFFFAOYSA-N 2 1 339.405 4.377 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000348835694 1024723222 /nfs/dbraw/zinc/72/32/22/1024723222.db2.gz AVRCSSOZFISROU-KKSFZXQISA-N 2 1 332.451 4.159 20 0 EIADMP COC1CCC(CC[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000548485646 1024838226 /nfs/dbraw/zinc/83/82/26/1024838226.db2.gz ASZZJZHNAJOVFY-UMDHHFKGSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C(Cc1ccccc1)Cc1ccccc1 ZINC000510937000 1024848930 /nfs/dbraw/zinc/84/89/30/1024848930.db2.gz XIOAHRPXXVNISO-UHFFFAOYSA-N 2 1 333.479 4.025 20 0 EIADMP Cc1ccncc1[C@@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510967781 1024870545 /nfs/dbraw/zinc/87/05/45/1024870545.db2.gz NFQLLUKTGNDOSV-WIYYLYMNSA-N 2 1 337.511 4.341 20 0 EIADMP Cc1ccncc1[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510967781 1024870547 /nfs/dbraw/zinc/87/05/47/1024870547.db2.gz NFQLLUKTGNDOSV-WIYYLYMNSA-N 2 1 337.511 4.341 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2nccn2-c2ccccc2)cc1 ZINC000277006646 1024993703 /nfs/dbraw/zinc/99/37/03/1024993703.db2.gz HRJORXXQNXZREJ-UHFFFAOYSA-N 2 1 348.494 4.004 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000684611409 1025056154 /nfs/dbraw/zinc/05/61/54/1025056154.db2.gz GLMNPPYBBXFDNC-OFNKIYASSA-N 2 1 349.522 4.425 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H](Oc2cccc(OC)c2)C1 ZINC001167824727 1025587021 /nfs/dbraw/zinc/58/70/21/1025587021.db2.gz FZDOOYYTJGQFCV-NQIIRXRSSA-N 2 1 348.531 4.049 20 0 EIADMP COc1cccc(CCC[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000303939293 1025589665 /nfs/dbraw/zinc/58/96/65/1025589665.db2.gz SIYIDRPZKPZNRG-OAQYLSRUSA-N 2 1 344.543 4.072 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+]1C[C@H]2[C@@H](C1)CCC[C@@H]2OCC1CC1 ZINC001167827666 1025668660 /nfs/dbraw/zinc/66/86/60/1025668660.db2.gz UNZHZGIPXRADAH-NRDMVMEKSA-N 2 1 336.564 4.024 20 0 EIADMP Cc1ccc(N2CCC([NH2+]Cc3cc4c(ccc(C)c4C)[nH]3)CC2)[nH+]c1 ZINC000472077368 1025689004 /nfs/dbraw/zinc/68/90/04/1025689004.db2.gz WSILYFOWHVHAHE-UHFFFAOYSA-N 2 1 348.494 4.247 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+][C@H](c2ccccc2)C2CCCC2)CCCO1 ZINC000432404666 1025870615 /nfs/dbraw/zinc/87/06/15/1025870615.db2.gz FFCPEKVNRQKPJN-GHTZIAJQSA-N 2 1 330.516 4.008 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2COc3ccccc32)cc1 ZINC000344011455 1025873187 /nfs/dbraw/zinc/87/31/87/1025873187.db2.gz DIWGPNSOEXWKQK-MAUKXSAKSA-N 2 1 333.435 4.008 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2COc3ccccc32)cc1 ZINC000344011458 1025873245 /nfs/dbraw/zinc/87/32/45/1025873245.db2.gz DIWGPNSOEXWKQK-YJBOKZPZSA-N 2 1 333.435 4.008 20 0 EIADMP CC(C)n1ccnc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000657309599 1025874431 /nfs/dbraw/zinc/87/44/31/1025874431.db2.gz DJPGGHNZYGGZQR-SFHVURJKSA-N 2 1 340.515 4.128 20 0 EIADMP CC(C)n1ccnc1C[NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000657309599 1025874449 /nfs/dbraw/zinc/87/44/49/1025874449.db2.gz DJPGGHNZYGGZQR-SFHVURJKSA-N 2 1 340.515 4.128 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(Cl)cc1 ZINC000432412235 1025883211 /nfs/dbraw/zinc/88/32/11/1025883211.db2.gz FSAQSRXSGVXEEL-VQIMIIECSA-N 2 1 338.923 4.128 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]Cc3ccc4occc4c3)C2)c1 ZINC000512099163 1025994635 /nfs/dbraw/zinc/99/46/35/1025994635.db2.gz KIORRWVZZGROFT-KRWDZBQOSA-N 2 1 340.492 4.496 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]Cc3ccc4occc4c3)C2)c1 ZINC000512099163 1025994654 /nfs/dbraw/zinc/99/46/54/1025994654.db2.gz KIORRWVZZGROFT-KRWDZBQOSA-N 2 1 340.492 4.496 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccncc1 ZINC000638718847 1026034161 /nfs/dbraw/zinc/03/41/61/1026034161.db2.gz MMLXTZDIKYUINP-ZNLUXHQJSA-N 2 1 335.495 4.143 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccncc1 ZINC000638718847 1026034182 /nfs/dbraw/zinc/03/41/82/1026034182.db2.gz MMLXTZDIKYUINP-ZNLUXHQJSA-N 2 1 335.495 4.143 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)c1 ZINC000344181392 1026099970 /nfs/dbraw/zinc/09/99/70/1026099970.db2.gz ZJFRTRFIFWEDLM-OAQYLSRUSA-N 2 1 326.459 4.445 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3ccncc3s2)c1 ZINC000657333084 1026138825 /nfs/dbraw/zinc/13/88/25/1026138825.db2.gz YRDYLXAVHOTYET-UHFFFAOYSA-N 2 1 339.508 4.426 20 0 EIADMP Fc1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CCC2)cc1 ZINC001167974371 1026173877 /nfs/dbraw/zinc/17/38/77/1026173877.db2.gz YFYCUUBXCJOAPZ-IHWFROFDSA-N 2 1 328.475 4.200 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC2([C@@H](C)CCO)CCC2)cc1 ZINC000344301514 1026228592 /nfs/dbraw/zinc/22/85/92/1026228592.db2.gz JNUMHOOVUSUWAS-DLBZAZTESA-N 2 1 341.499 4.020 20 0 EIADMP Cc1cncc(C[NH+]2CCC3(CCC[N@H+](C4CCCC4)C3)CC2)c1 ZINC001279573392 1026278423 /nfs/dbraw/zinc/27/84/23/1026278423.db2.gz CBGUSAXXDREBSG-UHFFFAOYSA-N 2 1 327.516 4.011 20 0 EIADMP CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CCC(F)(F)CC1 ZINC001167978531 1026344994 /nfs/dbraw/zinc/34/49/94/1026344994.db2.gz OKYHUPGZRFUIPS-ALOPSCKCSA-N 2 1 326.475 4.197 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC(C)(C)CC3)CC2)oc1C ZINC000657372435 1026368054 /nfs/dbraw/zinc/36/80/54/1026368054.db2.gz SPPLYLVJUBBFEG-LJQANCHMSA-N 2 1 347.547 4.452 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccc(F)cc1 ZINC000163523310 1026378740 /nfs/dbraw/zinc/37/87/40/1026378740.db2.gz CSVVXRCNXPNOON-LJQANCHMSA-N 2 1 327.447 4.239 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCCc4sccc43)CC2)[nH+]c1 ZINC000163513155 1026379645 /nfs/dbraw/zinc/37/96/45/1026379645.db2.gz FNYIITVDZMVYIH-KRWDZBQOSA-N 2 1 327.497 4.088 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3cc(F)c(F)c(F)c3)CC2)[nH+]c1 ZINC000163487875 1026380466 /nfs/dbraw/zinc/38/04/66/1026380466.db2.gz FZNLFQPRPYITOM-CYBMUJFWSA-N 2 1 349.400 4.127 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000550239231 1026393336 /nfs/dbraw/zinc/39/33/36/1026393336.db2.gz TUPAZDOIFKPBPH-PBHICJAKSA-N 2 1 326.406 4.184 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000550239231 1026393349 /nfs/dbraw/zinc/39/33/49/1026393349.db2.gz TUPAZDOIFKPBPH-PBHICJAKSA-N 2 1 326.406 4.184 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000550239231 1026393365 /nfs/dbraw/zinc/39/33/65/1026393365.db2.gz TUPAZDOIFKPBPH-PBHICJAKSA-N 2 1 326.406 4.184 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000550239231 1026393379 /nfs/dbraw/zinc/39/33/79/1026393379.db2.gz TUPAZDOIFKPBPH-PBHICJAKSA-N 2 1 326.406 4.184 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc3ncccc3c2)C1 ZINC000512196607 1026407936 /nfs/dbraw/zinc/40/79/36/1026407936.db2.gz OROIQBPFEBFNTK-UYAOXDASSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc3ncccc3c2)C1 ZINC000512196607 1026407947 /nfs/dbraw/zinc/40/79/47/1026407947.db2.gz OROIQBPFEBFNTK-UYAOXDASSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc3ncccc3c2)C1 ZINC000512196607 1026407953 /nfs/dbraw/zinc/40/79/53/1026407953.db2.gz OROIQBPFEBFNTK-UYAOXDASSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc3ncccc3c2)C1 ZINC000512196607 1026407959 /nfs/dbraw/zinc/40/79/59/1026407959.db2.gz OROIQBPFEBFNTK-UYAOXDASSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc3ncccc3c2)C1 ZINC000512196605 1026409314 /nfs/dbraw/zinc/40/93/14/1026409314.db2.gz OROIQBPFEBFNTK-QUCCMNQESA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc3ncccc3c2)C1 ZINC000512196605 1026409323 /nfs/dbraw/zinc/40/93/23/1026409323.db2.gz OROIQBPFEBFNTK-QUCCMNQESA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc3ncccc3c2)C1 ZINC000512196605 1026409331 /nfs/dbraw/zinc/40/93/31/1026409331.db2.gz OROIQBPFEBFNTK-QUCCMNQESA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc3ncccc3c2)C1 ZINC000512196605 1026409347 /nfs/dbraw/zinc/40/93/47/1026409347.db2.gz OROIQBPFEBFNTK-QUCCMNQESA-N 2 1 337.511 4.321 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(F)c(F)cc2F)CC1 ZINC000506890812 1026507395 /nfs/dbraw/zinc/50/73/95/1026507395.db2.gz AHBYERLJMFGLAS-UHFFFAOYSA-N 2 1 328.422 4.048 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(F)c(F)cc2F)CC1 ZINC000506890812 1026507406 /nfs/dbraw/zinc/50/74/06/1026507406.db2.gz AHBYERLJMFGLAS-UHFFFAOYSA-N 2 1 328.422 4.048 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1)c1ccccn1 ZINC000158671136 1026620795 /nfs/dbraw/zinc/62/07/95/1026620795.db2.gz AQWCYSGSEPENMI-FHWLQOOXSA-N 2 1 337.511 4.410 20 0 EIADMP Cc1ccc2cc(C[NH2+][C@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)[nH]c2c1 ZINC000657429839 1026641064 /nfs/dbraw/zinc/64/10/64/1026641064.db2.gz LMEDEXIBHHNPJC-AEFFLSMTSA-N 2 1 325.500 4.219 20 0 EIADMP Cc1ccc2cc(C[NH2+][C@H](C)[C@@H]3CCC[N@H+](C4CCC4)C3)[nH]c2c1 ZINC000657429843 1026641204 /nfs/dbraw/zinc/64/12/04/1026641204.db2.gz LMEDEXIBHHNPJC-SJLPKXTDSA-N 2 1 325.500 4.219 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCCOc2cccc3ccccc32)CC1 ZINC000507362353 1026765980 /nfs/dbraw/zinc/76/59/80/1026765980.db2.gz QVHOZDZHASZPIN-UHFFFAOYSA-N 2 1 340.511 4.413 20 0 EIADMP C[C@@H]([NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1)[C@H]1CCCOC1 ZINC000507533211 1026830936 /nfs/dbraw/zinc/83/09/36/1026830936.db2.gz NPUBOLSZZXUYTE-HBFSDRIKSA-N 2 1 330.516 4.055 20 0 EIADMP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](CCc3ccncc3)CC2)c2ccccc21 ZINC000152872036 1026858667 /nfs/dbraw/zinc/85/86/67/1026858667.db2.gz AVNMKKTZVGXIQZ-WZONZLPQSA-N 2 1 349.522 4.317 20 0 EIADMP Cc1[nH+]c2ccc(-n3cc(CC[NH3+])c4cc(O)ccc43)cc2n1C(C)C ZINC001167986710 1026869809 /nfs/dbraw/zinc/86/98/09/1026869809.db2.gz ZZPIHDDQXGBABD-UHFFFAOYSA-N 2 1 348.450 4.076 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cccnc32)cc1 ZINC000684957071 1026891494 /nfs/dbraw/zinc/89/14/94/1026891494.db2.gz GMXLGSURGLUMEO-FOIQADDNSA-N 2 1 332.451 4.304 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCCc3cccnc32)C[N@H+]1Cc1ccccc1 ZINC000684960970 1026899618 /nfs/dbraw/zinc/89/96/18/1026899618.db2.gz VVQREQUABORPIE-CBQOVEMMSA-N 2 1 349.522 4.349 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCOc2ccc(Cl)cc21 ZINC000164592516 1026963223 /nfs/dbraw/zinc/96/32/23/1026963223.db2.gz BPDGBFFVIAJMQU-KRWDZBQOSA-N 2 1 333.863 4.129 20 0 EIADMP CSCCCC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000925093160 1027028768 /nfs/dbraw/zinc/02/87/68/1027028768.db2.gz AVAQMOSKYCOETB-IHWFROFDSA-N 2 1 332.557 4.305 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCOc2cc(C)c(C)cc21 ZINC000164649272 1027072290 /nfs/dbraw/zinc/07/22/90/1027072290.db2.gz GNQFMKCLGGVOAA-LJQANCHMSA-N 2 1 327.472 4.092 20 0 EIADMP Cc1cc(NC[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302504985 1027322283 /nfs/dbraw/zinc/32/22/83/1027322283.db2.gz WBRVNHILBAMCQG-RDTXWAMCSA-N 2 1 333.838 4.287 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](CCc1ccc(C)cc1)Cc1ccco1 ZINC000342858826 1027329815 /nfs/dbraw/zinc/32/98/15/1027329815.db2.gz GMZBTBJHLQOTIN-UHFFFAOYSA-N 2 1 337.467 4.228 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](CCc1ccc(C)cc1)Cc1ccco1 ZINC000342858826 1027329835 /nfs/dbraw/zinc/32/98/35/1027329835.db2.gz GMZBTBJHLQOTIN-UHFFFAOYSA-N 2 1 337.467 4.228 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000441322845 1027458280 /nfs/dbraw/zinc/45/82/80/1027458280.db2.gz LGKCTDQSFJYOED-UHFFFAOYSA-N 2 1 333.426 4.305 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000441322845 1027458290 /nfs/dbraw/zinc/45/82/90/1027458290.db2.gz LGKCTDQSFJYOED-UHFFFAOYSA-N 2 1 333.426 4.305 20 0 EIADMP Clc1ccc(CCC[N@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)cc1 ZINC000441410718 1027527033 /nfs/dbraw/zinc/52/70/33/1027527033.db2.gz LTMXLAKPEYUKPX-FXAWDEMLSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441410718 1027527048 /nfs/dbraw/zinc/52/70/48/1027527048.db2.gz LTMXLAKPEYUKPX-FXAWDEMLSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441410718 1027527067 /nfs/dbraw/zinc/52/70/67/1027527067.db2.gz LTMXLAKPEYUKPX-FXAWDEMLSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000441410718 1027527083 /nfs/dbraw/zinc/52/70/83/1027527083.db2.gz LTMXLAKPEYUKPX-FXAWDEMLSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000441410718 1027527097 /nfs/dbraw/zinc/52/70/97/1027527097.db2.gz LTMXLAKPEYUKPX-FXAWDEMLSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1cccc(OCCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441403229 1027541732 /nfs/dbraw/zinc/54/17/32/1027541732.db2.gz CERSPABZYFZHIX-UZLBHIALSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000441403229 1027541751 /nfs/dbraw/zinc/54/17/51/1027541751.db2.gz CERSPABZYFZHIX-UZLBHIALSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000441403229 1027541769 /nfs/dbraw/zinc/54/17/69/1027541769.db2.gz CERSPABZYFZHIX-UZLBHIALSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1cccc(OCCC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000441403229 1027541778 /nfs/dbraw/zinc/54/17/78/1027541778.db2.gz CERSPABZYFZHIX-UZLBHIALSA-N 2 1 348.918 4.058 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1OC ZINC000152465775 1027661761 /nfs/dbraw/zinc/66/17/61/1027661761.db2.gz LGEWIZXJLJYNJQ-SJORKVTESA-N 2 1 346.515 4.009 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474881953 1027729034 /nfs/dbraw/zinc/72/90/34/1027729034.db2.gz SPMRLWHJRGUKQI-UHFFFAOYSA-N 2 1 327.299 4.168 20 0 EIADMP Fc1cccc([C@H]2CC[N@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)c1 ZINC001167995011 1027736610 /nfs/dbraw/zinc/73/66/10/1027736610.db2.gz TYMFMBCQCZUTSG-YBVXAUJNSA-N 2 1 328.475 4.020 20 0 EIADMP Fc1cccc([C@H]2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)C2)c1 ZINC001167995011 1027736648 /nfs/dbraw/zinc/73/66/48/1027736648.db2.gz TYMFMBCQCZUTSG-YBVXAUJNSA-N 2 1 328.475 4.020 20 0 EIADMP Fc1cccc([C@H]2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)C2)c1 ZINC001167995011 1027736671 /nfs/dbraw/zinc/73/66/71/1027736671.db2.gz TYMFMBCQCZUTSG-YBVXAUJNSA-N 2 1 328.475 4.020 20 0 EIADMP CCCc1nc(C)c(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)o1 ZINC000428366736 1027803489 /nfs/dbraw/zinc/80/34/89/1027803489.db2.gz ZABQIFAWVPZULD-KRWDZBQOSA-N 2 1 347.547 4.412 20 0 EIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](CCCc4cccnc4)CC[C@H]32)cc1 ZINC001167646332 1027827518 /nfs/dbraw/zinc/82/75/18/1027827518.db2.gz AUFPPRKHFPYAQU-DHIUTWEWSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](CCCc4cccnc4)CC[C@H]32)cc1 ZINC001167646332 1027827523 /nfs/dbraw/zinc/82/75/23/1027827523.db2.gz AUFPPRKHFPYAQU-DHIUTWEWSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](CCCc4cccnc4)CC[C@H]32)cc1 ZINC001167646332 1027827529 /nfs/dbraw/zinc/82/75/29/1027827529.db2.gz AUFPPRKHFPYAQU-DHIUTWEWSA-N 2 1 349.522 4.001 20 0 EIADMP Fc1cccc([C@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167996133 1027847191 /nfs/dbraw/zinc/84/71/91/1027847191.db2.gz XEGOZEJYUMDGKC-JGUMPVPUSA-N 2 1 328.475 4.368 20 0 EIADMP Fc1cccc([C@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167996133 1027847193 /nfs/dbraw/zinc/84/71/93/1027847193.db2.gz XEGOZEJYUMDGKC-JGUMPVPUSA-N 2 1 328.475 4.368 20 0 EIADMP Fc1cccc([C@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167996133 1027847194 /nfs/dbraw/zinc/84/71/94/1027847194.db2.gz XEGOZEJYUMDGKC-JGUMPVPUSA-N 2 1 328.475 4.368 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]CCC[NH+]2CCCCC2)cc1OC ZINC000444606743 1027888022 /nfs/dbraw/zinc/88/80/22/1027888022.db2.gz GTGSRJNCYOXXRP-QGZVFWFLSA-N 2 1 334.504 4.011 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H](C)CCc2cccc(C(F)(F)F)c2)C1 ZINC000583052205 1027904255 /nfs/dbraw/zinc/90/42/55/1027904255.db2.gz XZOKBYUPMBPEDD-DOTOQJQBSA-N 2 1 342.449 4.346 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H](C)CCc2cccc(C(F)(F)F)c2)C1 ZINC000583052207 1027904877 /nfs/dbraw/zinc/90/48/77/1027904877.db2.gz XZOKBYUPMBPEDD-RDJZCZTQSA-N 2 1 342.449 4.346 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000548786381 1027930915 /nfs/dbraw/zinc/93/09/15/1027930915.db2.gz UQZZIFGAYMJBOR-MRXNPFEDSA-N 2 1 344.449 4.028 20 0 EIADMP Cc1cccc2nc(C3CC[NH+](CC[C@H]4CCCC[N@@H+]4C)CC3)oc21 ZINC000444780293 1028045034 /nfs/dbraw/zinc/04/50/34/1028045034.db2.gz FSVBBTLLUBEHLF-GOSISDBHSA-N 2 1 341.499 4.190 20 0 EIADMP CCCCc1oc2ccccc2c1C[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000324148538 1028161957 /nfs/dbraw/zinc/16/19/57/1028161957.db2.gz AXPCNKZXIZKNJI-INIZCTEOSA-N 2 1 326.484 4.349 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cnc(Cl)s2)CC1 ZINC000079319870 1028263271 /nfs/dbraw/zinc/26/32/71/1028263271.db2.gz MOAZIAHPCADEGO-UHFFFAOYSA-N 2 1 349.931 4.141 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cnc(Cl)s2)CC1 ZINC000079319870 1028263294 /nfs/dbraw/zinc/26/32/94/1028263294.db2.gz MOAZIAHPCADEGO-UHFFFAOYSA-N 2 1 349.931 4.141 20 0 EIADMP Cc1cccc([C@@H](O)C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1 ZINC001167660089 1028268356 /nfs/dbraw/zinc/26/83/56/1028268356.db2.gz ZFKIRFZPWGYURR-KNQAVFIVSA-N 2 1 344.543 4.005 20 0 EIADMP Cc1nc(CC[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)cs1 ZINC000280931311 1028283965 /nfs/dbraw/zinc/28/39/65/1028283965.db2.gz HDUOGZCRSTUDOF-UHFFFAOYSA-N 2 1 343.540 4.027 20 0 EIADMP CC[C@H](C)[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1ccccc1 ZINC000346152054 1028286262 /nfs/dbraw/zinc/28/62/62/1028286262.db2.gz OMOXVTFVFXUVPH-KRWDZBQOSA-N 2 1 334.467 4.376 20 0 EIADMP Cc1ccc(C[N@@H+](Cc2cn(-c3cc[nH+]cc3)nc2C)C(C)C)s1 ZINC000346186911 1028293526 /nfs/dbraw/zinc/29/35/26/1028293526.db2.gz WJCJJGLXYGWORD-UHFFFAOYSA-N 2 1 340.496 4.356 20 0 EIADMP Cc1nn(-c2ccncc2)cc1CN(C)[C@@H](C)c1ccccc1Cl ZINC000346160427 1028295783 /nfs/dbraw/zinc/29/57/83/1028295783.db2.gz WQRBORBOXXWDFF-HNNXBMFYSA-N 2 1 340.858 4.422 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC[N@@H+]1C ZINC000280948330 1028299403 /nfs/dbraw/zinc/29/94/03/1028299403.db2.gz XCUBHQRGRDSTPW-ODVANORSSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC[N@H+]1C ZINC000280948330 1028299422 /nfs/dbraw/zinc/29/94/22/1028299422.db2.gz XCUBHQRGRDSTPW-ODVANORSSA-N 2 1 326.406 4.024 20 0 EIADMP Cc1nccn1CC[N@H+]1CCc2ccccc2[C@@H]1Cc1ccccc1 ZINC000346179711 1028306731 /nfs/dbraw/zinc/30/67/31/1028306731.db2.gz JKRZTCFEIIQCHU-QFIPXVFZSA-N 2 1 331.463 4.034 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000346178266 1028309406 /nfs/dbraw/zinc/30/94/06/1028309406.db2.gz OWNGADWMAPIENQ-OAQYLSRUSA-N 2 1 346.478 4.173 20 0 EIADMP CCc1cccc2c(C3CC[NH+](CCn4cc[nH+]c4C)CC3)c[nH]c21 ZINC000346312289 1028379508 /nfs/dbraw/zinc/37/95/08/1028379508.db2.gz OYEWWUINTLAURQ-UHFFFAOYSA-N 2 1 336.483 4.115 20 0 EIADMP Brc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCC2 ZINC000092721002 1028609381 /nfs/dbraw/zinc/60/93/81/1028609381.db2.gz BIMVEASNHMQSME-GOSISDBHSA-N 2 1 349.316 4.043 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CC[C@H](C)c3ccccc32)cn1 ZINC000126438326 1028613077 /nfs/dbraw/zinc/61/30/77/1028613077.db2.gz SVSMMOWBMCZOLE-MGPUTAFESA-N 2 1 332.451 4.304 20 0 EIADMP CC(C)n1cc([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cn1 ZINC000156224855 1028678981 /nfs/dbraw/zinc/67/89/81/1028678981.db2.gz OCGRJJPCOSEXHQ-ZWKOTPCHSA-N 2 1 328.504 4.025 20 0 EIADMP CC(C)n1cc([C@@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)cn1 ZINC000156224855 1028679008 /nfs/dbraw/zinc/67/90/08/1028679008.db2.gz OCGRJJPCOSEXHQ-ZWKOTPCHSA-N 2 1 328.504 4.025 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC[C@H]2CCO[C@@H](C)C2)cc1 ZINC000346858956 1028796077 /nfs/dbraw/zinc/79/60/77/1028796077.db2.gz HLGJXNJQTZCOJU-BQFCYCMXSA-N 2 1 327.472 4.037 20 0 EIADMP Cc1nc(F)ccc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000278285148 1028820512 /nfs/dbraw/zinc/82/05/12/1028820512.db2.gz BFSSEEUKWSVAEW-MRXNPFEDSA-N 2 1 341.474 4.193 20 0 EIADMP C(=C\C[N@H+]1CCC[C@H]1c1cccnc1)\C[NH+]1CCC[C@@H]1c1cccnc1 ZINC000346978602 1028831692 /nfs/dbraw/zinc/83/16/92/1028831692.db2.gz UEZABGVONGZQNQ-LJLUTMTPSA-N 2 1 348.494 4.007 20 0 EIADMP C(=C\C[N@@H+]1CCC[C@@H]1c1cccnc1)\C[NH+]1CCC[C@H]1c1cccnc1 ZINC000346978602 1028831694 /nfs/dbraw/zinc/83/16/94/1028831694.db2.gz UEZABGVONGZQNQ-LJLUTMTPSA-N 2 1 348.494 4.007 20 0 EIADMP C(=C\C[N@H+]1CCC[C@@H]1c1cccnc1)\C[NH+]1CCC[C@H]1c1cccnc1 ZINC000346978602 1028831697 /nfs/dbraw/zinc/83/16/97/1028831697.db2.gz UEZABGVONGZQNQ-LJLUTMTPSA-N 2 1 348.494 4.007 20 0 EIADMP [NH3+]Cc1ccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2Cl)c(F)c1 ZINC000650717812 1028876766 /nfs/dbraw/zinc/87/67/66/1028876766.db2.gz NQMPIZOUXDCSBH-UHFFFAOYSA-N 2 1 346.755 4.246 20 0 EIADMP CC(C)O[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000428325948 1028884089 /nfs/dbraw/zinc/88/40/89/1028884089.db2.gz OMVAWMLDOVTIHS-CZTZKLFOSA-N 2 1 344.543 4.395 20 0 EIADMP Cc1cccnc1CCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000583692970 1029043935 /nfs/dbraw/zinc/04/39/35/1029043935.db2.gz RQDJKSUOFLIEHT-NRFANRHFSA-N 2 1 349.522 4.109 20 0 EIADMP Cc1cccnc1CCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000583692970 1029043948 /nfs/dbraw/zinc/04/39/48/1029043948.db2.gz RQDJKSUOFLIEHT-NRFANRHFSA-N 2 1 349.522 4.109 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444200772 1029072157 /nfs/dbraw/zinc/07/21/57/1029072157.db2.gz UESXPABGYIFMDL-JKSUJKDBSA-N 2 1 338.442 4.157 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444200772 1029072175 /nfs/dbraw/zinc/07/21/75/1029072175.db2.gz UESXPABGYIFMDL-JKSUJKDBSA-N 2 1 338.442 4.157 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](c3ccncc3)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168053358 1029160971 /nfs/dbraw/zinc/16/09/71/1029160971.db2.gz OCGOLJUOUGSCFN-IYRWYFENSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@H](c3ccncc3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053358 1029160983 /nfs/dbraw/zinc/16/09/83/1029160983.db2.gz OCGOLJUOUGSCFN-IYRWYFENSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3ccncc3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053358 1029160994 /nfs/dbraw/zinc/16/09/94/1029160994.db2.gz OCGOLJUOUGSCFN-IYRWYFENSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000511244938 1029255599 /nfs/dbraw/zinc/25/55/99/1029255599.db2.gz XDDLYRHBZQWAPK-OXFYSEKESA-N 2 1 344.524 4.057 20 0 EIADMP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000511244938 1029255619 /nfs/dbraw/zinc/25/56/19/1029255619.db2.gz XDDLYRHBZQWAPK-OXFYSEKESA-N 2 1 344.524 4.057 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(F)(F)F ZINC000583934206 1029382722 /nfs/dbraw/zinc/38/27/22/1029382722.db2.gz SGFZMEGXYIXBOS-MRXNPFEDSA-N 2 1 340.433 4.362 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(F)(F)F ZINC000583934206 1029382740 /nfs/dbraw/zinc/38/27/40/1029382740.db2.gz SGFZMEGXYIXBOS-MRXNPFEDSA-N 2 1 340.433 4.362 20 0 EIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H](Cc1ccccc1)c1ccccc1F ZINC000583942567 1029394100 /nfs/dbraw/zinc/39/41/00/1029394100.db2.gz ILPRNIUHAZDMPU-NRFANRHFSA-N 2 1 337.442 4.065 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000508567472 1029419620 /nfs/dbraw/zinc/41/96/20/1029419620.db2.gz YNKVAAUBOVAKQB-SFHVURJKSA-N 2 1 340.511 4.401 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000508567472 1029419628 /nfs/dbraw/zinc/41/96/28/1029419628.db2.gz YNKVAAUBOVAKQB-SFHVURJKSA-N 2 1 340.511 4.401 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000508567472 1029419637 /nfs/dbraw/zinc/41/96/37/1029419637.db2.gz YNKVAAUBOVAKQB-SFHVURJKSA-N 2 1 340.511 4.401 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000508567472 1029419643 /nfs/dbraw/zinc/41/96/43/1029419643.db2.gz YNKVAAUBOVAKQB-SFHVURJKSA-N 2 1 340.511 4.401 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000151269327 1029451107 /nfs/dbraw/zinc/45/11/07/1029451107.db2.gz BAMQUSNITUXUDE-QRQLOZEOSA-N 2 1 328.525 4.413 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000151269327 1029451117 /nfs/dbraw/zinc/45/11/17/1029451117.db2.gz BAMQUSNITUXUDE-QRQLOZEOSA-N 2 1 328.525 4.413 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@H](C(F)(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168061385 1029539925 /nfs/dbraw/zinc/53/99/25/1029539925.db2.gz IFESMEYCIUAQKE-INMHGKMJSA-N 2 1 340.433 4.312 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)CC(F)F ZINC000647320053 1029547532 /nfs/dbraw/zinc/54/75/32/1029547532.db2.gz SZACUPKOSZXREN-JCHJZTRSSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@H]([NH+](C)Cc1cncc(C[N@H+](C)[C@@H](C)C2(C)CC2)c1)C1(C)CC1 ZINC000584094450 1029612572 /nfs/dbraw/zinc/61/25/72/1029612572.db2.gz PTPUIXZKJKSSLE-IRXDYDNUSA-N 2 1 329.532 4.322 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C3CC(C)(C)[NH2+]C(C)(C)C3)oc21 ZINC000192935203 1029650949 /nfs/dbraw/zinc/65/09/49/1029650949.db2.gz RKGISWXNUXIJKO-CYBMUJFWSA-N 2 1 330.472 4.401 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@H]([NH3+])C[C@H]3C)s2)cc1 ZINC000584180406 1029661311 /nfs/dbraw/zinc/66/13/11/1029661311.db2.gz MJDFJSHPRBEJAO-PBHICJAKSA-N 2 1 329.513 4.245 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@H]([NH3+])C[C@H]3C)s2)cc1 ZINC000584180406 1029661315 /nfs/dbraw/zinc/66/13/15/1029661315.db2.gz MJDFJSHPRBEJAO-PBHICJAKSA-N 2 1 329.513 4.245 20 0 EIADMP c1ccc([C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)[C@@H]2CCCO2)cc1 ZINC000584188391 1029664448 /nfs/dbraw/zinc/66/44/48/1029664448.db2.gz FAMZOTAYDYSAJN-VXKWHMMOSA-N 2 1 342.527 4.293 20 0 EIADMP Cc1cccc(C[NH+]2CCC(N[C@@H](C)c3cnn(C(C)C)c3)CC2)c1 ZINC000159355757 1029700741 /nfs/dbraw/zinc/70/07/41/1029700741.db2.gz HRQWCPURFIUKJN-SFHVURJKSA-N 2 1 340.515 4.088 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000708510420 1029743684 /nfs/dbraw/zinc/74/36/84/1029743684.db2.gz JXVSRBSVBCUHFN-OXQOHEQNSA-N 2 1 344.449 4.482 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)s1 ZINC000584411431 1029833839 /nfs/dbraw/zinc/83/38/39/1029833839.db2.gz OMUMQMOLHHXSEH-SFHVURJKSA-N 2 1 341.524 4.047 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)s1 ZINC000584411431 1029833843 /nfs/dbraw/zinc/83/38/43/1029833843.db2.gz OMUMQMOLHHXSEH-SFHVURJKSA-N 2 1 341.524 4.047 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CCCC2)CC1)c1cc2cnccc2o1 ZINC000657859693 1029844875 /nfs/dbraw/zinc/84/48/75/1029844875.db2.gz XCTAEMGEWBGWSX-OAHLLOKOSA-N 2 1 327.472 4.133 20 0 EIADMP C[N@H+]1CC[C@H](C[NH2+]Cc2ccc3occc3c2)[C@@H]1c1cccs1 ZINC000375751892 1029865304 /nfs/dbraw/zinc/86/53/04/1029865304.db2.gz YBYZZMBGUXNQDJ-VQIMIIECSA-N 2 1 326.465 4.277 20 0 EIADMP CCc1cc(CCC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)on1 ZINC000450684685 1029897053 /nfs/dbraw/zinc/89/70/53/1029897053.db2.gz RXRGQJQVKLHEDN-HNNXBMFYSA-N 2 1 338.455 4.015 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccc(F)cn1 ZINC000092743140 1029934956 /nfs/dbraw/zinc/93/49/56/1029934956.db2.gz KTQROGSSAPSUHK-QGZVFWFLSA-N 2 1 341.474 4.448 20 0 EIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000525694896 1029939310 /nfs/dbraw/zinc/93/93/10/1029939310.db2.gz QBVMMBUYMDLQKU-CALCHBBNSA-N 2 1 326.484 4.356 20 0 EIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000525694896 1029939322 /nfs/dbraw/zinc/93/93/22/1029939322.db2.gz QBVMMBUYMDLQKU-CALCHBBNSA-N 2 1 326.484 4.356 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@H+](CC/C=C\c3ccccc3)C1)CCCC2 ZINC000450788529 1029982378 /nfs/dbraw/zinc/98/23/78/1029982378.db2.gz UKMLICDVMODECS-RVPHRTOXSA-N 2 1 335.495 4.421 20 0 EIADMP Cc1[nH+]c2c(n1[C@@H]1CC[N@@H+](CC/C=C\c3ccccc3)C1)CCCC2 ZINC000450788529 1029982407 /nfs/dbraw/zinc/98/24/07/1029982407.db2.gz UKMLICDVMODECS-RVPHRTOXSA-N 2 1 335.495 4.421 20 0 EIADMP Fc1ccc(C[C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000447536259 1030142772 /nfs/dbraw/zinc/14/27/72/1030142772.db2.gz LZPUEEIWBHOTNO-XMSQKQJNSA-N 2 1 338.470 4.183 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)cc2)c1 ZINC000443970353 1030226508 /nfs/dbraw/zinc/22/65/08/1030226508.db2.gz UFLAXWQQCNEMMD-QGZVFWFLSA-N 2 1 340.442 4.192 20 0 EIADMP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001168165166 1030248934 /nfs/dbraw/zinc/24/89/34/1030248934.db2.gz HRMILEFVHORCJL-OAHLLOKOSA-N 2 1 346.877 4.360 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH+](C)[C@@H]1CC[N@@H+](C)C[C@@H]1C ZINC000685470049 1030356977 /nfs/dbraw/zinc/35/69/77/1030356977.db2.gz LMSWROTUWHNWPP-MHZPLBOYSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH+](C)[C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000685470049 1030357003 /nfs/dbraw/zinc/35/70/03/1030357003.db2.gz LMSWROTUWHNWPP-MHZPLBOYSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[N@@H+](C)[C@@H]1CC[NH+](C)C[C@@H]1C ZINC000685470049 1030357018 /nfs/dbraw/zinc/35/70/18/1030357018.db2.gz LMSWROTUWHNWPP-MHZPLBOYSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[N@H+](C)[C@@H]1CC[NH+](C)C[C@@H]1C ZINC000685470049 1030357031 /nfs/dbraw/zinc/35/70/31/1030357031.db2.gz LMSWROTUWHNWPP-MHZPLBOYSA-N 2 1 340.433 4.381 20 0 EIADMP CCOC1CCC([NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)CC1 ZINC000657891316 1030361128 /nfs/dbraw/zinc/36/11/28/1030361128.db2.gz ZEYZALOINJXLKH-FQVISZRSSA-N 2 1 330.516 4.149 20 0 EIADMP C[C@@H]([NH2+]CCc1ccc(F)c(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527041845 1030421643 /nfs/dbraw/zinc/42/16/43/1030421643.db2.gz BSTWTEHIJUHSFI-APWZRJJASA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]([NH2+]CCCc1ccccc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000530477268 1030447641 /nfs/dbraw/zinc/44/76/41/1030447641.db2.gz XBPRETQYAMNESR-GHTZIAJQSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(c2ccc(F)cc2)CC1 ZINC001168169306 1030451761 /nfs/dbraw/zinc/45/17/61/1030451761.db2.gz WYJWUNNWEZORNB-HNNXBMFYSA-N 2 1 346.877 4.360 20 0 EIADMP Cc1cccc2nc(C3CC[NH+](CCC[NH+]4CCCCC4)CC3)oc21 ZINC000189804054 1030511408 /nfs/dbraw/zinc/51/14/08/1030511408.db2.gz ORIZJNAZKWHRBD-UHFFFAOYSA-N 2 1 341.499 4.192 20 0 EIADMP COC[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccc(Cl)c1 ZINC000685645164 1030614238 /nfs/dbraw/zinc/61/42/38/1030614238.db2.gz KLIOHYXLUTZTLB-APWZRJJASA-N 2 1 338.923 4.129 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCOc2cccc3ccccc32)CCN1C ZINC000530666368 1030620495 /nfs/dbraw/zinc/62/04/95/1030620495.db2.gz UVVGMLFIWSWFHE-MJGOQNOKSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCOc2cccc3ccccc32)CC[N@@H+]1C ZINC000530666368 1030620505 /nfs/dbraw/zinc/62/05/05/1030620505.db2.gz UVVGMLFIWSWFHE-MJGOQNOKSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)CCCOc2cccc3ccccc32)CC[N@H+]1C ZINC000530666368 1030620521 /nfs/dbraw/zinc/62/05/21/1030620521.db2.gz UVVGMLFIWSWFHE-MJGOQNOKSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCOc2cccc3ccccc32)CC[NH+]1C ZINC000530666368 1030620537 /nfs/dbraw/zinc/62/05/37/1030620537.db2.gz UVVGMLFIWSWFHE-MJGOQNOKSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCOc2cccc3ccccc32)CC[NH+]1C ZINC000530666368 1030620558 /nfs/dbraw/zinc/62/05/58/1030620558.db2.gz UVVGMLFIWSWFHE-MJGOQNOKSA-N 2 1 326.484 4.023 20 0 EIADMP CCOC1CCC([NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000657933749 1030629359 /nfs/dbraw/zinc/62/93/59/1030629359.db2.gz VFCDYNUWTHIUGV-UREXAPBRSA-N 2 1 344.543 4.224 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(C(F)F)nc2)C1 ZINC000657932239 1030637107 /nfs/dbraw/zinc/63/71/07/1030637107.db2.gz VAJNSEPGZLPTBD-GJZGRUSLSA-N 2 1 325.447 4.038 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(C(F)F)nc2)C1 ZINC000657932239 1030637120 /nfs/dbraw/zinc/63/71/20/1030637120.db2.gz VAJNSEPGZLPTBD-GJZGRUSLSA-N 2 1 325.447 4.038 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527349642 1030640250 /nfs/dbraw/zinc/64/02/50/1030640250.db2.gz PVYVVBGCFVMPMX-SZMVWBNQSA-N 2 1 342.449 4.464 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527349640 1030642352 /nfs/dbraw/zinc/64/23/52/1030642352.db2.gz PVYVVBGCFVMPMX-NJAFHUGGSA-N 2 1 342.449 4.464 20 0 EIADMP C[C@@H](CC1CCOCC1)[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000685665255 1030664534 /nfs/dbraw/zinc/66/45/34/1030664534.db2.gz ZWTBYODIVNWVFH-SIKLNZKXSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(O[C@H](C)c2ccccc2)cc1 ZINC000657982949 1030740550 /nfs/dbraw/zinc/74/05/50/1030740550.db2.gz PCPDHLYGPYKHJB-QZTJIDSGSA-N 2 1 349.478 4.453 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(C(F)F)nc1 ZINC000657999295 1030768953 /nfs/dbraw/zinc/76/89/53/1030768953.db2.gz TXCYQKJMBFALSV-RDJZCZTQSA-N 2 1 345.437 4.192 20 0 EIADMP CCOC1CCC([NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000658018539 1030782739 /nfs/dbraw/zinc/78/27/39/1030782739.db2.gz ITZABOUJHDBJML-ITAUSPCMSA-N 2 1 344.543 4.226 20 0 EIADMP Clc1cnccc1C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000527632504 1030788074 /nfs/dbraw/zinc/78/80/74/1030788074.db2.gz IQZWSTOICJCRHD-UHFFFAOYSA-N 2 1 329.875 4.011 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCc4ccc(O)cc43)CC2)C1 ZINC000658241845 1030899449 /nfs/dbraw/zinc/89/94/49/1030899449.db2.gz VUAVROFXFMIZIT-YWMUFLPLSA-N 2 1 328.500 4.012 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCc4ccc(O)cc43)CC2)C1 ZINC000658241843 1030900228 /nfs/dbraw/zinc/90/02/28/1030900228.db2.gz VUAVROFXFMIZIT-FQELHTAISA-N 2 1 328.500 4.012 20 0 EIADMP COc1cccc(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000531188850 1030954368 /nfs/dbraw/zinc/95/43/68/1030954368.db2.gz NHTAQWYUPAQRTH-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000531188850 1030954390 /nfs/dbraw/zinc/95/43/90/1030954390.db2.gz NHTAQWYUPAQRTH-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000531188850 1030954399 /nfs/dbraw/zinc/95/43/99/1030954399.db2.gz NHTAQWYUPAQRTH-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000531188850 1030954411 /nfs/dbraw/zinc/95/44/11/1030954411.db2.gz NHTAQWYUPAQRTH-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP Cc1ccccc1[C@H]([NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)C1CCCC1 ZINC000658296195 1030959707 /nfs/dbraw/zinc/95/97/07/1030959707.db2.gz RAJJTKBUXWJVEW-IFMALSPDSA-N 2 1 342.527 4.069 20 0 EIADMP Cc1cccc(N([C@@H](C)Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)[nH+]1 ZINC001168191882 1030973554 /nfs/dbraw/zinc/97/35/54/1030973554.db2.gz LAHOXCULGSCIQR-INIZCTEOSA-N 2 1 343.902 4.233 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cncs1 ZINC000658319531 1030977525 /nfs/dbraw/zinc/97/75/25/1030977525.db2.gz FYEQZJAXPOQXRL-FUHWJXTLSA-N 2 1 341.524 4.096 20 0 EIADMP Cc1cncc([C@H](C)[NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000658320182 1030978997 /nfs/dbraw/zinc/97/89/97/1030978997.db2.gz PLRQHZYWPSYAOD-SIKLNZKXSA-N 2 1 349.522 4.343 20 0 EIADMP C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527964483 1031007281 /nfs/dbraw/zinc/00/72/81/1031007281.db2.gz KSCRHKLTRJXPFS-HARLFGEKSA-N 2 1 349.522 4.423 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCSc2ccc(Cl)cc2)[C@@H](C)C1 ZINC001167686157 1031028456 /nfs/dbraw/zinc/02/84/56/1031028456.db2.gz OICXACFCFZZISX-YOEHRIQHSA-N 2 1 326.937 4.094 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCSc2ccc(Cl)cc2)[C@@H](C)C1 ZINC001167686157 1031028477 /nfs/dbraw/zinc/02/84/77/1031028477.db2.gz OICXACFCFZZISX-YOEHRIQHSA-N 2 1 326.937 4.094 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCSc2ccc(Cl)cc2)[C@@H](C)C1 ZINC001167686157 1031028499 /nfs/dbraw/zinc/02/84/99/1031028499.db2.gz OICXACFCFZZISX-YOEHRIQHSA-N 2 1 326.937 4.094 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](CCC)CC2)cc1OC ZINC000532454311 1031087590 /nfs/dbraw/zinc/08/75/90/1031087590.db2.gz KTSPRYXUWOBTCX-QGZVFWFLSA-N 2 1 348.531 4.399 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCOc1ccc(Cl)cc1Cl ZINC000532464687 1031124411 /nfs/dbraw/zinc/12/44/11/1031124411.db2.gz ZIBFIHXMECYVNM-IOASZLSFSA-N 2 1 345.314 4.081 20 0 EIADMP Cc1csc(CCCC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)n1 ZINC000340226449 1031199124 /nfs/dbraw/zinc/19/91/24/1031199124.db2.gz QPWKZNZDZPKPPB-RBUKOAKNSA-N 2 1 343.540 4.199 20 0 EIADMP Cc1csc(CCCC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)n1 ZINC000340226449 1031199142 /nfs/dbraw/zinc/19/91/42/1031199142.db2.gz QPWKZNZDZPKPPB-RBUKOAKNSA-N 2 1 343.540 4.199 20 0 EIADMP Cc1csc(CCCC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)n1 ZINC000340226447 1031199627 /nfs/dbraw/zinc/19/96/27/1031199627.db2.gz QPWKZNZDZPKPPB-MOPGFXCFSA-N 2 1 343.540 4.199 20 0 EIADMP Cc1csc(CCCC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)n1 ZINC000340226447 1031199640 /nfs/dbraw/zinc/19/96/40/1031199640.db2.gz QPWKZNZDZPKPPB-MOPGFXCFSA-N 2 1 343.540 4.199 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000532477059 1031204676 /nfs/dbraw/zinc/20/46/76/1031204676.db2.gz MPKQUSUOBDUGEJ-LZJOCLMNSA-N 2 1 342.552 4.391 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccccc1OCc1ccccc1 ZINC000532507299 1031229950 /nfs/dbraw/zinc/22/99/50/1031229950.db2.gz RGQQYFDMWJSTCR-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP Cc1nc(C[N@@H+]2CCC[C@H](n3ccnc3C(C)C)C2)nc2ccccc12 ZINC000375809210 1031271392 /nfs/dbraw/zinc/27/13/92/1031271392.db2.gz DULUWVJKOBDADU-KRWDZBQOSA-N 2 1 349.482 4.095 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]CC2=Cc3ccccc3OC2)CC1 ZINC000116368270 1031384284 /nfs/dbraw/zinc/38/42/84/1031384284.db2.gz CTVNRDVFIUPVME-GOSISDBHSA-N 2 1 348.490 4.278 20 0 EIADMP Clc1ccc(C[C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000449090467 1031449193 /nfs/dbraw/zinc/44/91/93/1031449193.db2.gz NDBVQOMVJODAMD-LEAZDLGRSA-N 2 1 332.919 4.268 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccc(OC)cc1 ZINC000123933014 1031496020 /nfs/dbraw/zinc/49/60/20/1031496020.db2.gz FBYOOBUWLXNYMH-OAQYLSRUSA-N 2 1 326.484 4.388 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)Cc3coc4ccccc34)CC2)[nH+]c1 ZINC000449163455 1031504418 /nfs/dbraw/zinc/50/44/18/1031504418.db2.gz MGVLPUTUHIUIOR-QGZVFWFLSA-N 2 1 349.478 4.326 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1nc(C(F)(F)F)cs1 ZINC000343824213 1031543055 /nfs/dbraw/zinc/54/30/55/1031543055.db2.gz ABBBTLNRILVVTG-LLVKDONJSA-N 2 1 343.418 4.074 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@H]3CCCC34CCCCC4)CC2)nc(C)[nH+]1 ZINC000449228318 1031557248 /nfs/dbraw/zinc/55/72/48/1031557248.db2.gz YABGQFIYBMAYCE-IBGZPJMESA-N 2 1 342.531 4.155 20 0 EIADMP C[C@@H](NCCC[N@H+]1CCCC[C@H]1C)c1ncc(-c2ccccc2)n1C ZINC000453093398 1031584602 /nfs/dbraw/zinc/58/46/02/1031584602.db2.gz RCJUIOYTVFWRDU-QZTJIDSGSA-N 2 1 340.515 4.002 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000453193671 1031704410 /nfs/dbraw/zinc/70/44/10/1031704410.db2.gz GKZLQYYKLZPGLB-WSTZPKSXSA-N 2 1 329.532 4.035 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000453193668 1031704453 /nfs/dbraw/zinc/70/44/53/1031704453.db2.gz GKZLQYYKLZPGLB-GGPKGHCWSA-N 2 1 329.532 4.035 20 0 EIADMP C[C@H]([C@H]1CC[N@@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@]2(CCSC2)C1 ZINC000453356541 1031885700 /nfs/dbraw/zinc/88/57/00/1031885700.db2.gz KWGXOJFLWIXNKH-HLAWJBBLSA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]([C@H]1CC[NH+](Cc2ccccc2)C1)[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000453356541 1031885714 /nfs/dbraw/zinc/88/57/14/1031885714.db2.gz KWGXOJFLWIXNKH-HLAWJBBLSA-N 2 1 344.568 4.116 20 0 EIADMP C[C@H]([C@H]1CC[NH+](Cc2ccccc2)C1)[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000453356541 1031885717 /nfs/dbraw/zinc/88/57/17/1031885717.db2.gz KWGXOJFLWIXNKH-HLAWJBBLSA-N 2 1 344.568 4.116 20 0 EIADMP CC(C)(C)CC(C)(C)[NH+]1CCC([N@H+]2CCC[C@]3(CCOC3)C2)CC1 ZINC000453384692 1031895236 /nfs/dbraw/zinc/89/52/36/1031895236.db2.gz TYKQGDOUNFDYDD-NRFANRHFSA-N 2 1 336.564 4.168 20 0 EIADMP C[N@@H+](CCCC[NH2+][C@H]1CCc2ccc(OC(F)(F)F)cc21)C1CC1 ZINC000453398538 1031933550 /nfs/dbraw/zinc/93/35/50/1031933550.db2.gz KPGFTBPYBCLKHB-KRWDZBQOSA-N 2 1 342.405 4.037 20 0 EIADMP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453406499 1031941463 /nfs/dbraw/zinc/94/14/63/1031941463.db2.gz RFDWTTUUSNCGDP-CQSZACIVSA-N 2 1 344.528 4.039 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]CCCC[N@H+](C)C3CC3)s2)cc1 ZINC000453594324 1032019254 /nfs/dbraw/zinc/01/92/54/1032019254.db2.gz HZCBZOKFNDSYIH-UHFFFAOYSA-N 2 1 329.513 4.083 20 0 EIADMP Cc1ccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c(C)n1 ZINC000433175080 1033984686 /nfs/dbraw/zinc/98/46/86/1033984686.db2.gz MTSVGWZPLCZHHQ-UHFFFAOYSA-N 2 1 349.522 4.187 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000513053792 1034371716 /nfs/dbraw/zinc/37/17/16/1034371716.db2.gz YIPUERXUFQKWHR-PXNSSMCTSA-N 2 1 333.479 4.311 20 0 EIADMP COCc1ccccc1/C=C(/C)C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000509921699 1034850726 /nfs/dbraw/zinc/85/07/26/1034850726.db2.gz BBCLHUXFOWCZPX-IZBXUMLASA-N 2 1 344.543 4.481 20 0 EIADMP COc1ccsc1C[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513495369 1034986608 /nfs/dbraw/zinc/98/66/08/1034986608.db2.gz OWKUOZIHKDCVIU-AEFFLSMTSA-N 2 1 344.524 4.147 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000513667932 1035088014 /nfs/dbraw/zinc/08/80/14/1035088014.db2.gz UXDGOHLJMJDWTC-LMVRJCEZSA-N 2 1 337.511 4.197 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000513667932 1035088024 /nfs/dbraw/zinc/08/80/24/1035088024.db2.gz UXDGOHLJMJDWTC-LMVRJCEZSA-N 2 1 337.511 4.197 20 0 EIADMP CC(C)[NH2+]C1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000501009508 1035344479 /nfs/dbraw/zinc/34/44/79/1035344479.db2.gz CEOPUZAKQQOTBG-CQSZACIVSA-N 2 1 328.422 4.271 20 0 EIADMP C[N@@H+](CCc1ccccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501063584 1035365941 /nfs/dbraw/zinc/36/59/41/1035365941.db2.gz QGXGKDLLOYJGRD-UHFFFAOYSA-N 2 1 343.902 4.126 20 0 EIADMP COc1ccccc1-c1ccc([C@H](C)[N@@H+](C)CC[C@H]2CC[NH2+]C2)cc1 ZINC000420294554 1035492482 /nfs/dbraw/zinc/49/24/82/1035492482.db2.gz BBEGUNNBGNMCFG-ZWKOTPCHSA-N 2 1 338.495 4.355 20 0 EIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000420299089 1035503044 /nfs/dbraw/zinc/50/30/44/1035503044.db2.gz GGBHINVZIOAIMJ-KBPBESRZSA-N 2 1 326.406 4.230 20 0 EIADMP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000420307245 1035505879 /nfs/dbraw/zinc/50/58/79/1035505879.db2.gz BILYTKVVPVAZCR-XLIONFOSSA-N 2 1 340.515 4.144 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@@H]4C[C@@]43C)CC2)cs1 ZINC000502279968 1036033475 /nfs/dbraw/zinc/03/34/75/1036033475.db2.gz HRUGPQKXPDNUDZ-POAQFYNOSA-N 2 1 347.572 4.086 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)s1 ZINC000414505848 1036188145 /nfs/dbraw/zinc/18/81/45/1036188145.db2.gz VLOXQWUEKYYQFG-ZBFHGGJFSA-N 2 1 349.931 4.284 20 0 EIADMP Fc1cc(Cl)cc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000485716961 1036201508 /nfs/dbraw/zinc/20/15/08/1036201508.db2.gz MTCYDFPXPVQCSA-QGZVFWFLSA-N 2 1 346.877 4.133 20 0 EIADMP Fc1cc(Cl)cc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000485716961 1036201519 /nfs/dbraw/zinc/20/15/19/1036201519.db2.gz MTCYDFPXPVQCSA-QGZVFWFLSA-N 2 1 346.877 4.133 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ncc(C[NH+](C)C)s2)C[C@@H](c2ccccc2)C1 ZINC000414507621 1036222899 /nfs/dbraw/zinc/22/28/99/1036222899.db2.gz BHLYRRVTUOUMIR-SZMVWBNQSA-N 2 1 343.540 4.267 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ncc(C[NH+](C)C)s2)C[C@H](c2ccccc2)C1 ZINC000414507614 1036223785 /nfs/dbraw/zinc/22/37/85/1036223785.db2.gz BHLYRRVTUOUMIR-CGTJXYLNSA-N 2 1 343.540 4.267 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000669614719 1036254331 /nfs/dbraw/zinc/25/43/31/1036254331.db2.gz JIOUIVXMJVFUMP-KYJSFNMBSA-N 2 1 340.433 4.273 20 0 EIADMP COc1ccccc1/C=C/C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000588177759 1036284334 /nfs/dbraw/zinc/28/43/34/1036284334.db2.gz FPBIHGYKSGUNJN-NYSSQEGZSA-N 2 1 330.516 4.056 20 0 EIADMP Clc1cccc(OCCC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000572047913 1036399790 /nfs/dbraw/zinc/39/97/90/1036399790.db2.gz ZVNZEUMLWDELKA-SFHVURJKSA-N 2 1 336.907 4.059 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502683279 1036501142 /nfs/dbraw/zinc/50/11/42/1036501142.db2.gz IPBDNSKAWDHTIS-KZNAEPCWSA-N 2 1 332.536 4.017 20 0 EIADMP CCC[N@H+](CCCCn1cc[nH+]c1C)[C@@H]1CCc2ccccc2C1 ZINC000502701673 1036524299 /nfs/dbraw/zinc/52/42/99/1036524299.db2.gz KEIPHJSSROFGGS-OAQYLSRUSA-N 2 1 325.500 4.241 20 0 EIADMP CCC[N@@H+](CCCCn1cc[nH+]c1C)[C@@H]1CCc2ccccc2C1 ZINC000502701673 1036524330 /nfs/dbraw/zinc/52/43/30/1036524330.db2.gz KEIPHJSSROFGGS-OAQYLSRUSA-N 2 1 325.500 4.241 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@H+](C)[C@H]2CCCC[C@@H]2c2ccccc2)s1 ZINC000414535010 1036565038 /nfs/dbraw/zinc/56/50/38/1036565038.db2.gz VYRZTDZVOQIZBP-MOPGFXCFSA-N 2 1 343.540 4.363 20 0 EIADMP C[NH+](C)Cc1cnc(C[N@@H+](C)[C@H]2CCCC[C@@H]2c2ccccc2)s1 ZINC000414535010 1036565060 /nfs/dbraw/zinc/56/50/60/1036565060.db2.gz VYRZTDZVOQIZBP-MOPGFXCFSA-N 2 1 343.540 4.363 20 0 EIADMP CC(C)c1ncc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000486565881 1036770847 /nfs/dbraw/zinc/77/08/47/1036770847.db2.gz NIVSOSPRXLQRMF-SJLPKXTDSA-N 2 1 343.540 4.267 20 0 EIADMP CC(C)c1ncc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000486565881 1036770863 /nfs/dbraw/zinc/77/08/63/1036770863.db2.gz NIVSOSPRXLQRMF-SJLPKXTDSA-N 2 1 343.540 4.267 20 0 EIADMP C[C@@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526521 1036786907 /nfs/dbraw/zinc/78/69/07/1036786907.db2.gz HHOKKCMPDOCUNR-RDTXWAMCSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526521 1036786935 /nfs/dbraw/zinc/78/69/35/1036786935.db2.gz HHOKKCMPDOCUNR-RDTXWAMCSA-N 2 1 332.488 4.326 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526521 1036786957 /nfs/dbraw/zinc/78/69/57/1036786957.db2.gz HHOKKCMPDOCUNR-RDTXWAMCSA-N 2 1 332.488 4.326 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]Cc3ccc4cccnc4c3)CC2)cc1 ZINC000589640850 1036857192 /nfs/dbraw/zinc/85/71/92/1036857192.db2.gz BUGSDBADRNWOIL-UHFFFAOYSA-N 2 1 345.490 4.032 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(OC(F)(F)F)cc1 ZINC000589836068 1036880308 /nfs/dbraw/zinc/88/03/08/1036880308.db2.gz FUQNOVJSRXLHHD-HNNXBMFYSA-N 2 1 344.421 4.329 20 0 EIADMP Clc1ccsc1CNC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000486928383 1036893141 /nfs/dbraw/zinc/89/31/41/1036893141.db2.gz VBYMHQUUSSFENH-ZDUSSCGKSA-N 2 1 340.945 4.465 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000486928383 1036893143 /nfs/dbraw/zinc/89/31/43/1036893143.db2.gz VBYMHQUUSSFENH-ZDUSSCGKSA-N 2 1 340.945 4.465 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000486928383 1036893146 /nfs/dbraw/zinc/89/31/46/1036893146.db2.gz VBYMHQUUSSFENH-ZDUSSCGKSA-N 2 1 340.945 4.465 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000486928383 1036893148 /nfs/dbraw/zinc/89/31/48/1036893148.db2.gz VBYMHQUUSSFENH-ZDUSSCGKSA-N 2 1 340.945 4.465 20 0 EIADMP CCS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000590243504 1037019013 /nfs/dbraw/zinc/01/90/13/1037019013.db2.gz PDJDLFLXPWRRAS-MTQWCTHYSA-N 2 1 332.557 4.476 20 0 EIADMP CCS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000590243504 1037019032 /nfs/dbraw/zinc/01/90/32/1037019032.db2.gz PDJDLFLXPWRRAS-MTQWCTHYSA-N 2 1 332.557 4.476 20 0 EIADMP CCS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000590243502 1037020339 /nfs/dbraw/zinc/02/03/39/1037020339.db2.gz PDJDLFLXPWRRAS-HAGHYFMRSA-N 2 1 332.557 4.476 20 0 EIADMP CCS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000590243502 1037020357 /nfs/dbraw/zinc/02/03/57/1037020357.db2.gz PDJDLFLXPWRRAS-HAGHYFMRSA-N 2 1 332.557 4.476 20 0 EIADMP COCC1([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCCCC1 ZINC000668810967 1037302763 /nfs/dbraw/zinc/30/27/63/1037302763.db2.gz KTLWDOBRBKVXLB-HXUWFJFHSA-N 2 1 342.527 4.123 20 0 EIADMP COCC1([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCCCC1 ZINC000668810967 1037302781 /nfs/dbraw/zinc/30/27/81/1037302781.db2.gz KTLWDOBRBKVXLB-HXUWFJFHSA-N 2 1 342.527 4.123 20 0 EIADMP CC(C)(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(F)ccc2C1 ZINC001168417413 1037354341 /nfs/dbraw/zinc/35/43/41/1037354341.db2.gz PLMHUOKVEAGBSI-UFYCRDLUSA-N 2 1 332.507 4.301 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)o1 ZINC000604415144 1037382640 /nfs/dbraw/zinc/38/26/40/1037382640.db2.gz XWZDHVCFMWGQSF-OAHLLOKOSA-N 2 1 330.447 4.216 20 0 EIADMP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(Br)cc1F)C(C)(C)C ZINC000604770951 1037511232 /nfs/dbraw/zinc/51/12/32/1037511232.db2.gz PFCMEGHUROJPLZ-OAHLLOKOSA-N 2 1 345.300 4.044 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CS1 ZINC000488434922 1037592642 /nfs/dbraw/zinc/59/26/42/1037592642.db2.gz UIGLUWJRYKDCER-MDNKFWRPSA-N 2 1 332.557 4.017 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CS1 ZINC000488434922 1037592656 /nfs/dbraw/zinc/59/26/56/1037592656.db2.gz UIGLUWJRYKDCER-MDNKFWRPSA-N 2 1 332.557 4.017 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)CC1 ZINC000488454055 1037598233 /nfs/dbraw/zinc/59/82/33/1037598233.db2.gz XZZICNOQJLPSPN-VQTJNVASSA-N 2 1 346.584 4.469 20 0 EIADMP CC[N@@H+](Cc1cnc(C2CC2)s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000573725327 1037678869 /nfs/dbraw/zinc/67/88/69/1037678869.db2.gz KUBALRDSCZKHAP-UHFFFAOYSA-N 2 1 329.513 4.104 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2ncc(C)cc2C)cc1 ZINC000573799065 1037687579 /nfs/dbraw/zinc/68/75/79/1037687579.db2.gz WADGBONOWWDXLN-KRWDZBQOSA-N 2 1 334.467 4.086 20 0 EIADMP C[N@@H+](Cc1ccccc1C[NH2+]C1CCC(C[NH3+])CC1)C1CCCCC1 ZINC000422727456 1037819271 /nfs/dbraw/zinc/81/92/71/1037819271.db2.gz CNEJUDZKQBGHLC-UHFFFAOYSA-N 3 1 343.559 4.058 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2ccccc2)cc1F ZINC000503569036 1037821530 /nfs/dbraw/zinc/82/15/30/1037821530.db2.gz MUQRBMAISXJUKR-MRXNPFEDSA-N 2 1 337.442 4.424 20 0 EIADMP COc1cccc([C@H]([NH2+][C@H](C)C[C@H](C)[NH3+])c2ccccc2Cl)c1 ZINC000422783216 1037832896 /nfs/dbraw/zinc/83/28/96/1037832896.db2.gz NTIHPEXMOXJJGU-KSMMKXTCSA-N 2 1 332.875 4.153 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(OC(F)(F)F)cc1 ZINC000422813899 1037839712 /nfs/dbraw/zinc/83/97/12/1037839712.db2.gz YXAPRZZAIYTMPI-MZPVMMEZSA-N 2 1 336.357 4.381 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)cc1OC ZINC000422891848 1037853064 /nfs/dbraw/zinc/85/30/64/1037853064.db2.gz LROLOKBQLDMQMX-ZOCIIQOWSA-N 2 1 340.467 4.279 20 0 EIADMP CCN(CC)[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)c1ccsc1 ZINC000422868784 1037856530 /nfs/dbraw/zinc/85/65/30/1037856530.db2.gz WAUGUVVCDYFZMO-MTQWCTHYSA-N 2 1 349.588 4.031 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000311123369 1037858763 /nfs/dbraw/zinc/85/87/63/1037858763.db2.gz HPZJHEKDDHEXNG-AVRDEDQJSA-N 2 1 338.495 4.258 20 0 EIADMP Clc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000422937842 1037875035 /nfs/dbraw/zinc/87/50/35/1037875035.db2.gz CUYJBJOIXGCIRF-YZGWKJHDSA-N 2 1 326.871 4.410 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCc3c2cccc3Br)c2ccccc21 ZINC000422952744 1037886715 /nfs/dbraw/zinc/88/67/15/1037886715.db2.gz DDCQBHJTTIWDQH-SQNIBIBYSA-N 2 1 343.268 4.171 20 0 EIADMP CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423035494 1037915844 /nfs/dbraw/zinc/91/58/44/1037915844.db2.gz JPKYSYYYCCIZJS-TUCQFJRYSA-N 2 1 330.859 4.150 20 0 EIADMP CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423035491 1037916660 /nfs/dbraw/zinc/91/66/60/1037916660.db2.gz JPKYSYYYCCIZJS-RCUQFMMVSA-N 2 1 330.859 4.150 20 0 EIADMP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423093426 1037955301 /nfs/dbraw/zinc/95/53/01/1037955301.db2.gz HKTDJSRNZAWWBY-HSCHXYMDSA-N 2 1 328.887 4.134 20 0 EIADMP C[C@H]([NH2+]CCc1cccc2[nH]ccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000503903621 1037975487 /nfs/dbraw/zinc/97/54/87/1037975487.db2.gz RDJZNOIOIUYCQB-RXVVDRJESA-N 2 1 347.506 4.211 20 0 EIADMP CC[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cccc(Cl)c1F ZINC000423182521 1038036045 /nfs/dbraw/zinc/03/60/45/1038036045.db2.gz FEBGFHSTGQZXMQ-KRWDZBQOSA-N 2 1 335.854 4.095 20 0 EIADMP Fc1cc(F)cc(C[N@@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c1 ZINC000414724796 1038071417 /nfs/dbraw/zinc/07/14/17/1038071417.db2.gz SZSVJKLYMUQWMA-GOSISDBHSA-N 2 1 348.462 4.171 20 0 EIADMP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+][C@H](C[NH3+])CC(C)C)s2)cc1 ZINC000423258118 1038089859 /nfs/dbraw/zinc/08/98/59/1038089859.db2.gz BAWHBSIDHDSCKL-CJNGLKHVSA-N 2 1 347.528 4.151 20 0 EIADMP CC[C@@H]([NH3+])C[NH2+][C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423475147 1038247838 /nfs/dbraw/zinc/24/78/38/1038247838.db2.gz RQAXWBBKZCRCEN-PRHODGIISA-N 2 1 328.300 4.112 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000490070160 1038331259 /nfs/dbraw/zinc/33/12/59/1038331259.db2.gz WRCXGXISGHLADO-DLBZAZTESA-N 2 1 347.572 4.076 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000490070160 1038331278 /nfs/dbraw/zinc/33/12/78/1038331278.db2.gz WRCXGXISGHLADO-DLBZAZTESA-N 2 1 347.572 4.076 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000490070160 1038331297 /nfs/dbraw/zinc/33/12/97/1038331297.db2.gz WRCXGXISGHLADO-DLBZAZTESA-N 2 1 347.572 4.076 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)CC[N@H+]1C ZINC000608061538 1038443007 /nfs/dbraw/zinc/44/30/07/1038443007.db2.gz JLQCDGZVCNUQEF-NQIIRXRSSA-N 2 1 347.506 4.262 20 0 EIADMP Cc1ccc(COc2ccc(C[NH2+][C@H]3CC[N@@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000608061370 1038453862 /nfs/dbraw/zinc/45/38/62/1038453862.db2.gz RGXOILJNFWAARJ-RXVVDRJESA-N 2 1 338.495 4.146 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000594974526 1038483817 /nfs/dbraw/zinc/48/38/17/1038483817.db2.gz KYCKVHZPXJOSOG-PKOBYXMFSA-N 2 1 332.557 4.162 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000594974526 1038484009 /nfs/dbraw/zinc/48/40/09/1038484009.db2.gz KYCKVHZPXJOSOG-PKOBYXMFSA-N 2 1 332.557 4.162 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000594974523 1038488566 /nfs/dbraw/zinc/48/85/66/1038488566.db2.gz KYCKVHZPXJOSOG-HKUYNNGSSA-N 2 1 332.557 4.162 20 0 EIADMP CSCC1(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000594974523 1038488604 /nfs/dbraw/zinc/48/86/04/1038488604.db2.gz KYCKVHZPXJOSOG-HKUYNNGSSA-N 2 1 332.557 4.162 20 0 EIADMP Cc1cc(N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c2ccccc2[nH+]1 ZINC000608092968 1038603979 /nfs/dbraw/zinc/60/39/79/1038603979.db2.gz ZWOLCPMFBLRWKK-IBGZPJMESA-N 2 1 331.463 4.254 20 0 EIADMP CC(C)n1cncc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000424127473 1038617730 /nfs/dbraw/zinc/61/77/30/1038617730.db2.gz DGUWCEYXMAOABA-SFHVURJKSA-N 2 1 340.515 4.128 20 0 EIADMP CC(C)n1cncc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000424127473 1038617734 /nfs/dbraw/zinc/61/77/34/1038617734.db2.gz DGUWCEYXMAOABA-SFHVURJKSA-N 2 1 340.515 4.128 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H](Cc1ccncc1)c1cccs1 ZINC000424266217 1038762666 /nfs/dbraw/zinc/76/26/66/1038762666.db2.gz WPYQMWFMOSTQSA-IEBWSBKVSA-N 2 1 343.540 4.281 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](Cc1ccncc1)c1cccs1 ZINC000424321623 1038802913 /nfs/dbraw/zinc/80/29/13/1038802913.db2.gz UWHIGUZTCMDPSS-SFHVURJKSA-N 2 1 340.496 4.002 20 0 EIADMP COc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c(C)c1 ZINC000539062445 1038807980 /nfs/dbraw/zinc/80/79/80/1038807980.db2.gz YYHSKXHOXIWKKN-AVRDEDQJSA-N 2 1 338.495 4.004 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@H+](C)C[C@H](C[NH3+])c1ccc(F)cc1 ZINC000424306879 1038813513 /nfs/dbraw/zinc/81/35/13/1038813513.db2.gz WESBYVAKFLBRDK-HIFRSBDPSA-N 2 1 343.471 4.171 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@@H+](C)C[C@H](C[NH3+])c1ccc(F)cc1 ZINC000424306879 1038813516 /nfs/dbraw/zinc/81/35/16/1038813516.db2.gz WESBYVAKFLBRDK-HIFRSBDPSA-N 2 1 343.471 4.171 20 0 EIADMP Fc1ccc(Oc2ccccc2C[NH2+]C2CC[NH2+]CC2)c(Cl)c1 ZINC000414786572 1038849302 /nfs/dbraw/zinc/84/93/02/1038849302.db2.gz XESFHUIPVROLAZ-UHFFFAOYSA-N 2 1 334.822 4.113 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000539162853 1038865287 /nfs/dbraw/zinc/86/52/87/1038865287.db2.gz MLXCARWRSAMKGX-RDTXWAMCSA-N 2 1 340.433 4.476 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539201329 1038879182 /nfs/dbraw/zinc/87/91/82/1038879182.db2.gz WTWIIUSWZHCSHY-RDTXWAMCSA-N 2 1 340.433 4.478 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@H]1C ZINC000537616542 1038889715 /nfs/dbraw/zinc/88/97/15/1038889715.db2.gz PHXBAZPBNWAIHE-OCCSQVGLSA-N 2 1 346.849 4.246 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@H]1C ZINC000537616542 1038889718 /nfs/dbraw/zinc/88/97/18/1038889718.db2.gz PHXBAZPBNWAIHE-OCCSQVGLSA-N 2 1 346.849 4.246 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@H]1C ZINC000537616542 1038889723 /nfs/dbraw/zinc/88/97/23/1038889723.db2.gz PHXBAZPBNWAIHE-OCCSQVGLSA-N 2 1 346.849 4.246 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@H]1C ZINC000537616542 1038889725 /nfs/dbraw/zinc/88/97/25/1038889725.db2.gz PHXBAZPBNWAIHE-OCCSQVGLSA-N 2 1 346.849 4.246 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000462107932 1038912338 /nfs/dbraw/zinc/91/23/38/1038912338.db2.gz JBZRSKKPICQGMG-WQVCFCJDSA-N 2 1 329.315 4.387 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000462107932 1038912373 /nfs/dbraw/zinc/91/23/73/1038912373.db2.gz JBZRSKKPICQGMG-WQVCFCJDSA-N 2 1 329.315 4.387 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000462107930 1038913397 /nfs/dbraw/zinc/91/33/97/1038913397.db2.gz JBZRSKKPICQGMG-MAZHCROVSA-N 2 1 329.315 4.387 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000462107930 1038913421 /nfs/dbraw/zinc/91/34/21/1038913421.db2.gz JBZRSKKPICQGMG-MAZHCROVSA-N 2 1 329.315 4.387 20 0 EIADMP CC[C@@H](C)[C@H]([NH2+]C1CC[NH+](CCOC)CC1)c1ccc(Cl)cc1 ZINC000462117775 1038934722 /nfs/dbraw/zinc/93/47/22/1038934722.db2.gz CKBSXWKDUHALHY-BEFAXECRSA-N 2 1 338.923 4.128 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cccc(Br)c2)C1 ZINC000481024777 1038964567 /nfs/dbraw/zinc/96/45/67/1038964567.db2.gz NJPQJONRZQKKHC-YOEHRIQHSA-N 2 1 339.321 4.222 20 0 EIADMP CC(C)COc1ccccc1C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000481042189 1038991912 /nfs/dbraw/zinc/99/19/12/1038991912.db2.gz CEJOPLSBGHIBSY-UHFFFAOYSA-N 2 1 330.516 4.218 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555232558 1038999563 /nfs/dbraw/zinc/99/95/63/1038999563.db2.gz HVPRVHXZAGIKNW-ZXMXYHOLSA-N 2 1 348.534 4.333 20 0 EIADMP FC(F)(F)CC[NH2+][C@@H]1CCCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000552042741 1039060567 /nfs/dbraw/zinc/06/05/67/1039060567.db2.gz ZPCDSZWSWVOHKW-RCCFBDPRSA-N 2 1 340.433 4.219 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)[C@@H]2CCC[C@H]21 ZINC000552052885 1039107148 /nfs/dbraw/zinc/10/71/48/1039107148.db2.gz IUMLOVMOTVXYCR-HRCADAONSA-N 2 1 326.937 4.187 20 0 EIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H](C)[C@@H](C)c1nc2ccccc2s1 ZINC000552098926 1039153520 /nfs/dbraw/zinc/15/35/20/1039153520.db2.gz SSORXKIDCRARDS-OAGGEKHMSA-N 2 1 331.529 4.252 20 0 EIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H](C)[C@@H](C)c1nc2ccccc2s1 ZINC000552098926 1039153535 /nfs/dbraw/zinc/15/35/35/1039153535.db2.gz SSORXKIDCRARDS-OAGGEKHMSA-N 2 1 331.529 4.252 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](CCc1ccc(F)cc1)C1CCCC1 ZINC000534219427 1039222897 /nfs/dbraw/zinc/22/28/97/1039222897.db2.gz NJDGUETUMIBLTQ-UHFFFAOYSA-N 2 1 329.463 4.208 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](CCc1ccc(F)cc1)C1CCCC1 ZINC000534219427 1039222916 /nfs/dbraw/zinc/22/29/16/1039222916.db2.gz NJDGUETUMIBLTQ-UHFFFAOYSA-N 2 1 329.463 4.208 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](Cc2ccccc2)c2sccc2C)C1 ZINC000481314185 1039283819 /nfs/dbraw/zinc/28/38/19/1039283819.db2.gz BNPWDZBOPYSXCH-MOPGFXCFSA-N 2 1 328.525 4.272 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000090723825 1039294634 /nfs/dbraw/zinc/29/46/34/1039294634.db2.gz CCWHWIWTURAEBX-MRXNPFEDSA-N 2 1 335.451 4.349 20 0 EIADMP CCC[C@@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1cccc(C(F)(F)F)c1 ZINC000481325247 1039295251 /nfs/dbraw/zinc/29/52/51/1039295251.db2.gz VBJJTDJWJMBBMT-RHSMWYFYSA-N 2 1 328.422 4.478 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2COc3ccccc32)cc1 ZINC000090845041 1039307959 /nfs/dbraw/zinc/30/79/59/1039307959.db2.gz NZYHVNFHVORNQK-MRUHUIDDSA-N 2 1 347.462 4.396 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(F)cc2C(F)(F)F)C[C@@H]1C ZINC000552290463 1039343795 /nfs/dbraw/zinc/34/37/95/1039343795.db2.gz JSZPCAZOOMYOTK-WFASDCNBSA-N 2 1 332.385 4.149 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@@H]1C ZINC000552290463 1039343804 /nfs/dbraw/zinc/34/38/04/1039343804.db2.gz JSZPCAZOOMYOTK-WFASDCNBSA-N 2 1 332.385 4.149 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@@H]1C ZINC000552290463 1039343816 /nfs/dbraw/zinc/34/38/16/1039343816.db2.gz JSZPCAZOOMYOTK-WFASDCNBSA-N 2 1 332.385 4.149 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@@H]1C ZINC000552290463 1039343826 /nfs/dbraw/zinc/34/38/26/1039343826.db2.gz JSZPCAZOOMYOTK-WFASDCNBSA-N 2 1 332.385 4.149 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(F)cc2C(F)(F)F)C[C@@H]1C ZINC000552290463 1039343832 /nfs/dbraw/zinc/34/38/32/1039343832.db2.gz JSZPCAZOOMYOTK-WFASDCNBSA-N 2 1 332.385 4.149 20 0 EIADMP C[NH+]1CCC([C@H]2CCN(c3cc[nH+]c4ccc(Cl)cc43)C2)CC1 ZINC000534419371 1039388815 /nfs/dbraw/zinc/38/88/15/1039388815.db2.gz RHMKRXYRRGGDDT-HNNXBMFYSA-N 2 1 329.875 4.056 20 0 EIADMP CC[NH+]1C[C@@H]2C[N@H+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@@H]2C1 ZINC001168347477 1039494124 /nfs/dbraw/zinc/49/41/24/1039494124.db2.gz LUFBJFFMPNMSJH-OYBTXZFASA-N 2 1 332.919 4.250 20 0 EIADMP CC[NH+]1C[C@@H]2C[N@@H+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@@H]2C1 ZINC001168347477 1039494143 /nfs/dbraw/zinc/49/41/43/1039494143.db2.gz LUFBJFFMPNMSJH-OYBTXZFASA-N 2 1 332.919 4.250 20 0 EIADMP C[C@H](CC[NH2+][C@H](c1cccnc1)C1CCC1)[N@@H+](C)Cc1ccccc1 ZINC000481666503 1039719301 /nfs/dbraw/zinc/71/93/01/1039719301.db2.gz IXANJMWBOPJLSZ-GCJKJVERSA-N 2 1 337.511 4.423 20 0 EIADMP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCc2c1cc(Cl)cc2Br ZINC000534792810 1039788606 /nfs/dbraw/zinc/78/86/06/1039788606.db2.gz DDAOQFSTCYADDG-ZUZCIYMTSA-N 2 1 345.712 4.020 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3ccc4c(c3)CCC4)CC2)n2c1CCCC2 ZINC000434663224 1039793769 /nfs/dbraw/zinc/79/37/69/1039793769.db2.gz FDAPBIUFUFHBJZ-UHFFFAOYSA-N 2 1 335.495 4.088 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(C)sc2C)[C@H](C)C1 ZINC000122844937 1039798973 /nfs/dbraw/zinc/79/89/73/1039798973.db2.gz PEQLWUNCNZJPFO-ALKREAHSSA-N 2 1 338.561 4.153 20 0 EIADMP C[N@H+]1CC[C@]2(CC[NH+](CCCCc3cccc(C(F)(F)F)c3)C2)C1 ZINC000430121185 1039845470 /nfs/dbraw/zinc/84/54/70/1039845470.db2.gz GIVINGOSNIDYIB-SFHVURJKSA-N 2 1 340.433 4.056 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@H+](CCCCc3cccc(C(F)(F)F)c3)C2)C1 ZINC000430121185 1039845473 /nfs/dbraw/zinc/84/54/73/1039845473.db2.gz GIVINGOSNIDYIB-SFHVURJKSA-N 2 1 340.433 4.056 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@@H+](CCCCc3cccc(C(F)(F)F)c3)C2)C1 ZINC000430121185 1039845474 /nfs/dbraw/zinc/84/54/74/1039845474.db2.gz GIVINGOSNIDYIB-SFHVURJKSA-N 2 1 340.433 4.056 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000430115485 1039852274 /nfs/dbraw/zinc/85/22/74/1039852274.db2.gz BFGYMFMUZONHCK-RXBGNRNISA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000430115485 1039852278 /nfs/dbraw/zinc/85/22/78/1039852278.db2.gz BFGYMFMUZONHCK-RXBGNRNISA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000430115485 1039852280 /nfs/dbraw/zinc/85/22/80/1039852280.db2.gz BFGYMFMUZONHCK-RXBGNRNISA-N 2 1 338.417 4.136 20 0 EIADMP C/C(=C/c1ccccc1C(F)(F)F)C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000430115485 1039852281 /nfs/dbraw/zinc/85/22/81/1039852281.db2.gz BFGYMFMUZONHCK-RXBGNRNISA-N 2 1 338.417 4.136 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000434745522 1039856911 /nfs/dbraw/zinc/85/69/11/1039856911.db2.gz KOPJSYMMZFBULC-VHFSOBRXSA-N 2 1 345.437 4.046 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CC(C)(C)C[C@@H]3C)CC2)cs1 ZINC000434754672 1039860541 /nfs/dbraw/zinc/86/05/41/1039860541.db2.gz IVZCHNYOFHUNPB-YJBOKZPZSA-N 2 1 349.588 4.332 20 0 EIADMP CCOCc1ccccc1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550999064 1039863327 /nfs/dbraw/zinc/86/33/27/1039863327.db2.gz HZLMNVCMSLYODK-FGZHOGPDSA-N 2 1 338.495 4.148 20 0 EIADMP CCOCc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550999064 1039863329 /nfs/dbraw/zinc/86/33/29/1039863329.db2.gz HZLMNVCMSLYODK-FGZHOGPDSA-N 2 1 338.495 4.148 20 0 EIADMP Cc1nc([C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cs1 ZINC000552920144 1039868914 /nfs/dbraw/zinc/86/89/14/1039868914.db2.gz SSSAPUUFJWJSTJ-TXPKVOOTSA-N 2 1 343.540 4.403 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000535083155 1039920628 /nfs/dbraw/zinc/92/06/28/1039920628.db2.gz LYAZDCXAHFBWRC-UHFFFAOYSA-N 2 1 344.421 4.137 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCO[C@H]2C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000551051606 1039923461 /nfs/dbraw/zinc/92/34/61/1039923461.db2.gz SLWLKRAOPIFNML-UWHLTILDSA-N 2 1 344.543 4.253 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCCO[C@H]2C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000551051606 1039923475 /nfs/dbraw/zinc/92/34/75/1039923475.db2.gz SLWLKRAOPIFNML-UWHLTILDSA-N 2 1 344.543 4.253 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2(C)Cc3ccccc3C2)C[C@@H]1c1ccccc1 ZINC000551087036 1039965747 /nfs/dbraw/zinc/96/57/47/1039965747.db2.gz KSXRVEDOMGWYFD-FGZHOGPDSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(C)Cc3ccccc3C2)C[C@@H]1c1ccccc1 ZINC000551087036 1039965775 /nfs/dbraw/zinc/96/57/75/1039965775.db2.gz KSXRVEDOMGWYFD-FGZHOGPDSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cnc(C4CCCCC4)s3)CC[C@@H]21 ZINC000537695387 1039974268 /nfs/dbraw/zinc/97/42/68/1039974268.db2.gz NUABRROLCQVIGW-AEFFLSMTSA-N 2 1 333.545 4.107 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3cnc(C4CCCCC4)s3)CC[C@@H]21 ZINC000537695387 1039974287 /nfs/dbraw/zinc/97/42/87/1039974287.db2.gz NUABRROLCQVIGW-AEFFLSMTSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3cnc(C4CCCCC4)s3)CC[C@@H]21 ZINC000537695387 1039974304 /nfs/dbraw/zinc/97/43/04/1039974304.db2.gz NUABRROLCQVIGW-AEFFLSMTSA-N 2 1 333.545 4.107 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3cnc(C4CCCCC4)s3)CC[C@@H]21 ZINC000537695387 1039974321 /nfs/dbraw/zinc/97/43/21/1039974321.db2.gz NUABRROLCQVIGW-AEFFLSMTSA-N 2 1 333.545 4.107 20 0 EIADMP CN(c1ccccc1C[N@H+]1CC[C@H]1c1ccccc1)C1CC[NH+](C)CC1 ZINC000434986061 1039984296 /nfs/dbraw/zinc/98/42/96/1039984296.db2.gz MCCNCNUUAFFMCO-QHCPKHFHSA-N 2 1 349.522 4.164 20 0 EIADMP C[C@@H](Cc1ccccc1)C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000435047222 1040026745 /nfs/dbraw/zinc/02/67/45/1040026745.db2.gz DIONOMIAFPBCKO-SFHVURJKSA-N 2 1 337.511 4.278 20 0 EIADMP C[C@H](Cc1ccccc1)C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000435047221 1040027619 /nfs/dbraw/zinc/02/76/19/1040027619.db2.gz DIONOMIAFPBCKO-GOSISDBHSA-N 2 1 337.511 4.278 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(OCc2ccccc2C)cc1 ZINC000482122669 1040033877 /nfs/dbraw/zinc/03/38/77/1040033877.db2.gz UJJMVECKYKSOKR-SFHVURJKSA-N 2 1 349.478 4.430 20 0 EIADMP C[C@H]1C[C@H]1c1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)o1 ZINC000435062035 1040039540 /nfs/dbraw/zinc/03/95/40/1040039540.db2.gz WIPBGNZPCHKIPR-HNAYVOBHSA-N 2 1 339.483 4.315 20 0 EIADMP CCOC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCC1 ZINC000551264831 1040124023 /nfs/dbraw/zinc/12/40/23/1040124023.db2.gz OJWSHOUSPXFTFP-MZADTFQBSA-N 2 1 342.527 4.121 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2c3cc(F)ccc3C[C@H]2C)c1 ZINC000482323922 1040167415 /nfs/dbraw/zinc/16/74/15/1040167415.db2.gz UJJGFRKNQMULGQ-VFNWGFHPSA-N 2 1 326.459 4.301 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(OC(F)F)cc1 ZINC000482328899 1040180504 /nfs/dbraw/zinc/18/05/04/1040180504.db2.gz IVLIDVYIAYJZSV-CRAIPNDOSA-N 2 1 340.458 4.449 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000482336224 1040186109 /nfs/dbraw/zinc/18/61/09/1040186109.db2.gz RVECHZWGPGIUIM-HUUCEWRRSA-N 2 1 328.422 4.476 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)C1 ZINC000482355197 1040196388 /nfs/dbraw/zinc/19/63/88/1040196388.db2.gz FKRXCVUQOCIMEU-CABCVRRESA-N 2 1 344.421 4.356 20 0 EIADMP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)c1 ZINC000482353527 1040199110 /nfs/dbraw/zinc/19/91/10/1040199110.db2.gz DABIGEQNDKCVMQ-CVEARBPZSA-N 2 1 340.458 4.367 20 0 EIADMP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000482353527 1040199141 /nfs/dbraw/zinc/19/91/41/1040199141.db2.gz DABIGEQNDKCVMQ-CVEARBPZSA-N 2 1 340.458 4.367 20 0 EIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482456269 1040254162 /nfs/dbraw/zinc/25/41/62/1040254162.db2.gz ZGWQUNFJGWFIJH-KKLQWCBXSA-N 2 1 334.507 4.074 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)o1 ZINC000482448898 1040260083 /nfs/dbraw/zinc/26/00/83/1040260083.db2.gz GQIXKWCNAKXNBD-IEBWSBKVSA-N 2 1 326.484 4.057 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)o1 ZINC000482448898 1040260100 /nfs/dbraw/zinc/26/01/00/1040260100.db2.gz GQIXKWCNAKXNBD-IEBWSBKVSA-N 2 1 326.484 4.057 20 0 EIADMP C[C@@H](Cc1ccccc1)C[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000482518168 1040314789 /nfs/dbraw/zinc/31/47/89/1040314789.db2.gz KQGOFIBNDRRBHS-IBGZPJMESA-N 2 1 337.511 4.109 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2c(s1)CCC2 ZINC000479467134 1040393355 /nfs/dbraw/zinc/39/33/55/1040393355.db2.gz VDPXLYFPHNQKBN-WMZOPIPTSA-N 2 1 340.536 4.410 20 0 EIADMP FC(F)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666999537 1040443760 /nfs/dbraw/zinc/44/37/60/1040443760.db2.gz TUBVFENPSPHNCM-OAHLLOKOSA-N 2 1 346.421 4.206 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccccc1F ZINC000479561980 1040473091 /nfs/dbraw/zinc/47/30/91/1040473091.db2.gz WIVNWVIFVDGKTB-PGRDOPGGSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccccc1F ZINC000479561980 1040473101 /nfs/dbraw/zinc/47/31/01/1040473101.db2.gz WIVNWVIFVDGKTB-PGRDOPGGSA-N 2 1 340.486 4.259 20 0 EIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](CCCc4ccncc4)CC[C@@H]32)cc1 ZINC000462314226 1040474830 /nfs/dbraw/zinc/47/48/30/1040474830.db2.gz JBUAKLCMTLYAFJ-GOTSBHOMSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](CCCc4ccncc4)CC[C@@H]32)cc1 ZINC000462314226 1040474835 /nfs/dbraw/zinc/47/48/35/1040474835.db2.gz JBUAKLCMTLYAFJ-GOTSBHOMSA-N 2 1 349.522 4.001 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](CCCc4ccncc4)CC[C@@H]32)cc1 ZINC000462314226 1040474842 /nfs/dbraw/zinc/47/48/42/1040474842.db2.gz JBUAKLCMTLYAFJ-GOTSBHOMSA-N 2 1 349.522 4.001 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cn(C(C)C)nc2C)CC1)CC(C)C ZINC000515093418 1040479832 /nfs/dbraw/zinc/47/98/32/1040479832.db2.gz KPELWSPVJXJRBI-UHFFFAOYSA-N 2 1 348.579 4.352 20 0 EIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000539508894 1040503009 /nfs/dbraw/zinc/50/30/09/1040503009.db2.gz BVDBEZRBYBVVLN-HUUCEWRRSA-N 2 1 325.456 4.487 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CCC([NH2+]C(C)C)CC2)cc1 ZINC000667571630 1040775008 /nfs/dbraw/zinc/77/50/08/1040775008.db2.gz ZXOUTTWAKAWMKB-UHFFFAOYSA-N 2 1 329.513 4.081 20 0 EIADMP CCCCOc1cc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)ccc1OC ZINC000539818055 1040811447 /nfs/dbraw/zinc/81/14/47/1040811447.db2.gz PJGDKLKPIIQSEK-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[N@@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)ccc1OC ZINC000539818055 1040811449 /nfs/dbraw/zinc/81/14/49/1040811449.db2.gz PJGDKLKPIIQSEK-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[NH+](C)[C@H]2CC[N@H+](CC)[C@@H](C)C2)ccc1OC ZINC000539818055 1040811451 /nfs/dbraw/zinc/81/14/51/1040811451.db2.gz PJGDKLKPIIQSEK-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP CCCCOc1cc(C[NH+](C)[C@H]2CC[N@@H+](CC)[C@@H](C)C2)ccc1OC ZINC000539818055 1040811460 /nfs/dbraw/zinc/81/14/60/1040811460.db2.gz PJGDKLKPIIQSEK-HKUYNNGSSA-N 2 1 348.531 4.179 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(OC)c3ccccc23)C1 ZINC000539821751 1040815207 /nfs/dbraw/zinc/81/52/07/1040815207.db2.gz LECWWBFJUZDFKT-KRWDZBQOSA-N 2 1 326.484 4.012 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(OC)c3ccccc23)C1 ZINC000539821751 1040815215 /nfs/dbraw/zinc/81/52/15/1040815215.db2.gz LECWWBFJUZDFKT-KRWDZBQOSA-N 2 1 326.484 4.012 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(OC)c3ccccc23)C1 ZINC000539821751 1040815222 /nfs/dbraw/zinc/81/52/22/1040815222.db2.gz LECWWBFJUZDFKT-KRWDZBQOSA-N 2 1 326.484 4.012 20 0 EIADMP CC[C@H](c1ccccc1)[N@@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1 ZINC000436056709 1040844150 /nfs/dbraw/zinc/84/41/50/1040844150.db2.gz TXHQPRQSDBGMBU-SJLPKXTDSA-N 2 1 329.513 4.014 20 0 EIADMP CC[C@H](c1ccccc1)[N@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1 ZINC000436056709 1040844155 /nfs/dbraw/zinc/84/41/55/1040844155.db2.gz TXHQPRQSDBGMBU-SJLPKXTDSA-N 2 1 329.513 4.014 20 0 EIADMP CCc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc1 ZINC000462727846 1040860697 /nfs/dbraw/zinc/86/06/97/1040860697.db2.gz XJQJBCOOMDPBBI-AZUAARDMSA-N 2 1 328.525 4.483 20 0 EIADMP CCc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cc1 ZINC000462727846 1040860703 /nfs/dbraw/zinc/86/07/03/1040860703.db2.gz XJQJBCOOMDPBBI-AZUAARDMSA-N 2 1 328.525 4.483 20 0 EIADMP Cc1ccncc1[C@@H](C)[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000537881518 1040869310 /nfs/dbraw/zinc/86/93/10/1040869310.db2.gz NZHAJUAUGYBCJP-MOXWOTFGSA-N 2 1 337.511 4.197 20 0 EIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(F)cc1OC(F)F ZINC000480039405 1040880301 /nfs/dbraw/zinc/88/03/01/1040880301.db2.gz NDTYCZKJTMHUPJ-LLVKDONJSA-N 2 1 344.421 4.387 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccc2c(c1)COC2 ZINC000483672077 1040960752 /nfs/dbraw/zinc/96/07/52/1040960752.db2.gz PPUYZLPVPHLNLJ-ZWKOTPCHSA-N 2 1 338.495 4.278 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCc2c1cc(Cl)cc2Cl ZINC000537967791 1040969817 /nfs/dbraw/zinc/96/98/17/1040969817.db2.gz AMFACMYNTRLZEY-DIFFPNOSSA-N 2 1 338.282 4.412 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(CNC2CC[NH+](C3CCCC3)CC2)c1 ZINC000537969807 1040973907 /nfs/dbraw/zinc/97/39/07/1040973907.db2.gz SVKWMKCSMOZSSV-UHFFFAOYSA-N 3 1 343.559 4.023 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)c1 ZINC000537969807 1040973935 /nfs/dbraw/zinc/97/39/35/1040973935.db2.gz SVKWMKCSMOZSSV-UHFFFAOYSA-N 3 1 343.559 4.023 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)c1 ZINC000537969807 1040973955 /nfs/dbraw/zinc/97/39/55/1040973955.db2.gz SVKWMKCSMOZSSV-UHFFFAOYSA-N 3 1 343.559 4.023 20 0 EIADMP COc1cc(C)c([C@@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C)cc1OC ZINC000483863496 1041050197 /nfs/dbraw/zinc/05/01/97/1041050197.db2.gz UQXYFRSCYJLYFD-QGZVFWFLSA-N 2 1 336.520 4.172 20 0 EIADMP CC(C)[C@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1cccnc1 ZINC000538115703 1041067132 /nfs/dbraw/zinc/06/71/32/1041067132.db2.gz AWLKXZWBWGWDFY-RXVVDRJESA-N 2 1 325.500 4.279 20 0 EIADMP 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 1041078555 /nfs/dbraw/zinc/07/85/55/1041078555.db2.gz NTILICQRBKONJP-GZMRBYKVSA-N 2 1 340.433 4.270 20 0 EIADMP Cc1ccc(SC2(C[NH2+][C@@H]3CC[N@@H+](C)[C@H](C)C3)CCCC2)cc1 ZINC000484287866 1041195916 /nfs/dbraw/zinc/19/59/16/1041195916.db2.gz CYHWAVGHHIMLBB-QZTJIDSGSA-N 2 1 332.557 4.472 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)[C@@H](C)C1 ZINC000667666261 1041240201 /nfs/dbraw/zinc/24/02/01/1041240201.db2.gz HJKDVEFSROVGCN-KXBFYZLASA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3scnc3C)cc2)[C@@H](C)C1 ZINC000667666261 1041240216 /nfs/dbraw/zinc/24/02/16/1041240216.db2.gz HJKDVEFSROVGCN-KXBFYZLASA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(-c3scnc3C)cc2)[C@@H](C)C1 ZINC000667666261 1041240229 /nfs/dbraw/zinc/24/02/29/1041240229.db2.gz HJKDVEFSROVGCN-KXBFYZLASA-N 2 1 343.540 4.281 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000667667649 1041251334 /nfs/dbraw/zinc/25/13/34/1041251334.db2.gz SEFBPYKHSRADQA-KDOFPFPSSA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000667667649 1041251352 /nfs/dbraw/zinc/25/13/52/1041251352.db2.gz SEFBPYKHSRADQA-KDOFPFPSSA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000667667649 1041251365 /nfs/dbraw/zinc/25/13/65/1041251365.db2.gz SEFBPYKHSRADQA-KDOFPFPSSA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000667667649 1041251385 /nfs/dbraw/zinc/25/13/85/1041251385.db2.gz SEFBPYKHSRADQA-KDOFPFPSSA-N 2 1 329.513 4.033 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000484506259 1041287365 /nfs/dbraw/zinc/28/73/65/1041287365.db2.gz QWQIYKVHYFRSQP-WIYYLYMNSA-N 2 1 338.495 4.004 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000484506259 1041287389 /nfs/dbraw/zinc/28/73/89/1041287389.db2.gz QWQIYKVHYFRSQP-WIYYLYMNSA-N 2 1 338.495 4.004 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC2(CCC[N@@H+]2C)CC1 ZINC000540298655 1041349863 /nfs/dbraw/zinc/34/98/63/1041349863.db2.gz UOFVTFZOGHHENI-CQSZACIVSA-N 2 1 342.405 4.206 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC000540298655 1041349873 /nfs/dbraw/zinc/34/98/73/1041349873.db2.gz UOFVTFZOGHHENI-CQSZACIVSA-N 2 1 342.405 4.206 20 0 EIADMP CCc1ccc([C@H]([NH2+]CC2([NH+]3CCCC3)CCOCC2)C(C)C)cc1 ZINC000540299988 1041349998 /nfs/dbraw/zinc/34/99/98/1041349998.db2.gz FWNMXSZIEHJUQP-OAQYLSRUSA-N 2 1 344.543 4.181 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)Oc1ccccc1 ZINC000463117278 1041357161 /nfs/dbraw/zinc/35/71/61/1041357161.db2.gz GRKOXHYCYUAQKA-QKNQBKEWSA-N 2 1 338.495 4.097 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)Oc1ccccc1 ZINC000463117278 1041357169 /nfs/dbraw/zinc/35/71/69/1041357169.db2.gz GRKOXHYCYUAQKA-QKNQBKEWSA-N 2 1 338.495 4.097 20 0 EIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463117246 1041358087 /nfs/dbraw/zinc/35/80/87/1041358087.db2.gz SIBXFFBLAWUNSU-QHCPKHFHSA-N 2 1 334.507 4.279 20 0 EIADMP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463152749 1041385675 /nfs/dbraw/zinc/38/56/75/1041385675.db2.gz SWUVDJHJEMRNKB-FDDCHVKYSA-N 2 1 334.507 4.217 20 0 EIADMP C[C@H]1C[C@@H](NC2(c3cccc(F)c3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000538553358 1041417128 /nfs/dbraw/zinc/41/71/28/1041417128.db2.gz DYUMVGSMGUDSCJ-UWJYYQICSA-N 2 1 338.470 4.458 20 0 EIADMP C[C@H]1C[C@@H](NC2(c3cccc(F)c3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000538553358 1041417133 /nfs/dbraw/zinc/41/71/33/1041417133.db2.gz DYUMVGSMGUDSCJ-UWJYYQICSA-N 2 1 338.470 4.458 20 0 EIADMP Cc1cccc(CCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)n1 ZINC000287323220 1041423698 /nfs/dbraw/zinc/42/36/98/1041423698.db2.gz FMSVDHDEKJOAPD-WBDAEOGXSA-N 2 1 349.522 4.108 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+]2C)cc1OC ZINC000540377595 1041428384 /nfs/dbraw/zinc/42/83/84/1041428384.db2.gz QHYHLNPFPKZLNH-WMZOPIPTSA-N 2 1 334.504 4.009 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000516214732 1041467242 /nfs/dbraw/zinc/46/72/42/1041467242.db2.gz XIOJVDBSJZGDME-ZIAGYGMSSA-N 2 1 339.405 4.240 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc(-c2cccnc2)c1 ZINC000554880554 1041478055 /nfs/dbraw/zinc/47/80/55/1041478055.db2.gz JRZZNUKYHGLGOM-UHFFFAOYSA-N 2 1 348.494 4.420 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc(-c2cccnc2)c1 ZINC000554880554 1041478059 /nfs/dbraw/zinc/47/80/59/1041478059.db2.gz JRZZNUKYHGLGOM-UHFFFAOYSA-N 2 1 348.494 4.420 20 0 EIADMP COc1ccc([C@@H](CCC(C)C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480749104 1041504240 /nfs/dbraw/zinc/50/42/40/1041504240.db2.gz ZWJARYOOIGBSRA-LAUBAEHRSA-N 2 1 330.516 4.246 20 0 EIADMP COc1ccc([C@@H](CCC(C)C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480749102 1041505413 /nfs/dbraw/zinc/50/54/13/1041505413.db2.gz ZWJARYOOIGBSRA-DYESRHJHSA-N 2 1 330.516 4.246 20 0 EIADMP c1csc(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)c1 ZINC000538762575 1041534935 /nfs/dbraw/zinc/53/49/35/1041534935.db2.gz XSUPPBQJVOOJHV-UHFFFAOYSA-N 2 1 326.509 4.236 20 0 EIADMP CCC[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000540605222 1041558177 /nfs/dbraw/zinc/55/81/77/1041558177.db2.gz FTTIYBUNGYFKOT-KRWDZBQOSA-N 2 1 326.406 4.398 20 0 EIADMP c1cc(-c2ccc(C[NH2+]C3CC[NH+](CC4CC4)CC3)cc2)cs1 ZINC001168359870 1041600929 /nfs/dbraw/zinc/60/09/29/1041600929.db2.gz FZFZJWLMJKKTFR-UHFFFAOYSA-N 2 1 326.509 4.379 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1Nc1ccc(C[NH+]2CCCC[C@H]2C)cc1 ZINC000540699941 1041614802 /nfs/dbraw/zinc/61/48/02/1041614802.db2.gz RRMSCPHOFKVVRT-IKVWTGGYSA-N 2 1 329.532 4.202 20 0 EIADMP C[C@@H]1C[NH+](C)[C@H](C)C[C@@H]1Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000540699941 1041614804 /nfs/dbraw/zinc/61/48/04/1041614804.db2.gz RRMSCPHOFKVVRT-IKVWTGGYSA-N 2 1 329.532 4.202 20 0 EIADMP C[C@@H]1C[NH+](C)[C@H](C)C[C@@H]1Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000540699941 1041614807 /nfs/dbraw/zinc/61/48/07/1041614807.db2.gz RRMSCPHOFKVVRT-IKVWTGGYSA-N 2 1 329.532 4.202 20 0 EIADMP CC[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)CC(F)(F)F ZINC000402582645 1041872522 /nfs/dbraw/zinc/87/25/22/1041872522.db2.gz UXLBBJCVRFERDM-INIZCTEOSA-N 2 1 342.449 4.262 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438094681 1042042496 /nfs/dbraw/zinc/04/24/96/1042042496.db2.gz OBVLVGAIPKHDMW-BVSLBCMMSA-N 2 1 326.528 4.161 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438094681 1042042506 /nfs/dbraw/zinc/04/25/06/1042042506.db2.gz OBVLVGAIPKHDMW-BVSLBCMMSA-N 2 1 326.528 4.161 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438094681 1042042515 /nfs/dbraw/zinc/04/25/15/1042042515.db2.gz OBVLVGAIPKHDMW-BVSLBCMMSA-N 2 1 326.528 4.161 20 0 EIADMP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3ccc(Cl)o3)c2)CC1 ZINC000517546955 1042076371 /nfs/dbraw/zinc/07/63/71/1042076371.db2.gz ACBMEKSGKURLIK-UHFFFAOYSA-N 2 1 332.875 4.455 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000438201637 1042078789 /nfs/dbraw/zinc/07/87/89/1042078789.db2.gz QIIFDCGFVRMQPE-OXFYSEKESA-N 2 1 346.515 4.491 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000438201637 1042078799 /nfs/dbraw/zinc/07/87/99/1042078799.db2.gz QIIFDCGFVRMQPE-OXFYSEKESA-N 2 1 346.515 4.491 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H]3CC[C@](C)(c4ccccc4)C3)CC2)[nH+]1 ZINC000438190842 1042083180 /nfs/dbraw/zinc/08/31/80/1042083180.db2.gz NRSFRKGUEVKLPO-GMAHTHKFSA-N 2 1 349.522 4.459 20 0 EIADMP Fc1ccc(C[N@H+]2CCCN(c3cc[nH+]c4ccccc43)CC2)cc1 ZINC000517639316 1042111941 /nfs/dbraw/zinc/11/19/41/1042111941.db2.gz KQDFXNDAEZSUPW-UHFFFAOYSA-N 2 1 335.426 4.086 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCCOc2ccc3ccccc3c2)C1 ZINC000464772670 1042165252 /nfs/dbraw/zinc/16/52/52/1042165252.db2.gz FRPFZORGQLQCKB-IBGZPJMESA-N 2 1 340.511 4.272 20 0 EIADMP CSC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000541915439 1042170024 /nfs/dbraw/zinc/17/00/24/1042170024.db2.gz MJLOMSYDHFPVGA-CZUORRHYSA-N 2 1 346.462 4.041 20 0 EIADMP CSC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000541915439 1042170028 /nfs/dbraw/zinc/17/00/28/1042170028.db2.gz MJLOMSYDHFPVGA-CZUORRHYSA-N 2 1 346.462 4.041 20 0 EIADMP Cc1cc(C)c(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1C ZINC000303149407 1042323014 /nfs/dbraw/zinc/32/30/14/1042323014.db2.gz FCWXXNPJMNTAEJ-JOCHJYFZSA-N 2 1 336.523 4.266 20 0 EIADMP FC(F)(F)c1cc(C[NH2+]CCC[NH+]2CCCCC2)ccc1Cl ZINC000518271187 1042444331 /nfs/dbraw/zinc/44/43/31/1042444331.db2.gz KDUJUPVAYVMSGC-UHFFFAOYSA-N 2 1 334.813 4.324 20 0 EIADMP CCc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)cc1 ZINC000518274283 1042447440 /nfs/dbraw/zinc/44/74/40/1042447440.db2.gz RAVGJTZYCDRVNL-IBGZPJMESA-N 2 1 328.525 4.312 20 0 EIADMP CCc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cc1 ZINC000518274283 1042447441 /nfs/dbraw/zinc/44/74/41/1042447441.db2.gz RAVGJTZYCDRVNL-IBGZPJMESA-N 2 1 328.525 4.312 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3)CC[N@H+]1Cc1ccccc1 ZINC000414974615 1042461095 /nfs/dbraw/zinc/46/10/95/1042461095.db2.gz DUDJKIOKKVBLDZ-AVRDEDQJSA-N 2 1 349.522 4.187 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3)CC[N@H+]1Cc1ccccc1 ZINC000414974622 1042461778 /nfs/dbraw/zinc/46/17/78/1042461778.db2.gz DUDJKIOKKVBLDZ-GCJKJVERSA-N 2 1 349.522 4.187 20 0 EIADMP C[C@H](CCCC(F)(F)F)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000303686573 1042497680 /nfs/dbraw/zinc/49/76/80/1042497680.db2.gz NTKGQEBTTUGZSK-OAHLLOKOSA-N 2 1 328.422 4.362 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)cc1F ZINC000304618825 1042578572 /nfs/dbraw/zinc/57/85/72/1042578572.db2.gz NUUBBMIYQPFZPS-INIZCTEOSA-N 2 1 330.447 4.007 20 0 EIADMP CCCc1csc(C[NH+]2CCC(CC[N@@H+](CC)CC3CC3)CC2)n1 ZINC000426407896 1042675760 /nfs/dbraw/zinc/67/57/60/1042675760.db2.gz XYEDETZWBZDOPS-UHFFFAOYSA-N 2 1 349.588 4.430 20 0 EIADMP Cc1nc2ccc(C[N@@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2s1 ZINC000426416019 1042680107 /nfs/dbraw/zinc/68/01/07/1042680107.db2.gz GENOXXYBPPVXIJ-LPHOPBHVSA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[N@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2s1 ZINC000426416019 1042680113 /nfs/dbraw/zinc/68/01/13/1042680113.db2.gz GENOXXYBPPVXIJ-LPHOPBHVSA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[NH+]3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)cc2s1 ZINC000426416019 1042680120 /nfs/dbraw/zinc/68/01/20/1042680120.db2.gz GENOXXYBPPVXIJ-LPHOPBHVSA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[NH+]3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)cc2s1 ZINC000426416019 1042680127 /nfs/dbraw/zinc/68/01/27/1042680127.db2.gz GENOXXYBPPVXIJ-LPHOPBHVSA-N 2 1 341.524 4.053 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000309710703 1042819952 /nfs/dbraw/zinc/81/99/52/1042819952.db2.gz JESXOHUZMZRMCF-WMZOPIPTSA-N 2 1 328.525 4.483 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000177271304 1042832776 /nfs/dbraw/zinc/83/27/76/1042832776.db2.gz BCQKTQWZGYLIGF-IAGOWNOFSA-N 2 1 344.524 4.320 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000177271304 1042832780 /nfs/dbraw/zinc/83/27/80/1042832780.db2.gz BCQKTQWZGYLIGF-IAGOWNOFSA-N 2 1 344.524 4.320 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccccc1)c1ccc(F)cc1 ZINC000177295744 1042833280 /nfs/dbraw/zinc/83/32/80/1042833280.db2.gz UDIDRPJYIZCMRE-IIBYNOLFSA-N 2 1 337.442 4.346 20 0 EIADMP Cc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc(C)c1O ZINC000310842004 1042846700 /nfs/dbraw/zinc/84/67/00/1042846700.db2.gz NWLHYLIDLQUMBO-GHTZIAJQSA-N 2 1 338.495 4.009 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2cccnc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311609395 1042862480 /nfs/dbraw/zinc/86/24/80/1042862480.db2.gz DZEDYWIJGNPCND-PGRDOPGGSA-N 2 1 345.490 4.235 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH+]2CCC(CC[N@@H+](CC)CC3CC3)CC2)CCO1 ZINC000507774386 1042876084 /nfs/dbraw/zinc/87/60/84/1042876084.db2.gz KAIQIBJWPBKJSN-LEWJYISDSA-N 2 1 336.564 4.026 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccccc1OC(F)F ZINC000320631100 1043031631 /nfs/dbraw/zinc/03/16/31/1043031631.db2.gz GIIVYEXFXUMLBO-OAHLLOKOSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2scnc2C2CC2)CC1 ZINC000494984391 1043094215 /nfs/dbraw/zinc/09/42/15/1043094215.db2.gz FBWBHPOMYBSUJG-MRXNPFEDSA-N 2 1 347.572 4.497 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000507827572 1043130580 /nfs/dbraw/zinc/13/05/80/1043130580.db2.gz RIFDCGAQRNPABO-KRWDZBQOSA-N 2 1 327.299 4.443 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000338773762 1043142061 /nfs/dbraw/zinc/14/20/61/1043142061.db2.gz FRMPCPBQLXRYSA-ZACQAIPSSA-N 2 1 341.499 4.425 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc2cnccc2o1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000657965808 1043221848 /nfs/dbraw/zinc/22/18/48/1043221848.db2.gz BOBQZHSXLJZENT-AOIWGVFYSA-N 2 1 349.478 4.389 20 0 EIADMP CC[C@H](Cc1ccccc1)[N@H+](CC)Cc1ncc(C[NH+](C)C)s1 ZINC000347864986 1043255976 /nfs/dbraw/zinc/25/59/76/1043255976.db2.gz OFCAORZHHTUWIC-QGZVFWFLSA-N 2 1 331.529 4.048 20 0 EIADMP CC[C@H](Cc1ccccc1)[N@@H+](CC)Cc1ncc(C[NH+](C)C)s1 ZINC000347864986 1043255981 /nfs/dbraw/zinc/25/59/81/1043255981.db2.gz OFCAORZHHTUWIC-QGZVFWFLSA-N 2 1 331.529 4.048 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC000665249204 1043261047 /nfs/dbraw/zinc/26/10/47/1043261047.db2.gz LATGHUSGVCYSFY-LBPRGKRZSA-N 2 1 333.476 4.180 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H](C)CCC3CC3)CC2)cs1 ZINC000186333195 1043270012 /nfs/dbraw/zinc/27/00/12/1043270012.db2.gz ADGDQWIPWHJURI-OAHLLOKOSA-N 2 1 335.561 4.086 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1cccnc1 ZINC000520811143 1043387420 /nfs/dbraw/zinc/38/74/20/1043387420.db2.gz ASLKTBLXNZDLOL-OAQYLSRUSA-N 2 1 349.522 4.146 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1cccnc1 ZINC000520811143 1043387430 /nfs/dbraw/zinc/38/74/30/1043387430.db2.gz ASLKTBLXNZDLOL-OAQYLSRUSA-N 2 1 349.522 4.146 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657998974 1043419639 /nfs/dbraw/zinc/41/96/39/1043419639.db2.gz QHTMWQXWFPMAPL-FUHWJXTLSA-N 2 1 335.451 4.001 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657998974 1043419654 /nfs/dbraw/zinc/41/96/54/1043419654.db2.gz QHTMWQXWFPMAPL-FUHWJXTLSA-N 2 1 335.451 4.001 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CC[N@@H+]1C ZINC000467439871 1043577439 /nfs/dbraw/zinc/57/74/39/1043577439.db2.gz YBRMTJZSGKCQEM-REBRKWNGSA-N 2 1 327.299 4.312 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CC[N@H+]1C ZINC000467439871 1043577461 /nfs/dbraw/zinc/57/74/61/1043577461.db2.gz YBRMTJZSGKCQEM-REBRKWNGSA-N 2 1 327.299 4.312 20 0 EIADMP C[NH+]1CCC([NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442645536 1043793466 /nfs/dbraw/zinc/79/34/66/1043793466.db2.gz IXBUTCUSLCDQMT-RHSMWYFYSA-N 2 1 326.406 4.025 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cnn1C(C)(C)C ZINC000191491701 1043820179 /nfs/dbraw/zinc/82/01/79/1043820179.db2.gz PFQAEXCXOFXGEE-SOLBZPMBSA-N 2 1 346.563 4.250 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cnn1C(C)(C)C ZINC000191491701 1043820183 /nfs/dbraw/zinc/82/01/83/1043820183.db2.gz PFQAEXCXOFXGEE-SOLBZPMBSA-N 2 1 346.563 4.250 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cnn1C(C)(C)C ZINC000191491673 1043821343 /nfs/dbraw/zinc/82/13/43/1043821343.db2.gz PFQAEXCXOFXGEE-XYJFISCASA-N 2 1 346.563 4.250 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cnn1C(C)(C)C ZINC000191491673 1043821346 /nfs/dbraw/zinc/82/13/46/1043821346.db2.gz PFQAEXCXOFXGEE-XYJFISCASA-N 2 1 346.563 4.250 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442773380 1043830201 /nfs/dbraw/zinc/83/02/01/1043830201.db2.gz CLULFFYLKZQREO-NVXWUHKLSA-N 2 1 337.389 4.136 20 0 EIADMP CCCCOc1ccc(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1Cl ZINC000191632483 1043832368 /nfs/dbraw/zinc/83/23/68/1043832368.db2.gz SFSDQAODMFBFJI-DLBZAZTESA-N 2 1 336.907 4.235 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1Cl ZINC000191632483 1043832372 /nfs/dbraw/zinc/83/23/72/1043832372.db2.gz SFSDQAODMFBFJI-DLBZAZTESA-N 2 1 336.907 4.235 20 0 EIADMP CCCCOc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1Cl ZINC000191632483 1043832381 /nfs/dbraw/zinc/83/23/81/1043832381.db2.gz SFSDQAODMFBFJI-DLBZAZTESA-N 2 1 336.907 4.235 20 0 EIADMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000442920472 1043897191 /nfs/dbraw/zinc/89/71/91/1043897191.db2.gz LMARWOSPEHTYQK-CQSZACIVSA-N 2 1 334.410 4.002 20 0 EIADMP C[C@@H](CCCC(C)(C)O)[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168015050 1043963579 /nfs/dbraw/zinc/96/35/79/1043963579.db2.gz ONLONCYDDAXERZ-HUUJSLGLSA-N 2 1 346.559 4.347 20 0 EIADMP CC(C)C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195132329 1044026244 /nfs/dbraw/zinc/02/62/44/1044026244.db2.gz ADCNEPBONVTYFK-UNMCSNQZSA-N 2 1 337.511 4.281 20 0 EIADMP Cc1ccc(OC2CC[NH+](CCC[NH+]3CCCCC3)CC2)cc1C ZINC000195632381 1044154102 /nfs/dbraw/zinc/15/41/02/1044154102.db2.gz CQTXWNCTOATLFN-UHFFFAOYSA-N 2 1 330.516 4.023 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1[C@@H]1CCOC1 ZINC000474043033 1044166969 /nfs/dbraw/zinc/16/69/69/1044166969.db2.gz YUZAUSYSQXRLHW-BHIFYINESA-N 2 1 344.543 4.212 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1CCCCC1)c1cc(Br)cs1 ZINC000226391540 1044172614 /nfs/dbraw/zinc/17/26/14/1044172614.db2.gz FXEINBNGPOUCLH-LBPRGKRZSA-N 2 1 331.323 4.037 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000193971556 1044224769 /nfs/dbraw/zinc/22/47/69/1044224769.db2.gz ANRZKBQAYNNBRP-CQSZACIVSA-N 2 1 340.433 4.243 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(Cc2cccc(F)c2)CC1 ZINC000348066933 1044388019 /nfs/dbraw/zinc/38/80/19/1044388019.db2.gz DPIGBUWLGDQJAG-UHFFFAOYSA-N 2 1 329.463 4.066 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2ccc(OC)c3F)c1 ZINC000675728667 1044460907 /nfs/dbraw/zinc/46/09/07/1044460907.db2.gz SRVJWOIRWZOWOG-LJQANCHMSA-N 2 1 342.458 4.063 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCC(C)(C)c2ccccc2)[C@H](C)C1 ZINC000675770731 1044485115 /nfs/dbraw/zinc/48/51/15/1044485115.db2.gz YLVAVAKSBPVVMV-CTNGQTDRSA-N 2 1 346.559 4.081 20 0 EIADMP CS[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)(C)C ZINC000543411860 1044551987 /nfs/dbraw/zinc/55/19/87/1044551987.db2.gz BZWRZFFEHJLASS-QXAKKESOSA-N 2 1 334.573 4.407 20 0 EIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1cccs1 ZINC000675880281 1044552882 /nfs/dbraw/zinc/55/28/82/1044552882.db2.gz CUNAOOCJXCXTIH-MSOLQXFVSA-N 2 1 336.545 4.068 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2C)C1 ZINC000443637617 1044584663 /nfs/dbraw/zinc/58/46/63/1044584663.db2.gz GPTYCYDECQRPKP-OAHLLOKOSA-N 2 1 328.422 4.178 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2C)C1 ZINC000443637617 1044584681 /nfs/dbraw/zinc/58/46/81/1044584681.db2.gz GPTYCYDECQRPKP-OAHLLOKOSA-N 2 1 328.422 4.178 20 0 EIADMP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2nc(C)sc2C)c1 ZINC000676488094 1044768294 /nfs/dbraw/zinc/76/82/94/1044768294.db2.gz BBSZZUVREHKMSY-AWEZNQCLSA-N 2 1 331.529 4.453 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CCC(C)([NH+]3CCC3)CC2)cc1 ZINC000895672594 1044848112 /nfs/dbraw/zinc/84/81/12/1044848112.db2.gz VLTAZVNCHZDGPE-UHFFFAOYSA-N 2 1 341.524 4.179 20 0 EIADMP C[C@@H](F)CC[NH+]1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000508976996 1044862145 /nfs/dbraw/zinc/86/21/45/1044862145.db2.gz HZOBQDZJOKUCHU-CQSZACIVSA-N 2 1 346.412 4.350 20 0 EIADMP C[C@@H](F)CC[NH+]1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000508976996 1044862151 /nfs/dbraw/zinc/86/21/51/1044862151.db2.gz HZOBQDZJOKUCHU-CQSZACIVSA-N 2 1 346.412 4.350 20 0 EIADMP COc1cc(C[NH2+]CCC[N@H+](C)C2CCCCC2)ccc1OC(C)C ZINC000327417068 1044897637 /nfs/dbraw/zinc/89/76/37/1044897637.db2.gz YNJDDQXRAHVAHN-UHFFFAOYSA-N 2 1 348.531 4.227 20 0 EIADMP COc1cc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)ccc1OC(C)C ZINC000327417068 1044897641 /nfs/dbraw/zinc/89/76/41/1044897641.db2.gz YNJDDQXRAHVAHN-UHFFFAOYSA-N 2 1 348.531 4.227 20 0 EIADMP COc1cc[nH+]c(N2CC[NH+]([C@H](C)c3ccc4ccccc4c3)CC2)c1 ZINC000303282217 1044977215 /nfs/dbraw/zinc/97/72/15/1044977215.db2.gz UUQKTCVSLZQOCO-QGZVFWFLSA-N 2 1 347.462 4.127 20 0 EIADMP C[C@@H]([NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)c1cncc(F)c1 ZINC001168034969 1044989807 /nfs/dbraw/zinc/98/98/07/1044989807.db2.gz RXHJKWWFBDUXDQ-BRWVUGGUSA-N 2 1 341.474 4.313 20 0 EIADMP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000495420197 1045090327 /nfs/dbraw/zinc/09/03/27/1045090327.db2.gz FZFPDNDAYGPXHJ-AOIWGVFYSA-N 2 1 326.484 4.403 20 0 EIADMP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000495420197 1045090343 /nfs/dbraw/zinc/09/03/43/1045090343.db2.gz FZFPDNDAYGPXHJ-AOIWGVFYSA-N 2 1 326.484 4.403 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](Cc1ccccc1)c1cccs1 ZINC000347921521 1045129400 /nfs/dbraw/zinc/12/94/00/1045129400.db2.gz QKQKJWFKKQNSPN-SFHVURJKSA-N 2 1 325.481 4.217 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@@H]1CCCSCC1 ZINC000657907114 1045136094 /nfs/dbraw/zinc/13/60/94/1045136094.db2.gz GTJZGQOJIRYUSN-BWPNAZKDSA-N 2 1 332.557 4.018 20 0 EIADMP C[C@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC([C@@H]2CCC[NH2+]CC2)CC1 ZINC000923508527 1045141317 /nfs/dbraw/zinc/14/13/17/1045141317.db2.gz WJUKUOYVHMPILF-HZPDHXFCSA-N 2 1 333.520 4.135 20 0 EIADMP CC[N@H+](Cc1nc2cc(F)ccc2o1)Cc1ccc(C[NH+](C)C)cc1 ZINC000626062719 1045165180 /nfs/dbraw/zinc/16/51/80/1045165180.db2.gz CYEPXPABSJYNSZ-UHFFFAOYSA-N 2 1 341.430 4.051 20 0 EIADMP CC[N@@H+](Cc1nc2cc(F)ccc2o1)Cc1ccc(C[NH+](C)C)cc1 ZINC000626062719 1045165184 /nfs/dbraw/zinc/16/51/84/1045165184.db2.gz CYEPXPABSJYNSZ-UHFFFAOYSA-N 2 1 341.430 4.051 20 0 EIADMP CCCCOc1ccc(C[NH2+]C2CC[NH+](C(C)C)CC2)cc1OCC ZINC000236682432 1045363559 /nfs/dbraw/zinc/36/35/59/1045363559.db2.gz PUTGJHNTSYIYTF-UHFFFAOYSA-N 2 1 348.531 4.227 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000236808448 1045366406 /nfs/dbraw/zinc/36/64/06/1045366406.db2.gz FIXUPTMGBZAYMS-AWEZNQCLSA-N 2 1 334.410 4.046 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000236808448 1045366414 /nfs/dbraw/zinc/36/64/14/1045366414.db2.gz FIXUPTMGBZAYMS-AWEZNQCLSA-N 2 1 334.410 4.046 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(F)c1 ZINC000398050263 1045826780 /nfs/dbraw/zinc/82/67/80/1045826780.db2.gz XICDCJDPPBXVGM-XGHQBKJUSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(F)c1 ZINC000398050263 1045826782 /nfs/dbraw/zinc/82/67/82/1045826782.db2.gz XICDCJDPPBXVGM-XGHQBKJUSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1cncc(F)c1 ZINC000247057803 1045839771 /nfs/dbraw/zinc/83/97/71/1045839771.db2.gz NQYXKBRCQLZBMB-DLBZAZTESA-N 2 1 341.474 4.303 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1OC ZINC000248404235 1045872553 /nfs/dbraw/zinc/87/25/53/1045872553.db2.gz PTMGXDSAXWRJOK-JZXOWHBKSA-N 2 1 346.515 4.007 20 0 EIADMP CC[C@H]1C[C@H]([N@@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170188947 1045919748 /nfs/dbraw/zinc/91/97/48/1045919748.db2.gz ABUPYMWCKAGVFT-NCYKPQTJSA-N 2 1 330.516 4.025 20 0 EIADMP C[C@@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(c2ccccc2F)CC1 ZINC001170260300 1045959360 /nfs/dbraw/zinc/95/93/60/1045959360.db2.gz HQVHYASNGXHDPM-HNNXBMFYSA-N 2 1 346.877 4.360 20 0 EIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@H](C)Cc2ccccc2Cl)CC1 ZINC001170253924 1045973777 /nfs/dbraw/zinc/97/37/77/1045973777.db2.gz CXSMEXFUDBONMN-MRXNPFEDSA-N 2 1 343.902 4.233 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)CC1 ZINC000161655132 1046021034 /nfs/dbraw/zinc/02/10/34/1046021034.db2.gz BNWLNGMURBRLBX-CYBMUJFWSA-N 2 1 330.394 4.110 20 0 EIADMP CCc1noc(C)c1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000769875464 1046101830 /nfs/dbraw/zinc/10/18/30/1046101830.db2.gz USFYGXJBNJVEAU-OAHLLOKOSA-N 2 1 329.488 4.236 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000261896125 1046161956 /nfs/dbraw/zinc/16/19/56/1046161956.db2.gz VAUQAPFXRCAALB-OXQOHEQNSA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@@H+](C)C[C@]1(C)CC[NH2+]C1 ZINC000261896125 1046161961 /nfs/dbraw/zinc/16/19/61/1046161961.db2.gz VAUQAPFXRCAALB-OXQOHEQNSA-N 2 1 343.540 4.419 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000125951159 1046385688 /nfs/dbraw/zinc/38/56/88/1046385688.db2.gz TYVSRVJZVBKSAF-GJZGRUSLSA-N 2 1 326.431 4.059 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1OCC ZINC000125985076 1046406628 /nfs/dbraw/zinc/40/66/28/1046406628.db2.gz VVTYGTIODRYDLR-MSOLQXFVSA-N 2 1 348.531 4.255 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@H]2CC2(Cl)Cl)CC1)CC1CC1 ZINC000771475333 1046409172 /nfs/dbraw/zinc/40/91/72/1046409172.db2.gz IYAUZLSOTJECTM-MRXNPFEDSA-N 2 1 333.347 4.014 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000508762428 1046549146 /nfs/dbraw/zinc/54/91/46/1046549146.db2.gz CJCVUMPVKPUZAE-SSUIOBEFSA-N 2 1 342.527 4.044 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000508762428 1046549159 /nfs/dbraw/zinc/54/91/59/1046549159.db2.gz CJCVUMPVKPUZAE-SSUIOBEFSA-N 2 1 342.527 4.044 20 0 EIADMP COc1ccc(C2(C[NH2+]C3CC[NH+](C4CC4)CC3)CCCCC2)cc1 ZINC000459401758 1046596735 /nfs/dbraw/zinc/59/67/35/1046596735.db2.gz XVJWGIUZEVDAKU-UHFFFAOYSA-N 2 1 342.527 4.114 20 0 EIADMP CCCOc1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1OC ZINC000536652968 1046596958 /nfs/dbraw/zinc/59/69/58/1046596958.db2.gz DBIWDLKUEORTJZ-UHFFFAOYSA-N 2 1 348.531 4.036 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(OC(F)F)c(Cl)c2)[C@@H](C)C1 ZINC000536678539 1046666408 /nfs/dbraw/zinc/66/64/08/1046666408.db2.gz CASQGRBTSJJWQA-WFASDCNBSA-N 2 1 346.849 4.104 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)[C@@H](C)C1 ZINC000536678539 1046666413 /nfs/dbraw/zinc/66/64/13/1046666413.db2.gz CASQGRBTSJJWQA-WFASDCNBSA-N 2 1 346.849 4.104 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)[C@@H](C)C1 ZINC000536678539 1046666417 /nfs/dbraw/zinc/66/64/17/1046666417.db2.gz CASQGRBTSJJWQA-WFASDCNBSA-N 2 1 346.849 4.104 20 0 EIADMP Cc1cc2cc(C[NH+]3CC[C@H](C[N@H+](C)CC4CC4)C3)oc2cc1C ZINC000536698651 1046693429 /nfs/dbraw/zinc/69/34/29/1046693429.db2.gz VXCRUHBDYPNZQQ-GOSISDBHSA-N 2 1 326.484 4.213 20 0 EIADMP Cc1cc2cc(C[NH+]3CC[C@H](C[N@@H+](C)CC4CC4)C3)oc2cc1C ZINC000536698651 1046693434 /nfs/dbraw/zinc/69/34/34/1046693434.db2.gz VXCRUHBDYPNZQQ-GOSISDBHSA-N 2 1 326.484 4.213 20 0 EIADMP Cc1cc2cc(C[N@H+]3CC[C@H](C[NH+](C)CC4CC4)C3)oc2cc1C ZINC000536698651 1046693443 /nfs/dbraw/zinc/69/34/43/1046693443.db2.gz VXCRUHBDYPNZQQ-GOSISDBHSA-N 2 1 326.484 4.213 20 0 EIADMP Cc1cc2cc(C[N@@H+]3CC[C@H](C[NH+](C)CC4CC4)C3)oc2cc1C ZINC000536698651 1046693456 /nfs/dbraw/zinc/69/34/56/1046693456.db2.gz VXCRUHBDYPNZQQ-GOSISDBHSA-N 2 1 326.484 4.213 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000379632385 1046731841 /nfs/dbraw/zinc/73/18/41/1046731841.db2.gz NQKMOZAYOJRDOI-QRQLOZEOSA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000379632385 1046731851 /nfs/dbraw/zinc/73/18/51/1046731851.db2.gz NQKMOZAYOJRDOI-QRQLOZEOSA-N 2 1 336.470 4.455 20 0 EIADMP CCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379643036 1046737485 /nfs/dbraw/zinc/73/74/85/1046737485.db2.gz ASJQLZYYGUZDMV-WIYYLYMNSA-N 2 1 338.495 4.228 20 0 EIADMP CC[N@H+](CCC1CC[NH+]([C@H](C)c2nc(C(C)C)no2)CC1)CC1CC1 ZINC000536736441 1046746653 /nfs/dbraw/zinc/74/66/53/1046746653.db2.gz MMEMAKHEJPNKFS-MRXNPFEDSA-N 2 1 348.535 4.088 20 0 EIADMP CC[N@@H+](CCC1CC[NH+]([C@H](C)c2nc(C(C)C)no2)CC1)CC1CC1 ZINC000536736441 1046746667 /nfs/dbraw/zinc/74/66/67/1046746667.db2.gz MMEMAKHEJPNKFS-MRXNPFEDSA-N 2 1 348.535 4.088 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3O)CC[N@@H+]1Cc1ccccc1 ZINC000379652754 1046746729 /nfs/dbraw/zinc/74/67/29/1046746729.db2.gz XWHZUOBYBCVFGC-PLMTUMEDSA-N 2 1 336.479 4.022 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cccc3O)CC[N@H+]1Cc1ccccc1 ZINC000379652754 1046746737 /nfs/dbraw/zinc/74/67/37/1046746737.db2.gz XWHZUOBYBCVFGC-PLMTUMEDSA-N 2 1 336.479 4.022 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@H]1CCC[NH+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000459523429 1046753147 /nfs/dbraw/zinc/75/31/47/1046753147.db2.gz VUVXSYFMFOGLGC-PMVMPFDFSA-N 2 1 349.522 4.172 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000459523429 1046753160 /nfs/dbraw/zinc/75/31/60/1046753160.db2.gz VUVXSYFMFOGLGC-PMVMPFDFSA-N 2 1 349.522 4.172 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@H+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000459523429 1046753173 /nfs/dbraw/zinc/75/31/73/1046753173.db2.gz VUVXSYFMFOGLGC-PMVMPFDFSA-N 2 1 349.522 4.172 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@@H+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000459523429 1046753189 /nfs/dbraw/zinc/75/31/89/1046753189.db2.gz VUVXSYFMFOGLGC-PMVMPFDFSA-N 2 1 349.522 4.172 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cccc(F)c1F ZINC000536863769 1046829382 /nfs/dbraw/zinc/82/93/82/1046829382.db2.gz MSKUJLBHWZNHIN-OXJNMPFZSA-N 2 1 344.449 4.008 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CC(C)(C)c2c(F)cccc2Cl)[C@H](C)C1 ZINC000536875850 1046839038 /nfs/dbraw/zinc/83/90/38/1046839038.db2.gz JFKJRTMHLMEYDP-CZUORRHYSA-N 2 1 326.887 4.077 20 0 EIADMP Clc1ccc(OCC2CC2)c(C[NH2+]Cc2ccc3c[nH+]cn3c2)c1 ZINC000459658493 1046842793 /nfs/dbraw/zinc/84/27/93/1046842793.db2.gz KOFKFINSCLAXNM-UHFFFAOYSA-N 2 1 341.842 4.066 20 0 EIADMP COc1ccc([C@@H]([NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)C2CC2)cc1 ZINC000536946956 1046876685 /nfs/dbraw/zinc/87/66/85/1046876685.db2.gz BRUZMNDYWFAMTK-UTKZUKDTSA-N 2 1 330.516 4.248 20 0 EIADMP COc1ccc([C@H]([NH2+]CCCC[N@H+]2CCCC[C@@H]2C)C2CC2)cc1 ZINC000536947127 1046877778 /nfs/dbraw/zinc/87/77/78/1046877778.db2.gz KCKJLLIOMZRTIG-LAUBAEHRSA-N 2 1 330.516 4.391 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC000537013244 1046895144 /nfs/dbraw/zinc/89/51/44/1046895144.db2.gz WQYCXHLSAQYORA-XGHQBKJUSA-N 2 1 329.532 4.338 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](COc1c(C)cccc1C)c1ccccc1 ZINC000537123730 1046952766 /nfs/dbraw/zinc/95/27/66/1046952766.db2.gz DMVQBKSFGRPCPK-NRFANRHFSA-N 2 1 349.478 4.218 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000537303713 1047085349 /nfs/dbraw/zinc/08/53/49/1047085349.db2.gz IVOYGQAYMOPURI-CHWSQXEVSA-N 2 1 343.298 4.001 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](c2ccc(F)cn2)C(C)C)c1 ZINC000497816902 1047098427 /nfs/dbraw/zinc/09/84/27/1047098427.db2.gz KHKGCHQRZDNNSE-HXUWFJFHSA-N 2 1 329.463 4.159 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497839060 1047114702 /nfs/dbraw/zinc/11/47/02/1047114702.db2.gz FTLPMRFFWXGHGJ-DYESRHJHSA-N 2 1 330.491 4.472 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2COCc3cccc(Cl)c32)C1 ZINC000788524999 1047199916 /nfs/dbraw/zinc/19/99/16/1047199916.db2.gz ADTAJWLIMVPGOI-MAUKXSAKSA-N 2 1 336.907 4.013 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2COCc3cccc(Cl)c32)C1 ZINC000788525000 1047201113 /nfs/dbraw/zinc/20/11/13/1047201113.db2.gz ADTAJWLIMVPGOI-QAPCUYQASA-N 2 1 336.907 4.013 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1cc[nH]c(=O)c1 ZINC000788525002 1047202215 /nfs/dbraw/zinc/20/22/15/1047202215.db2.gz AEIGLMZUEHZTQM-DLBZAZTESA-N 2 1 339.483 4.012 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCOc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000556064368 1047430603 /nfs/dbraw/zinc/43/06/03/1047430603.db2.gz YGHRFHZNBKXKRS-AZUAARDMSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCOc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000556064368 1047430607 /nfs/dbraw/zinc/43/06/07/1047430607.db2.gz YGHRFHZNBKXKRS-AZUAARDMSA-N 2 1 344.886 4.144 20 0 EIADMP COc1cccc2c1CC[C@@H]2[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556103675 1047454301 /nfs/dbraw/zinc/45/43/01/1047454301.db2.gz ULFRTTDSRNYXDU-DZFGPLHGSA-N 2 1 336.479 4.108 20 0 EIADMP COc1cccc2c1CC[C@@H]2[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556103675 1047454310 /nfs/dbraw/zinc/45/43/10/1047454310.db2.gz ULFRTTDSRNYXDU-DZFGPLHGSA-N 2 1 336.479 4.108 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cn2ccccc2n1 ZINC000556234052 1047598898 /nfs/dbraw/zinc/59/88/98/1047598898.db2.gz MYJKAGIILODOQX-QGZVFWFLSA-N 2 1 336.483 4.025 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cn2ccccc2n1 ZINC000556234052 1047598904 /nfs/dbraw/zinc/59/89/04/1047598904.db2.gz MYJKAGIILODOQX-QGZVFWFLSA-N 2 1 336.483 4.025 20 0 EIADMP CC(C)C[C@@H](CCO)C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000556261902 1047633901 /nfs/dbraw/zinc/63/39/01/1047633901.db2.gz OWMBPSSFUJPHOU-ITAUSPCMSA-N 2 1 346.559 4.064 20 0 EIADMP Clc1ccc(-c2ncc(C[NH2+]CCC[NH+]3CCCC3)s2)cc1 ZINC000556391770 1047728909 /nfs/dbraw/zinc/72/89/09/1047728909.db2.gz GGLWCYZQXBANEQ-UHFFFAOYSA-N 2 1 335.904 4.039 20 0 EIADMP C[N@@H+](CCCN[C@@H]1CC[NH+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608677 1047758254 /nfs/dbraw/zinc/75/82/54/1047758254.db2.gz LGJMVKAZCANWIW-IFMALSPDSA-N 2 1 343.559 4.066 20 0 EIADMP C[NH+](CCCN[C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608677 1047758265 /nfs/dbraw/zinc/75/82/65/1047758265.db2.gz LGJMVKAZCANWIW-IFMALSPDSA-N 2 1 343.559 4.066 20 0 EIADMP C[NH+](CCCN[C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608677 1047758275 /nfs/dbraw/zinc/75/82/75/1047758275.db2.gz LGJMVKAZCANWIW-IFMALSPDSA-N 2 1 343.559 4.066 20 0 EIADMP C[NH+](C)C1CCC([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001168306115 1047781628 /nfs/dbraw/zinc/78/16/28/1047781628.db2.gz QPIVCNMKMQAPON-NEBFTCOFSA-N 3 1 335.580 4.011 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)C1CCCC1 ZINC000550678075 1047813523 /nfs/dbraw/zinc/81/35/23/1047813523.db2.gz AERKODVVUKPUPF-BHDDXSALSA-N 2 1 344.543 4.397 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)C1CCCC1 ZINC000550678075 1047813524 /nfs/dbraw/zinc/81/35/24/1047813524.db2.gz AERKODVVUKPUPF-BHDDXSALSA-N 2 1 344.543 4.397 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@]2(C)CC2(Cl)Cl)cc1 ZINC000824771212 1047924513 /nfs/dbraw/zinc/92/45/13/1047924513.db2.gz ACHWBVQJXDCZCS-BLLLJJGKSA-N 2 1 338.282 4.415 20 0 EIADMP CC1(C)[C@@H]2C[C@@H]([NH2+][C@H]3CC[N@H+](Cc4ccccc4)CC3(C)C)C[C@@H]21 ZINC001170738862 1047969634 /nfs/dbraw/zinc/96/96/34/1047969634.db2.gz PUMGACMYGWQSJW-HAGHYFMRSA-N 2 1 326.528 4.311 20 0 EIADMP CC1(C)[C@@H]2C[C@@H]([NH2+][C@H]3CC[N@@H+](Cc4ccccc4)CC3(C)C)C[C@@H]21 ZINC001170738862 1047969685 /nfs/dbraw/zinc/96/96/85/1047969685.db2.gz PUMGACMYGWQSJW-HAGHYFMRSA-N 2 1 326.528 4.311 20 0 EIADMP CC(C)[C@H](NCC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939042 1047992779 /nfs/dbraw/zinc/99/27/79/1047992779.db2.gz FDXHNMPIJDWPHW-UTKZUKDTSA-N 2 1 343.490 4.418 20 0 EIADMP CC(C)[C@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939042 1047992800 /nfs/dbraw/zinc/99/28/00/1047992800.db2.gz FDXHNMPIJDWPHW-UTKZUKDTSA-N 2 1 343.490 4.418 20 0 EIADMP CC(C)[C@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939042 1047992825 /nfs/dbraw/zinc/99/28/25/1047992825.db2.gz FDXHNMPIJDWPHW-UTKZUKDTSA-N 2 1 343.490 4.418 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000824988015 1048016832 /nfs/dbraw/zinc/01/68/32/1048016832.db2.gz GAFOGGJIRFEOCB-YZDRTPDPSA-N 2 1 340.433 4.412 20 0 EIADMP CCCCOc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000556926117 1048220080 /nfs/dbraw/zinc/22/00/80/1048220080.db2.gz XWRIYYFVCKSONB-HXUWFJFHSA-N 2 1 330.516 4.029 20 0 EIADMP CCCCOc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1 ZINC000556926117 1048220095 /nfs/dbraw/zinc/22/00/95/1048220095.db2.gz XWRIYYFVCKSONB-HXUWFJFHSA-N 2 1 330.516 4.029 20 0 EIADMP CCCCOc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1 ZINC000556926117 1048220107 /nfs/dbraw/zinc/22/01/07/1048220107.db2.gz XWRIYYFVCKSONB-HXUWFJFHSA-N 2 1 330.516 4.029 20 0 EIADMP CCCCOc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1 ZINC000556926117 1048220124 /nfs/dbraw/zinc/22/01/24/1048220124.db2.gz XWRIYYFVCKSONB-HXUWFJFHSA-N 2 1 330.516 4.029 20 0 EIADMP C[NH+]1CCC2(CC[N@@H+](Cc3ccc(C(F)(F)F)c(Cl)c3)C2)CC1 ZINC001143809993 1048222353 /nfs/dbraw/zinc/22/23/53/1048222353.db2.gz JRBXXXZPSIGXNH-UHFFFAOYSA-N 2 1 346.824 4.277 20 0 EIADMP Cc1ccc([C@@H]2CCC[C@@H]2[N@@H+](C)Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000809582780 1048424164 /nfs/dbraw/zinc/42/41/64/1048424164.db2.gz DDGNZKREOGBTEL-OALUTQOASA-N 2 1 343.540 4.281 20 0 EIADMP Cc1ccc([C@@H]2CCC[C@@H]2[N@H+](C)Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000809582780 1048424175 /nfs/dbraw/zinc/42/41/75/1048424175.db2.gz DDGNZKREOGBTEL-OALUTQOASA-N 2 1 343.540 4.281 20 0 EIADMP c1cc2c(s1)C[NH+](CCCC[N@H+]1CCc3ccsc3C1)CC2 ZINC000132689998 1048439260 /nfs/dbraw/zinc/43/92/60/1048439260.db2.gz RDUBWCKPHMXHLO-UHFFFAOYSA-N 2 1 332.538 4.006 20 0 EIADMP Cc1ccc(-c2n[nH]cc2C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000809739109 1048511029 /nfs/dbraw/zinc/51/10/29/1048511029.db2.gz XQSIOQZIBHJHRW-UHFFFAOYSA-N 2 1 348.494 4.079 20 0 EIADMP CC(C)c1ccc(C2(O)CCC([NH2+][C@H](C)C[N@H+](C)C(C)C)CC2)cc1 ZINC000810254996 1048730896 /nfs/dbraw/zinc/73/08/96/1048730896.db2.gz UBLAZOJMOPONRA-OSFYOIPJSA-N 2 1 346.559 4.259 20 0 EIADMP CC(C)c1ccc(C2(O)CCC([NH2+][C@H](C)C[N@@H+](C)C(C)C)CC2)cc1 ZINC000810254996 1048730915 /nfs/dbraw/zinc/73/09/15/1048730915.db2.gz UBLAZOJMOPONRA-OSFYOIPJSA-N 2 1 346.559 4.259 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@]2(C)C[C@]2(F)Cl)CC[N@@H+]1Cc1ccccc1 ZINC000846030261 1048797410 /nfs/dbraw/zinc/79/74/10/1048797410.db2.gz ABCXSGPOCRZZHF-OQIJWPOYSA-N 2 1 338.898 4.334 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@]2(C)C[C@]2(F)Cl)CC[N@H+]1Cc1ccccc1 ZINC000846030261 1048797427 /nfs/dbraw/zinc/79/74/27/1048797427.db2.gz ABCXSGPOCRZZHF-OQIJWPOYSA-N 2 1 338.898 4.334 20 0 EIADMP CC1(C)Cc2cccc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)c2O1 ZINC000236698675 1048834075 /nfs/dbraw/zinc/83/40/75/1048834075.db2.gz UCFIFLWAVWDWBZ-UHFFFAOYSA-N 2 1 342.527 4.287 20 0 EIADMP CC(C)Cc1ccc([C@@H]([NH2+][C@H](C)C2C[NH2+]C2)c2cccs2)cc1 ZINC000817897341 1049056886 /nfs/dbraw/zinc/05/68/86/1049056886.db2.gz LFQGHAAVVMAQJQ-FOIQADDNSA-N 2 1 328.525 4.234 20 0 EIADMP COc1cc([C@@H](C)[NH2+][C@H](C[NH3+])CC(C)C)ccc1SC(F)F ZINC000817958194 1049068557 /nfs/dbraw/zinc/06/85/57/1049068557.db2.gz INHRBFAXTGRZCA-YPMHNXCESA-N 2 1 332.460 4.034 20 0 EIADMP CC(C)c1ccc(C2(O)CCC([NH2+][C@@H](C[NH3+])C3CCCC3)CC2)cc1 ZINC000817982422 1049076919 /nfs/dbraw/zinc/07/69/19/1049076919.db2.gz RZNNRNQRKMTDQT-ORFBVSJDSA-N 2 1 344.543 4.047 20 0 EIADMP COC1CCC(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000348097486 1049417373 /nfs/dbraw/zinc/41/73/73/1049417373.db2.gz PNNOXTOBUCMQKV-FVWXCPNNSA-N 2 1 327.472 4.037 20 0 EIADMP FC1(F)CCC([NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)CC1 ZINC000716716087 1049703093 /nfs/dbraw/zinc/70/30/93/1049703093.db2.gz ZNVYCAGQONXAJS-UHOSZYNNSA-N 2 1 334.454 4.207 20 0 EIADMP CN1CCC([N@@H+](C2CCCC2)[C@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171500528 1049737508 /nfs/dbraw/zinc/73/75/08/1049737508.db2.gz QXTFAFZHSANXCG-IBGZPJMESA-N 2 1 348.481 4.161 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](CCc3ccccc3)CC1)C2 ZINC001171555989 1049753808 /nfs/dbraw/zinc/75/38/08/1049753808.db2.gz GGVJHBZDKIOJRO-HSZRJFAPSA-N 2 1 348.534 4.149 20 0 EIADMP Clc1oc2ccccc2c1C[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC001171554688 1049754096 /nfs/dbraw/zinc/75/40/96/1049754096.db2.gz NJYHWXAHVGOWKR-UHFFFAOYSA-N 2 1 341.842 4.194 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706776 1049776534 /nfs/dbraw/zinc/77/65/34/1049776534.db2.gz MACDXJRERGAPMZ-OTWHNJEPSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706776 1049776536 /nfs/dbraw/zinc/77/65/36/1049776536.db2.gz MACDXJRERGAPMZ-OTWHNJEPSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706776 1049776543 /nfs/dbraw/zinc/77/65/43/1049776543.db2.gz MACDXJRERGAPMZ-OTWHNJEPSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1C(C)(C)CC([N@H+]2CCC[C@H](Sc3ccncc3)C2)CC1(C)C ZINC001171639985 1049779444 /nfs/dbraw/zinc/77/94/44/1049779444.db2.gz XPQDKCGZUGCJEG-SFHVURJKSA-N 2 1 347.572 4.290 20 0 EIADMP C[C@H]1C[N@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)[C@@H](c2ccccc2)CO1 ZINC001171640360 1049780037 /nfs/dbraw/zinc/78/00/37/1049780037.db2.gz FAVSZZBTHACNAE-QFBILLFUSA-N 2 1 330.516 4.100 20 0 EIADMP C[C@H]1C[N@@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)[C@@H](c2ccccc2)CO1 ZINC001171640360 1049780041 /nfs/dbraw/zinc/78/00/41/1049780041.db2.gz FAVSZZBTHACNAE-QFBILLFUSA-N 2 1 330.516 4.100 20 0 EIADMP Cc1cccc2c(CC[NH3+])cn([C@H]3C[C@@H](C)[N@H+](Cc4ccccc4)C3)c21 ZINC001171726355 1049784735 /nfs/dbraw/zinc/78/47/35/1049784735.db2.gz VERMBNJPXMICEV-NQIIRXRSSA-N 2 1 347.506 4.286 20 0 EIADMP Cc1c(CC[NH3+])c2ccccc2n1[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727251 1049785256 /nfs/dbraw/zinc/78/52/56/1049785256.db2.gz TXZBBCIPFWARSQ-PXNSSMCTSA-N 2 1 347.506 4.286 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)[C@@H]2Cc3cccc(F)c3C2)CC1 ZINC001171786969 1049804961 /nfs/dbraw/zinc/80/49/61/1049804961.db2.gz FVDKOJJFZNUHSV-GUDVDZBRSA-N 2 1 330.491 4.055 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C[C@H](C)O1 ZINC000813789099 1049816605 /nfs/dbraw/zinc/81/66/05/1049816605.db2.gz IWJKEGUIUDKHAG-NBNATQRXSA-N 2 1 342.527 4.118 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001171961668 1049824326 /nfs/dbraw/zinc/82/43/26/1049824326.db2.gz ABLVLXFERXUTSO-ZDUSSCGKSA-N 2 1 337.389 4.173 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCc2ccc(F)cc2)CC[N@H+]1Cc1ccccc1 ZINC001171963646 1049825386 /nfs/dbraw/zinc/82/53/86/1049825386.db2.gz IJYCXRWNFDAMGM-OAQYLSRUSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@]1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCS1 ZINC000245686799 1049826316 /nfs/dbraw/zinc/82/63/16/1049826316.db2.gz JQRNVYDRXVKTCH-YSTOQKLRSA-N 2 1 330.541 4.057 20 0 EIADMP CC(C)([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171965724 1049826411 /nfs/dbraw/zinc/82/64/11/1049826411.db2.gz QSTXATSDXWUEGV-FQEVSTJZSA-N 2 1 337.511 4.350 20 0 EIADMP CC1(C)C[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171967078 1049827977 /nfs/dbraw/zinc/82/79/77/1049827977.db2.gz XFXZRKVNDUCNNF-QZTJIDSGSA-N 2 1 336.470 4.455 20 0 EIADMP CCCC[C@@H](COC)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813881963 1049830256 /nfs/dbraw/zinc/83/02/56/1049830256.db2.gz YEELAEXDSUOMAY-MJLAPFRSSA-N 2 1 344.543 4.367 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+](C)CCC[NH+]1CCCC1 ZINC001171975814 1049837832 /nfs/dbraw/zinc/83/78/32/1049837832.db2.gz ZUOHYOFHZNHSGI-OAHLLOKOSA-N 2 1 328.422 4.054 20 0 EIADMP CC1(C)C[C@H](Nc2cccc(CC[NH3+])c2)CC[N@H+]1Cc1ccccc1 ZINC001171979059 1049838321 /nfs/dbraw/zinc/83/83/21/1049838321.db2.gz KVTTVQUTANDYLM-OAQYLSRUSA-N 2 1 337.511 4.043 20 0 EIADMP CSC1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171986338 1049840869 /nfs/dbraw/zinc/84/08/69/1049840869.db2.gz HOBXSHMDMWGVOT-GOSISDBHSA-N 2 1 332.557 4.257 20 0 EIADMP CC[N@H+](Cc1cccnc1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984190 1049841003 /nfs/dbraw/zinc/84/10/03/1049841003.db2.gz IWFDXIYMMLSEKU-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP CC[N@@H+](Cc1cccnc1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984190 1049841006 /nfs/dbraw/zinc/84/10/06/1049841006.db2.gz IWFDXIYMMLSEKU-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP CC[NH+](Cc1cccnc1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984190 1049841008 /nfs/dbraw/zinc/84/10/08/1049841008.db2.gz IWFDXIYMMLSEKU-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP CC[NH+](Cc1cccnc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984190 1049841010 /nfs/dbraw/zinc/84/10/10/1049841010.db2.gz IWFDXIYMMLSEKU-OAQYLSRUSA-N 2 1 337.511 4.347 20 0 EIADMP C[N@@H+](CC1CC(F)(F)C1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987772 1049841160 /nfs/dbraw/zinc/84/11/60/1049841160.db2.gz JFVCWVYGWHUOAL-SFHVURJKSA-N 2 1 336.470 4.407 20 0 EIADMP C[NH+](CC1CC(F)(F)C1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987772 1049841162 /nfs/dbraw/zinc/84/11/62/1049841162.db2.gz JFVCWVYGWHUOAL-SFHVURJKSA-N 2 1 336.470 4.407 20 0 EIADMP C[NH+](CC1CC(F)(F)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987772 1049841163 /nfs/dbraw/zinc/84/11/63/1049841163.db2.gz JFVCWVYGWHUOAL-SFHVURJKSA-N 2 1 336.470 4.407 20 0 EIADMP FC[C@H]1CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172074130 1049843822 /nfs/dbraw/zinc/84/38/22/1049843822.db2.gz FURMTDYIBZZTPI-MXEMCNAFSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@H]1CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172074130 1049843824 /nfs/dbraw/zinc/84/38/24/1049843824.db2.gz FURMTDYIBZZTPI-MXEMCNAFSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172074130 1049843828 /nfs/dbraw/zinc/84/38/28/1049843828.db2.gz FURMTDYIBZZTPI-MXEMCNAFSA-N 2 1 330.491 4.254 20 0 EIADMP FC[C@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172074130 1049843832 /nfs/dbraw/zinc/84/38/32/1049843832.db2.gz FURMTDYIBZZTPI-MXEMCNAFSA-N 2 1 330.491 4.254 20 0 EIADMP CCCO[C@H]1CC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076489 1049844570 /nfs/dbraw/zinc/84/45/70/1049844570.db2.gz ZOQFPJVFVLRDEC-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP CCCO[C@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172076489 1049844574 /nfs/dbraw/zinc/84/45/74/1049844574.db2.gz ZOQFPJVFVLRDEC-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP CCCO[C@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172076489 1049844576 /nfs/dbraw/zinc/84/45/76/1049844576.db2.gz ZOQFPJVFVLRDEC-LRSLUSHPSA-N 2 1 342.527 4.073 20 0 EIADMP CSC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172076139 1049844750 /nfs/dbraw/zinc/84/47/50/1049844750.db2.gz VOLVMSGAWZSJFY-PMOLBWCYSA-N 2 1 344.568 4.400 20 0 EIADMP C[NH2+]Cc1cccc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172084277 1049847079 /nfs/dbraw/zinc/84/70/79/1049847079.db2.gz VRQWAMNNQVPIOP-WBDAEOGXSA-N 2 1 349.522 4.404 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H](N2CCc4cccnc4C2)C3)cc1 ZINC001172081923 1049847784 /nfs/dbraw/zinc/84/77/84/1049847784.db2.gz IGKDWSOKAXALES-KOUNCHBCSA-N 2 1 347.506 4.025 20 0 EIADMP Cc1ccccc1[C@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172099944 1049849861 /nfs/dbraw/zinc/84/98/61/1049849861.db2.gz NVKSIITYDMAWCP-XAPVIXHLSA-N 2 1 335.495 4.084 20 0 EIADMP Cc1ccccc1[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172099944 1049849866 /nfs/dbraw/zinc/84/98/66/1049849866.db2.gz NVKSIITYDMAWCP-XAPVIXHLSA-N 2 1 335.495 4.084 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CC[C@H]2CCCCO2)C3)cc1 ZINC001172062538 1049850377 /nfs/dbraw/zinc/85/03/77/1049850377.db2.gz OZDJKRIVBBWXFB-YUMYIRISSA-N 2 1 342.527 4.121 20 0 EIADMP Cc1cncc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172064422 1049850983 /nfs/dbraw/zinc/85/09/83/1049850983.db2.gz FWAARLMTZRFKDY-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1cncc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172064422 1049850984 /nfs/dbraw/zinc/85/09/84/1049850984.db2.gz FWAARLMTZRFKDY-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP FC1(F)CC[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172068232 1049851251 /nfs/dbraw/zinc/85/12/51/1049851251.db2.gz PSESVDKMJHPNCN-CADBVGFASA-N 2 1 334.454 4.350 20 0 EIADMP Cc1cccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC001172067246 1049851475 /nfs/dbraw/zinc/85/14/75/1049851475.db2.gz LZCSYIZDDUVFCC-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1cccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)n1 ZINC001172067246 1049851480 /nfs/dbraw/zinc/85/14/80/1049851480.db2.gz LZCSYIZDDUVFCC-KOUNCHBCSA-N 2 1 335.495 4.065 20 0 EIADMP C[C@]1(CF)CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070257 1049852868 /nfs/dbraw/zinc/85/28/68/1049852868.db2.gz XRPCYOGEKCQSTN-IVAOSVALSA-N 2 1 330.491 4.254 20 0 EIADMP C[C@]1(CF)CC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070257 1049852871 /nfs/dbraw/zinc/85/28/71/1049852871.db2.gz XRPCYOGEKCQSTN-IVAOSVALSA-N 2 1 330.491 4.254 20 0 EIADMP C[C@]1(CF)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070257 1049852874 /nfs/dbraw/zinc/85/28/74/1049852874.db2.gz XRPCYOGEKCQSTN-IVAOSVALSA-N 2 1 330.491 4.254 20 0 EIADMP C[C@]1(CF)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070257 1049852877 /nfs/dbraw/zinc/85/28/77/1049852877.db2.gz XRPCYOGEKCQSTN-IVAOSVALSA-N 2 1 330.491 4.254 20 0 EIADMP C[C@H]1C[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)CCc2ccc(Cl)cc21 ZINC001172128822 1049854494 /nfs/dbraw/zinc/85/44/94/1049854494.db2.gz UPYDPKISJSDRLK-FZDIXFNVSA-N 2 1 332.919 4.317 20 0 EIADMP C[C@H]1C[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)CCc2ccc(Cl)cc21 ZINC001172128822 1049854497 /nfs/dbraw/zinc/85/44/97/1049854497.db2.gz UPYDPKISJSDRLK-FZDIXFNVSA-N 2 1 332.919 4.317 20 0 EIADMP C[C@H]1C[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CCc2ccc(Cl)cc21 ZINC001172128822 1049854502 /nfs/dbraw/zinc/85/45/02/1049854502.db2.gz UPYDPKISJSDRLK-FZDIXFNVSA-N 2 1 332.919 4.317 20 0 EIADMP C[C@H]1C[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)CCc2ccc(Cl)cc21 ZINC001172128825 1049854729 /nfs/dbraw/zinc/85/47/29/1049854729.db2.gz UPYDPKISJSDRLK-WQANXHIZSA-N 2 1 332.919 4.317 20 0 EIADMP C[C@H]1C[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)CCc2ccc(Cl)cc21 ZINC001172128825 1049854731 /nfs/dbraw/zinc/85/47/31/1049854731.db2.gz UPYDPKISJSDRLK-WQANXHIZSA-N 2 1 332.919 4.317 20 0 EIADMP C[C@H]1C[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)CCc2ccc(Cl)cc21 ZINC001172128825 1049854733 /nfs/dbraw/zinc/85/47/33/1049854733.db2.gz UPYDPKISJSDRLK-WQANXHIZSA-N 2 1 332.919 4.317 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3cc(Br)ccc31)C2 ZINC001172104950 1049856367 /nfs/dbraw/zinc/85/63/67/1049856367.db2.gz FDJSZGYSRQHTBC-KYHPRHEASA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3cc(Br)ccc31)C2 ZINC001172104950 1049856369 /nfs/dbraw/zinc/85/63/69/1049856369.db2.gz FDJSZGYSRQHTBC-KYHPRHEASA-N 2 1 349.316 4.041 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Br)s1 ZINC001172103746 1049856891 /nfs/dbraw/zinc/85/68/91/1049856891.db2.gz XDUHJBGCTDZDSX-RVMXOQNASA-N 2 1 343.334 4.177 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCCc1ccc(C(F)(F)F)cc1)C2 ZINC001172107436 1049856953 /nfs/dbraw/zinc/85/69/53/1049856953.db2.gz XPIYDLPJSZNELM-NNZMDNLPSA-N 2 1 340.433 4.243 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3ccccc3Br)CC1)C2 ZINC001172113574 1049858174 /nfs/dbraw/zinc/85/81/74/1049858174.db2.gz DNNIGCSNFQZDOP-QDMKHBRRSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3ccccc3Br)CC1)C2 ZINC001172113574 1049858177 /nfs/dbraw/zinc/85/81/77/1049858177.db2.gz DNNIGCSNFQZDOP-QDMKHBRRSA-N 2 1 349.316 4.043 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Oc3ccccc3Cl)CC1)C2 ZINC001172123142 1049858430 /nfs/dbraw/zinc/85/84/30/1049858430.db2.gz YMKVJIAIJJPDDP-BJWYYQGGSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Oc3ccccc3Cl)CC1)C2 ZINC001172123142 1049858431 /nfs/dbraw/zinc/85/84/31/1049858431.db2.gz YMKVJIAIJJPDDP-BJWYYQGGSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001172114996 1049858626 /nfs/dbraw/zinc/85/86/26/1049858626.db2.gz TVOLVQRZIOTQGH-ACDBMABISA-N 2 1 330.903 4.444 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001172114996 1049858631 /nfs/dbraw/zinc/85/86/31/1049858631.db2.gz TVOLVQRZIOTQGH-ACDBMABISA-N 2 1 330.903 4.444 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001172114996 1049858637 /nfs/dbraw/zinc/85/86/37/1049858637.db2.gz TVOLVQRZIOTQGH-ACDBMABISA-N 2 1 330.903 4.444 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001172114996 1049858638 /nfs/dbraw/zinc/85/86/38/1049858638.db2.gz TVOLVQRZIOTQGH-ACDBMABISA-N 2 1 330.903 4.444 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172118215 1049858869 /nfs/dbraw/zinc/85/88/69/1049858869.db2.gz OJLDNISDHUYWKT-QDMKHBRRSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172118215 1049858873 /nfs/dbraw/zinc/85/88/73/1049858873.db2.gz OJLDNISDHUYWKT-QDMKHBRRSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172118215 1049858874 /nfs/dbraw/zinc/85/88/74/1049858874.db2.gz OJLDNISDHUYWKT-QDMKHBRRSA-N 2 1 327.299 4.441 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(Cc3cccc(Cl)c3)CC1)C2 ZINC001172112634 1049858951 /nfs/dbraw/zinc/85/89/51/1049858951.db2.gz YBXIYMCRKMEVIQ-REPLKXPHSA-N 2 1 332.919 4.268 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001172114999 1049858964 /nfs/dbraw/zinc/85/89/64/1049858964.db2.gz TVOLVQRZIOTQGH-PMOLBWCYSA-N 2 1 330.903 4.444 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001172114999 1049858966 /nfs/dbraw/zinc/85/89/66/1049858966.db2.gz TVOLVQRZIOTQGH-PMOLBWCYSA-N 2 1 330.903 4.444 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001172114999 1049858968 /nfs/dbraw/zinc/85/89/68/1049858968.db2.gz TVOLVQRZIOTQGH-PMOLBWCYSA-N 2 1 330.903 4.444 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001172114999 1049858970 /nfs/dbraw/zinc/85/89/70/1049858970.db2.gz TVOLVQRZIOTQGH-PMOLBWCYSA-N 2 1 330.903 4.444 20 0 EIADMP C[N@@H+](Cc1ccccc1C(F)(F)F)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172124218 1049860267 /nfs/dbraw/zinc/86/02/67/1049860267.db2.gz JNXPDKIXEMJQLE-MUJYYYPQSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1ccccc1C(F)(F)F)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172124218 1049860271 /nfs/dbraw/zinc/86/02/71/1049860271.db2.gz JNXPDKIXEMJQLE-MUJYYYPQSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1ccccc1C(F)(F)F)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172124218 1049860275 /nfs/dbraw/zinc/86/02/75/1049860275.db2.gz JNXPDKIXEMJQLE-MUJYYYPQSA-N 2 1 326.406 4.153 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC([NH3+])(c2ccc(Cl)cc2)CC1 ZINC001172335060 1049887020 /nfs/dbraw/zinc/88/70/20/1049887020.db2.gz NVNNWPKZVPFNRE-JKSUJKDBSA-N 2 1 338.923 4.184 20 0 EIADMP C[C@@H]1CC[C@@H]([NH2+][C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2[NH3+])C[C@@H]1C ZINC001172369556 1049897183 /nfs/dbraw/zinc/89/71/83/1049897183.db2.gz RTASDKLVWUTVDQ-DEMFUQBKSA-N 2 1 346.518 4.388 20 0 EIADMP COc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@H](C)[C@H](C)C3)CC2)cc1 ZINC001172367739 1049897347 /nfs/dbraw/zinc/89/73/47/1049897347.db2.gz MVUZJYWYJNDXKQ-WAOWUJCRSA-N 2 1 344.543 4.116 20 0 EIADMP CC(C)OCC[C@H](C)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001172459670 1049916837 /nfs/dbraw/zinc/91/68/37/1049916837.db2.gz KPSHRPILUNLAIX-ILWGZMRPSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001172459670 1049916843 /nfs/dbraw/zinc/91/68/43/1049916843.db2.gz KPSHRPILUNLAIX-ILWGZMRPSA-N 2 1 344.543 4.034 20 0 EIADMP CC(C)OCC[C@H](C)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001172459670 1049916850 /nfs/dbraw/zinc/91/68/50/1049916850.db2.gz KPSHRPILUNLAIX-ILWGZMRPSA-N 2 1 344.543 4.034 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccncc2)[C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172555413 1049931410 /nfs/dbraw/zinc/93/14/10/1049931410.db2.gz ICGRZNQMERYDGF-ODAXIHTASA-N 2 1 349.522 4.490 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc3ccccc3n2)C1 ZINC000246359620 1049960321 /nfs/dbraw/zinc/96/03/21/1049960321.db2.gz IKJYYYGWWKPGAV-QZTJIDSGSA-N 2 1 325.500 4.253 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc3ccccc3n2)C1 ZINC000246359620 1049960330 /nfs/dbraw/zinc/96/03/30/1049960330.db2.gz IKJYYYGWWKPGAV-QZTJIDSGSA-N 2 1 325.500 4.253 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Br)s2)C1 ZINC000246902214 1050005123 /nfs/dbraw/zinc/00/51/23/1050005123.db2.gz FLKUXUWKOIVNGJ-OLZOCXBDSA-N 2 1 345.350 4.282 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3OC)cc2)C1 ZINC000246902595 1050005228 /nfs/dbraw/zinc/00/52/28/1050005228.db2.gz FWKAEEXJTUXSQM-QZTJIDSGSA-N 2 1 338.495 4.355 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cncc(F)c1 ZINC000247126497 1050014325 /nfs/dbraw/zinc/01/43/25/1050014325.db2.gz RKBPSDPMGLZASS-IAGOWNOFSA-N 2 1 341.474 4.446 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1cncc(F)c1 ZINC000247126497 1050014331 /nfs/dbraw/zinc/01/43/31/1050014331.db2.gz RKBPSDPMGLZASS-IAGOWNOFSA-N 2 1 341.474 4.446 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(CC)s2)[C@H](C)C1 ZINC000248174435 1050045525 /nfs/dbraw/zinc/04/55/25/1050045525.db2.gz VJBVKJMUFCTYPB-RYRKJORJSA-N 2 1 338.561 4.098 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248397946 1050053875 /nfs/dbraw/zinc/05/38/75/1050053875.db2.gz ILTAOIGWUOPEKF-SCTDSRPQSA-N 2 1 330.516 4.389 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[NH+]3CCC(C)([NH3+])CC3)s2)cc1 ZINC000649416131 1050086895 /nfs/dbraw/zinc/08/68/95/1050086895.db2.gz RDTDJQYOWQRWHT-UHFFFAOYSA-N 2 1 329.513 4.247 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]C[C@@H](C)c2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000249137877 1050093782 /nfs/dbraw/zinc/09/37/82/1050093782.db2.gz XENCLJLFTDPAAX-KEYYUXOJSA-N 2 1 328.422 4.129 20 0 EIADMP Clc1cc2c(c(Cl)c1)CC[C@H]2[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000089694785 1050128590 /nfs/dbraw/zinc/12/85/90/1050128590.db2.gz CVTNGXXNCLXSQP-QGZVFWFLSA-N 2 1 325.283 4.197 20 0 EIADMP Clc1cc2c(c(Cl)c1)CC[C@H]2[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000089695997 1050128766 /nfs/dbraw/zinc/12/87/66/1050128766.db2.gz PRPLALUPGOEJQE-APPDUMDISA-N 2 1 325.283 4.055 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828152 1050165616 /nfs/dbraw/zinc/16/56/16/1050165616.db2.gz IPRRGCNJDTXLJH-BVSLBCMMSA-N 2 1 326.528 4.367 20 0 EIADMP CCC1(C[NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)CCOCC1 ZINC001177257640 1050175115 /nfs/dbraw/zinc/17/51/15/1050175115.db2.gz XRVARCNPUAFOJQ-LJQANCHMSA-N 2 1 344.543 4.215 20 0 EIADMP CC(C)c1nc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c2ccccn21 ZINC001177299492 1050180831 /nfs/dbraw/zinc/18/08/31/1050180831.db2.gz SIKJLBATCCSDFS-GOSISDBHSA-N 2 1 342.531 4.202 20 0 EIADMP COC1(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)CCCCC1 ZINC001177266113 1050183029 /nfs/dbraw/zinc/18/30/29/1050183029.db2.gz AMYDVPCMXGDVAZ-LJQANCHMSA-N 2 1 344.543 4.500 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@H]2C(C)=CCC[C@@H]2C)cc1F ZINC001177454611 1050212864 /nfs/dbraw/zinc/21/28/64/1050212864.db2.gz SXMBSFBPBNISKT-YJBOKZPZSA-N 2 1 327.447 4.402 20 0 EIADMP Brc1ccc([C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CC2)cc1 ZINC000091268611 1050246628 /nfs/dbraw/zinc/24/66/28/1050246628.db2.gz VINQERBLSLOOTL-GOSISDBHSA-N 2 1 349.316 4.117 20 0 EIADMP COc1cc(C)ccc1C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001177548593 1050250181 /nfs/dbraw/zinc/25/01/81/1050250181.db2.gz KWURWVKNTJYBCT-FQEVSTJZSA-N 2 1 338.495 4.005 20 0 EIADMP COc1cc(C)ccc1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001177548593 1050250189 /nfs/dbraw/zinc/25/01/89/1050250189.db2.gz KWURWVKNTJYBCT-FQEVSTJZSA-N 2 1 338.495 4.005 20 0 EIADMP CCCOC1CCC([N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC001173100360 1050302663 /nfs/dbraw/zinc/30/26/63/1050302663.db2.gz ILAYRMMZKLMZLD-ITAUSPCMSA-N 2 1 344.543 4.178 20 0 EIADMP CCCOC1CCC([NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC001173100360 1050302673 /nfs/dbraw/zinc/30/26/73/1050302673.db2.gz ILAYRMMZKLMZLD-ITAUSPCMSA-N 2 1 344.543 4.178 20 0 EIADMP CCCOC1CCC([NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001173100360 1050302685 /nfs/dbraw/zinc/30/26/85/1050302685.db2.gz ILAYRMMZKLMZLD-ITAUSPCMSA-N 2 1 344.543 4.178 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173110347 1050307740 /nfs/dbraw/zinc/30/77/40/1050307740.db2.gz MNDVASVSPMYJMN-PPFQCUIHSA-N 3 1 335.580 4.154 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](C)[C@H](C)Cc2ccccc2OC)CC1 ZINC001173113312 1050309133 /nfs/dbraw/zinc/30/91/33/1050309133.db2.gz MZBUNHBKDJKSFE-QHGAOEGBSA-N 2 1 332.532 4.211 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+]2C[C@H]3[C@@H](C2)CCC[C@H]3OCC2CC2)CC1 ZINC001173111104 1050310351 /nfs/dbraw/zinc/31/03/51/1050310351.db2.gz RWAPSHAYTFIOMK-VQSBLYBRSA-N 2 1 348.575 4.167 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H](Oc3ccccc3C)C2)CC1 ZINC001173112197 1050310619 /nfs/dbraw/zinc/31/06/19/1050310619.db2.gz SMSVAQANODZVDG-CBNMVNINSA-N 2 1 344.543 4.491 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCO[C@@](C)(c3ccc(F)cc3)C2)CC1 ZINC001173112575 1050310813 /nfs/dbraw/zinc/31/08/13/1050310813.db2.gz CBYVICPSVABWCZ-XVAXZDLZSA-N 2 1 348.506 4.026 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@@H](C)CC2CCCCC2)[C@@H](C)C1 ZINC001177843948 1050312472 /nfs/dbraw/zinc/31/24/72/1050312472.db2.gz ICRPCABPNQPXQC-ZJOUEHCJSA-N 2 1 338.580 4.320 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001177855569 1050316682 /nfs/dbraw/zinc/31/66/82/1050316682.db2.gz ZDJAZJKCIAAODB-NNMXDRDESA-N 2 1 344.518 4.391 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC001177910409 1050323765 /nfs/dbraw/zinc/32/37/65/1050323765.db2.gz AEOFFNFROOTNHX-UHFFFAOYSA-N 2 1 325.481 4.490 20 0 EIADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c(C)c1 ZINC001177920118 1050328676 /nfs/dbraw/zinc/32/86/76/1050328676.db2.gz QOWRSFDKPXFVTA-XLIONFOSSA-N 2 1 344.524 4.238 20 0 EIADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c(C)c1 ZINC001177920118 1050328682 /nfs/dbraw/zinc/32/86/82/1050328682.db2.gz QOWRSFDKPXFVTA-XLIONFOSSA-N 2 1 344.524 4.238 20 0 EIADMP CC[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CCC[C@H](N(C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276630 1050405669 /nfs/dbraw/zinc/40/56/69/1050405669.db2.gz CLORNAMJBCZDRP-NQOGSSOHSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CCC[C@H]([NH+](C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276630 1050405674 /nfs/dbraw/zinc/40/56/74/1050405674.db2.gz CLORNAMJBCZDRP-NQOGSSOHSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([N@H+]2C[C@@H]3CCC[C@H]([NH+](C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276630 1050405680 /nfs/dbraw/zinc/40/56/80/1050405680.db2.gz CLORNAMJBCZDRP-NQOGSSOHSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([NH+]2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276630 1050405682 /nfs/dbraw/zinc/40/56/82/1050405682.db2.gz CLORNAMJBCZDRP-NQOGSSOHSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@H]([NH+]2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276630 1050405686 /nfs/dbraw/zinc/40/56/86/1050405686.db2.gz CLORNAMJBCZDRP-NQOGSSOHSA-N 2 1 341.543 4.193 20 0 EIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)C1 ZINC001173278998 1050408035 /nfs/dbraw/zinc/40/80/35/1050408035.db2.gz NVMAZKALAOKVRT-UYAOXDASSA-N 2 1 341.543 4.337 20 0 EIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC3(CCC[N@H+]3Cc3c(C)noc3C)CC2)C1 ZINC001173284388 1050410158 /nfs/dbraw/zinc/41/01/58/1050410158.db2.gz ZNLMFJFMJWUCDC-RTBURBONSA-N 2 1 345.531 4.301 20 0 EIADMP C[C@H]([NH2+]Cc1cccc2ccoc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001178330267 1050436389 /nfs/dbraw/zinc/43/63/89/1050436389.db2.gz ALMSVPXXIXCOGO-UWJYYQICSA-N 2 1 334.463 4.433 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2Cc3cc(F)c(F)cc3C2)C2CCCCC2)CC1 ZINC001173475336 1050458301 /nfs/dbraw/zinc/45/83/01/1050458301.db2.gz CMVJXULZRDRUEO-SAABIXHNSA-N 2 1 348.481 4.337 20 0 EIADMP C[C@H]([NH2+]Cc1cc2cc(F)ccc2o1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001178457876 1050474208 /nfs/dbraw/zinc/47/42/08/1050474208.db2.gz FUPRIRFMPMCBMP-GJZGRUSLSA-N 2 1 330.447 4.315 20 0 EIADMP C[C@H]([NH2+]Cc1cc2cc(F)ccc2o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001178457876 1050474216 /nfs/dbraw/zinc/47/42/16/1050474216.db2.gz FUPRIRFMPMCBMP-GJZGRUSLSA-N 2 1 330.447 4.315 20 0 EIADMP CC[C@@H]1CCC[C@H]1C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001178748939 1050542152 /nfs/dbraw/zinc/54/21/52/1050542152.db2.gz XLBDKKXEAVXVIK-MOPGFXCFSA-N 2 1 332.507 4.249 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001179338362 1050680553 /nfs/dbraw/zinc/68/05/53/1050680553.db2.gz GKMNTOZAAUPNIX-AUSIDOKSSA-N 2 1 348.534 4.292 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCC(C)(C)CO2)CC[N@@H+]1Cc1ccccc1 ZINC001179686365 1050746828 /nfs/dbraw/zinc/74/68/28/1050746828.db2.gz WMJLIOHKNRRLEQ-HMXCVIKNSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCC(C)(C)CO2)CC[N@H+]1Cc1ccccc1 ZINC001179686365 1050746836 /nfs/dbraw/zinc/74/68/36/1050746836.db2.gz WMJLIOHKNRRLEQ-HMXCVIKNSA-N 2 1 344.543 4.224 20 0 EIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877916 1050814932 /nfs/dbraw/zinc/81/49/32/1050814932.db2.gz KHSXWLHZIFGZMC-QQUYBBDPSA-N 2 1 326.528 4.433 20 0 EIADMP Cc1cc(C)c(/C=C/C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1C ZINC001179877916 1050814944 /nfs/dbraw/zinc/81/49/44/1050814944.db2.gz KHSXWLHZIFGZMC-QQUYBBDPSA-N 2 1 326.528 4.433 20 0 EIADMP CC(C)(C)[C@@]1(C[N@@H+]2CCOC(C)(C)C2)CC[NH+](Cc2ccccc2)C1 ZINC001180271130 1050940074 /nfs/dbraw/zinc/94/00/74/1050940074.db2.gz DFEBKZGCMVZJQX-QFIPXVFZSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)(C)[C@@]1(C[N@H+]2CCOC(C)(C)C2)CC[NH+](Cc2ccccc2)C1 ZINC001180271130 1050940088 /nfs/dbraw/zinc/94/00/88/1050940088.db2.gz DFEBKZGCMVZJQX-QFIPXVFZSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)(C)[C@@]1(C[NH+]2CCOC(C)(C)C2)CC[N@H+](Cc2ccccc2)C1 ZINC001180271130 1050940093 /nfs/dbraw/zinc/94/00/93/1050940093.db2.gz DFEBKZGCMVZJQX-QFIPXVFZSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)(C)[C@@]1(C[NH+]2CCOC(C)(C)C2)CC[N@@H+](Cc2ccccc2)C1 ZINC001180271130 1050940096 /nfs/dbraw/zinc/94/00/96/1050940096.db2.gz DFEBKZGCMVZJQX-QFIPXVFZSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001180302568 1050945675 /nfs/dbraw/zinc/94/56/75/1050945675.db2.gz ZLYNMXDPUBINFN-XYEHWOGUSA-N 2 1 326.528 4.455 20 0 EIADMP Cc1cc(Nc2cccc3c2C[N@@H+](C)C[C@@H]3c2ccccc2)cc[nH+]1 ZINC001174656998 1051129292 /nfs/dbraw/zinc/12/92/92/1051129292.db2.gz YKAMZAMXGIXLNO-HXUWFJFHSA-N 2 1 329.447 4.133 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000620513426 1051148854 /nfs/dbraw/zinc/14/88/54/1051148854.db2.gz IUZGOKZMODHIKM-FQEVSTJZSA-N 2 1 330.516 4.077 20 0 EIADMP Cc1csc(CCC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)n1 ZINC000157289719 1051151319 /nfs/dbraw/zinc/15/13/19/1051151319.db2.gz YUAPDHMHSVPBBI-HNNXBMFYSA-N 2 1 340.496 4.229 20 0 EIADMP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2csc(C)n2)ccc1OC ZINC000775376796 1051158740 /nfs/dbraw/zinc/15/87/40/1051158740.db2.gz SBKDMHZKNSIEGX-AWEZNQCLSA-N 2 1 347.528 4.153 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(C(F)F)c(F)c2)cc1 ZINC001181483956 1051245254 /nfs/dbraw/zinc/24/52/54/1051245254.db2.gz CMQZNHLCCSHRRR-UHFFFAOYSA-N 2 1 336.401 4.457 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190826077 1051286049 /nfs/dbraw/zinc/28/60/49/1051286049.db2.gz FCEIDLAOTIVWPG-NJYVYQBISA-N 2 1 336.564 4.170 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190826077 1051286064 /nfs/dbraw/zinc/28/60/64/1051286064.db2.gz FCEIDLAOTIVWPG-NJYVYQBISA-N 2 1 336.564 4.170 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cccc3ncccc23)C1 ZINC001191048959 1051350634 /nfs/dbraw/zinc/35/06/34/1051350634.db2.gz VLVCRMHDWSLVHU-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cccc3ncccc23)C1 ZINC001191048959 1051350646 /nfs/dbraw/zinc/35/06/46/1051350646.db2.gz VLVCRMHDWSLVHU-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cccc3ncccc23)C1 ZINC001191048959 1051350655 /nfs/dbraw/zinc/35/06/55/1051350655.db2.gz VLVCRMHDWSLVHU-RTBURBONSA-N 2 1 337.511 4.321 20 0 EIADMP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311188772 1051470255 /nfs/dbraw/zinc/47/02/55/1051470255.db2.gz DJWVWNJTRNVTPU-QUCCMNQESA-N 2 1 338.495 4.176 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCOc3cccc(C(C)(C)C)c3)CC[C@@H]21 ZINC001191521356 1051472459 /nfs/dbraw/zinc/47/24/59/1051472459.db2.gz PYFYREOFWSGLPC-RXVVDRJESA-N 2 1 344.543 4.169 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCOc3cccc(C(C)(C)C)c3)CC[C@@H]21 ZINC001191521356 1051472473 /nfs/dbraw/zinc/47/24/73/1051472473.db2.gz PYFYREOFWSGLPC-RXVVDRJESA-N 2 1 344.543 4.169 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCOc3cccc(C(C)(C)C)c3)CC[C@@H]21 ZINC001191521356 1051472481 /nfs/dbraw/zinc/47/24/81/1051472481.db2.gz PYFYREOFWSGLPC-RXVVDRJESA-N 2 1 344.543 4.169 20 0 EIADMP CC(C)[C@H]1CC[N@@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)C1 ZINC001191541434 1051479746 /nfs/dbraw/zinc/47/97/46/1051479746.db2.gz SKFVNYVOLJITTQ-QFIPXVFZSA-N 2 1 328.544 4.309 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cncc(Cl)c2)CC1 ZINC001191549274 1051486449 /nfs/dbraw/zinc/48/64/49/1051486449.db2.gz ADZQKXSYCHUOFM-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cncc(Cl)c2)CC1 ZINC001191549274 1051486457 /nfs/dbraw/zinc/48/64/57/1051486457.db2.gz ADZQKXSYCHUOFM-MRXNPFEDSA-N 2 1 335.923 4.212 20 0 EIADMP CSc1ccccc1C[N@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001175352144 1051543319 /nfs/dbraw/zinc/54/33/19/1051543319.db2.gz OJXBCBWIKMYDJA-LJQANCHMSA-N 2 1 332.557 4.495 20 0 EIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2cc(Cl)ccc2C(F)(F)F)CC1 ZINC001205571015 1051548816 /nfs/dbraw/zinc/54/88/16/1051548816.db2.gz RSJKGHJSRFFWAR-AWEZNQCLSA-N 2 1 338.776 4.012 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000774376631 1051569617 /nfs/dbraw/zinc/56/96/17/1051569617.db2.gz KHFFJIYTKSQUHK-NSHDSACASA-N 2 1 330.303 4.101 20 0 EIADMP CC(C)C[N@H+](Cc1cnc2ccccc2c1)CC1CC[NH+](C)CC1 ZINC001175600778 1051664923 /nfs/dbraw/zinc/66/49/23/1051664923.db2.gz CALUJSAMCYOPHX-UHFFFAOYSA-N 2 1 325.500 4.035 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158097946 1051708792 /nfs/dbraw/zinc/70/87/92/1051708792.db2.gz HVYGODQRFLCXCG-HIFRSBDPSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000158097946 1051708807 /nfs/dbraw/zinc/70/88/07/1051708807.db2.gz HVYGODQRFLCXCG-HIFRSBDPSA-N 2 1 347.503 4.250 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2nc(C(C)(C)C)co2)CC1)CC1CC1 ZINC001192500880 1051747469 /nfs/dbraw/zinc/74/74/69/1051747469.db2.gz JVBCVZLFGDPJOK-UHFFFAOYSA-N 2 1 347.547 4.306 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2nc(C(C)(C)C)co2)CC1)CC1CC1 ZINC001192500880 1051747476 /nfs/dbraw/zinc/74/74/76/1051747476.db2.gz JVBCVZLFGDPJOK-UHFFFAOYSA-N 2 1 347.547 4.306 20 0 EIADMP CCc1cccc(C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC001192909335 1051829911 /nfs/dbraw/zinc/82/99/11/1051829911.db2.gz HNUCCTWHBYIRED-UHFFFAOYSA-N 2 1 337.511 4.383 20 0 EIADMP C[C@H]1CC[N@@H+](Cc2c(Cl)cccc2C(F)(F)F)CC[C@H]1C[NH3+] ZINC001205628564 1051914954 /nfs/dbraw/zinc/91/49/54/1051914954.db2.gz VZXUTCYMPLUGOM-RYUDHWBXSA-N 2 1 334.813 4.166 20 0 EIADMP CC(C)(C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)C1CCC1 ZINC000716731038 1051980869 /nfs/dbraw/zinc/98/08/69/1051980869.db2.gz JFDWZDGUZJSWDB-JBACZVJFSA-N 2 1 326.528 4.455 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cncs1 ZINC000290210180 1052001769 /nfs/dbraw/zinc/00/17/69/1052001769.db2.gz PWFMAINYFBPMJR-SJLPKXTDSA-N 2 1 329.513 4.096 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cncs1 ZINC000290210180 1052001772 /nfs/dbraw/zinc/00/17/72/1052001772.db2.gz PWFMAINYFBPMJR-SJLPKXTDSA-N 2 1 329.513 4.096 20 0 EIADMP CC(C)COc1ccccc1CN1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001184399415 1052003030 /nfs/dbraw/zinc/00/30/30/1052003030.db2.gz WBYQZTFUCCGTAK-SZPZYZBQSA-N 2 1 342.527 4.029 20 0 EIADMP CC(C)COc1ccccc1C[N@@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001184399415 1052003037 /nfs/dbraw/zinc/00/30/37/1052003037.db2.gz WBYQZTFUCCGTAK-SZPZYZBQSA-N 2 1 342.527 4.029 20 0 EIADMP CC(C)COc1ccccc1C[N@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001184399415 1052003050 /nfs/dbraw/zinc/00/30/50/1052003050.db2.gz WBYQZTFUCCGTAK-SZPZYZBQSA-N 2 1 342.527 4.029 20 0 EIADMP CC(C)COc1ccccc1C[NH+]1C[C@@]23C[N@H+](C)C[C@]2(C1)CCCC3 ZINC001184399415 1052003058 /nfs/dbraw/zinc/00/30/58/1052003058.db2.gz WBYQZTFUCCGTAK-SZPZYZBQSA-N 2 1 342.527 4.029 20 0 EIADMP CC(C)COc1ccccc1C[NH+]1C[C@@]23C[N@@H+](C)C[C@]2(C1)CCCC3 ZINC001184399415 1052003067 /nfs/dbraw/zinc/00/30/67/1052003067.db2.gz WBYQZTFUCCGTAK-SZPZYZBQSA-N 2 1 342.527 4.029 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(SC)c(OC)c2)CC1 ZINC000164485705 1052031099 /nfs/dbraw/zinc/03/10/99/1052031099.db2.gz IDYZMUHEWQIWHR-OAHLLOKOSA-N 2 1 336.545 4.332 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426546 1052146645 /nfs/dbraw/zinc/14/66/45/1052146645.db2.gz LBWINWMPIAIAMK-UXHICEINSA-N 2 1 332.532 4.082 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426546 1052146658 /nfs/dbraw/zinc/14/66/58/1052146658.db2.gz LBWINWMPIAIAMK-UXHICEINSA-N 2 1 332.532 4.082 20 0 EIADMP c1[nH]c2ccccc2c1CCC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000174369916 1052565273 /nfs/dbraw/zinc/56/52/73/1052565273.db2.gz DTRBTMUNKMVWHS-UHFFFAOYSA-N 2 1 347.506 4.355 20 0 EIADMP CCOc1cccc2cc([C@@H](C)N[C@@H]3CC[N@@H+](C)C(C)(C)C3)oc21 ZINC000623342617 1052626108 /nfs/dbraw/zinc/62/61/08/1052626108.db2.gz GQXUTNKLQDJWIX-GDBMZVCRSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)oc21 ZINC000623342617 1052626115 /nfs/dbraw/zinc/62/61/15/1052626115.db2.gz GQXUTNKLQDJWIX-GDBMZVCRSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+][C@@H]3CC[N@@H+](C)C(C)(C)C3)oc21 ZINC000623342617 1052626119 /nfs/dbraw/zinc/62/61/19/1052626119.db2.gz GQXUTNKLQDJWIX-GDBMZVCRSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@H](C)N[C@@H]3CC[N@@H+](C)C(C)(C)C3)oc21 ZINC000623342619 1052626171 /nfs/dbraw/zinc/62/61/71/1052626171.db2.gz GQXUTNKLQDJWIX-GOEBONIOSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)oc21 ZINC000623342619 1052626179 /nfs/dbraw/zinc/62/61/79/1052626179.db2.gz GQXUTNKLQDJWIX-GOEBONIOSA-N 2 1 330.472 4.355 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+][C@@H]3CC[N@@H+](C)C(C)(C)C3)oc21 ZINC000623342619 1052626181 /nfs/dbraw/zinc/62/61/81/1052626181.db2.gz GQXUTNKLQDJWIX-GOEBONIOSA-N 2 1 330.472 4.355 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3cccc4n[nH]cc43)cc2)C1 ZINC000623357428 1052632322 /nfs/dbraw/zinc/63/23/22/1052632322.db2.gz OKRDFVYEOVMQGM-KRWDZBQOSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Br)cc1F ZINC000623524423 1052671568 /nfs/dbraw/zinc/67/15/68/1052671568.db2.gz SMNNQWURSWOCOW-DGCLKSJQSA-N 2 1 343.284 4.112 20 0 EIADMP C[N@H+]1CC[C@H](NC2(c3ccc(OC(F)(F)F)cc3)CC2)CC1(C)C ZINC000623535393 1052674922 /nfs/dbraw/zinc/67/49/22/1052674922.db2.gz YFRSYEDGFSVFOB-AWEZNQCLSA-N 2 1 342.405 4.037 20 0 EIADMP CN1CC[C@H]([NH2+]C2(c3ccc(OC(F)(F)F)cc3)CC2)CC1(C)C ZINC000623535393 1052674923 /nfs/dbraw/zinc/67/49/23/1052674923.db2.gz YFRSYEDGFSVFOB-AWEZNQCLSA-N 2 1 342.405 4.037 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C2(c3ccc(OC(F)(F)F)cc3)CC2)CC1(C)C ZINC000623535393 1052674927 /nfs/dbraw/zinc/67/49/27/1052674927.db2.gz YFRSYEDGFSVFOB-AWEZNQCLSA-N 2 1 342.405 4.037 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C2(c3ccc(OC(F)(F)F)cc3)CC2)CC1(C)C ZINC000623535393 1052674929 /nfs/dbraw/zinc/67/49/29/1052674929.db2.gz YFRSYEDGFSVFOB-AWEZNQCLSA-N 2 1 342.405 4.037 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCc3[nH]c4ccc(Cl)cc4c3C2)CC1(C)C ZINC000623556902 1052680372 /nfs/dbraw/zinc/68/03/72/1052680372.db2.gz CZYOPUPPQZWLNN-GJZGRUSLSA-N 2 1 345.918 4.141 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cc(C)ccc1OC(F)F ZINC000178698344 1052711134 /nfs/dbraw/zinc/71/11/34/1052711134.db2.gz RTFNLQJAQWAKPP-UONOGXRCSA-N 2 1 337.414 4.088 20 0 EIADMP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000623755264 1052779540 /nfs/dbraw/zinc/77/95/40/1052779540.db2.gz ABWLZIDAEWAULR-CLCXKQKWSA-N 2 1 343.902 4.415 20 0 EIADMP Clc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000623861235 1052824643 /nfs/dbraw/zinc/82/46/43/1052824643.db2.gz SJGQZRZFOOYSFG-ORAYPTAESA-N 2 1 343.902 4.273 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCCC[C@@H]1Sc1ccc(F)cc1 ZINC000623881416 1052829321 /nfs/dbraw/zinc/82/93/21/1052829321.db2.gz NKCMFXGQEKZQSB-ROUUACIJSA-N 2 1 333.476 4.024 20 0 EIADMP COc1ccc([C@@H]([NH2+]C[C@H]2CCCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000624121676 1052867382 /nfs/dbraw/zinc/86/73/82/1052867382.db2.gz AUPOUYYBTFCHBJ-GCJKJVERSA-N 2 1 338.495 4.106 20 0 EIADMP COc1ccc([C@@H]([NH2+]C[C@H]2CCCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000624121676 1052867384 /nfs/dbraw/zinc/86/73/84/1052867384.db2.gz AUPOUYYBTFCHBJ-GCJKJVERSA-N 2 1 338.495 4.106 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c2ccccc12 ZINC000624119586 1052867448 /nfs/dbraw/zinc/86/74/48/1052867448.db2.gz FNMQOZKBFSLDEJ-DLBZAZTESA-N 2 1 326.484 4.231 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]C[C@@H]3CCCC[N@H+](C)C3)c(C)c2c1 ZINC000624121118 1052867662 /nfs/dbraw/zinc/86/76/62/1052867662.db2.gz ONPHRCZXDGMQSN-HOTGVXAUSA-N 2 1 330.472 4.132 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]C[C@@H]3CCCC[N@@H+](C)C3)c(C)c2c1 ZINC000624121118 1052867664 /nfs/dbraw/zinc/86/76/64/1052867664.db2.gz ONPHRCZXDGMQSN-HOTGVXAUSA-N 2 1 330.472 4.132 20 0 EIADMP Cc1oc2ccccc2c1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381134575 1053054856 /nfs/dbraw/zinc/05/48/56/1053054856.db2.gz AEUCCACRWBUTMA-IBGZPJMESA-N 2 1 334.463 4.353 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)CCO2 ZINC000764973525 1053395866 /nfs/dbraw/zinc/39/58/66/1053395866.db2.gz QSHIXLAIBUKJAC-FGTMMUONSA-N 2 1 330.516 4.030 20 0 EIADMP CCOc1cccc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000385805307 1053550301 /nfs/dbraw/zinc/55/03/01/1053550301.db2.gz NHLNJVUOKPDENL-NQIIRXRSSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000765450263 1053550457 /nfs/dbraw/zinc/55/04/57/1053550457.db2.gz PBYNWNYEOWEPQC-PKOBYXMFSA-N 2 1 334.573 4.408 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccnc(Cl)c1 ZINC000765449392 1053550595 /nfs/dbraw/zinc/55/05/95/1053550595.db2.gz JJJAPKMQMWUBKW-AEFFLSMTSA-N 2 1 343.902 4.298 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2c(Cl)n[nH]c2C2CC2)cc1 ZINC000921514302 1053561222 /nfs/dbraw/zinc/56/12/22/1053561222.db2.gz XXFZJJUILIFFFH-UHFFFAOYSA-N 2 1 346.906 4.072 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2ccccc2o1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386238406 1053645363 /nfs/dbraw/zinc/64/53/63/1053645363.db2.gz BOAPTJQWEWMOHV-XLIONFOSSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2ccccc2o1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386238406 1053645370 /nfs/dbraw/zinc/64/53/70/1053645370.db2.gz BOAPTJQWEWMOHV-XLIONFOSSA-N 2 1 334.463 4.433 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866250230 1053664887 /nfs/dbraw/zinc/66/48/87/1053664887.db2.gz WZLFIKXHXNSQOB-CYBMUJFWSA-N 2 1 335.879 4.396 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)C1 ZINC000866259784 1053667293 /nfs/dbraw/zinc/66/72/93/1053667293.db2.gz GBNVVNLCWDFRAO-KBPBESRZSA-N 2 1 335.879 4.252 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)C1 ZINC000866259784 1053667297 /nfs/dbraw/zinc/66/72/97/1053667297.db2.gz GBNVVNLCWDFRAO-KBPBESRZSA-N 2 1 335.879 4.252 20 0 EIADMP C[C@@H](Cc1cccs1)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000690007585 1053741792 /nfs/dbraw/zinc/74/17/92/1053741792.db2.gz SPBAGCJURPZFBJ-PXNSSMCTSA-N 2 1 328.525 4.181 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CC[C@@H]2CCCS2)C3)cc1 ZINC000866482256 1053746068 /nfs/dbraw/zinc/74/60/68/1053746068.db2.gz ZJEXLENRIZOXDD-HAGHYFMRSA-N 2 1 330.541 4.057 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2ccccc2C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386546136 1053771361 /nfs/dbraw/zinc/77/13/61/1053771361.db2.gz SFZXELNJKSBGRT-OFAXGOBFSA-N 2 1 334.507 4.044 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386578556 1053781325 /nfs/dbraw/zinc/78/13/25/1053781325.db2.gz ZGJCZCGMRKYEEG-AQOAWAETSA-N 2 1 338.470 4.313 20 0 EIADMP CC(C)C[C@@H](C)C[N@H+]1CC[C@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856559696 1054085078 /nfs/dbraw/zinc/08/50/78/1054085078.db2.gz SMUOPAJPWAIMNW-NQIIRXRSSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)C[C@@H](C)C[NH+]1CC[C@H](Oc2ccnc(C[N@H+](C)C(C)C)c2)C1 ZINC000856559696 1054085088 /nfs/dbraw/zinc/08/50/88/1054085088.db2.gz SMUOPAJPWAIMNW-NQIIRXRSSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)C[C@@H](C)C[NH+]1CC[C@H](Oc2ccnc(C[N@@H+](C)C(C)C)c2)C1 ZINC000856559696 1054085094 /nfs/dbraw/zinc/08/50/94/1054085094.db2.gz SMUOPAJPWAIMNW-NQIIRXRSSA-N 2 1 347.547 4.057 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@H]1c1ccccc1Cl ZINC000542667112 1054179167 /nfs/dbraw/zinc/17/91/67/1054179167.db2.gz WYFZVZWIYUGQNX-DKSSEZFCSA-N 2 1 331.891 4.407 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CCc1ccccc1F ZINC001198989704 1054322470 /nfs/dbraw/zinc/32/24/70/1054322470.db2.gz AFMRURBMZDSNAR-UHFFFAOYSA-N 2 1 328.475 4.116 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cccc(O)c2F)cc1 ZINC000872019162 1054334995 /nfs/dbraw/zinc/33/49/95/1054334995.db2.gz UGFOHJJLOGTUQD-HNNXBMFYSA-N 2 1 330.447 4.224 20 0 EIADMP CC1(C)C[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCO1 ZINC000872071933 1054378519 /nfs/dbraw/zinc/37/85/19/1054378519.db2.gz ABXKNBSNWPNGOL-WVVQBRDUSA-N 2 1 342.527 4.119 20 0 EIADMP CC1(C)C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCO1 ZINC000872071932 1054379161 /nfs/dbraw/zinc/37/91/61/1054379161.db2.gz ABXKNBSNWPNGOL-UDEWTMQYSA-N 2 1 342.527 4.119 20 0 EIADMP CCOc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+](C)CC)c2)c1 ZINC000123940362 1054380361 /nfs/dbraw/zinc/38/03/61/1054380361.db2.gz OFFODTACZPTHFY-QGZVFWFLSA-N 2 1 326.484 4.388 20 0 EIADMP COc1ccc(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)cc1Cl ZINC001199296540 1054383148 /nfs/dbraw/zinc/38/31/48/1054383148.db2.gz VHAFOIRPVLYRMS-UHFFFAOYSA-N 2 1 346.902 4.479 20 0 EIADMP COc1cccc2c1CCC[C@H]([NH2+]C[C@]1([NH+](C)C)CCC[C@H](C)C1)C2 ZINC001199638599 1054437403 /nfs/dbraw/zinc/43/74/03/1054437403.db2.gz FCYCDUPTSRFTDT-JLMWRMLUSA-N 2 1 344.543 4.043 20 0 EIADMP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H](C)c1ccc(C(F)(F)F)nc1 ZINC000873297500 1054524491 /nfs/dbraw/zinc/52/44/91/1054524491.db2.gz XSGMZSVDXOPNFI-NFAWXSAZSA-N 2 1 329.410 4.062 20 0 EIADMP CSc1ccc(C[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)s1 ZINC001200940973 1054598407 /nfs/dbraw/zinc/59/84/07/1054598407.db2.gz BEWSPIIDWSTTAO-OAHLLOKOSA-N 2 1 334.554 4.470 20 0 EIADMP CSc1ccc(C[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)s1 ZINC001200940973 1054598423 /nfs/dbraw/zinc/59/84/23/1054598423.db2.gz BEWSPIIDWSTTAO-OAHLLOKOSA-N 2 1 334.554 4.470 20 0 EIADMP CCOc1ccc(C2=CC[N@H+](CC[C@H]3CCCC[NH+]3C)CC2)cc1 ZINC000509503686 1054701521 /nfs/dbraw/zinc/70/15/21/1054701521.db2.gz OZRXMFQQBMXUAD-HXUWFJFHSA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccc(C2=CC[N@@H+](CC[C@H]3CCCC[NH+]3C)CC2)cc1 ZINC000509503686 1054701535 /nfs/dbraw/zinc/70/15/35/1054701535.db2.gz OZRXMFQQBMXUAD-HXUWFJFHSA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccc(C2=CC[NH+](CC[C@H]3CCCC[N@@H+]3C)CC2)cc1 ZINC000509503686 1054701550 /nfs/dbraw/zinc/70/15/50/1054701550.db2.gz OZRXMFQQBMXUAD-HXUWFJFHSA-N 2 1 328.500 4.049 20 0 EIADMP CCOc1ccc(C2=CC[NH+](CC[C@H]3CCCC[N@H+]3C)CC2)cc1 ZINC000509503686 1054701567 /nfs/dbraw/zinc/70/15/67/1054701567.db2.gz OZRXMFQQBMXUAD-HXUWFJFHSA-N 2 1 328.500 4.049 20 0 EIADMP C[N@@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](CC1CCCCC1)CC2 ZINC001201392681 1054789282 /nfs/dbraw/zinc/78/92/82/1054789282.db2.gz DPLUKVTUYVOUIC-UHFFFAOYSA-N 2 1 341.543 4.338 20 0 EIADMP Cc1cn2c(cccc2NC2=C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC001201470206 1054811564 /nfs/dbraw/zinc/81/15/64/1054811564.db2.gz MZMBPNCHAAKXGK-UXHICEINSA-N 2 1 344.462 4.375 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](CCc1ccccc1)CC2 ZINC001201596276 1054847307 /nfs/dbraw/zinc/84/73/07/1054847307.db2.gz BXKURMGJRGDNBA-NRFANRHFSA-N 2 1 338.495 4.199 20 0 EIADMP c1ccc(CC[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC001201602835 1054861887 /nfs/dbraw/zinc/86/18/87/1054861887.db2.gz CMFDPYJTWMNIRX-UHFFFAOYSA-N 2 1 334.507 4.217 20 0 EIADMP C[C@H]([NH2+]C/C=C/c1cccc(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001201705173 1054882521 /nfs/dbraw/zinc/88/25/21/1054882521.db2.gz XGJFNCNFSCXVHX-SHDQBEOMSA-N 2 1 338.470 4.339 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cnc2c(F)cccc2c1 ZINC000877529280 1055071138 /nfs/dbraw/zinc/07/11/38/1055071138.db2.gz YCGQSCIIIRACEC-UHFFFAOYSA-N 2 1 340.446 4.045 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cnc2c(F)cccc2c1 ZINC000877529280 1055071150 /nfs/dbraw/zinc/07/11/50/1055071150.db2.gz YCGQSCIIIRACEC-UHFFFAOYSA-N 2 1 340.446 4.045 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]CCC3SCCS3)CC[N@@H+]2C2CC2)cc1 ZINC000877636968 1055097116 /nfs/dbraw/zinc/09/71/16/1055097116.db2.gz LSQFGIGWIQOQEI-AEFFLSMTSA-N 2 1 348.581 4.140 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]CCC3SCCS3)CC[N@H+]2C2CC2)cc1 ZINC000877636968 1055097126 /nfs/dbraw/zinc/09/71/26/1055097126.db2.gz LSQFGIGWIQOQEI-AEFFLSMTSA-N 2 1 348.581 4.140 20 0 EIADMP [NH3+][C@H]1C[C@H]([NH2+]Cc2cn(C(F)F)c3ccccc23)c2ccccc21 ZINC000863547140 1055226691 /nfs/dbraw/zinc/22/66/91/1055226691.db2.gz PGSVZKBODZIIOY-IRXDYDNUSA-N 2 1 327.378 4.271 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1 ZINC000515315596 1056676735 /nfs/dbraw/zinc/67/67/35/1056676735.db2.gz HWVDPVVKKRVIOB-OALUTQOASA-N 2 1 344.886 4.274 20 0 EIADMP C[C@@H](CC[NH2+]Cc1cnc2ccccc2c1)[N@H+](C)Cc1ccccc1 ZINC000379627302 1059648843 /nfs/dbraw/zinc/64/88/43/1059648843.db2.gz MTNUKOISYODTRH-SFHVURJKSA-N 2 1 333.479 4.235 20 0 EIADMP C[C@@H](CC[NH2+]Cc1cnc2ccccc2c1)[N@@H+](C)Cc1ccccc1 ZINC000379627302 1059648867 /nfs/dbraw/zinc/64/88/67/1059648867.db2.gz MTNUKOISYODTRH-SFHVURJKSA-N 2 1 333.479 4.235 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000386483102 1060269018 /nfs/dbraw/zinc/26/90/18/1060269018.db2.gz WLRQDPIDGSNHHW-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000766460876 1060367044 /nfs/dbraw/zinc/36/70/44/1060367044.db2.gz HVGUYIKLKULYRY-SCTDSRPQSA-N 2 1 334.573 4.407 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000766460876 1060367067 /nfs/dbraw/zinc/36/70/67/1060367067.db2.gz HVGUYIKLKULYRY-SCTDSRPQSA-N 2 1 334.573 4.407 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CCC[C@H]1C[NH3+] ZINC001205996032 1060565243 /nfs/dbraw/zinc/56/52/43/1060565243.db2.gz UBOWPPKEPATJCA-JSGCOSHPSA-N 2 1 332.435 4.105 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)Cc1ccccc1C(F)(F)F)C2 ZINC001169119392 1060647574 /nfs/dbraw/zinc/64/75/74/1060647574.db2.gz SIVRZKFGCRUFFF-PHZGNYQRSA-N 2 1 340.433 4.241 20 0 EIADMP CCCC[C@H]([NH3+])Cc1cn([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc12 ZINC001169109481 1060657905 /nfs/dbraw/zinc/65/79/05/1060657905.db2.gz JDNYHUBZMNHQQG-HAGHYFMRSA-N 2 1 339.527 4.499 20 0 EIADMP 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 1060672982 /nfs/dbraw/zinc/67/29/82/1060672982.db2.gz FBUZOQODHKRDRY-ZRNYENFQSA-N 2 1 342.527 4.278 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@H](C)C3)C[C@@H]2C)CC1 ZINC001169233953 1060704172 /nfs/dbraw/zinc/70/41/72/1060704172.db2.gz YRCMSQTYZSKORT-ZEXGJKEESA-N 3 1 349.607 4.019 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(Cc3ccccc3C(F)(F)F)CCC2)CC1 ZINC001169241948 1060717504 /nfs/dbraw/zinc/71/75/04/1060717504.db2.gz VHNXDJCJTMVGPM-UHFFFAOYSA-N 2 1 340.433 4.245 20 0 EIADMP C[N@H+]1CCC[C@H](CCNc2[nH+]ccc3c2ccn3Cc2ccccc2)C1 ZINC001156390079 1061006592 /nfs/dbraw/zinc/00/65/92/1061006592.db2.gz UUDOHFSMSWAMHB-LJQANCHMSA-N 2 1 348.494 4.228 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000767351142 1061202100 /nfs/dbraw/zinc/20/21/00/1061202100.db2.gz UFDVESUVHOWFQZ-UHFFFAOYSA-N 2 1 336.483 4.333 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1COc1ccc(Cl)cc1 ZINC000767346424 1061202760 /nfs/dbraw/zinc/20/27/60/1061202760.db2.gz KYOMLTHSLQPRLG-SFHVURJKSA-N 2 1 347.890 4.169 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1COc1ccc(Cl)cc1 ZINC000767346424 1061202784 /nfs/dbraw/zinc/20/27/84/1061202784.db2.gz KYOMLTHSLQPRLG-SFHVURJKSA-N 2 1 347.890 4.169 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cn2ccccc2n1 ZINC000571229920 370704982 /nfs/dbraw/zinc/70/49/82/370704982.db2.gz KVUBFMWSBLCLPL-QGZVFWFLSA-N 2 1 336.483 4.027 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[NH+](Cc2cccc3cc[nH]c32)CC1 ZINC000275806957 564010107 /nfs/dbraw/zinc/01/01/07/564010107.db2.gz TXVUOLQVHORPEW-OAQYLSRUSA-N 2 1 348.494 4.049 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[NH+](Cc2cccc3cc[nH]c32)CC1 ZINC000275806957 564010108 /nfs/dbraw/zinc/01/01/08/564010108.db2.gz TXVUOLQVHORPEW-OAQYLSRUSA-N 2 1 348.494 4.049 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@H+](Cc2cccc3cc[nH]c32)CC1 ZINC000275806957 564010109 /nfs/dbraw/zinc/01/01/09/564010109.db2.gz TXVUOLQVHORPEW-OAQYLSRUSA-N 2 1 348.494 4.049 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[N@@H+](Cc2cccc3cc[nH]c32)CC1 ZINC000275806957 564010110 /nfs/dbraw/zinc/01/01/10/564010110.db2.gz TXVUOLQVHORPEW-OAQYLSRUSA-N 2 1 348.494 4.049 20 0 EIADMP COc1ccc2c(cc[nH+]c2N2CCCC[C@@H]2CC[NH+]2CCCC2)c1 ZINC001165046488 721967409 /nfs/dbraw/zinc/96/74/09/721967409.db2.gz GCAJBYJQSGQCPJ-GOSISDBHSA-N 2 1 339.483 4.088 20 0 EIADMP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]Cc3ccc4ccccc4n3)CC2)C1 ZINC000532205411 1032073775 /nfs/dbraw/zinc/07/37/75/1032073775.db2.gz SFMXWUSOJOLCMB-UWJYYQICSA-N 2 1 337.511 4.368 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@H]3CCc4ccccc43)C2)c1 ZINC000532219512 1032100296 /nfs/dbraw/zinc/10/02/96/1032100296.db2.gz WYNUXRUDTBNCGV-JXFKEZNVSA-N 2 1 326.509 4.237 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3CCc4ccccc43)C2)c1 ZINC000532219512 1032100307 /nfs/dbraw/zinc/10/03/07/1032100307.db2.gz WYNUXRUDTBNCGV-JXFKEZNVSA-N 2 1 326.509 4.237 20 0 EIADMP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000532226264 1032105846 /nfs/dbraw/zinc/10/58/46/1032105846.db2.gz RQZGUQQWKHFPKP-MOPGFXCFSA-N 2 1 328.525 4.272 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C(C)(C)c1ccc(OC(F)(F)F)cc1 ZINC000475698194 1032206957 /nfs/dbraw/zinc/20/69/57/1032206957.db2.gz IFDANGAPLLMGRF-UHFFFAOYSA-N 2 1 341.377 4.005 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2nc(-c3ccccc3)c[nH]2)c1 ZINC000194266657 1032283077 /nfs/dbraw/zinc/28/30/77/1032283077.db2.gz QCYNNCVRAFQEHX-UHFFFAOYSA-N 2 1 348.494 4.207 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2nc(-c3ccccc3)c[nH]2)c1 ZINC000194266657 1032283105 /nfs/dbraw/zinc/28/31/05/1032283105.db2.gz QCYNNCVRAFQEHX-UHFFFAOYSA-N 2 1 348.494 4.207 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)C[C@H](C)O1 ZINC000648431537 1032293516 /nfs/dbraw/zinc/29/35/16/1032293516.db2.gz BPAXAJQZSBWTCE-RMFSNUHRSA-N 2 1 344.543 4.497 20 0 EIADMP Clc1cnc2oc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)cc2c1 ZINC000648438626 1032313177 /nfs/dbraw/zinc/31/31/77/1032313177.db2.gz RCOPMEDSJGRYQM-UHFFFAOYSA-N 2 1 347.890 4.225 20 0 EIADMP Clc1cc2cccnc2c(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000172575430 1032326723 /nfs/dbraw/zinc/32/67/23/1032326723.db2.gz POVUZWURWFTYCH-LJQANCHMSA-N 2 1 343.902 4.339 20 0 EIADMP Clc1cc2cccnc2c(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000172575430 1032326736 /nfs/dbraw/zinc/32/67/36/1032326736.db2.gz POVUZWURWFTYCH-LJQANCHMSA-N 2 1 343.902 4.339 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]CC2Cc3ccccc3C2)[C@@H]1c1cccs1 ZINC000514697959 1032420267 /nfs/dbraw/zinc/42/02/67/1032420267.db2.gz VIKVHLRRXBLMLW-TZIWHRDSSA-N 2 1 340.536 4.136 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]CC2Cc3ccccc3C2)[C@@H]1c1cccs1 ZINC000514697959 1032420275 /nfs/dbraw/zinc/42/02/75/1032420275.db2.gz VIKVHLRRXBLMLW-TZIWHRDSSA-N 2 1 340.536 4.136 20 0 EIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccncc1 ZINC000245750726 1032459253 /nfs/dbraw/zinc/45/92/53/1032459253.db2.gz TZBIKJDSJZDLTG-LRSLUSHPSA-N 2 1 335.495 4.318 20 0 EIADMP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2c(Cl)cccc2OC(F)F)cc1 ZINC000666755340 1032499201 /nfs/dbraw/zinc/49/92/01/1032499201.db2.gz QMNKFVQZOSJMJU-NSHDSACASA-N 2 1 340.801 4.251 20 0 EIADMP c1cc2c(o1)CCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000178800269 1032540706 /nfs/dbraw/zinc/54/07/06/1032540706.db2.gz PIOQHRLTOHCOBX-SMLSOGCJSA-N 2 1 336.479 4.442 20 0 EIADMP c1cc2c(o1)CCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000178800269 1032540715 /nfs/dbraw/zinc/54/07/15/1032540715.db2.gz PIOQHRLTOHCOBX-SMLSOGCJSA-N 2 1 336.479 4.442 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1 ZINC000178703105 1032544419 /nfs/dbraw/zinc/54/44/19/1032544419.db2.gz CIWZXSMVMCLSCV-QWHCGFSZSA-N 2 1 325.378 4.197 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)c1 ZINC000180043502 1032583402 /nfs/dbraw/zinc/58/34/02/1032583402.db2.gz RFXJUMIBPGBXPW-JOCHJYFZSA-N 2 1 331.463 4.022 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000683108311 1018835330 /nfs/dbraw/zinc/83/53/30/1018835330.db2.gz BPQXJIZNJGCTKU-AABGKKOBSA-N 2 1 332.557 4.018 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)o1 ZINC000432799773 1032823687 /nfs/dbraw/zinc/82/36/87/1032823687.db2.gz ZMYZOUGKXVFSIQ-KRWDZBQOSA-N 2 1 330.447 4.310 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)o1 ZINC000432799773 1032823692 /nfs/dbraw/zinc/82/36/92/1032823692.db2.gz ZMYZOUGKXVFSIQ-KRWDZBQOSA-N 2 1 330.447 4.310 20 0 EIADMP C[C@H](c1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)cc1)C(F)(F)F ZINC000660661327 1032830023 /nfs/dbraw/zinc/83/00/23/1032830023.db2.gz CHIBTHAKEVSHST-CRAIPNDOSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[N@H+]2CCC[C@]3(CC[NH+](C)C3)C2)cc1)C(F)(F)F ZINC000660661327 1032830031 /nfs/dbraw/zinc/83/00/31/1032830031.db2.gz CHIBTHAKEVSHST-CRAIPNDOSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CCC[C@]3(CC[N@H+](C)C3)C2)cc1)C(F)(F)F ZINC000660661327 1032830037 /nfs/dbraw/zinc/83/00/37/1032830037.db2.gz CHIBTHAKEVSHST-CRAIPNDOSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CCC[C@]3(CC[N@@H+](C)C3)C2)cc1)C(F)(F)F ZINC000660661327 1032830041 /nfs/dbraw/zinc/83/00/41/1032830041.db2.gz CHIBTHAKEVSHST-CRAIPNDOSA-N 2 1 340.433 4.270 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613705 1019459800 /nfs/dbraw/zinc/45/98/00/1019459800.db2.gz YMUBJSLFCPVHKF-HIFRSBDPSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@@H](C[N@@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613705 1019459817 /nfs/dbraw/zinc/45/98/17/1019459817.db2.gz YMUBJSLFCPVHKF-HIFRSBDPSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@@H](C[N@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613705 1019459832 /nfs/dbraw/zinc/45/98/32/1019459832.db2.gz YMUBJSLFCPVHKF-HIFRSBDPSA-N 2 1 327.299 4.125 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000179493369 1019745369 /nfs/dbraw/zinc/74/53/69/1019745369.db2.gz CMFZMXJKOFGYFW-CYBMUJFWSA-N 2 1 341.377 4.173 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000179493369 1019745537 /nfs/dbraw/zinc/74/55/37/1019745537.db2.gz CMFZMXJKOFGYFW-CYBMUJFWSA-N 2 1 341.377 4.173 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000432816806 1032873003 /nfs/dbraw/zinc/87/30/03/1032873003.db2.gz RKDGZEOXJLFNMS-QGZVFWFLSA-N 2 1 332.488 4.470 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000246949931 1020292892 /nfs/dbraw/zinc/29/28/92/1020292892.db2.gz FMTNZNAXVAZLKT-OALUTQOASA-N 2 1 338.495 4.343 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000246949931 1020292897 /nfs/dbraw/zinc/29/28/97/1020292897.db2.gz FMTNZNAXVAZLKT-OALUTQOASA-N 2 1 338.495 4.343 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](CC[C@@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255608 1020677584 /nfs/dbraw/zinc/67/75/84/1020677584.db2.gz JSZUAJWRNLHXIF-JKSUJKDBSA-N 2 1 333.347 4.014 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CC[C@@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255608 1020677595 /nfs/dbraw/zinc/67/75/95/1020677595.db2.gz JSZUAJWRNLHXIF-JKSUJKDBSA-N 2 1 333.347 4.014 20 0 EIADMP Cc1ccccc1[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)C(C)(C)C ZINC000655721285 1020915746 /nfs/dbraw/zinc/91/57/46/1020915746.db2.gz MMAVLFAZDVXCCT-CTNGQTDRSA-N 2 1 344.543 4.315 20 0 EIADMP COc1ccc2cc([C@H](C)[NH2+]C[C@H](C)Cn3cc[nH+]c3C)ccc2c1 ZINC000121519571 1020999419 /nfs/dbraw/zinc/99/94/19/1020999419.db2.gz OFWHVGGCMSMGMI-HOTGVXAUSA-N 2 1 337.467 4.340 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+]Cc1ccc(Oc2cc(F)cc(F)c2)cc1 ZINC000340441133 1021032656 /nfs/dbraw/zinc/03/26/56/1021032656.db2.gz SRNHRWPQQFKERR-UHFFFAOYSA-N 2 1 343.377 4.052 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1C ZINC000683704986 1021124128 /nfs/dbraw/zinc/12/41/28/1021124128.db2.gz HVBOAOUOUSVLMZ-NRFANRHFSA-N 2 1 338.495 4.005 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000539080395 1021311610 /nfs/dbraw/zinc/31/16/10/1021311610.db2.gz TZPXPGUIHXGXPZ-VXGBXAGGSA-N 2 1 326.271 4.485 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000536301403 1021413056 /nfs/dbraw/zinc/41/30/56/1021413056.db2.gz APSBMRNFUWSMNE-QGZVFWFLSA-N 2 1 327.299 4.445 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3cc4c(s3)CCC4)CC2)[nH+]c1 ZINC000163495978 1021716682 /nfs/dbraw/zinc/71/66/82/1021716682.db2.gz NKRLTRWBEVYATR-OAHLLOKOSA-N 2 1 341.524 4.260 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000580225598 1021777915 /nfs/dbraw/zinc/77/79/15/1021777915.db2.gz UTMDEGDQYQEHMI-IEBWSBKVSA-N 2 1 332.536 4.133 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCO3)c1 ZINC000177977853 1021837728 /nfs/dbraw/zinc/83/77/28/1021837728.db2.gz VIYSAWJWQVKZMK-KRWDZBQOSA-N 2 1 338.495 4.313 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC000414103510 1021858432 /nfs/dbraw/zinc/85/84/32/1021858432.db2.gz DUXDLFYWESCUCR-BZSNNMDCSA-N 2 1 330.516 4.307 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000414182579 1022056874 /nfs/dbraw/zinc/05/68/74/1022056874.db2.gz MWVJOXUYTMBSTE-MSOLQXFVSA-N 2 1 339.483 4.256 20 0 EIADMP COc1ccsc1[C@H](C)NCC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000471580444 1022062874 /nfs/dbraw/zinc/06/28/74/1022062874.db2.gz IFUKFAYONTXUKZ-HOTGVXAUSA-N 2 1 332.513 4.318 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000471580444 1022062903 /nfs/dbraw/zinc/06/29/03/1022062903.db2.gz IFUKFAYONTXUKZ-HOTGVXAUSA-N 2 1 332.513 4.318 20 0 EIADMP c1ccc(-c2cccc(CNC[C@@H]3CC[N@H+]3C3CCCCC3)c2)nc1 ZINC001203155726 1022383695 /nfs/dbraw/zinc/38/36/95/1022383695.db2.gz FNZMVOPYFPDOPP-NRFANRHFSA-N 2 1 335.495 4.245 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)c2cccnc2)cc1 ZINC000106471285 1022444647 /nfs/dbraw/zinc/44/46/47/1022444647.db2.gz GMGPZPXXWMAGSU-QFIPXVFZSA-N 2 1 349.453 4.162 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000236810899 1022493194 /nfs/dbraw/zinc/49/31/94/1022493194.db2.gz IQOGODFYSFVAJN-MRXNPFEDSA-N 2 1 330.447 4.216 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000236810899 1022493207 /nfs/dbraw/zinc/49/32/07/1022493207.db2.gz IQOGODFYSFVAJN-MRXNPFEDSA-N 2 1 330.447 4.216 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)[C@H]2CCN(C)C[C@H]2C)cc1OCC ZINC000580801446 1022511548 /nfs/dbraw/zinc/51/15/48/1022511548.db2.gz JFPYGVJEIBKKAX-MJGOQNOKSA-N 2 1 348.531 4.036 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@H]2C)cc1OCC ZINC000580801446 1022511572 /nfs/dbraw/zinc/51/15/72/1022511572.db2.gz JFPYGVJEIBKKAX-MJGOQNOKSA-N 2 1 348.531 4.036 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@H]2C)cc1OCC ZINC000580801446 1022511581 /nfs/dbraw/zinc/51/15/81/1022511581.db2.gz JFPYGVJEIBKKAX-MJGOQNOKSA-N 2 1 348.531 4.036 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC000414341051 1022637824 /nfs/dbraw/zinc/63/78/24/1022637824.db2.gz UVOJFHIYIOSJRB-RXVVDRJESA-N 2 1 337.511 4.002 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2cccnc2)CC[N@H+]1Cc1ccccc1 ZINC000414341051 1022637844 /nfs/dbraw/zinc/63/78/44/1022637844.db2.gz UVOJFHIYIOSJRB-RXVVDRJESA-N 2 1 337.511 4.002 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1C ZINC000580945762 1022735416 /nfs/dbraw/zinc/73/54/16/1022735416.db2.gz ZVIQVSWXRBGARS-PXNSSMCTSA-N 2 1 344.524 4.238 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ccc1C ZINC000580945762 1022735433 /nfs/dbraw/zinc/73/54/33/1022735433.db2.gz ZVIQVSWXRBGARS-PXNSSMCTSA-N 2 1 344.524 4.238 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H](Cc2ccccc2)C2CC2)C[C@H]1c1ccccc1 ZINC000580955654 1022747444 /nfs/dbraw/zinc/74/74/44/1022747444.db2.gz KVEMPZPDJUATCX-ZRBLBEILSA-N 2 1 334.507 4.433 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H](Cc2ccccc2)C2CC2)C[C@H]1c1ccccc1 ZINC000580955654 1022747460 /nfs/dbraw/zinc/74/74/60/1022747460.db2.gz KVEMPZPDJUATCX-ZRBLBEILSA-N 2 1 334.507 4.433 20 0 EIADMP c1nc(-c2ccccc2)sc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647542783 1022780674 /nfs/dbraw/zinc/78/06/74/1022780674.db2.gz BSWGVIFTIVTDTG-ROUUACIJSA-N 2 1 341.524 4.022 20 0 EIADMP Clc1cccc2c1SCC[C@H]2[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000423194258 1022811867 /nfs/dbraw/zinc/81/18/67/1022811867.db2.gz YSEHAZBGTHJFDX-QGZVFWFLSA-N 2 1 347.915 4.041 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000311066157 1022864431 /nfs/dbraw/zinc/86/44/31/1022864431.db2.gz YDGHYKQIIYHNNI-GCJKJVERSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000178158839 1023061625 /nfs/dbraw/zinc/06/16/25/1023061625.db2.gz NPHJKQROAITBMN-YUXAGFNASA-N 2 1 334.507 4.423 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)[C@@H]1C[C@H]1c1cccs1 ZINC000417302018 1023248045 /nfs/dbraw/zinc/24/80/45/1023248045.db2.gz QJLJUFDNKBTTNM-LSTHTHJFSA-N 2 1 340.536 4.494 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H]2COCc4ccccc42)C3)cc1 ZINC000417364538 1023290064 /nfs/dbraw/zinc/29/00/64/1023290064.db2.gz MXFOBAADCNYXOC-QXUYBEEESA-N 2 1 348.490 4.043 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H]2COCc4ccccc42)C3)cc1 ZINC000417364538 1023290080 /nfs/dbraw/zinc/29/00/80/1023290080.db2.gz MXFOBAADCNYXOC-QXUYBEEESA-N 2 1 348.490 4.043 20 0 EIADMP C[C@@H]1CC(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C[C@@H](C)O1 ZINC000581501309 1023309371 /nfs/dbraw/zinc/30/93/71/1023309371.db2.gz QXPKIEPNPLZKIS-JPAWQOSXSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]1CC(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C[C@@H](C)O1 ZINC000581501309 1023309376 /nfs/dbraw/zinc/30/93/76/1023309376.db2.gz QXPKIEPNPLZKIS-JPAWQOSXSA-N 2 1 344.543 4.223 20 0 EIADMP COc1cccc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1Cl ZINC000660256990 1023392313 /nfs/dbraw/zinc/39/23/13/1023392313.db2.gz PJCOXNNWJCHXKI-GDBMZVCRSA-N 2 1 336.907 4.091 20 0 EIADMP COc1cccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1Cl ZINC000660256990 1023392318 /nfs/dbraw/zinc/39/23/18/1023392318.db2.gz PJCOXNNWJCHXKI-GDBMZVCRSA-N 2 1 336.907 4.091 20 0 EIADMP C[C@H](NCc1nsc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000660258047 1023393786 /nfs/dbraw/zinc/39/37/86/1023393786.db2.gz YVVYQIVNLLVQSE-GJZGRUSLSA-N 2 1 329.513 4.039 20 0 EIADMP C[C@@H]([NH3+])[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000415014149 1023395318 /nfs/dbraw/zinc/39/53/18/1023395318.db2.gz LMDKTYVZBLAIPK-GHMZBOCLSA-N 2 1 339.302 4.003 20 0 EIADMP Cc1noc(C)c1[C@H](C)[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000925616296 1023402121 /nfs/dbraw/zinc/40/21/21/1023402121.db2.gz QQAZWZJTCFSUSS-FTRWYGJKSA-N 2 1 341.499 4.243 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CCCC[C@H]3[C@H]3CC[NH2+]C3)s2)cc1 ZINC000415038595 1023404126 /nfs/dbraw/zinc/40/41/26/1023404126.db2.gz IABAIWHEXITKRM-HKUYNNGSSA-N 2 1 341.524 4.083 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC(N[C@@H](CCC[NH3+])c2ccccc2)CC1 ZINC000415052860 1023409386 /nfs/dbraw/zinc/40/93/86/1023409386.db2.gz LVQOOQNRRYKSRT-BVYCBKJFSA-N 2 1 343.559 4.099 20 0 EIADMP [NH3+]CCC[C@H]([NH2+][C@H](CCc1ccccc1)C(F)F)c1ccccc1 ZINC000415052413 1023409891 /nfs/dbraw/zinc/40/98/91/1023409891.db2.gz LDNRUHHXNRPNNK-RBUKOAKNSA-N 2 1 332.438 4.323 20 0 EIADMP CSc1cc(C)ccc1C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415085919 1023434398 /nfs/dbraw/zinc/43/43/98/1023434398.db2.gz RABQSZALTJMZBW-RTBURBONSA-N 2 1 326.509 4.300 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cccc(OC(F)F)c1 ZINC000119864855 1023440113 /nfs/dbraw/zinc/44/01/13/1023440113.db2.gz PDMOGTDOQRVIKY-ZDUSSCGKSA-N 2 1 326.431 4.202 20 0 EIADMP c1sc(C[N@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)nc1-c1ccccc1 ZINC000656784833 1023531225 /nfs/dbraw/zinc/53/12/25/1023531225.db2.gz HSQOAODBBXUUGG-SFHVURJKSA-N 2 1 341.524 4.022 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(OCCC(C)C)cc1 ZINC000236785107 1023718142 /nfs/dbraw/zinc/71/81/42/1023718142.db2.gz DGLBSLBXVKITFS-KRWDZBQOSA-N 2 1 329.488 4.042 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cncs1 ZINC000164179167 1023783041 /nfs/dbraw/zinc/78/30/41/1023783041.db2.gz ZUXDWNZAYBFXOM-MRXNPFEDSA-N 2 1 329.513 4.370 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCc1c[nH+]cn1C ZINC000276652282 1023814073 /nfs/dbraw/zinc/81/40/73/1023814073.db2.gz MPENAYHEXOACKO-AWEZNQCLSA-N 2 1 340.496 4.054 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000500420901 1023815156 /nfs/dbraw/zinc/81/51/56/1023815156.db2.gz LYNUFAJNEXCBOS-SFKKXYGYSA-N 2 1 340.433 4.430 20 0 EIADMP Fc1ccc(/C=C/C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000511784740 1023881515 /nfs/dbraw/zinc/88/15/15/1023881515.db2.gz HTRSVHHRMMMBJK-ZLHKHBAESA-N 2 1 342.433 4.090 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000341582814 1023890013 /nfs/dbraw/zinc/89/00/13/1023890013.db2.gz HCILQLPAJYRMEP-MRXNPFEDSA-N 2 1 325.378 4.255 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CO2 ZINC000581962208 1023937071 /nfs/dbraw/zinc/93/70/71/1023937071.db2.gz PLZIPDQNBSZQFV-KEZQHZCBSA-N 2 1 348.490 4.214 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3Cc1ccccc1)CO2 ZINC000581962208 1023937092 /nfs/dbraw/zinc/93/70/92/1023937092.db2.gz PLZIPDQNBSZQFV-KEZQHZCBSA-N 2 1 348.490 4.214 20 0 EIADMP CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000430718148 1023977191 /nfs/dbraw/zinc/97/71/91/1023977191.db2.gz CFGUGCOAVKURKM-CDHQVMDDSA-N 2 1 347.547 4.308 20 0 EIADMP C[C@H](c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)cc1)C(F)(F)F ZINC000660661337 1024004775 /nfs/dbraw/zinc/00/47/75/1024004775.db2.gz CHIBTHAKEVSHST-QAPCUYQASA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[N@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)cc1)C(F)(F)F ZINC000660661337 1024004794 /nfs/dbraw/zinc/00/47/94/1024004794.db2.gz CHIBTHAKEVSHST-QAPCUYQASA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CCC[C@@]3(CC[N@H+](C)C3)C2)cc1)C(F)(F)F ZINC000660661337 1024004813 /nfs/dbraw/zinc/00/48/13/1024004813.db2.gz CHIBTHAKEVSHST-QAPCUYQASA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CCC[C@@]3(CC[N@@H+](C)C3)C2)cc1)C(F)(F)F ZINC000660661337 1024004844 /nfs/dbraw/zinc/00/48/44/1024004844.db2.gz CHIBTHAKEVSHST-QAPCUYQASA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cc3cnccc3o2)CC[N@@H+]1Cc1ccccc1 ZINC000651637990 1024062172 /nfs/dbraw/zinc/06/21/72/1024062172.db2.gz HEEBYAABMNNZDA-XLIONFOSSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cc3cnccc3o2)CC[N@H+]1Cc1ccccc1 ZINC000651637990 1024062190 /nfs/dbraw/zinc/06/21/90/1024062190.db2.gz HEEBYAABMNNZDA-XLIONFOSSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cc3cnccc3o2)CC[NH+]1Cc1ccccc1 ZINC000651637990 1024062212 /nfs/dbraw/zinc/06/22/12/1024062212.db2.gz HEEBYAABMNNZDA-XLIONFOSSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cc3cnccc3o2)CC[NH+]1Cc1ccccc1 ZINC000651637990 1024062230 /nfs/dbraw/zinc/06/22/30/1024062230.db2.gz HEEBYAABMNNZDA-XLIONFOSSA-N 2 1 349.478 4.313 20 0 EIADMP Fc1ccccc1Oc1cccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000651864450 1024116064 /nfs/dbraw/zinc/11/60/64/1024116064.db2.gz UKNSQBRUIZTJEY-ROUUACIJSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1ccccc1Oc1cccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000651864450 1024116087 /nfs/dbraw/zinc/11/60/87/1024116087.db2.gz UKNSQBRUIZTJEY-ROUUACIJSA-N 2 1 340.442 4.334 20 0 EIADMP c1ccc2sc([C@H]3CCC[N@@H+](CCC[NH+]4CCCCC4)C3)nc2c1 ZINC000548394683 1024188351 /nfs/dbraw/zinc/18/83/51/1024188351.db2.gz DBQZRZCUYRYZQH-KRWDZBQOSA-N 2 1 343.540 4.352 20 0 EIADMP c1ccc2sc([C@H]3CCC[N@H+](CCC[NH+]4CCCCC4)C3)nc2c1 ZINC000548394683 1024188380 /nfs/dbraw/zinc/18/83/80/1024188380.db2.gz DBQZRZCUYRYZQH-KRWDZBQOSA-N 2 1 343.540 4.352 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510671959 1024209270 /nfs/dbraw/zinc/20/92/70/1024209270.db2.gz ROOZVPMIOSWFJY-RDJZCZTQSA-N 2 1 342.449 4.348 20 0 EIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1Cl ZINC000401781550 1024269281 /nfs/dbraw/zinc/26/92/81/1024269281.db2.gz QMBMTLCLNWJDFH-VIFPVBQESA-N 2 1 332.662 4.274 20 0 EIADMP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1cc2cnccc2o1 ZINC000651731090 1024280627 /nfs/dbraw/zinc/28/06/27/1024280627.db2.gz GAHVVLHOYRHHRS-IAGOWNOFSA-N 2 1 349.478 4.074 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CC[C@@H]3C3CCC3)CC2)cs1 ZINC000510716706 1024302269 /nfs/dbraw/zinc/30/22/69/1024302269.db2.gz FPMVBCLEEMOXKI-MOPGFXCFSA-N 2 1 347.572 4.086 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CC[C@H]3C3CCC3)CC2)cs1 ZINC000510716710 1024303933 /nfs/dbraw/zinc/30/39/33/1024303933.db2.gz FPMVBCLEEMOXKI-OALUTQOASA-N 2 1 347.572 4.086 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)CCCOc2ccc(Cl)c(C)c2)CC1 ZINC000510730618 1024361381 /nfs/dbraw/zinc/36/13/81/1024361381.db2.gz FXKANKUPYPGKSS-INIZCTEOSA-N 2 1 338.923 4.270 20 0 EIADMP Clc1ccc2c(c1)OCCC[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000341758602 1024616253 /nfs/dbraw/zinc/61/62/53/1024616253.db2.gz BQQXREDGYBKZCX-GOSISDBHSA-N 2 1 334.891 4.018 20 0 EIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347860 1024688844 /nfs/dbraw/zinc/68/88/44/1024688844.db2.gz NGVKBXAPAJGLOC-KANFNMMFSA-N 2 1 336.907 4.009 20 0 EIADMP C[C@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000511909681 1024745029 /nfs/dbraw/zinc/74/50/29/1024745029.db2.gz FRJMJEVRSDFNCZ-VEVDHJHJSA-N 2 1 334.454 4.221 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](COCc1ccccc1)c1ccccc1 ZINC000341855468 1024826790 /nfs/dbraw/zinc/82/67/90/1024826790.db2.gz WISLMOIQYMHMDK-QFIPXVFZSA-N 2 1 349.478 4.129 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)Cc1c(Cl)cccc1Cl ZINC000510927673 1024834291 /nfs/dbraw/zinc/83/42/91/1024834291.db2.gz GRUKPUQMIIYGBS-GFCCVEGCSA-N 2 1 326.271 4.109 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCC1 ZINC000342026979 1025041499 /nfs/dbraw/zinc/04/14/99/1025041499.db2.gz WIEPQODTCTYBSD-KRWDZBQOSA-N 2 1 337.389 4.341 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H](C)c3cccs3)CC2)cs1 ZINC000161772795 1025072896 /nfs/dbraw/zinc/07/28/96/1025072896.db2.gz RYWFMTDBTZTQJR-CQSZACIVSA-N 2 1 349.569 4.330 20 0 EIADMP c1csc(-c2ncc(C[NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)s2)c1 ZINC000663346178 1025142484 /nfs/dbraw/zinc/14/24/84/1025142484.db2.gz QBQUUSNZEAKNDB-HNNXBMFYSA-N 2 1 347.553 4.083 20 0 EIADMP c1csc(-c2ncc(C[NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)s2)c1 ZINC000663346178 1025142502 /nfs/dbraw/zinc/14/25/02/1025142502.db2.gz QBQUUSNZEAKNDB-HNNXBMFYSA-N 2 1 347.553 4.083 20 0 EIADMP FC(F)(F)C1CCC(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)CC1 ZINC000663346948 1025143644 /nfs/dbraw/zinc/14/36/44/1025143644.db2.gz YKKGRYCBZUZCRM-ARWYELJZSA-N 2 1 332.454 4.067 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@@H](CCC(C)C)C3CC3)CCCC2)CC1 ZINC000549610226 1025313325 /nfs/dbraw/zinc/31/33/25/1025313325.db2.gz DEOWQHPMIXQGTD-FQEVSTJZSA-N 2 1 336.564 4.214 20 0 EIADMP C[C@@H](Cc1coc2ccccc12)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663466261 1025390886 /nfs/dbraw/zinc/39/08/86/1025390886.db2.gz QDVIOSJHQTXFLR-WMZOPIPTSA-N 2 1 326.484 4.075 20 0 EIADMP Clc1cccc(C2CC([NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)C2)c1 ZINC000663466628 1025398987 /nfs/dbraw/zinc/39/89/87/1025398987.db2.gz WDABFGAASSKFTG-PPDQVPDSSA-N 2 1 332.919 4.298 20 0 EIADMP c1cncc([C@@H]([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)C2CCCCC2)c1 ZINC000663467017 1025402639 /nfs/dbraw/zinc/40/26/39/1025402639.db2.gz YZWZURYEBFPYEW-KNQAVFIVSA-N 2 1 341.543 4.415 20 0 EIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663470228 1025411690 /nfs/dbraw/zinc/41/16/90/1025411690.db2.gz TWWIHJDOQUGEGP-PBHICJAKSA-N 2 1 335.561 4.348 20 0 EIADMP C[C@H]1C[C@H](NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469481 1025417408 /nfs/dbraw/zinc/41/74/08/1025417408.db2.gz PRZWXLCTGPLFCM-QRTARXTBSA-N 2 1 336.570 4.385 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469481 1025417417 /nfs/dbraw/zinc/41/74/17/1025417417.db2.gz PRZWXLCTGPLFCM-QRTARXTBSA-N 2 1 336.570 4.385 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c2ccsc2S1 ZINC000663469481 1025417438 /nfs/dbraw/zinc/41/74/38/1025417438.db2.gz PRZWXLCTGPLFCM-QRTARXTBSA-N 2 1 336.570 4.385 20 0 EIADMP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000563135561 1025517045 /nfs/dbraw/zinc/51/70/45/1025517045.db2.gz QKRSOJGTBDAWRS-ZJUUUORDSA-N 2 1 344.311 4.332 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2occc2c1 ZINC000511995493 1025596518 /nfs/dbraw/zinc/59/65/18/1025596518.db2.gz ABNDZKZARBUYFV-UWJYYQICSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2occc2c1 ZINC000511995491 1025599765 /nfs/dbraw/zinc/59/97/65/1025599765.db2.gz ABNDZKZARBUYFV-LAUBAEHRSA-N 2 1 334.463 4.433 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+]1Cc2cccc(Br)c2C1 ZINC001167827253 1025638733 /nfs/dbraw/zinc/63/87/33/1025638733.db2.gz VHHUXKZHDDODNW-AWEZNQCLSA-N 2 1 339.321 4.275 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1Cc2cccc(Br)c2C1 ZINC001167827253 1025638747 /nfs/dbraw/zinc/63/87/47/1025638747.db2.gz VHHUXKZHDDODNW-AWEZNQCLSA-N 2 1 339.321 4.275 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCc3[nH+]ccn3C1)CCCS2 ZINC000278933308 1025725977 /nfs/dbraw/zinc/72/59/77/1025725977.db2.gz JKFFDRZDYKGTDT-XJKSGUPXSA-N 2 1 347.915 4.316 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](Cc1ccccc1F)c1ccccc1 ZINC000511035457 1025760606 /nfs/dbraw/zinc/76/06/06/1025760606.db2.gz DSFQRFWIFBUIGX-OAQYLSRUSA-N 2 1 337.442 4.294 20 0 EIADMP C[N@@H+](CCc1cccc(Cl)c1Cl)CC[C@H]1CCCC[NH+]1C ZINC001167509506 1025815056 /nfs/dbraw/zinc/81/50/56/1025815056.db2.gz OHWLKPOWKDPJSF-OAHLLOKOSA-N 2 1 329.315 4.342 20 0 EIADMP C[N@H+](CCc1cccc(Cl)c1Cl)CC[C@H]1CCCC[NH+]1C ZINC001167509506 1025815059 /nfs/dbraw/zinc/81/50/59/1025815059.db2.gz OHWLKPOWKDPJSF-OAHLLOKOSA-N 2 1 329.315 4.342 20 0 EIADMP C[NH+](CCc1cccc(Cl)c1Cl)CC[C@H]1CCCC[N@@H+]1C ZINC001167509506 1025815066 /nfs/dbraw/zinc/81/50/66/1025815066.db2.gz OHWLKPOWKDPJSF-OAHLLOKOSA-N 2 1 329.315 4.342 20 0 EIADMP C[NH+](CCc1cccc(Cl)c1Cl)CC[C@H]1CCCC[N@H+]1C ZINC001167509506 1025815074 /nfs/dbraw/zinc/81/50/74/1025815074.db2.gz OHWLKPOWKDPJSF-OAHLLOKOSA-N 2 1 329.315 4.342 20 0 EIADMP CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)[C@H](C)CCC[NH+](CC)CC ZINC001167835293 1025836495 /nfs/dbraw/zinc/83/64/95/1025836495.db2.gz RBOJGSXQGMSUTF-UYAOXDASSA-N 2 1 332.532 4.480 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000390891448 1025837976 /nfs/dbraw/zinc/83/79/76/1025837976.db2.gz ZJWWJSKSEMXASF-ZWKOTPCHSA-N 2 1 336.470 4.312 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000390891448 1025837981 /nfs/dbraw/zinc/83/79/81/1025837981.db2.gz ZJWWJSKSEMXASF-ZWKOTPCHSA-N 2 1 336.470 4.312 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2cccc(SC(F)(F)F)c2)CC1 ZINC000759965917 1025845823 /nfs/dbraw/zinc/84/58/23/1025845823.db2.gz KAYRWUZBFULUHW-AWEZNQCLSA-N 2 1 332.435 4.215 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2cccc(SC(F)(F)F)c2)CC1 ZINC000759965917 1025845825 /nfs/dbraw/zinc/84/58/25/1025845825.db2.gz KAYRWUZBFULUHW-AWEZNQCLSA-N 2 1 332.435 4.215 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc(OC(F)F)cc1 ZINC000319773490 1025859364 /nfs/dbraw/zinc/85/93/64/1025859364.db2.gz FKIHICHZNXZGPQ-GJZGRUSLSA-N 2 1 326.431 4.203 20 0 EIADMP COc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)cc1 ZINC001167967032 1025863730 /nfs/dbraw/zinc/86/37/30/1025863730.db2.gz AGYCZDFQRQWZMC-GFSYIJCISA-N 2 1 340.511 4.141 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+]CC2(c3cccs3)CCCCC2)s1 ZINC000512065768 1025871161 /nfs/dbraw/zinc/87/11/61/1025871161.db2.gz AVFGHRUSXMRXHE-UHFFFAOYSA-N 2 1 349.569 4.258 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](Cc1cc(C)no1)Cc1ccccc1 ZINC001167841998 1025893186 /nfs/dbraw/zinc/89/31/86/1025893186.db2.gz VNSWKQRDVBZVTP-IBGZPJMESA-N 2 1 343.515 4.496 20 0 EIADMP CCSc1cc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)ccn1 ZINC000187799789 1025897225 /nfs/dbraw/zinc/89/72/25/1025897225.db2.gz DIPZVNKTNMYJEV-UHFFFAOYSA-N 2 1 333.545 4.080 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H](CC2CCC2)c2ccccc2)CCCO1 ZINC000432421194 1025902808 /nfs/dbraw/zinc/90/28/08/1025902808.db2.gz OKJFVISBYQILHB-NQIIRXRSSA-N 2 1 330.516 4.008 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C1(C)C ZINC000344066015 1025953784 /nfs/dbraw/zinc/95/37/84/1025953784.db2.gz DPOAMVDZCSKLEK-ZOCIIQOWSA-N 2 1 327.472 4.035 20 0 EIADMP Fc1cccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CCC2)c1 ZINC001167975250 1026236813 /nfs/dbraw/zinc/23/68/13/1026236813.db2.gz MYXHHHRAVJUBLC-IHWFROFDSA-N 2 1 328.475 4.200 20 0 EIADMP c1[nH+]c(C2CC[NH+](CCOC3CCCCCC3)CC2)n2c1CCCC2 ZINC000434690907 1026336122 /nfs/dbraw/zinc/33/61/22/1026336122.db2.gz LIPDDWCWXJEAAQ-UHFFFAOYSA-N 2 1 345.531 4.138 20 0 EIADMP COc1ccccc1[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C1CC1 ZINC001167978515 1026346442 /nfs/dbraw/zinc/34/64/42/1026346442.db2.gz NXWHZVOACNHSOT-MFXLTOHQSA-N 2 1 340.511 4.141 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1cccc(OC)c1 ZINC000163464898 1026372520 /nfs/dbraw/zinc/37/25/20/1026372520.db2.gz LMBCVWJHHZFTME-HXUWFJFHSA-N 2 1 339.483 4.108 20 0 EIADMP CCOc1ccc([C@@H](CC)[NH2+]C2CC[NH+](C3CC3)CC2)cc1OCC ZINC000119718942 1026395911 /nfs/dbraw/zinc/39/59/11/1026395911.db2.gz XQMQZGBHOMWVNE-LJQANCHMSA-N 2 1 346.515 4.152 20 0 EIADMP c1cc2c(cc[nH+]c2N2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)[nH]1 ZINC000663753217 1026401088 /nfs/dbraw/zinc/40/10/88/1026401088.db2.gz DZVGKVYGLNXVJA-UHFFFAOYSA-N 2 1 346.478 4.055 20 0 EIADMP c1cc2cccc(C[NH+]3CCC(c4[nH+]cc5n4CCCC5)CC3)c2[nH]1 ZINC000279452695 1026436746 /nfs/dbraw/zinc/43/67/46/1026436746.db2.gz QJDMZXVYUYZPCM-UHFFFAOYSA-N 2 1 334.467 4.080 20 0 EIADMP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)cs2)cs1 ZINC000152425120 1026544151 /nfs/dbraw/zinc/54/41/51/1026544151.db2.gz JGYSWIYSQSFGFW-JSGCOSHPSA-N 2 1 347.553 4.315 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]CC(Cc2ccccc2)Cc2ccccc2)C1 ZINC000582457712 1026666808 /nfs/dbraw/zinc/66/68/08/1026666808.db2.gz BHZWWKYVCGKOFB-QFIPXVFZSA-N 2 1 336.523 4.019 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(c2ccnc3ccccc32)CC1 ZINC000563361629 1026668216 /nfs/dbraw/zinc/66/82/16/1026668216.db2.gz NFENYKNYZVPLFB-IBGZPJMESA-N 2 1 337.511 4.289 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148321 1026750406 /nfs/dbraw/zinc/75/04/06/1026750406.db2.gz XOKFCLNKPINFAN-FUHWJXTLSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148321 1026750410 /nfs/dbraw/zinc/75/04/10/1026750410.db2.gz XOKFCLNKPINFAN-FUHWJXTLSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148321 1026750417 /nfs/dbraw/zinc/75/04/17/1026750417.db2.gz XOKFCLNKPINFAN-FUHWJXTLSA-N 2 1 340.433 4.369 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+][C@@H](c4cccnc4)C4CC4)[C@H]3C2)cc1 ZINC000507463486 1026804315 /nfs/dbraw/zinc/80/43/15/1026804315.db2.gz UCGSBTBJCOGUAY-CWBXHPNXSA-N 2 1 347.506 4.033 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)[C@@H]1CCCOC1 ZINC000507511130 1026822079 /nfs/dbraw/zinc/82/20/79/1026822079.db2.gz NXBRGJSJWCKNGF-GHTZIAJQSA-N 2 1 344.543 4.356 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000684953664 1026889104 /nfs/dbraw/zinc/88/91/04/1026889104.db2.gz QQSJSTXCMJWDET-PGRDOPGGSA-N 2 1 349.522 4.481 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCc3cccnc32)cc1 ZINC000684957073 1026891971 /nfs/dbraw/zinc/89/19/71/1026891971.db2.gz GMXLGSURGLUMEO-MGPUTAFESA-N 2 1 332.451 4.304 20 0 EIADMP CCO[C@@H](CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000582664322 1026916115 /nfs/dbraw/zinc/91/61/15/1026916115.db2.gz FDQUZWJIMDBVBR-SFTDATJTSA-N 2 1 344.543 4.224 20 0 EIADMP CCO[C@@H](CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)C ZINC000582664322 1026916122 /nfs/dbraw/zinc/91/61/22/1026916122.db2.gz FDQUZWJIMDBVBR-SFTDATJTSA-N 2 1 344.543 4.224 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCOc2c(C)cc(C)cc21 ZINC000164684430 1027087791 /nfs/dbraw/zinc/08/77/91/1027087791.db2.gz FAKOLYNFZJUILM-LJQANCHMSA-N 2 1 327.472 4.092 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000474477200 1027110711 /nfs/dbraw/zinc/11/07/11/1027110711.db2.gz RCBBSSSKCCLRQH-QRVBRYPASA-N 2 1 332.532 4.431 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CC(C)(C)[NH+]2CCCCC2)cc1OC ZINC000474482840 1027116147 /nfs/dbraw/zinc/11/61/47/1027116147.db2.gz PKNQAJBWAPLRNZ-SJORKVTESA-N 2 1 348.531 4.050 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000164707697 1027162253 /nfs/dbraw/zinc/16/22/53/1027162253.db2.gz AOQZLLYWLKNWNG-ZDUSSCGKSA-N 2 1 341.377 4.221 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccccn1)Cc1ccccc1C ZINC000582788513 1027332554 /nfs/dbraw/zinc/33/25/54/1027332554.db2.gz IJDRFJRORYYWHT-UHFFFAOYSA-N 2 1 348.494 4.378 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccccn1)Cc1ccccc1C ZINC000582788513 1027332575 /nfs/dbraw/zinc/33/25/75/1027332575.db2.gz IJDRFJRORYYWHT-UHFFFAOYSA-N 2 1 348.494 4.378 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC000342860984 1027334220 /nfs/dbraw/zinc/33/42/20/1027334220.db2.gz TZGYBCCRRXHIEC-UHFFFAOYSA-N 2 1 333.426 4.305 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC000342860984 1027334234 /nfs/dbraw/zinc/33/42/34/1027334234.db2.gz TZGYBCCRRXHIEC-UHFFFAOYSA-N 2 1 333.426 4.305 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000261663809 1027342936 /nfs/dbraw/zinc/34/29/36/1027342936.db2.gz GNPNKYVHNWTVHR-ZDUSSCGKSA-N 2 1 326.406 4.230 20 0 EIADMP C[C@H]1CC([N@H+](C)Cc2cccc(O)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040511 1027399823 /nfs/dbraw/zinc/39/98/23/1027399823.db2.gz NQYKMRXBJAHTJJ-ROUUACIJSA-N 2 1 338.495 4.266 20 0 EIADMP C[C@H]1CC([N@@H+](C)Cc2cccc(O)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040511 1027399843 /nfs/dbraw/zinc/39/98/43/1027399843.db2.gz NQYKMRXBJAHTJJ-ROUUACIJSA-N 2 1 338.495 4.266 20 0 EIADMP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]C1CC[NH+](CCc2ccncc2)CC1 ZINC000153468677 1027478270 /nfs/dbraw/zinc/47/82/70/1027478270.db2.gz PQMQJKDGTHNLGA-GCJKJVERSA-N 2 1 349.522 4.235 20 0 EIADMP Clc1ccc(CCC[N@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)cc1 ZINC000441410723 1027528140 /nfs/dbraw/zinc/52/81/40/1027528140.db2.gz LTMXLAKPEYUKPX-XLIONFOSSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441410723 1027528157 /nfs/dbraw/zinc/52/81/57/1027528157.db2.gz LTMXLAKPEYUKPX-XLIONFOSSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441410723 1027528174 /nfs/dbraw/zinc/52/81/74/1027528174.db2.gz LTMXLAKPEYUKPX-XLIONFOSSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000441410723 1027528191 /nfs/dbraw/zinc/52/81/91/1027528191.db2.gz LTMXLAKPEYUKPX-XLIONFOSSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000441410723 1027528205 /nfs/dbraw/zinc/52/82/05/1027528205.db2.gz LTMXLAKPEYUKPX-XLIONFOSSA-N 2 1 332.919 4.221 20 0 EIADMP CC(C)OC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000090771944 1027583840 /nfs/dbraw/zinc/58/38/40/1027583840.db2.gz BGLCSXKHDHRJOE-YOLZPYMBSA-N 2 1 344.543 4.365 20 0 EIADMP CC(C)OC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000090771944 1027583854 /nfs/dbraw/zinc/58/38/54/1027583854.db2.gz BGLCSXKHDHRJOE-YOLZPYMBSA-N 2 1 344.543 4.365 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1OC ZINC000161644856 1027658959 /nfs/dbraw/zinc/65/89/59/1027658959.db2.gz OOXBZTWUIMARJD-QXAKKESOSA-N 2 1 346.515 4.152 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(SC(F)F)cc1 ZINC000178706737 1027679369 /nfs/dbraw/zinc/67/93/69/1027679369.db2.gz MZRNSDINBRDMDL-STQMWFEESA-N 2 1 339.455 4.493 20 0 EIADMP CC(C)[C@@H](C[NH2+]CC1([NH+]2CCCCC2)CCOCC1)c1ccccc1 ZINC000474893267 1027743273 /nfs/dbraw/zinc/74/32/73/1027743273.db2.gz XAMDXSLIQFLAIK-OAQYLSRUSA-N 2 1 344.543 4.051 20 0 EIADMP COc1ccc([C@@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995748 1027807783 /nfs/dbraw/zinc/80/77/83/1027807783.db2.gz PORMFVUPRTVAIQ-CZJMCEMMSA-N 2 1 340.511 4.238 20 0 EIADMP COc1ccc([C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167995748 1027807788 /nfs/dbraw/zinc/80/77/88/1027807788.db2.gz PORMFVUPRTVAIQ-CZJMCEMMSA-N 2 1 340.511 4.238 20 0 EIADMP COc1ccc([C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167995748 1027807793 /nfs/dbraw/zinc/80/77/93/1027807793.db2.gz PORMFVUPRTVAIQ-CZJMCEMMSA-N 2 1 340.511 4.238 20 0 EIADMP FC(F)(F)c1cccc([C@@H]2CC[N@@H+](CCC[NH+]3CCCCC3)C2)c1 ZINC000444608399 1027888374 /nfs/dbraw/zinc/88/83/74/1027888374.db2.gz KZMSAEGABOJFSG-QGZVFWFLSA-N 2 1 340.433 4.371 20 0 EIADMP C[C@@H](Cc1ccco1)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000796682290 1027979299 /nfs/dbraw/zinc/97/92/99/1027979299.db2.gz IDVIPCINMNUIFJ-KKXNLOMOSA-N 2 1 326.484 4.243 20 0 EIADMP c1ccc2c(c1)cccc2OCCC[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000523556991 1028210743 /nfs/dbraw/zinc/21/07/43/1028210743.db2.gz XFYDAWBKHMEDBN-IBGZPJMESA-N 2 1 338.495 4.026 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC000346143613 1028278432 /nfs/dbraw/zinc/27/84/32/1028278432.db2.gz DVCWYVKNDOLQGY-FQEVSTJZSA-N 2 1 346.478 4.345 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+][C@H](c2ccc(F)cc2)c2ccccn2)c1 ZINC000346488182 1028468243 /nfs/dbraw/zinc/46/82/43/1028468243.db2.gz PLPMSIUFSXKFQK-JOCHJYFZSA-N 2 1 349.453 4.162 20 0 EIADMP Brc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCC2 ZINC000092721003 1028608726 /nfs/dbraw/zinc/60/87/26/1028608726.db2.gz BIMVEASNHMQSME-SFHVURJKSA-N 2 1 349.316 4.043 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cn1 ZINC000156224726 1028677620 /nfs/dbraw/zinc/67/76/20/1028677620.db2.gz OCGRJJPCOSEXHQ-MSOLQXFVSA-N 2 1 328.504 4.025 20 0 EIADMP CC(C)n1cc([C@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)cn1 ZINC000156224726 1028677636 /nfs/dbraw/zinc/67/76/36/1028677636.db2.gz OCGRJJPCOSEXHQ-MSOLQXFVSA-N 2 1 328.504 4.025 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc3cccnc32)CC[N@@H+]1Cc1ccccc1 ZINC000080338940 1028717695 /nfs/dbraw/zinc/71/76/95/1028717695.db2.gz IGFJWDKCVHPEHE-AVRDEDQJSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc3cccnc32)CC[N@H+]1Cc1ccccc1 ZINC000080338940 1028717714 /nfs/dbraw/zinc/71/77/14/1028717714.db2.gz IGFJWDKCVHPEHE-AVRDEDQJSA-N 2 1 345.490 4.378 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH+]3CCC[C@@H](C(C)(C)C)C3)sc2C1 ZINC000475634085 1028909721 /nfs/dbraw/zinc/90/97/21/1028909721.db2.gz ZMFQJYUGNJSAOV-OAHLLOKOSA-N 2 1 335.561 4.168 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH+]3CCC[C@@H](C(C)(C)C)C3)sc2C1 ZINC000475634085 1028909751 /nfs/dbraw/zinc/90/97/51/1028909751.db2.gz ZMFQJYUGNJSAOV-OAHLLOKOSA-N 2 1 335.561 4.168 20 0 EIADMP CC(C)[NH+]1CCc2nc(C[N@@H+]3CCC[C@@H](C(C)(C)C)C3)sc2C1 ZINC000475634085 1028909786 /nfs/dbraw/zinc/90/97/86/1028909786.db2.gz ZMFQJYUGNJSAOV-OAHLLOKOSA-N 2 1 335.561 4.168 20 0 EIADMP CC(C)[NH+]1CCc2nc(C[N@H+]3CCC[C@@H](C(C)(C)C)C3)sc2C1 ZINC000475634085 1028909805 /nfs/dbraw/zinc/90/98/05/1028909805.db2.gz ZMFQJYUGNJSAOV-OAHLLOKOSA-N 2 1 335.561 4.168 20 0 EIADMP Cc1nc(C(C)C)oc1CN[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000428430029 1029127069 /nfs/dbraw/zinc/12/70/69/1029127069.db2.gz GUEYEGXSAWATCT-VQIMIIECSA-N 2 1 341.499 4.107 20 0 EIADMP CCC[N@H+]1CC[C@H](CN[C@@H](C)c2nc(-c3ccccc3)cs2)C1 ZINC000151136369 1029144165 /nfs/dbraw/zinc/14/41/65/1029144165.db2.gz QVDJXEVDCKRJMK-JKSUJKDBSA-N 2 1 329.513 4.193 20 0 EIADMP Cc1nc(F)ccc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000278421067 1029180658 /nfs/dbraw/zinc/18/06/58/1029180658.db2.gz QQHLCPAHPMNYGL-INIZCTEOSA-N 2 1 341.474 4.051 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2noc3ccccc32)CC1 ZINC000583822823 1029231826 /nfs/dbraw/zinc/23/18/26/1029231826.db2.gz YCNYOQNTEAKJRV-UHFFFAOYSA-N 2 1 349.478 4.361 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@H](C)c2ncc(-c3ccccc3)o2)CC1 ZINC000524991501 1029385090 /nfs/dbraw/zinc/38/50/90/1029385090.db2.gz ZRVDTETYGCHDMI-QGZVFWFLSA-N 2 1 341.499 4.455 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2cc3cccc(OC)c3o2)CC1 ZINC000192844405 1029441926 /nfs/dbraw/zinc/44/19/26/1029441926.db2.gz BBAPKTVFEVIROQ-OAHLLOKOSA-N 2 1 330.472 4.357 20 0 EIADMP C[C@@H]1[C@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000475278835 1029484841 /nfs/dbraw/zinc/48/48/41/1029484841.db2.gz XFRGCHVCJFGVPL-UZVYXBEXSA-N 2 1 334.507 4.290 20 0 EIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000475291259 1029504011 /nfs/dbraw/zinc/50/40/11/1029504011.db2.gz NRATXTNUWIULCC-QRVBRYPASA-N 2 1 332.557 4.018 20 0 EIADMP C[C@@H]1C[C@@H](NCc2cc(Cl)ccc2OC2CCCC2)CC[N@H+]1C ZINC000525207850 1029513953 /nfs/dbraw/zinc/51/39/53/1029513953.db2.gz RFDBKVYVIQJXKK-PBHICJAKSA-N 2 1 336.907 4.234 20 0 EIADMP C[C@H]1CC([N@@H+](C)CC2CC(F)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168063901 1029617179 /nfs/dbraw/zinc/61/71/79/1029617179.db2.gz NUYPBONUNMUUME-HOTGVXAUSA-N 2 1 336.470 4.405 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2c(C)cc(C)nc2C)cc1 ZINC000639567096 1029642840 /nfs/dbraw/zinc/64/28/40/1029642840.db2.gz IDTJNINYEFXXLB-INIZCTEOSA-N 2 1 334.467 4.352 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2nc(C3CC3)cs2)CC1)CC1CC1 ZINC000343744994 1029742139 /nfs/dbraw/zinc/74/21/39/1029742139.db2.gz VYCTUZJYFUZPHD-UHFFFAOYSA-N 2 1 347.572 4.355 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2nc(C3CC3)cs2)CC1)CC1CC1 ZINC000343744994 1029742151 /nfs/dbraw/zinc/74/21/51/1029742151.db2.gz VYCTUZJYFUZPHD-UHFFFAOYSA-N 2 1 347.572 4.355 20 0 EIADMP C[N@@H+]1CCC[C@H]2CN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)CC[C@H]21 ZINC000301798198 1029810705 /nfs/dbraw/zinc/81/07/05/1029810705.db2.gz QVVGMCNSYLWLPV-SUMWQHHRSA-N 2 1 349.400 4.174 20 0 EIADMP C[N@H+]1CCC[C@H]2CN(c3cc[nH+]c4cc(C(F)(F)F)ccc43)CC[C@H]21 ZINC000301798198 1029810708 /nfs/dbraw/zinc/81/07/08/1029810708.db2.gz QVVGMCNSYLWLPV-SUMWQHHRSA-N 2 1 349.400 4.174 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000091335687 1029884562 /nfs/dbraw/zinc/88/45/62/1029884562.db2.gz FZTJSTWUJDVXQW-CXAGYDPISA-N 2 1 326.406 4.088 20 0 EIADMP C[C@H]([NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)c1ccc(F)cn1 ZINC000092767896 1029949121 /nfs/dbraw/zinc/94/91/21/1029949121.db2.gz VMPIVZNMVKLLBV-ULQDDVLXSA-N 2 1 341.474 4.028 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@H+](CC/C=C/c3ccccc3)C1)CCCC2 ZINC000450788525 1029984387 /nfs/dbraw/zinc/98/43/87/1029984387.db2.gz UKMLICDVMODECS-OEMHODTASA-N 2 1 335.495 4.421 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@@H+](CC/C=C/c3ccccc3)C1)CCCC2 ZINC000450788525 1029984412 /nfs/dbraw/zinc/98/44/12/1029984412.db2.gz UKMLICDVMODECS-OEMHODTASA-N 2 1 335.495 4.421 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447522308 1030118360 /nfs/dbraw/zinc/11/83/60/1030118360.db2.gz QDISWBXQPROLSE-WJMWBRGCSA-N 2 1 338.495 4.386 20 0 EIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCCSCC1 ZINC000657886229 1030205445 /nfs/dbraw/zinc/20/54/45/1030205445.db2.gz DAPARUZNSYJASG-IBGZPJMESA-N 2 1 344.524 4.287 20 0 EIADMP C[C@H](c1ccc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1)C(F)(F)F ZINC000451066192 1030220158 /nfs/dbraw/zinc/22/01/58/1030220158.db2.gz BTWDZOIDUNLJKO-QAPCUYQASA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)cc1)C(F)(F)F ZINC000451066192 1030220178 /nfs/dbraw/zinc/22/01/78/1030220178.db2.gz BTWDZOIDUNLJKO-QAPCUYQASA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1)C(F)(F)F ZINC000451066192 1030220207 /nfs/dbraw/zinc/22/02/07/1030220207.db2.gz BTWDZOIDUNLJKO-QAPCUYQASA-N 2 1 340.433 4.270 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3csc(C(C)C)n3)CC2)[nH+]1 ZINC000186343228 1030280223 /nfs/dbraw/zinc/28/02/23/1030280223.db2.gz PYCGSTQQFYMMOX-HNNXBMFYSA-N 2 1 344.528 4.290 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)Cc3ccc(F)cc3)C2)s1 ZINC000685412421 1030287226 /nfs/dbraw/zinc/28/72/26/1030287226.db2.gz PEEQQOIGVZQJLF-QGZVFWFLSA-N 2 1 332.488 4.150 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)Cc3ccc(F)cc3)C2)s1 ZINC000685412421 1030287246 /nfs/dbraw/zinc/28/72/46/1030287246.db2.gz PEEQQOIGVZQJLF-QGZVFWFLSA-N 2 1 332.488 4.150 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)Cc3ccc(F)cc3)C2)s1 ZINC000685412421 1030287260 /nfs/dbraw/zinc/28/72/60/1030287260.db2.gz PEEQQOIGVZQJLF-QGZVFWFLSA-N 2 1 332.488 4.150 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)Cc3ccc(F)cc3)C2)s1 ZINC000685412421 1030287288 /nfs/dbraw/zinc/28/72/88/1030287288.db2.gz PEEQQOIGVZQJLF-QGZVFWFLSA-N 2 1 332.488 4.150 20 0 EIADMP Cn1cc[nH+]c1CC1CC[NH+](CCCc2c(F)cccc2Cl)CC1 ZINC000447737714 1030312021 /nfs/dbraw/zinc/31/20/21/1030312021.db2.gz ACVYQRXKZDEQGQ-UHFFFAOYSA-N 2 1 349.881 4.100 20 0 EIADMP CC[N@H+](Cc1nc2c(s1)CCCC2)Cc1ccc(C[NH+](C)C)cc1 ZINC000685456732 1030334732 /nfs/dbraw/zinc/33/47/32/1030334732.db2.gz QZQNNZRWMNLPDH-UHFFFAOYSA-N 2 1 343.540 4.106 20 0 EIADMP CC[N@@H+](Cc1nc2c(s1)CCCC2)Cc1ccc(C[NH+](C)C)cc1 ZINC000685456732 1030334749 /nfs/dbraw/zinc/33/47/49/1030334749.db2.gz QZQNNZRWMNLPDH-UHFFFAOYSA-N 2 1 343.540 4.106 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]CC2(F)CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000526989029 1030383751 /nfs/dbraw/zinc/38/37/51/1030383751.db2.gz PLZBWFSPKBIQFY-GDBMZVCRSA-N 2 1 344.396 4.180 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]CC2(F)CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000526989029 1030383768 /nfs/dbraw/zinc/38/37/68/1030383768.db2.gz PLZBWFSPKBIQFY-GDBMZVCRSA-N 2 1 344.396 4.180 20 0 EIADMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cnn1C(C)C ZINC000191238393 1030610484 /nfs/dbraw/zinc/61/04/84/1030610484.db2.gz YRFVMLANRNVRKA-MRXNPFEDSA-N 2 1 332.536 4.078 20 0 EIADMP C[C@@H]([NH2+]CCCCOc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000527354934 1030664504 /nfs/dbraw/zinc/66/45/04/1030664504.db2.gz OAFPUEYSCGKFCQ-MOPGFXCFSA-N 2 1 330.516 4.088 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(F)cc1 ZINC000398037976 1030690413 /nfs/dbraw/zinc/69/04/13/1030690413.db2.gz QOMYXALHUONLMM-FIKGOQFSSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(F)cc1 ZINC000398037976 1030690423 /nfs/dbraw/zinc/69/04/23/1030690423.db2.gz QOMYXALHUONLMM-FIKGOQFSSA-N 2 1 326.459 4.387 20 0 EIADMP Cc1cc(F)ccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398051034 1030694255 /nfs/dbraw/zinc/69/42/55/1030694255.db2.gz XSMZPGYZINEKAE-UWJYYQICSA-N 2 1 326.459 4.134 20 0 EIADMP CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc(-n3ccnc3)cc2)s1 ZINC000122200683 1030732677 /nfs/dbraw/zinc/73/26/77/1030732677.db2.gz JZEZMQCZWMAXKF-HNNXBMFYSA-N 2 1 340.496 4.393 20 0 EIADMP COCCC1(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCCC1 ZINC000122379935 1030811209 /nfs/dbraw/zinc/81/12/09/1030811209.db2.gz HNNCOVDTBZZKMB-QGZVFWFLSA-N 2 1 341.499 4.428 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCc3ccc(O)cc32)CC1 ZINC000658242557 1030899568 /nfs/dbraw/zinc/89/95/68/1030899568.db2.gz ZXVSECYLLURXMR-GQWLDOHISA-N 2 1 328.500 4.012 20 0 EIADMP Cc1ccc[nH+]c1N([C@H](C)Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001168191871 1030973357 /nfs/dbraw/zinc/97/33/57/1030973357.db2.gz KPYHIJZJEAWBDG-MRXNPFEDSA-N 2 1 343.902 4.233 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC000658320002 1030979430 /nfs/dbraw/zinc/97/94/30/1030979430.db2.gz LPPXBLLDTCDEFJ-PZJWPPBQSA-N 2 1 349.522 4.343 20 0 EIADMP c1ccc(C[N@@H+]2C[C@H](C[NH2+][C@@H]3CCCSCC3)C3(CCC3)C2)cc1 ZINC000658318856 1030981580 /nfs/dbraw/zinc/98/15/80/1030981580.db2.gz SYJIGFXSIYEVLD-VQTJNVASSA-N 2 1 344.568 4.164 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)[C@H](C)C1 ZINC000532459606 1031111309 /nfs/dbraw/zinc/11/13/09/1031111309.db2.gz MDFXGJZBQIDVMJ-GCJKJVERSA-N 2 1 338.495 4.086 20 0 EIADMP C[N@@H+]1CC[C@H](N[C@H]2CCCOc3ccccc32)C[C@@H]1c1ccccc1 ZINC000340219130 1031195073 /nfs/dbraw/zinc/19/50/73/1031195073.db2.gz IHHBPSSBEMVQKX-SESVDKBCSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@H+]1CC[C@H](N[C@H]2CCCOc3ccccc32)C[C@@H]1c1ccccc1 ZINC000340219130 1031195082 /nfs/dbraw/zinc/19/50/82/1031195082.db2.gz IHHBPSSBEMVQKX-SESVDKBCSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCOc3ccccc32)C[C@@H]1c1ccccc1 ZINC000340219130 1031195099 /nfs/dbraw/zinc/19/50/99/1031195099.db2.gz IHHBPSSBEMVQKX-SESVDKBCSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCOc3ccccc32)C[C@@H]1c1ccccc1 ZINC000340219130 1031195121 /nfs/dbraw/zinc/19/51/21/1031195121.db2.gz IHHBPSSBEMVQKX-SESVDKBCSA-N 2 1 336.479 4.325 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)c(OCCC)c1 ZINC000532505308 1031225606 /nfs/dbraw/zinc/22/56/06/1031225606.db2.gz AWDAVHVZWRZAKF-QZTJIDSGSA-N 2 1 348.531 4.257 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)c(OCCC)c1 ZINC000532505308 1031225628 /nfs/dbraw/zinc/22/56/28/1031225628.db2.gz AWDAVHVZWRZAKF-QZTJIDSGSA-N 2 1 348.531 4.257 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1sccc1Br ZINC000532522680 1031241141 /nfs/dbraw/zinc/24/11/41/1031241141.db2.gz CHUHIAZDQTUTEO-NSHDSACASA-N 2 1 342.306 4.147 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1sccc1Br ZINC000532522675 1031242210 /nfs/dbraw/zinc/24/22/10/1031242210.db2.gz CHUHIAZDQTUTEO-LLVKDONJSA-N 2 1 342.306 4.147 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2cc(F)ccc2F)cc1 ZINC000532550457 1031263528 /nfs/dbraw/zinc/26/35/28/1031263528.db2.gz LWZHZJMLVUGXBK-AWEZNQCLSA-N 2 1 341.405 4.352 20 0 EIADMP CCCC[N@@H+](C)CC1CCN(Cc2cccnc2C(F)(F)F)CC1 ZINC000528356362 1031428313 /nfs/dbraw/zinc/42/83/13/1031428313.db2.gz QWKDMOVGMKFCJS-UHFFFAOYSA-N 2 1 343.437 4.044 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2cccnc2C(F)(F)F)CC1 ZINC000528356362 1031428322 /nfs/dbraw/zinc/42/83/22/1031428322.db2.gz QWKDMOVGMKFCJS-UHFFFAOYSA-N 2 1 343.437 4.044 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccnc2C(F)(F)F)CC1 ZINC000528356362 1031428344 /nfs/dbraw/zinc/42/83/44/1031428344.db2.gz QWKDMOVGMKFCJS-UHFFFAOYSA-N 2 1 343.437 4.044 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000531614317 1031430071 /nfs/dbraw/zinc/43/00/71/1031430071.db2.gz BSAZSHKFOBXINT-KRWDZBQOSA-N 2 1 343.540 4.350 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@H]2CCOC3(CCC3)C2)cc1 ZINC000449080391 1031434262 /nfs/dbraw/zinc/43/42/62/1031434262.db2.gz VTTAYHOTQNXRDC-RXVVDRJESA-N 2 1 342.527 4.252 20 0 EIADMP C[C@H]([NH2+]C1(C[NH2+][C@@H]2CCOC3(CCC3)C2)CCCC1)c1ccccc1 ZINC000449154730 1031485299 /nfs/dbraw/zinc/48/52/99/1031485299.db2.gz JJLDQHRMQUNESO-AZUAARDMSA-N 2 1 342.527 4.341 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](CN[C@@H](C)c2sccc2Br)C1 ZINC000531702765 1031488702 /nfs/dbraw/zinc/48/87/02/1031488702.db2.gz WGUHFPFAIGUXIU-STQMWFEESA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2sccc2Br)C1 ZINC000531702765 1031488718 /nfs/dbraw/zinc/48/87/18/1031488718.db2.gz WGUHFPFAIGUXIU-STQMWFEESA-N 2 1 345.350 4.282 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2sccc2Br)C1 ZINC000531702765 1031488742 /nfs/dbraw/zinc/48/87/42/1031488742.db2.gz WGUHFPFAIGUXIU-STQMWFEESA-N 2 1 345.350 4.282 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3cc(OC)ccc32)c1 ZINC000123983373 1031496726 /nfs/dbraw/zinc/49/67/26/1031496726.db2.gz REQCLAOAXXXZQI-QFIPXVFZSA-N 2 1 338.495 4.314 20 0 EIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1nc(C(F)(F)F)cs1 ZINC000185969639 1031522417 /nfs/dbraw/zinc/52/24/17/1031522417.db2.gz FQKXHUHZFKZEQR-GFCCVEGCSA-N 2 1 346.422 4.188 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cn1 ZINC000453066173 1031529781 /nfs/dbraw/zinc/52/97/81/1031529781.db2.gz VGSNPKQZKNOBOC-INIZCTEOSA-N 2 1 336.439 4.120 20 0 EIADMP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H](c2cccnc2)C2CC2)CC1 ZINC000449202810 1031545684 /nfs/dbraw/zinc/54/56/84/1031545684.db2.gz GRKCEVGKIMDXDF-MBSDFSHPSA-N 2 1 349.522 4.218 20 0 EIADMP C[C@H]([NH2+]C1CCC(OC2CCCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000449231326 1031562452 /nfs/dbraw/zinc/56/24/52/1031562452.db2.gz DGUQYEXVNBSWJX-KHKYRLRFSA-N 2 1 348.575 4.499 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2cc(-c3ccccc3)nn2C)CC1 ZINC000453087434 1031576437 /nfs/dbraw/zinc/57/64/37/1031576437.db2.gz PSCVPGPDDKWSAU-QGZVFWFLSA-N 2 1 340.515 4.002 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CCCc2cccnc2)c1 ZINC000453098349 1031593262 /nfs/dbraw/zinc/59/32/62/1031593262.db2.gz XHIGYEBIOYJSFV-IBGZPJMESA-N 2 1 339.527 4.423 20 0 EIADMP CCOc1ccccc1C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000065976617 1031638962 /nfs/dbraw/zinc/63/89/62/1031638962.db2.gz FPMNZFZFAMXKGL-UHFFFAOYSA-N 2 1 326.484 4.215 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2ccccn2)CC[N@@H+]1Cc1ccccc1 ZINC000449399227 1031704357 /nfs/dbraw/zinc/70/43/57/1031704357.db2.gz YTJBVJYGUFZZGF-QUCCMNQESA-N 2 1 337.511 4.002 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2ccccn2)CC[N@H+]1Cc1ccccc1 ZINC000449399227 1031704372 /nfs/dbraw/zinc/70/43/72/1031704372.db2.gz YTJBVJYGUFZZGF-QUCCMNQESA-N 2 1 337.511 4.002 20 0 EIADMP CCc1ccc(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)o1 ZINC000531865903 1031743133 /nfs/dbraw/zinc/74/31/33/1031743133.db2.gz JIZYDNRYGYIDPG-UHFFFAOYSA-N 2 1 326.484 4.364 20 0 EIADMP CCC[NH+]1CCC([NH2+]C2(c3ccc(OC(F)(F)F)cc3)CC2)CC1 ZINC000453233457 1031752365 /nfs/dbraw/zinc/75/23/65/1031752365.db2.gz HKWGGQKULKJBRB-UHFFFAOYSA-N 2 1 342.405 4.038 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)C1CCOCC1 ZINC000531947152 1031858646 /nfs/dbraw/zinc/85/86/46/1031858646.db2.gz HNGSHGJGTZTUDG-PGRDOPGGSA-N 2 1 344.543 4.213 20 0 EIADMP C[C@H](C[NH2+][C@@H]1C[C@H](C)[N@@H+](C)C[C@@H]1C)c1c(Cl)cccc1Cl ZINC000531963662 1031884290 /nfs/dbraw/zinc/88/42/90/1031884290.db2.gz LNNLFEFSMYYNES-LMOYCYGVSA-N 2 1 329.315 4.415 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453389396 1031898226 /nfs/dbraw/zinc/89/82/26/1031898226.db2.gz CGRHHUOIUCUYQA-AWEZNQCLSA-N 2 1 328.422 4.100 20 0 EIADMP CCC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531972394 1031908795 /nfs/dbraw/zinc/90/87/95/1031908795.db2.gz OBLIUZGOOVTXOM-WMLDXEAASA-N 2 1 328.422 4.478 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531972392 1031909953 /nfs/dbraw/zinc/90/99/53/1031909953.db2.gz OBLIUZGOOVTXOM-PBHICJAKSA-N 2 1 328.422 4.478 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H](Cc1ccccc1)c1ccccc1 ZINC000531993769 1031960012 /nfs/dbraw/zinc/96/00/12/1031960012.db2.gz LEIBZYUZJOKJCW-NNLJWKLDSA-N 2 1 336.523 4.331 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000453393766 1031960248 /nfs/dbraw/zinc/96/02/48/1031960248.db2.gz GHAMIVATZACCES-AEGPPILISA-N 2 1 326.937 4.358 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]CCCC[N@@H+](C)C3CC3)c(C)c2c1 ZINC000453419328 1031975031 /nfs/dbraw/zinc/97/50/31/1031975031.db2.gz YUHNVSKYXOPYOG-HNNXBMFYSA-N 2 1 330.472 4.275 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Br)cc1F ZINC000453420112 1031976378 /nfs/dbraw/zinc/97/63/78/1031976378.db2.gz ZDVMRTBSCIFKOC-GFCCVEGCSA-N 2 1 343.284 4.113 20 0 EIADMP Clc1ccc2c(c1Cl)CC[C@H]2[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000152482440 1031986573 /nfs/dbraw/zinc/98/65/73/1031986573.db2.gz VEJXYTHYOAXBBJ-MEDUHNTESA-N 2 1 325.283 4.055 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+]CC(C)(C)C3=CCCC3)sc2C1 ZINC000453585752 1032032876 /nfs/dbraw/zinc/03/28/76/1032032876.db2.gz TVVZHHBLESQRAY-UHFFFAOYSA-N 2 1 333.545 4.136 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+]CC(C)(C)C3=CCCC3)sc2C1 ZINC000453585752 1032032888 /nfs/dbraw/zinc/03/28/88/1032032888.db2.gz TVVZHHBLESQRAY-UHFFFAOYSA-N 2 1 333.545 4.136 20 0 EIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(Cl)c(Br)c1)C1CC1 ZINC000453590076 1032035495 /nfs/dbraw/zinc/03/54/95/1032035495.db2.gz AGTXOHHNFYJICZ-UHFFFAOYSA-N 2 1 345.712 4.067 20 0 EIADMP [NH2+]=C(Nc1cccc(-c2nc3ccccc3s2)c1)SCC[NH3+] ZINC001167912041 1033314557 /nfs/dbraw/zinc/31/45/57/1033314557.db2.gz JXDMZNYMHYUDHU-UHFFFAOYSA-N 2 1 328.466 4.002 20 0 EIADMP CSCCCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000512633898 1033571491 /nfs/dbraw/zinc/57/14/91/1033571491.db2.gz AWGPDSDOTGQSFS-XUVXKRRUSA-N 2 1 332.557 4.020 20 0 EIADMP CC(C)Oc1ccc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)cc1 ZINC000512803852 1033989854 /nfs/dbraw/zinc/98/98/54/1033989854.db2.gz CIFKYYJKQZDIJM-UHFFFAOYSA-N 2 1 338.495 4.012 20 0 EIADMP CC(C)Oc1ccc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)cc1 ZINC000512803852 1033989868 /nfs/dbraw/zinc/98/98/68/1033989868.db2.gz CIFKYYJKQZDIJM-UHFFFAOYSA-N 2 1 338.495 4.012 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000512848748 1034068363 /nfs/dbraw/zinc/06/83/63/1034068363.db2.gz JDDDYIBUQDHLRE-AWEZNQCLSA-N 2 1 334.916 4.500 20 0 EIADMP c1ccc(C(CC[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000246525033 1034720328 /nfs/dbraw/zinc/72/03/28/1034720328.db2.gz KVWMXYLAHDLPIP-VXKWHMMOSA-N 2 1 334.507 4.425 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CSc3ccccc32)CC1 ZINC000513208001 1034836094 /nfs/dbraw/zinc/83/60/94/1034836094.db2.gz KNNBKALTEUMZDL-AYOQOUSVSA-N 2 1 330.541 4.466 20 0 EIADMP COCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCCC1 ZINC000513341516 1034889341 /nfs/dbraw/zinc/88/93/41/1034889341.db2.gz WCMYHAZKHGUJAR-FPOVZHCZSA-N 2 1 344.543 4.226 20 0 EIADMP COCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCCC1 ZINC000513341516 1034889342 /nfs/dbraw/zinc/88/93/42/1034889342.db2.gz WCMYHAZKHGUJAR-FPOVZHCZSA-N 2 1 344.543 4.226 20 0 EIADMP CCc1ccc([C@H]2CCC[N@H+](CCCCn3cc[nH+]c3C)C2)cc1 ZINC000513378080 1034896497 /nfs/dbraw/zinc/89/64/97/1034896497.db2.gz YYVZWWWSSSAEHV-NRFANRHFSA-N 2 1 325.500 4.414 20 0 EIADMP CCc1ccc([C@H]2CCC[N@@H+](CCCCn3cc[nH+]c3C)C2)cc1 ZINC000513378080 1034896502 /nfs/dbraw/zinc/89/65/02/1034896502.db2.gz YYVZWWWSSSAEHV-NRFANRHFSA-N 2 1 325.500 4.414 20 0 EIADMP c1cc2cccc(C[N@@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)c2[nH]1 ZINC000513425170 1034927276 /nfs/dbraw/zinc/92/72/76/1034927276.db2.gz QNJNNRMDJGNJHA-GOSISDBHSA-N 2 1 325.500 4.256 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501070250 1035368315 /nfs/dbraw/zinc/36/83/15/1035368315.db2.gz SDWTYXJEDBOMFJ-HNNXBMFYSA-N 2 1 345.437 4.269 20 0 EIADMP CCc1cc(OC)ccc1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000501452969 1035447590 /nfs/dbraw/zinc/44/75/90/1035447590.db2.gz LOXAAVBZLQRPTJ-UHFFFAOYSA-N 2 1 338.495 4.012 20 0 EIADMP c1ccc(OCCC[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491057669 1035797647 /nfs/dbraw/zinc/79/76/47/1035797647.db2.gz FBNYDSHTQQGEBX-HXUWFJFHSA-N 2 1 330.516 4.044 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000485257789 1035801371 /nfs/dbraw/zinc/80/13/71/1035801371.db2.gz HADPKMFKABLZFO-BPXKWBHBSA-N 2 1 338.470 4.313 20 0 EIADMP c1ccc(CC(C[NH2+]C2CC[NH+](C3CC3)CC2)Cc2ccccc2)cc1 ZINC000571157445 1035977853 /nfs/dbraw/zinc/97/78/53/1035977853.db2.gz VUDZZOBJIUGCEK-UHFFFAOYSA-N 2 1 348.534 4.304 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000502420480 1036203797 /nfs/dbraw/zinc/20/37/97/1036203797.db2.gz YNLNPXISQLMMLZ-GBAJDQEWSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC23CCSCC3)CC[N@@H+]1Cc1ccccc1 ZINC000421388013 1036348571 /nfs/dbraw/zinc/34/85/71/1036348571.db2.gz SSFNQHQDPSIPOF-MISYRCLQSA-N 2 1 344.568 4.162 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC23CCSCC3)CC[N@H+]1Cc1ccccc1 ZINC000421388013 1036348591 /nfs/dbraw/zinc/34/85/91/1036348591.db2.gz SSFNQHQDPSIPOF-MISYRCLQSA-N 2 1 344.568 4.162 20 0 EIADMP CCSCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000572036352 1036398527 /nfs/dbraw/zinc/39/85/27/1036398527.db2.gz NNTAFJVOTZBNSP-HKUYNNGSSA-N 2 1 332.557 4.305 20 0 EIADMP CCSCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000572036352 1036398555 /nfs/dbraw/zinc/39/85/55/1036398555.db2.gz NNTAFJVOTZBNSP-HKUYNNGSSA-N 2 1 332.557 4.305 20 0 EIADMP C[C@@H](NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502683276 1036500669 /nfs/dbraw/zinc/50/06/69/1036500669.db2.gz IPBDNSKAWDHTIS-FGTMMUONSA-N 2 1 332.536 4.017 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502683276 1036500690 /nfs/dbraw/zinc/50/06/90/1036500690.db2.gz IPBDNSKAWDHTIS-FGTMMUONSA-N 2 1 332.536 4.017 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502683276 1036500718 /nfs/dbraw/zinc/50/07/18/1036500718.db2.gz IPBDNSKAWDHTIS-FGTMMUONSA-N 2 1 332.536 4.017 20 0 EIADMP CSc1ccccc1[C@H]1CCC[N@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168389175 1036735294 /nfs/dbraw/zinc/73/52/94/1036735294.db2.gz KWXGLFMONBVRRY-LJQANCHMSA-N 2 1 330.541 4.420 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165313602 1036773484 /nfs/dbraw/zinc/77/34/84/1036773484.db2.gz PINRHQNEEJFJCZ-IEBWSBKVSA-N 2 1 334.573 4.061 20 0 EIADMP CCc1onc(C)c1C[NH+]1CCC(CC[N@H+](CC)CC(C)C)CC1 ZINC001168413865 1036779972 /nfs/dbraw/zinc/77/99/72/1036779972.db2.gz LIWWCKILFPXVAF-UHFFFAOYSA-N 2 1 335.536 4.125 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000572849123 1036843668 /nfs/dbraw/zinc/84/36/68/1036843668.db2.gz HJSZLDZBDSSWJK-PTNGSMBKSA-N 2 1 340.433 4.382 20 0 EIADMP CC(C)C[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043717 1036883785 /nfs/dbraw/zinc/88/37/85/1036883785.db2.gz HDLPTYWMRGXHNR-NVXWUHKLSA-N 2 1 328.422 4.334 20 0 EIADMP CC(C)C[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043717 1036883788 /nfs/dbraw/zinc/88/37/88/1036883788.db2.gz HDLPTYWMRGXHNR-NVXWUHKLSA-N 2 1 328.422 4.334 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2CCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000503078748 1036894733 /nfs/dbraw/zinc/89/47/33/1036894733.db2.gz SINVKFPAGNXCFU-APWZRJJASA-N 2 1 336.470 4.455 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2CCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000503078748 1036894740 /nfs/dbraw/zinc/89/47/40/1036894740.db2.gz SINVKFPAGNXCFU-APWZRJJASA-N 2 1 336.470 4.455 20 0 EIADMP c1sc(C2CCCCC2)nc1C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000573005527 1037225040 /nfs/dbraw/zinc/22/50/40/1037225040.db2.gz SCTGIZAXFDRYIX-KRWDZBQOSA-N 2 1 333.545 4.012 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)COC2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000272691536 1037268770 /nfs/dbraw/zinc/26/87/70/1037268770.db2.gz PQQGJUYLHSHXRI-LZLYRXPVSA-N 2 1 328.500 4.020 20 0 EIADMP CCOCCC1(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000272711310 1037275464 /nfs/dbraw/zinc/27/54/64/1037275464.db2.gz COBHMDYZFCHCLH-CTNGQTDRSA-N 2 1 344.543 4.084 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc3ccc(F)cc3[nH]2)CC1 ZINC000488335971 1037524177 /nfs/dbraw/zinc/52/41/77/1037524177.db2.gz YRIJAMSHPOBVPI-UHFFFAOYSA-N 2 1 331.479 4.251 20 0 EIADMP c1sc(C2CCCCC2)nc1C[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000573497380 1037569575 /nfs/dbraw/zinc/56/95/75/1037569575.db2.gz XJIWWWTYHJCQNP-IAGOWNOFSA-N 2 1 333.545 4.012 20 0 EIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)CS1 ZINC000488434577 1037592102 /nfs/dbraw/zinc/59/21/02/1037592102.db2.gz JEAZSXIEQXQFOE-AQNXPRMDSA-N 2 1 346.584 4.061 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)CS1 ZINC000488437678 1037596033 /nfs/dbraw/zinc/59/60/33/1037596033.db2.gz WJUOJGJWOCYGFG-AHRSYUTCSA-N 2 1 332.557 4.332 20 0 EIADMP [NH3+]C[C@H]1CC[N@@H+](Cc2ccccc2Oc2ccc(F)cc2Cl)C1 ZINC000414649870 1037662369 /nfs/dbraw/zinc/66/23/69/1037662369.db2.gz COMMKEKLYZXLFH-CYBMUJFWSA-N 2 1 334.822 4.052 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)Cc1c(Cl)cccc1Cl ZINC000513787390 1037719262 /nfs/dbraw/zinc/71/92/62/1037719262.db2.gz YDPBDOSTEAXBAW-QWHCGFSZSA-N 2 1 340.298 4.355 20 0 EIADMP Cc1ccc(CCC[N@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1 ZINC000503410484 1037743772 /nfs/dbraw/zinc/74/37/72/1037743772.db2.gz BBAHWPBLWJNGMX-HXUWFJFHSA-N 2 1 337.511 4.340 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)c1c[nH+]ccc1N)c1cccc(C(F)(F)F)c1 ZINC000422803322 1037835542 /nfs/dbraw/zinc/83/55/42/1037835542.db2.gz CPJYLGINQGHFMN-CHWSQXEVSA-N 2 1 337.389 4.357 20 0 EIADMP Cc1cc(Br)cc(C)c1C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422831104 1037843878 /nfs/dbraw/zinc/84/38/78/1037843878.db2.gz WGYRSJKZHWNHBV-ROUUACIJSA-N 2 1 345.284 4.300 20 0 EIADMP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000422854970 1037846821 /nfs/dbraw/zinc/84/68/21/1037846821.db2.gz BNYLTAPPZRQWLB-DGCLKSJQSA-N 2 1 332.517 4.015 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CN[C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422863317 1037848212 /nfs/dbraw/zinc/84/82/12/1037848212.db2.gz OOGSDHXIGRQNMG-MQNAVGNWSA-N 2 1 349.522 4.295 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422863317 1037848215 /nfs/dbraw/zinc/84/82/15/1037848215.db2.gz OOGSDHXIGRQNMG-MQNAVGNWSA-N 3 1 349.522 4.295 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422863317 1037848217 /nfs/dbraw/zinc/84/82/17/1037848217.db2.gz OOGSDHXIGRQNMG-MQNAVGNWSA-N 3 1 349.522 4.295 20 0 EIADMP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000422871100 1037858026 /nfs/dbraw/zinc/85/80/26/1037858026.db2.gz ZTNKZTZETRYJIZ-UKRRQHHQSA-N 2 1 341.480 4.034 20 0 EIADMP Clc1ccc2c(c1Cl)OCCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422899572 1037860872 /nfs/dbraw/zinc/86/08/72/1037860872.db2.gz HQVMUBVENWXVTN-BTQFLJHSSA-N 2 1 341.282 4.080 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC000574097103 1037938381 /nfs/dbraw/zinc/93/83/81/1037938381.db2.gz RWGVBYSBWJORQU-UHFFFAOYSA-N 2 1 337.389 4.036 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC000574097103 1037938403 /nfs/dbraw/zinc/93/84/03/1037938403.db2.gz RWGVBYSBWJORQU-UHFFFAOYSA-N 2 1 337.389 4.036 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1c[nH+]ccc1N ZINC000423103016 1037964272 /nfs/dbraw/zinc/96/42/72/1037964272.db2.gz XGWXKIXOQVIDHO-UXIGCNINSA-N 2 1 335.373 4.110 20 0 EIADMP CC[N@@H+](Cc1cnc(-c2ccc(C)cc2)s1)[C@H]1CCC[NH2+]CC1 ZINC000414718366 1037981985 /nfs/dbraw/zinc/98/19/85/1037981985.db2.gz RLSVYADJCFVCTD-KRWDZBQOSA-N 2 1 329.513 4.083 20 0 EIADMP CCOc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1Cl ZINC000423110470 1037989791 /nfs/dbraw/zinc/98/97/91/1037989791.db2.gz UTPCLYPIKPRQKW-HKUYNNGSSA-N 2 1 344.886 4.322 20 0 EIADMP Cc1cc(C)c(C[N@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)cc1C ZINC000414720777 1038030954 /nfs/dbraw/zinc/03/09/54/1038030954.db2.gz ZUKRIUSHLRXLCO-QFIPXVFZSA-N 2 1 337.511 4.151 20 0 EIADMP Cc1cc(C)c(C[N@@H+](Cc2ccccn2)[C@H]2CCC[NH2+]CC2)cc1C ZINC000414720777 1038030979 /nfs/dbraw/zinc/03/09/79/1038030979.db2.gz ZUKRIUSHLRXLCO-QFIPXVFZSA-N 2 1 337.511 4.151 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cccc3c2OC(C)(C)C3)C1 ZINC000606469274 1038092793 /nfs/dbraw/zinc/09/27/93/1038092793.db2.gz FHBXMVFUNYHYOV-KRWDZBQOSA-N 2 1 330.516 4.002 20 0 EIADMP C[C@H]([NH3+])c1ccc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cc1 ZINC000423291470 1038095866 /nfs/dbraw/zinc/09/58/66/1038095866.db2.gz IKOCHZXUNGLNJB-KRWDZBQOSA-N 3 1 345.575 4.475 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423290810 1038096566 /nfs/dbraw/zinc/09/65/66/1038096566.db2.gz FODDJEPMBCTEFR-HOTGVXAUSA-N 3 1 334.467 4.051 20 0 EIADMP C[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423311348 1038108707 /nfs/dbraw/zinc/10/87/07/1038108707.db2.gz BWKODGGMDFRMSG-OQPBUACISA-N 2 1 340.311 4.112 20 0 EIADMP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1csc(-c2ccccc2F)n1 ZINC000423277792 1038108812 /nfs/dbraw/zinc/10/88/12/1038108812.db2.gz ORXFPEWYOYTDEQ-XEZPLFJOSA-N 2 1 333.476 4.117 20 0 EIADMP CCCC[C@H](C[NH3+])[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423300562 1038125881 /nfs/dbraw/zinc/12/58/81/1038125881.db2.gz RVYXQEZZFNBWTG-MOPGFXCFSA-N 2 1 331.891 4.126 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000423362806 1038178355 /nfs/dbraw/zinc/17/83/55/1038178355.db2.gz YGTOHOUOXBFCQJ-XTQVGHSUSA-N 2 1 349.522 4.146 20 0 EIADMP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423435278 1038235435 /nfs/dbraw/zinc/23/54/35/1038235435.db2.gz DNIZTMRGBXCOEW-CIUDSAMLSA-N 2 1 328.300 4.111 20 0 EIADMP CC[C@H]([NH3+])C[NH2+][C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423475146 1038247089 /nfs/dbraw/zinc/24/70/89/1038247089.db2.gz RQAXWBBKZCRCEN-PELKAZGASA-N 2 1 328.300 4.112 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)o1 ZINC000423476152 1038250360 /nfs/dbraw/zinc/25/03/60/1038250360.db2.gz QTBNNGXPVXAHLY-URLQWDBASA-N 2 1 330.447 4.025 20 0 EIADMP CC[N@H+]1CC[C@@H](CN[C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000490168565 1038366827 /nfs/dbraw/zinc/36/68/27/1038366827.db2.gz XJWDOVWJSQMGBJ-MGPUTAFESA-N 2 1 346.877 4.500 20 0 EIADMP c1cc2c(s1)CC[NH+](CCCCC[N@H+]1CCc3sccc3C1)C2 ZINC000607150565 1038390785 /nfs/dbraw/zinc/39/07/85/1038390785.db2.gz AORYDGBADFZHAU-UHFFFAOYSA-N 2 1 346.565 4.396 20 0 EIADMP COc1cccc2c1CC[C@@H]2[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000480778575 1038803954 /nfs/dbraw/zinc/80/39/54/1038803954.db2.gz IRLZZGHBUBCCAV-NRFANRHFSA-N 2 1 338.495 4.313 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)cc1Cl ZINC000539072155 1038822029 /nfs/dbraw/zinc/82/20/29/1038822029.db2.gz VEDDCVFJGJBYBI-QLFBSQMISA-N 2 1 342.886 4.019 20 0 EIADMP Clc1ccc(SCC[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000608499831 1038839021 /nfs/dbraw/zinc/83/90/21/1038839021.db2.gz YMCXKHMUMZVUSP-MRXNPFEDSA-N 2 1 338.948 4.240 20 0 EIADMP Clc1ccc(SCC[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000608499831 1038839023 /nfs/dbraw/zinc/83/90/23/1038839023.db2.gz YMCXKHMUMZVUSP-MRXNPFEDSA-N 2 1 338.948 4.240 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2cccc3C)[C@H](C)C1 ZINC000504921121 1038843990 /nfs/dbraw/zinc/84/39/90/1038843990.db2.gz QXKPVXUODWIJDB-RMVXJAJNSA-N 2 1 344.543 4.270 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCCC[N@H+]2C)cc1OC ZINC000539252278 1038896121 /nfs/dbraw/zinc/89/61/21/1038896121.db2.gz ILKJDAFIPRPSJX-FUHWJXTLSA-N 2 1 334.504 4.009 20 0 EIADMP Fc1ccc(-c2ccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCC4)C3)o2)cc1 ZINC000537616000 1038897774 /nfs/dbraw/zinc/89/77/74/1038897774.db2.gz GRGYJQYWJHVEQZ-INIZCTEOSA-N 2 1 328.431 4.003 20 0 EIADMP Fc1ccc(-c2ccc(C[N@H+]3CC[C@@H](C[NH+]4CCCC4)C3)o2)cc1 ZINC000537616000 1038897778 /nfs/dbraw/zinc/89/77/78/1038897778.db2.gz GRGYJQYWJHVEQZ-INIZCTEOSA-N 2 1 328.431 4.003 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000462104370 1038907810 /nfs/dbraw/zinc/90/78/10/1038907810.db2.gz JONLIIFIIAHOBE-WTIAFYNJSA-N 2 1 336.523 4.303 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)CC[N@H+]1C ZINC000462104370 1038907827 /nfs/dbraw/zinc/90/78/27/1038907827.db2.gz JONLIIFIIAHOBE-WTIAFYNJSA-N 2 1 336.523 4.303 20 0 EIADMP C[NH+](C)C1CCC([N@H+]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC001168328139 1038937282 /nfs/dbraw/zinc/93/72/82/1038937282.db2.gz XCHGYKVUVIIETQ-FAEJEUNOSA-N 2 1 340.433 4.368 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(Cl)ccc2OC(F)F)C1 ZINC000481017563 1038947282 /nfs/dbraw/zinc/94/72/82/1038947282.db2.gz CJLCLPALLKLFND-OLZOCXBDSA-N 2 1 346.849 4.324 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(Cl)ccc2OC(F)F)C1 ZINC000481017563 1038947315 /nfs/dbraw/zinc/94/73/15/1038947315.db2.gz CJLCLPALLKLFND-OLZOCXBDSA-N 2 1 346.849 4.324 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2oc3ccc(OC)cc3c2C)C1 ZINC000481019946 1038958427 /nfs/dbraw/zinc/95/84/27/1038958427.db2.gz GWVZSYGTDQAYPF-JKSUJKDBSA-N 2 1 330.472 4.132 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2oc3ccc(OC)cc3c2C)C1 ZINC000481019946 1038958437 /nfs/dbraw/zinc/95/84/37/1038958437.db2.gz GWVZSYGTDQAYPF-JKSUJKDBSA-N 2 1 330.472 4.132 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3cc(OC)ccc3c2)C1 ZINC000481023373 1038958686 /nfs/dbraw/zinc/95/86/86/1038958686.db2.gz NDLRMRVNLVIEHW-DLBZAZTESA-N 2 1 326.484 4.231 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@@H]2c2ccc(OC)c(F)c2)C1 ZINC000481039927 1038987037 /nfs/dbraw/zinc/98/70/37/1038987037.db2.gz QINATYYIUFKGPW-YVWKXTFCSA-N 2 1 348.506 4.182 20 0 EIADMP CCOc1cccc(CN(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000552059529 1039077718 /nfs/dbraw/zinc/07/77/18/1039077718.db2.gz IQRPXOKIBSBCEU-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CCOc1cccc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000552059529 1039077741 /nfs/dbraw/zinc/07/77/41/1039077741.db2.gz IQRPXOKIBSBCEU-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CCOc1cccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000552059529 1039077759 /nfs/dbraw/zinc/07/77/59/1039077759.db2.gz IQRPXOKIBSBCEU-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CCCOCc1ccccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000481293949 1039225665 /nfs/dbraw/zinc/22/56/65/1039225665.db2.gz IZTBLHSCRSNKBR-UHFFFAOYSA-N 2 1 344.543 4.500 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(OCc3ccccc3)c2)C1 ZINC000481294926 1039231611 /nfs/dbraw/zinc/23/16/11/1039231611.db2.gz MZQGGPMAXWLLAT-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+][C@@H](C[NH3+])C1CCCCC1 ZINC000414833979 1039278372 /nfs/dbraw/zinc/27/83/72/1039278372.db2.gz GBLBUZXNPPQJKV-UZLBHIALSA-N 2 1 345.531 4.024 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](Cc2ccccc2)c2sccc2C)C1 ZINC000481314188 1039284706 /nfs/dbraw/zinc/28/47/06/1039284706.db2.gz BNPWDZBOPYSXCH-OALUTQOASA-N 2 1 328.525 4.272 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](CC)c2cccc(C)c2)[C@H](C)C1 ZINC000552244527 1039312261 /nfs/dbraw/zinc/31/22/61/1039312261.db2.gz DEYJCPYKLAQTFD-NRSPTQNISA-N 2 1 332.532 4.173 20 0 EIADMP COC(C)(C)C[C@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000552244437 1039312607 /nfs/dbraw/zinc/31/26/07/1039312607.db2.gz AHHRXHYIHVNDAN-KKXNLOMOSA-N 2 1 332.532 4.223 20 0 EIADMP C[C@H]1C[C@@H](N(C)Cc2ccc(Cl)o2)CC[N@H+]1Cc1ccccc1 ZINC000552256657 1039316997 /nfs/dbraw/zinc/31/69/97/1039316997.db2.gz WJTLDRFBMCGRFR-RDJZCZTQSA-N 2 1 332.875 4.418 20 0 EIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@@H+](CC)C1 ZINC000481339690 1039320183 /nfs/dbraw/zinc/32/01/83/1039320183.db2.gz QZXOQCIGDRZKGU-ZBFHGGJFSA-N 2 1 326.937 4.142 20 0 EIADMP Fc1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000513858759 1039337259 /nfs/dbraw/zinc/33/72/59/1039337259.db2.gz DFRSBEOITUMAKH-MGPUTAFESA-N 2 1 344.499 4.376 20 0 EIADMP Fc1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000513858759 1039337280 /nfs/dbraw/zinc/33/72/80/1039337280.db2.gz DFRSBEOITUMAKH-MGPUTAFESA-N 2 1 344.499 4.376 20 0 EIADMP C[N@@H+](CCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1)C1CCCCC1 ZINC000534351246 1039338057 /nfs/dbraw/zinc/33/80/57/1039338057.db2.gz TWLFGMAGANENQH-KNQAVFIVSA-N 2 1 344.543 4.399 20 0 EIADMP C[N@H+]1CCC[C@@]2(CC[NH+](CCCOc3cccc4ccccc43)C2)C1 ZINC000555598027 1039420512 /nfs/dbraw/zinc/42/05/12/1039420512.db2.gz MTZRHORSVDBKEY-JOCHJYFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[NH+]1CCC[C@@]2(CC[N@H+](CCCOc3cccc4ccccc43)C2)C1 ZINC000555598027 1039420537 /nfs/dbraw/zinc/42/05/37/1039420537.db2.gz MTZRHORSVDBKEY-JOCHJYFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](CCCOc3cccc4ccccc43)C2)C1 ZINC000555598027 1039420559 /nfs/dbraw/zinc/42/05/59/1039420559.db2.gz MTZRHORSVDBKEY-JOCHJYFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cccc(OC(F)(F)F)c1 ZINC000481433660 1039425964 /nfs/dbraw/zinc/42/59/64/1039425964.db2.gz JCMWVDOEQIIZAJ-ZDUSSCGKSA-N 2 1 342.405 4.253 20 0 EIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)o1 ZINC000061070802 1039776893 /nfs/dbraw/zinc/77/68/93/1039776893.db2.gz JPJMHTFFZSXZIS-IRXDYDNUSA-N 2 1 326.484 4.356 20 0 EIADMP c1[nH+]c(C2CC[NH+]([C@@H]3CCCc4ccccc43)CC2)n2c1CCCC2 ZINC000434689056 1039811628 /nfs/dbraw/zinc/81/16/28/1039811628.db2.gz SNVYQHYCMPCNTK-OAQYLSRUSA-N 2 1 335.495 4.476 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000537647924 1039822108 /nfs/dbraw/zinc/82/21/08/1039822108.db2.gz VUKBKZZBKISPCR-MRXNPFEDSA-N 2 1 330.447 4.168 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000537647924 1039822109 /nfs/dbraw/zinc/82/21/09/1039822109.db2.gz VUKBKZZBKISPCR-MRXNPFEDSA-N 2 1 330.447 4.168 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000537647924 1039822111 /nfs/dbraw/zinc/82/21/11/1039822111.db2.gz VUKBKZZBKISPCR-MRXNPFEDSA-N 2 1 330.447 4.168 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(F)cc3C)o2)C1 ZINC000537647924 1039822112 /nfs/dbraw/zinc/82/21/12/1039822112.db2.gz VUKBKZZBKISPCR-MRXNPFEDSA-N 2 1 330.447 4.168 20 0 EIADMP CSc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551007500 1039861234 /nfs/dbraw/zinc/86/12/34/1039861234.db2.gz PDDBFXQQLZHQQE-AZUAARDMSA-N 2 1 326.509 4.334 20 0 EIADMP CSc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551007500 1039861237 /nfs/dbraw/zinc/86/12/37/1039861237.db2.gz PDDBFXQQLZHQQE-AZUAARDMSA-N 2 1 326.509 4.334 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCSc2ccccc2)C[C@@H]1c1ccccc1 ZINC000550999045 1039863173 /nfs/dbraw/zinc/86/31/73/1039863173.db2.gz GZWIYUXCJVPHDP-AZUAARDMSA-N 2 1 326.509 4.204 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCSc2ccccc2)C[C@@H]1c1ccccc1 ZINC000550999045 1039863175 /nfs/dbraw/zinc/86/31/75/1039863175.db2.gz GZWIYUXCJVPHDP-AZUAARDMSA-N 2 1 326.509 4.204 20 0 EIADMP Cc1nc([C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cs1 ZINC000552920135 1039868067 /nfs/dbraw/zinc/86/80/67/1039868067.db2.gz SSSAPUUFJWJSTJ-BXWFABGCSA-N 2 1 343.540 4.403 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](c2cccnc2)C2CCC2)CC1 ZINC000481920546 1039895167 /nfs/dbraw/zinc/89/51/67/1039895167.db2.gz JNSCMQOISBTVCY-HSZRJFAPSA-N 2 1 349.522 4.485 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)Cc2ccccc2C(F)(F)F)C1 ZINC000481925959 1039899948 /nfs/dbraw/zinc/89/99/48/1039899948.db2.gz NPJTUSBBKCEGNF-HOTGVXAUSA-N 2 1 342.449 4.346 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC[N@@H+]1C ZINC000482010793 1039947126 /nfs/dbraw/zinc/94/71/26/1039947126.db2.gz CLUZNNAZIVUWJU-OIISXLGYSA-N 2 1 341.524 4.260 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC[N@H+]1C ZINC000482010793 1039947142 /nfs/dbraw/zinc/94/71/42/1039947142.db2.gz CLUZNNAZIVUWJU-OIISXLGYSA-N 2 1 341.524 4.260 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2(C)Cc3ccccc3C2)C[C@H]1c1ccccc1 ZINC000551087038 1039967112 /nfs/dbraw/zinc/96/71/12/1039967112.db2.gz KSXRVEDOMGWYFD-YADHBBJMSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(C)Cc3ccccc3C2)C[C@H]1c1ccccc1 ZINC000551087038 1039967128 /nfs/dbraw/zinc/96/71/28/1039967128.db2.gz KSXRVEDOMGWYFD-YADHBBJMSA-N 2 1 334.507 4.217 20 0 EIADMP CSc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551174779 1040018405 /nfs/dbraw/zinc/01/84/05/1040018405.db2.gz DAIKOORIQDXPQY-TZIWHRDSSA-N 2 1 340.536 4.376 20 0 EIADMP CSc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551174779 1040018425 /nfs/dbraw/zinc/01/84/25/1040018425.db2.gz DAIKOORIQDXPQY-TZIWHRDSSA-N 2 1 340.536 4.376 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000551176434 1040021779 /nfs/dbraw/zinc/02/17/79/1040021779.db2.gz XPOZPJVJBOEJSW-TUFLPTIASA-N 2 1 330.516 4.005 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000551176434 1040021801 /nfs/dbraw/zinc/02/18/01/1040021801.db2.gz XPOZPJVJBOEJSW-TUFLPTIASA-N 2 1 330.516 4.005 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2ccc(Cl)c(Cl)c2)CC[N@H+]1C ZINC000482135995 1040028609 /nfs/dbraw/zinc/02/86/09/1040028609.db2.gz FYLHBZACXHUDHK-TZMCWYRMSA-N 2 1 329.315 4.343 20 0 EIADMP C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000514633512 1040067064 /nfs/dbraw/zinc/06/70/64/1040067064.db2.gz GARKPRQOZDCAPG-PGRDOPGGSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)CC[N@@H+]1C ZINC000482246484 1040092078 /nfs/dbraw/zinc/09/20/78/1040092078.db2.gz SBLQQUFUWRYHIF-HBGVWJBISA-N 2 1 326.459 4.182 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)CC[N@H+]1C ZINC000482246484 1040092099 /nfs/dbraw/zinc/09/20/99/1040092099.db2.gz SBLQQUFUWRYHIF-HBGVWJBISA-N 2 1 326.459 4.182 20 0 EIADMP Cc1sc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)nc1-c1ccc(Cl)cc1 ZINC000514737459 1040180438 /nfs/dbraw/zinc/18/04/38/1040180438.db2.gz BYFOVBHIHHNCDC-CABCVRRESA-N 2 1 335.904 4.131 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000482336222 1040184125 /nfs/dbraw/zinc/18/41/25/1040184125.db2.gz RVECHZWGPGIUIM-CABCVRRESA-N 2 1 328.422 4.476 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](CN[C@@H](C)c2ccccc2Br)C1 ZINC000482362200 1040202312 /nfs/dbraw/zinc/20/23/12/1040202312.db2.gz VSZBVVZWTSTGKC-LSDHHAIUSA-N 2 1 339.321 4.220 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1F ZINC000482448465 1040256018 /nfs/dbraw/zinc/25/60/18/1040256018.db2.gz ODIXJCIWRLEVIY-FUHWJXTLSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1F ZINC000482448465 1040256033 /nfs/dbraw/zinc/25/60/33/1040256033.db2.gz ODIXJCIWRLEVIY-FUHWJXTLSA-N 2 1 344.449 4.180 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)o1 ZINC000482448895 1040260605 /nfs/dbraw/zinc/26/06/05/1040260605.db2.gz GQIXKWCNAKXNBD-HKUYNNGSSA-N 2 1 326.484 4.057 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)o1 ZINC000482448895 1040260616 /nfs/dbraw/zinc/26/06/16/1040260616.db2.gz GQIXKWCNAKXNBD-HKUYNNGSSA-N 2 1 326.484 4.057 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+][C@H](Cc3ccccc3)C3CC3)C2)cc1 ZINC000482452126 1040261960 /nfs/dbraw/zinc/26/19/60/1040261960.db2.gz ABHIMGHYFMWALQ-LADGPHEKSA-N 2 1 348.534 4.162 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(OC)c1 ZINC000479461732 1040366374 /nfs/dbraw/zinc/36/63/74/1040366374.db2.gz DLJDMMGEBSUECV-KNQAVFIVSA-N 2 1 338.495 4.258 20 0 EIADMP c1ccc(C[C@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C2CC2)cc1 ZINC000479462203 1040370882 /nfs/dbraw/zinc/37/08/82/1040370882.db2.gz FPIKYDSQQWXYQU-GMAHTHKFSA-N 2 1 334.507 4.119 20 0 EIADMP Cc1ccc2cc(C[N@H+]3CCC[C@@H](c4ncc5n4CCCC5)C3)[nH]c2c1 ZINC000668104700 1040430968 /nfs/dbraw/zinc/43/09/68/1040430968.db2.gz MBAKIMCCSCVCSR-GOSISDBHSA-N 2 1 348.494 4.389 20 0 EIADMP Cc1cccc2[nH]c(C[N@H+]3CCC[C@H](c4ncc5n4CCCC5)C3)cc21 ZINC000668104512 1040431308 /nfs/dbraw/zinc/43/13/08/1040431308.db2.gz IRFSOLYIYFGVAX-KRWDZBQOSA-N 2 1 348.494 4.389 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1nccc2ccccc21 ZINC000515019140 1040434263 /nfs/dbraw/zinc/43/42/63/1040434263.db2.gz HZSYULOATZWXPC-KURKYZTESA-N 2 1 325.500 4.253 20 0 EIADMP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000539500223 1040492010 /nfs/dbraw/zinc/49/20/10/1040492010.db2.gz VCCSMAYZGQBXQB-CVEARBPZSA-N 2 1 326.484 4.439 20 0 EIADMP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000539500223 1040492016 /nfs/dbraw/zinc/49/20/16/1040492016.db2.gz VCCSMAYZGQBXQB-CVEARBPZSA-N 2 1 326.484 4.439 20 0 EIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(-c2ccc(F)cc2)s1 ZINC000539507849 1040501875 /nfs/dbraw/zinc/50/18/75/1040501875.db2.gz QMANIGYGNLUUIW-AWEZNQCLSA-N 2 1 330.472 4.467 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000482808296 1040503741 /nfs/dbraw/zinc/50/37/41/1040503741.db2.gz CKHONPKHYUHQHQ-GOEBONIOSA-N 2 1 336.907 4.091 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000482808296 1040503758 /nfs/dbraw/zinc/50/37/58/1040503758.db2.gz CKHONPKHYUHQHQ-GOEBONIOSA-N 2 1 336.907 4.091 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(Cl)cc1OC ZINC000482832989 1040510773 /nfs/dbraw/zinc/51/07/73/1040510773.db2.gz DAPUXAYWIXITRO-UHFFFAOYSA-N 2 1 335.879 4.020 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(Cl)cc1OC ZINC000482832989 1040510790 /nfs/dbraw/zinc/51/07/90/1040510790.db2.gz DAPUXAYWIXITRO-UHFFFAOYSA-N 2 1 335.879 4.020 20 0 EIADMP CC[N@@H+](Cc1cc2ccncc2s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000668161368 1040583679 /nfs/dbraw/zinc/58/36/79/1040583679.db2.gz ZTPBNNBOUXSOLL-UHFFFAOYSA-N 2 1 339.508 4.380 20 0 EIADMP COc1ncc([C@@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)cc1Cl ZINC000551794100 1040606677 /nfs/dbraw/zinc/60/66/77/1040606677.db2.gz MBUOEVZFTRIWJK-CQSZACIVSA-N 2 1 339.911 4.049 20 0 EIADMP COc1ncc([C@@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1Cl ZINC000551794100 1040606685 /nfs/dbraw/zinc/60/66/85/1040606685.db2.gz MBUOEVZFTRIWJK-CQSZACIVSA-N 2 1 339.911 4.049 20 0 EIADMP Cc1cccc2c1[nH+]cc(C)c2N1CC[NH+]([C@H](C)c2cccnc2)CC1 ZINC000462494933 1040666946 /nfs/dbraw/zinc/66/69/46/1040666946.db2.gz BKNMVMUZIVXOQB-GOSISDBHSA-N 2 1 346.478 4.130 20 0 EIADMP Fc1cccc(-c2ccc(C[N@@H+]3CC[C@H](C[NH+]4CCCC4)C3)o2)c1F ZINC000483263688 1040799289 /nfs/dbraw/zinc/79/92/89/1040799289.db2.gz PGAPSOMFZZCLCB-OAHLLOKOSA-N 2 1 346.421 4.143 20 0 EIADMP Fc1cccc(-c2ccc(C[N@H+]3CC[C@H](C[NH+]4CCCC4)C3)o2)c1F ZINC000483263688 1040799309 /nfs/dbraw/zinc/79/93/09/1040799309.db2.gz PGAPSOMFZZCLCB-OAHLLOKOSA-N 2 1 346.421 4.143 20 0 EIADMP CN(C/C=C\c1ccc(F)cc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539834039 1040828587 /nfs/dbraw/zinc/82/85/87/1040828587.db2.gz WFTRWPXVSWSNQU-HUCIYCNJSA-N 2 1 338.470 4.293 20 0 EIADMP C[NH+](C/C=C\c1ccc(F)cc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539834039 1040828612 /nfs/dbraw/zinc/82/86/12/1040828612.db2.gz WFTRWPXVSWSNQU-HUCIYCNJSA-N 2 1 338.470 4.293 20 0 EIADMP C[NH+](C/C=C\c1ccc(F)cc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000539834039 1040828615 /nfs/dbraw/zinc/82/86/15/1040828615.db2.gz WFTRWPXVSWSNQU-HUCIYCNJSA-N 2 1 338.470 4.293 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCO[C@H](C(C)(C)C)C1 ZINC000480007608 1040848647 /nfs/dbraw/zinc/84/86/47/1040848647.db2.gz KSZYCRIKOKMRPD-PMACEKPBSA-N 2 1 346.559 4.328 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2ncc(C(C)(C)C)o2)CC1)CC1CC1 ZINC000537846644 1040850423 /nfs/dbraw/zinc/85/04/23/1040850423.db2.gz KPYMGPQAWPEEGD-UHFFFAOYSA-N 2 1 347.547 4.306 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ncc(C(C)(C)C)o2)CC1)CC1CC1 ZINC000537846644 1040850437 /nfs/dbraw/zinc/85/04/37/1040850437.db2.gz KPYMGPQAWPEEGD-UHFFFAOYSA-N 2 1 347.547 4.306 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3cc(C)c(F)c(C)c3)CC2)[nH+]c1 ZINC000483494957 1040874889 /nfs/dbraw/zinc/87/48/89/1040874889.db2.gz CFOGCUNFYFKASZ-KRWDZBQOSA-N 2 1 341.474 4.466 20 0 EIADMP FC(F)(F)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167960331 1040884799 /nfs/dbraw/zinc/88/47/99/1040884799.db2.gz YBKOOTLWBGFCDA-AYHJJNSGSA-N 2 1 338.417 4.200 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@@H]3C[C@H](C)CC(C)(C)C3)CCCC2)CC1 ZINC000462744755 1040892075 /nfs/dbraw/zinc/89/20/75/1040892075.db2.gz MOFXANNMQGYQSW-ZWKOTPCHSA-N 2 1 336.564 4.214 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000537939341 1040901984 /nfs/dbraw/zinc/90/19/84/1040901984.db2.gz MBVYCCPJRSHGJZ-ZIFCJYIRSA-N 2 1 341.474 4.172 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000537939338 1040902241 /nfs/dbraw/zinc/90/22/41/1040902241.db2.gz MBVYCCPJRSHGJZ-AOIWGVFYSA-N 2 1 341.474 4.172 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1cncs1 ZINC000537941599 1040904604 /nfs/dbraw/zinc/90/46/04/1040904604.db2.gz XLEMBIUWVDPEBJ-SOLBZPMBSA-N 2 1 329.513 4.094 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000462796983 1040949935 /nfs/dbraw/zinc/94/99/35/1040949935.db2.gz ALEGNUVKWCEITL-BVYCBKJFSA-N 2 1 344.543 4.212 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000483755958 1041001908 /nfs/dbraw/zinc/00/19/08/1041001908.db2.gz QCMNEYBSHUVOFM-HBFSDRIKSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000483755958 1041001921 /nfs/dbraw/zinc/00/19/21/1041001921.db2.gz QCMNEYBSHUVOFM-HBFSDRIKSA-N 2 1 338.495 4.399 20 0 EIADMP C[N@H+]1CCCC[C@H]1CCN1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000425503116 1041017218 /nfs/dbraw/zinc/01/72/18/1041017218.db2.gz INJYSRSJDPJFIH-KRWDZBQOSA-N 2 1 347.572 4.076 20 0 EIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000425503116 1041017229 /nfs/dbraw/zinc/01/72/29/1041017229.db2.gz INJYSRSJDPJFIH-KRWDZBQOSA-N 2 1 347.572 4.076 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000480178433 1041041530 /nfs/dbraw/zinc/04/15/30/1041041530.db2.gz IAYADEDUDVPNBD-CQSZACIVSA-N 2 1 332.410 4.009 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000480178433 1041041543 /nfs/dbraw/zinc/04/15/43/1041041543.db2.gz IAYADEDUDVPNBD-CQSZACIVSA-N 2 1 332.410 4.009 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1ccc(SCC(F)F)cc1 ZINC000480189357 1041065054 /nfs/dbraw/zinc/06/50/54/1041065054.db2.gz IJZHVHIODLPTQS-CQSZACIVSA-N 2 1 330.488 4.425 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1ccc(SCC(F)F)cc1 ZINC000480189357 1041065061 /nfs/dbraw/zinc/06/50/61/1041065061.db2.gz IJZHVHIODLPTQS-CQSZACIVSA-N 2 1 330.488 4.425 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(OCC(F)(F)F)cc1 ZINC000538163077 1041107136 /nfs/dbraw/zinc/10/71/36/1041107136.db2.gz PVHRFOXCJHKESP-GDBMZVCRSA-N 2 1 344.421 4.153 20 0 EIADMP CC(C)CCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000480268466 1041140204 /nfs/dbraw/zinc/14/02/04/1041140204.db2.gz UTCQMNMGZMUQID-KRWDZBQOSA-N 2 1 330.516 4.389 20 0 EIADMP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000540168903 1041212091 /nfs/dbraw/zinc/21/20/91/1041212091.db2.gz OGPHYEDRTBKTFI-UONOGXRCSA-N 2 1 335.879 4.231 20 0 EIADMP COC1(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)CCCCC1 ZINC000480342635 1041232286 /nfs/dbraw/zinc/23/22/86/1041232286.db2.gz HYWCDTXUWUOHPM-FUHWJXTLSA-N 2 1 336.545 4.070 20 0 EIADMP COC1(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CCCCC1 ZINC000480342635 1041232306 /nfs/dbraw/zinc/23/23/06/1041232306.db2.gz HYWCDTXUWUOHPM-FUHWJXTLSA-N 2 1 336.545 4.070 20 0 EIADMP [NH2+]=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C12CC3CC(CC(C3)C1)C2 ZINC001167960809 1041258648 /nfs/dbraw/zinc/25/86/48/1041258648.db2.gz DMKNJCWUAHNOGR-UXVFMDBASA-N 2 1 341.543 4.175 20 0 EIADMP COc1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)ccc1C ZINC000463071232 1041316819 /nfs/dbraw/zinc/31/68/19/1041316819.db2.gz WJLMUXGXMMSYDA-GHTZIAJQSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ccc1C ZINC000463071232 1041316838 /nfs/dbraw/zinc/31/68/38/1041316838.db2.gz WJLMUXGXMMSYDA-GHTZIAJQSA-N 2 1 338.495 4.146 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]3CCCC3)oc21 ZINC000538397488 1041316922 /nfs/dbraw/zinc/31/69/22/1041316922.db2.gz IYMHEOIPXCZIRK-HZPDHXFCSA-N 2 1 330.472 4.214 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccc(C(F)(F)F)cc2)C(C)C)C1 ZINC000540258971 1041325338 /nfs/dbraw/zinc/32/53/38/1041325338.db2.gz KLUZKOPAYWHPDU-YOEHRIQHSA-N 2 1 328.422 4.334 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)C1 ZINC000540258967 1041327181 /nfs/dbraw/zinc/32/71/81/1041327181.db2.gz KLUZKOPAYWHPDU-RHSMWYFYSA-N 2 1 328.422 4.334 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc(OCC3CCCCC3)c2)CC[N@H+]1C ZINC000538411212 1041329077 /nfs/dbraw/zinc/32/90/77/1041329077.db2.gz XUYZHNNVBKUPNU-PXNSSMCTSA-N 2 1 330.516 4.218 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cc(F)cc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463114931 1041342347 /nfs/dbraw/zinc/34/23/47/1041342347.db2.gz IBNORDXGCPXBPM-HRAATJIYSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2cc(F)cc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463114931 1041342364 /nfs/dbraw/zinc/34/23/64/1041342364.db2.gz IBNORDXGCPXBPM-HRAATJIYSA-N 2 1 344.449 4.150 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000540302934 1041355934 /nfs/dbraw/zinc/35/59/34/1041355934.db2.gz WMRLMJXLVNKPBE-PBHICJAKSA-N 2 1 328.422 4.334 20 0 EIADMP CCCCn1cc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)c(C)n1 ZINC000540318199 1041364715 /nfs/dbraw/zinc/36/47/15/1041364715.db2.gz NBTPLQABPBSWCW-UTKZUKDTSA-N 2 1 346.563 4.124 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)C1(c2ccccc2)CCCC1 ZINC000554734345 1041366871 /nfs/dbraw/zinc/36/68/71/1041366871.db2.gz JRLPSQQKFVYBIN-QZTJIDSGSA-N 2 1 325.500 4.318 20 0 EIADMP Cc1ccc([C@@H](C)C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000463133093 1041369317 /nfs/dbraw/zinc/36/93/17/1041369317.db2.gz WTHQCLIYECUCHO-FQEVSTJZSA-N 2 1 336.523 4.395 20 0 EIADMP CC[NH+](CC)[C@@H](C[NH2+]C1CCN(c2ccccc2)CC1)CC(C)C ZINC000463131852 1041369395 /nfs/dbraw/zinc/36/93/95/1041369395.db2.gz LQVFHKPBAPJJIE-OAQYLSRUSA-N 2 1 331.548 4.002 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463141468 1041374671 /nfs/dbraw/zinc/37/46/71/1041374671.db2.gz ZDONDTLABANVOK-VWPQPMDRSA-N 3 1 345.575 4.140 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463141468 1041374686 /nfs/dbraw/zinc/37/46/86/1041374686.db2.gz ZDONDTLABANVOK-VWPQPMDRSA-N 3 1 345.575 4.140 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463155554 1041387074 /nfs/dbraw/zinc/38/70/74/1041387074.db2.gz OAXCISMVKFWALT-MSYGRNIXSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000463155554 1041387086 /nfs/dbraw/zinc/38/70/86/1041387086.db2.gz OAXCISMVKFWALT-MSYGRNIXSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cnc2ccsc2c1 ZINC000480601049 1041412736 /nfs/dbraw/zinc/41/27/36/1041412736.db2.gz NJGQNWWIWBYHFB-BZUAXINKSA-N 2 1 331.529 4.315 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC000667706284 1041421389 /nfs/dbraw/zinc/42/13/89/1041421389.db2.gz WBQTYGYDSJMMNF-OALUTQOASA-N 2 1 341.524 4.035 20 0 EIADMP COc1cc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1OC ZINC000480611637 1041422589 /nfs/dbraw/zinc/42/25/89/1041422589.db2.gz OPJGOJUXXAZOIY-WMZOPIPTSA-N 2 1 348.531 4.175 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000467554510 1041423000 /nfs/dbraw/zinc/42/30/00/1041423000.db2.gz OHSINPYAQIJJAL-YLJYHZDGSA-N 2 1 346.478 4.344 20 0 EIADMP COc1ccc(OC)c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000480617988 1041426979 /nfs/dbraw/zinc/42/69/79/1041426979.db2.gz VRBMIILHSPLWRZ-DLBZAZTESA-N 2 1 334.504 4.009 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000480666438 1041461056 /nfs/dbraw/zinc/46/10/56/1041461056.db2.gz IQYSWQVMNJTJNZ-AWEZNQCLSA-N 2 1 334.410 4.046 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000480666438 1041461059 /nfs/dbraw/zinc/46/10/59/1041461059.db2.gz IQYSWQVMNJTJNZ-AWEZNQCLSA-N 2 1 334.410 4.046 20 0 EIADMP c1ccc(COC[C@H]([NH2+]CCC[NH+]2CCCC2)c2ccccc2)cc1 ZINC000540456978 1041477695 /nfs/dbraw/zinc/47/76/95/1041477695.db2.gz SUIRANYQPSDISD-QFIPXVFZSA-N 2 1 338.495 4.020 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000195138221 1041487237 /nfs/dbraw/zinc/48/72/37/1041487237.db2.gz NYQSPSIALCMJEX-FUHWJXTLSA-N 2 1 342.458 4.007 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000195138221 1041487240 /nfs/dbraw/zinc/48/72/40/1041487240.db2.gz NYQSPSIALCMJEX-FUHWJXTLSA-N 2 1 342.458 4.007 20 0 EIADMP Cc1cccc(COc2ccc(C[NH2+][C@@H]3CC[N@H+](C)C[C@H]3C)cc2)c1 ZINC000480753976 1041509098 /nfs/dbraw/zinc/50/90/98/1041509098.db2.gz COSKOHGXJMVQEU-XMSQKQJNSA-N 2 1 338.495 4.004 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@@H](C)C1 ZINC000538738193 1041513759 /nfs/dbraw/zinc/51/37/59/1041513759.db2.gz FCFHPPVUSHNYAC-KXBFYZLASA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@@H](C)C1 ZINC000538738193 1041513774 /nfs/dbraw/zinc/51/37/74/1041513774.db2.gz FCFHPPVUSHNYAC-KXBFYZLASA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@@H](C)C1 ZINC000538738193 1041513780 /nfs/dbraw/zinc/51/37/80/1041513780.db2.gz FCFHPPVUSHNYAC-KXBFYZLASA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@@H](C)C1 ZINC000538738193 1041513790 /nfs/dbraw/zinc/51/37/90/1041513790.db2.gz FCFHPPVUSHNYAC-KXBFYZLASA-N 2 1 330.447 4.248 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1c(F)cccc1F ZINC000402035871 1041514700 /nfs/dbraw/zinc/51/47/00/1041514700.db2.gz CYEQTXKRDYQTRO-IIBYNOLFSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccns1 ZINC000924678302 1041580824 /nfs/dbraw/zinc/58/08/24/1041580824.db2.gz BIYDGQXHOSKPQB-HOTGVXAUSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccns1 ZINC000924678302 1041580831 /nfs/dbraw/zinc/58/08/31/1041580831.db2.gz BIYDGQXHOSKPQB-HOTGVXAUSA-N 2 1 329.513 4.226 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cc(C)ccc1OC ZINC000538984303 1041601002 /nfs/dbraw/zinc/60/10/02/1041601002.db2.gz GDXSYYYVDBRRDH-HXUWFJFHSA-N 2 1 330.516 4.451 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000539040710 1041616361 /nfs/dbraw/zinc/61/63/61/1041616361.db2.gz PLDSAIMJORKVFZ-DYXWJJEUSA-N 2 1 337.511 4.341 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)[C@H](C)C1 ZINC000437073869 1041625101 /nfs/dbraw/zinc/62/51/01/1041625101.db2.gz HOMIJMQEDIWFMD-PBHICJAKSA-N 2 1 340.433 4.057 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000540982765 1041766285 /nfs/dbraw/zinc/76/62/85/1041766285.db2.gz SJDMRFDKZVVJAU-FQEVSTJZSA-N 2 1 330.516 4.029 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000540982765 1041766289 /nfs/dbraw/zinc/76/62/89/1041766289.db2.gz SJDMRFDKZVVJAU-FQEVSTJZSA-N 2 1 330.516 4.029 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2cnn(C)c2)C(C)(C)C)CC1 ZINC000540984052 1041767522 /nfs/dbraw/zinc/76/75/22/1041767522.db2.gz CMSPVPUVYRLHKF-UXPWSPDFSA-N 2 1 346.563 4.140 20 0 EIADMP C[N@@H+](CCCc1ccsc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000541202343 1041845142 /nfs/dbraw/zinc/84/51/42/1041845142.db2.gz GWDTWORJVJDZBA-UHFFFAOYSA-N 2 1 343.540 4.314 20 0 EIADMP C[C@H](CC[NH2+][C@@H](C)c1ccccc1OC(F)F)[NH+]1CCCCC1 ZINC000541558862 1042000823 /nfs/dbraw/zinc/00/08/23/1042000823.db2.gz ZLJGBHLFMNIKSL-CABCVRRESA-N 2 1 326.431 4.203 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000438087600 1042039832 /nfs/dbraw/zinc/03/98/32/1042039832.db2.gz LXNMXOLEXHIJNW-VVLHAWIVSA-N 2 1 334.470 4.455 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](CCSc2ccc(Cl)cc2)C1 ZINC000464780564 1042160293 /nfs/dbraw/zinc/16/02/93/1042160293.db2.gz QYQQHFHJROUNOE-HNNXBMFYSA-N 2 1 326.937 4.096 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCSc2ccc(Cl)cc2)C1 ZINC000464780564 1042160295 /nfs/dbraw/zinc/16/02/95/1042160295.db2.gz QYQQHFHJROUNOE-HNNXBMFYSA-N 2 1 326.937 4.096 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464829233 1042186632 /nfs/dbraw/zinc/18/66/32/1042186632.db2.gz FDFZHJOKSBMKAG-WMZOPIPTSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464829233 1042186636 /nfs/dbraw/zinc/18/66/36/1042186636.db2.gz FDFZHJOKSBMKAG-WMZOPIPTSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464829233 1042186638 /nfs/dbraw/zinc/18/66/38/1042186638.db2.gz FDFZHJOKSBMKAG-WMZOPIPTSA-N 2 1 344.449 4.480 20 0 EIADMP C[C@@H](c1ccc(F)c(F)c1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464829233 1042186640 /nfs/dbraw/zinc/18/66/40/1042186640.db2.gz FDFZHJOKSBMKAG-WMZOPIPTSA-N 2 1 344.449 4.480 20 0 EIADMP C[N@@H+](CCc1ccccc1Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845988 1042194250 /nfs/dbraw/zinc/19/42/50/1042194250.db2.gz HZWWFSBSVWPXCV-IBGZPJMESA-N 2 1 342.914 4.336 20 0 EIADMP C[NH+](CCc1ccccc1Cl)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464845988 1042194254 /nfs/dbraw/zinc/19/42/54/1042194254.db2.gz HZWWFSBSVWPXCV-IBGZPJMESA-N 2 1 342.914 4.336 20 0 EIADMP C[NH+](CCc1ccccc1Cl)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464845988 1042194258 /nfs/dbraw/zinc/19/42/58/1042194258.db2.gz HZWWFSBSVWPXCV-IBGZPJMESA-N 2 1 342.914 4.336 20 0 EIADMP C[C@@H]1CCCC[C@H]1OCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464847133 1042194335 /nfs/dbraw/zinc/19/43/35/1042194335.db2.gz UTUIURPIHCXRCE-CEMLEFRQSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1CCCC[C@H]1OCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464847133 1042194341 /nfs/dbraw/zinc/19/43/41/1042194341.db2.gz UTUIURPIHCXRCE-CEMLEFRQSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1CCCC[C@H]1OCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464847133 1042194345 /nfs/dbraw/zinc/19/43/45/1042194345.db2.gz UTUIURPIHCXRCE-CEMLEFRQSA-N 2 1 344.543 4.036 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCCOc3ccc(F)cc3)C2)CC1 ZINC000302998427 1042231371 /nfs/dbraw/zinc/23/13/71/1042231371.db2.gz HIOGYLUKGIXUTF-LJQANCHMSA-N 2 1 348.506 4.039 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CC2(c3cccc(F)c3F)CCCC2)[C@H](C)C1 ZINC000426055482 1042237693 /nfs/dbraw/zinc/23/76/93/1042237693.db2.gz RTVYBQCKDDKSGR-CRAIPNDOSA-N 2 1 336.470 4.097 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+](C)CCCn2cc[nH+]c2C)cc1 ZINC000518619425 1042592557 /nfs/dbraw/zinc/59/25/57/1042592557.db2.gz ULXPBZUXWRQGOC-UHFFFAOYSA-N 2 1 349.478 4.389 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)CCCn2cc[nH+]c2C)cc1 ZINC000518619425 1042592566 /nfs/dbraw/zinc/59/25/66/1042592566.db2.gz ULXPBZUXWRQGOC-UHFFFAOYSA-N 2 1 349.478 4.389 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccncc1 ZINC000173927430 1042629405 /nfs/dbraw/zinc/62/94/05/1042629405.db2.gz HHOBQLUNJLYZFJ-OTWHNJEPSA-N 2 1 337.511 4.410 20 0 EIADMP CC(C)CSCCC[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492426625 1042648920 /nfs/dbraw/zinc/64/89/20/1042648920.db2.gz WLTOBZDNXVIREY-UYAOXDASSA-N 2 1 334.573 4.266 20 0 EIADMP Clc1ccc(CNC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c(Cl)c1 ZINC001167964877 1042717291 /nfs/dbraw/zinc/71/72/91/1042717291.db2.gz ZGZHQFUHXSKBBY-ALOPSCKCSA-N 2 1 339.310 4.488 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000439789395 1042768484 /nfs/dbraw/zinc/76/84/84/1042768484.db2.gz PKXGRTPVRGANEF-NRFANRHFSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cn(C)nc2C2CCCCC2)CC1 ZINC000542465054 1042811107 /nfs/dbraw/zinc/81/11/07/1042811107.db2.gz QEBWQHXTLLUNIH-UHFFFAOYSA-N 2 1 346.563 4.020 20 0 EIADMP c1ccc(CSCCC[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000536382713 1042817091 /nfs/dbraw/zinc/81/70/91/1042817091.db2.gz NEUBRQROERRPBU-FQEVSTJZSA-N 2 1 332.557 4.118 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000310067874 1042827001 /nfs/dbraw/zinc/82/70/01/1042827001.db2.gz CCUIKCVOFUJRII-NVXWUHKLSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1F ZINC000310067874 1042827002 /nfs/dbraw/zinc/82/70/02/1042827002.db2.gz CCUIKCVOFUJRII-NVXWUHKLSA-N 2 1 330.422 4.138 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310236031 1042831883 /nfs/dbraw/zinc/83/18/83/1042831883.db2.gz KSFFZNFLYDVSOF-YTQUADARSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000310591410 1042840966 /nfs/dbraw/zinc/84/09/66/1042840966.db2.gz OPYBISDIEXOZAY-LQWHRVPQSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000310591410 1042840969 /nfs/dbraw/zinc/84/09/69/1042840969.db2.gz OPYBISDIEXOZAY-LQWHRVPQSA-N 2 1 338.495 4.399 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310970369 1042848879 /nfs/dbraw/zinc/84/88/79/1042848879.db2.gz DDQQVYWGAWSCGW-ICSRJNTNSA-N 2 1 338.495 4.176 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1OC ZINC000310985597 1042849373 /nfs/dbraw/zinc/84/93/73/1042849373.db2.gz GTHDBFODEHWHDM-TZIWHRDSSA-N 2 1 338.495 4.258 20 0 EIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCc2cc(F)ccc2C1 ZINC001168448844 1042859919 /nfs/dbraw/zinc/85/99/19/1042859919.db2.gz QGSQIIBYUBMARV-QFIPXVFZSA-N 2 1 344.518 4.412 20 0 EIADMP COc1ccc([C@H]([NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c2ccccc2)cc1 ZINC000493277232 1042891117 /nfs/dbraw/zinc/89/11/17/1042891117.db2.gz PQZVAEDXJRBGLU-JAXLGGSGSA-N 2 1 338.495 4.247 20 0 EIADMP CC[C@H]1C[C@H](C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000507784921 1042935085 /nfs/dbraw/zinc/93/50/85/1042935085.db2.gz UERKNUIPWHBCQB-YADHBBJMSA-N 2 1 344.543 4.036 20 0 EIADMP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000493889998 1042972251 /nfs/dbraw/zinc/97/22/51/1042972251.db2.gz ZVJIVCOYSFAYKF-AVRDEDQJSA-N 2 1 338.495 4.017 20 0 EIADMP CC[C@@H]1C[C@@H](C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)CCO1 ZINC000507791856 1042974880 /nfs/dbraw/zinc/97/48/80/1042974880.db2.gz DEELGINHOSLZLF-HLAWJBBLSA-N 2 1 336.564 4.168 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2cc(Br)cs2)CC1 ZINC000194088855 1042982632 /nfs/dbraw/zinc/98/26/32/1042982632.db2.gz SNXZLARPVYGYTN-LLVKDONJSA-N 2 1 331.323 4.034 20 0 EIADMP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(Br)c(Cl)c2)C1 ZINC000494081522 1043014434 /nfs/dbraw/zinc/01/44/34/1043014434.db2.gz ZBUMBUJLQYGBJZ-OLZOCXBDSA-N 2 1 345.712 4.065 20 0 EIADMP COc1ccc2oc(C[NH2+][C@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)cc2c1 ZINC000183100937 1043037345 /nfs/dbraw/zinc/03/73/45/1043037345.db2.gz LLFPMPQQKFLGON-CVEARBPZSA-N 2 1 342.483 4.184 20 0 EIADMP COc1ccc2oc(C[NH2+][C@H](C)[C@H]3CCC[N@H+](C4CCC4)C3)cc2c1 ZINC000183100937 1043037352 /nfs/dbraw/zinc/03/73/52/1043037352.db2.gz LLFPMPQQKFLGON-CVEARBPZSA-N 2 1 342.483 4.184 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000429144364 1043082415 /nfs/dbraw/zinc/08/24/15/1043082415.db2.gz UNBJNPFDKLWYIP-QGZVFWFLSA-N 2 1 335.904 4.102 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000429144364 1043082432 /nfs/dbraw/zinc/08/24/32/1043082432.db2.gz UNBJNPFDKLWYIP-QGZVFWFLSA-N 2 1 335.904 4.102 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000338773332 1043134825 /nfs/dbraw/zinc/13/48/25/1043134825.db2.gz FRMPCPBQLXRYSA-ULQDDVLXSA-N 2 1 341.499 4.425 20 0 EIADMP Brc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CCC2 ZINC000356682445 1043253330 /nfs/dbraw/zinc/25/33/30/1043253330.db2.gz SDWNQWRLVNSSAD-LZLYRXPVSA-N 2 1 349.316 4.043 20 0 EIADMP CSCCCCC[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000186772668 1043308048 /nfs/dbraw/zinc/30/80/48/1043308048.db2.gz SZBDANACFHFKGN-HSALFYBXSA-N 2 1 332.557 4.020 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)C1CCSCC1 ZINC000187122115 1043329960 /nfs/dbraw/zinc/32/99/60/1043329960.db2.gz GWUCORRZDFNTMC-HOTGVXAUSA-N 2 1 338.586 4.081 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCSCC1 ZINC000187122115 1043329981 /nfs/dbraw/zinc/32/99/81/1043329981.db2.gz GWUCORRZDFNTMC-HOTGVXAUSA-N 2 1 338.586 4.081 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000188977131 1043397201 /nfs/dbraw/zinc/39/72/01/1043397201.db2.gz CNMHTIHABQBMSM-ZDUSSCGKSA-N 2 1 344.421 4.499 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCC34CCCC4)CC2)cs1 ZINC000189120782 1043438671 /nfs/dbraw/zinc/43/86/71/1043438671.db2.gz UXEQXQVFLNRSMA-GOSISDBHSA-N 2 1 347.572 4.230 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3F)s2)C1 ZINC000520943398 1043444391 /nfs/dbraw/zinc/44/43/91/1043444391.db2.gz AIFQFQQUGVCRPX-OAHLLOKOSA-N 2 1 332.488 4.376 20 0 EIADMP CCc1nc(C)c(CN(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC000428242689 1043462438 /nfs/dbraw/zinc/46/24/38/1043462438.db2.gz WEBWELBOWQSTNO-QFBILLFUSA-N 2 1 341.499 4.030 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467363818 1043577707 /nfs/dbraw/zinc/57/77/07/1043577707.db2.gz GBQFDCAWLNURDZ-OALUTQOASA-N 2 1 340.515 4.035 20 0 EIADMP Clc1ccc(-c2cc(CN3CCC[C@H](n4ccnc4)C3)on2)cc1 ZINC000674322008 1043597705 /nfs/dbraw/zinc/59/77/05/1043597705.db2.gz GNFUCFLDGDSRSM-INIZCTEOSA-N 2 1 342.830 4.029 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3cccnc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000674336107 1043605242 /nfs/dbraw/zinc/60/52/42/1043605242.db2.gz ZAMKKSBYZHQQOB-PGRDOPGGSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3cccnc3c2)CC[N@H+]1Cc1ccccc1 ZINC000674336107 1043605259 /nfs/dbraw/zinc/60/52/59/1043605259.db2.gz ZAMKKSBYZHQQOB-PGRDOPGGSA-N 2 1 345.490 4.378 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)Cc1ccc(C(C)C)cc1 ZINC000544347085 1043726430 /nfs/dbraw/zinc/72/64/30/1043726430.db2.gz DVJBMIYSGUGKKB-UHFFFAOYSA-N 2 1 334.467 4.331 20 0 EIADMP COCCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000521477538 1043787740 /nfs/dbraw/zinc/78/77/40/1043787740.db2.gz RLFSCTLNDBHCCU-BHDDXSALSA-N 2 1 344.543 4.084 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cnn1C(C)(C)C ZINC000191178413 1043789235 /nfs/dbraw/zinc/78/92/35/1043789235.db2.gz XVXXDQCIOXZNSA-IRXDYDNUSA-N 2 1 334.552 4.109 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cnn1C(C)C ZINC000191179505 1043793288 /nfs/dbraw/zinc/79/32/88/1043793288.db2.gz CLDQIXNBMIJRJN-FGTMMUONSA-N 2 1 334.552 4.181 20 0 EIADMP C[NH+]1CCC([NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442645540 1043795410 /nfs/dbraw/zinc/79/54/10/1043795410.db2.gz IXBUTCUSLCDQMT-YOEHRIQHSA-N 2 1 326.406 4.025 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cnn1C(C)C ZINC000191491613 1043820823 /nfs/dbraw/zinc/82/08/23/1043820823.db2.gz RPPYYGBKOWFJBI-XYJFISCASA-N 2 1 332.536 4.076 20 0 EIADMP Cc1c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cnn1C(C)C ZINC000191491613 1043820828 /nfs/dbraw/zinc/82/08/28/1043820828.db2.gz RPPYYGBKOWFJBI-XYJFISCASA-N 2 1 332.536 4.076 20 0 EIADMP FC(F)(F)c1cccc(CCCC[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000192469806 1043926682 /nfs/dbraw/zinc/92/66/82/1043926682.db2.gz FDGSUYVDSVKXJP-MRXNPFEDSA-N 2 1 340.433 4.102 20 0 EIADMP C[C@@H](C[NH2+]Cc1c[nH+]ccc1N(C)C)c1ccc(C(F)(F)F)cc1 ZINC000442994565 1043938847 /nfs/dbraw/zinc/93/88/47/1043938847.db2.gz CMPZMDDDZHKULC-ZDUSSCGKSA-N 2 1 337.389 4.060 20 0 EIADMP C[C@@H]([NH2+]CCc1ccc(F)cc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000428271199 1044063863 /nfs/dbraw/zinc/06/38/63/1044063863.db2.gz YHMKTQBJKAQMKQ-GDBMZVCRSA-N 2 1 338.898 4.264 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035644 1044174913 /nfs/dbraw/zinc/17/49/13/1044174913.db2.gz CMUWDRBBSFHYDV-KBXCAEBGSA-N 2 1 332.875 4.372 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035644 1044174934 /nfs/dbraw/zinc/17/49/34/1044174934.db2.gz CMUWDRBBSFHYDV-KBXCAEBGSA-N 2 1 332.875 4.372 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035644 1044174947 /nfs/dbraw/zinc/17/49/47/1044174947.db2.gz CMUWDRBBSFHYDV-KBXCAEBGSA-N 2 1 332.875 4.372 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000522035644 1044174966 /nfs/dbraw/zinc/17/49/66/1044174966.db2.gz CMUWDRBBSFHYDV-KBXCAEBGSA-N 2 1 332.875 4.372 20 0 EIADMP COc1ccc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cc1Cl ZINC000174312974 1044260600 /nfs/dbraw/zinc/26/06/00/1044260600.db2.gz VKYWPJQSTKJYBO-UHFFFAOYSA-N 2 1 346.902 4.479 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCc3ccc(F)cc32)CC1 ZINC000479416541 1044264395 /nfs/dbraw/zinc/26/43/95/1044264395.db2.gz FELPOFDWKRODDQ-JOCHJYFZSA-N 2 1 338.470 4.376 20 0 EIADMP Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000733797888 1044316233 /nfs/dbraw/zinc/31/62/33/1044316233.db2.gz CAFLJSQFQRLDDT-HNNXBMFYSA-N 2 1 327.472 4.128 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3ncccc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168020343 1044380197 /nfs/dbraw/zinc/38/01/97/1044380197.db2.gz MHNNIWZKHMIXGR-KQZHTCIUSA-N 2 1 349.522 4.490 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCc2cccnc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168021952 1044462712 /nfs/dbraw/zinc/46/27/12/1044462712.db2.gz RNPFEWYOJVVLOG-HATOLVCRSA-N 2 1 337.511 4.045 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)c(C)c2c1 ZINC000675752375 1044467424 /nfs/dbraw/zinc/46/74/24/1044467424.db2.gz RZXOLPJXFOKLJW-XHSDSOJGSA-N 2 1 328.456 4.027 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)c(C)c2c1 ZINC000675752375 1044467434 /nfs/dbraw/zinc/46/74/34/1044467434.db2.gz RZXOLPJXFOKLJW-XHSDSOJGSA-N 2 1 328.456 4.027 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000443583900 1044494479 /nfs/dbraw/zinc/49/44/79/1044494479.db2.gz QXWJOEDWPLRKMM-XMCHAPAWSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000443583900 1044494484 /nfs/dbraw/zinc/49/44/84/1044494484.db2.gz QXWJOEDWPLRKMM-XMCHAPAWSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000443583900 1044494492 /nfs/dbraw/zinc/49/44/92/1044494492.db2.gz QXWJOEDWPLRKMM-XMCHAPAWSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000443583900 1044494497 /nfs/dbraw/zinc/49/44/97/1044494497.db2.gz QXWJOEDWPLRKMM-XMCHAPAWSA-N 2 1 330.903 4.276 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CC[C@@H](c2cc(C)cc(C)c2)C1 ZINC000543412783 1044554761 /nfs/dbraw/zinc/55/47/61/1044554761.db2.gz OAVUYJDJTGYWTG-LJQANCHMSA-N 2 1 346.478 4.182 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2C)C1 ZINC000443637615 1044585640 /nfs/dbraw/zinc/58/56/40/1044585640.db2.gz GPTYCYDECQRPKP-HNNXBMFYSA-N 2 1 328.422 4.178 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2C)C1 ZINC000443637615 1044585658 /nfs/dbraw/zinc/58/56/58/1044585658.db2.gz GPTYCYDECQRPKP-HNNXBMFYSA-N 2 1 328.422 4.178 20 0 EIADMP Cc1ccccc1[C@H]([NH2+]CCc1c[nH+]cn1C)[C@H]1CCC[C@@H](C)C1 ZINC001168724423 1044598404 /nfs/dbraw/zinc/59/84/04/1044598404.db2.gz WCBBJAYPNAXICG-PLMTUMEDSA-N 2 1 325.500 4.428 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ocnc3c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168024330 1044611987 /nfs/dbraw/zinc/61/19/87/1044611987.db2.gz FDDAYYRGGPFLSR-XEMDLRDOSA-N 2 1 349.478 4.359 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3csc(-c4cccs4)n3)C2)CC1 ZINC000550573288 1044695752 /nfs/dbraw/zinc/69/57/52/1044695752.db2.gz BNUPBSXUKKYVGQ-OAHLLOKOSA-N 2 1 347.553 4.035 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(F)(F)F)s2)C1 ZINC000428869844 1044783890 /nfs/dbraw/zinc/78/38/90/1044783890.db2.gz CPDUGDLWGAHTBI-ZDUSSCGKSA-N 2 1 334.451 4.225 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(F)(F)F)s2)C1 ZINC000428869844 1044783903 /nfs/dbraw/zinc/78/39/03/1044783903.db2.gz CPDUGDLWGAHTBI-ZDUSSCGKSA-N 2 1 334.451 4.225 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2nc3ccc(F)cc3s2)C1 ZINC000428878593 1044809944 /nfs/dbraw/zinc/80/99/44/1044809944.db2.gz AMMLCHQRAQRDSW-GASCZTMLSA-N 2 1 349.519 4.283 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccn(C)n1 ZINC000543601359 1044892202 /nfs/dbraw/zinc/89/22/02/1044892202.db2.gz FRMDNGDEQXLJHW-FQEVSTJZSA-N 2 1 340.515 4.037 20 0 EIADMP Cc1cc(C#N)ccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390899069 1044902835 /nfs/dbraw/zinc/90/28/35/1044902835.db2.gz PFDSAWIWJPONAY-QFIPXVFZSA-N 2 1 347.506 4.257 20 0 EIADMP Cc1cc(C#N)ccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390899069 1044902860 /nfs/dbraw/zinc/90/28/60/1044902860.db2.gz PFDSAWIWJPONAY-QFIPXVFZSA-N 2 1 347.506 4.257 20 0 EIADMP Clc1cccc2c1C[C@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001168735394 1044980208 /nfs/dbraw/zinc/98/02/08/1044980208.db2.gz SDIDRTWYDFKIIE-QZTJIDSGSA-N 2 1 332.919 4.148 20 0 EIADMP Clc1cccc2c1C[C@@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001168735395 1044980820 /nfs/dbraw/zinc/98/08/20/1044980820.db2.gz SDIDRTWYDFKIIE-ROUUACIJSA-N 2 1 332.919 4.148 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1cccc(Cl)c1 ZINC000673627875 1045048956 /nfs/dbraw/zinc/04/89/56/1045048956.db2.gz WEBYHMHCIMXESU-RTBURBONSA-N 2 1 336.907 4.024 20 0 EIADMP S=c1ccn(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c2ccccc12 ZINC000738271546 1045049368 /nfs/dbraw/zinc/04/93/68/1045049368.db2.gz NLNRZMKYIPGWMK-QGZVFWFLSA-N 2 1 341.524 4.279 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCc2cccs2)CC[N@@H+]1Cc1ccccc1 ZINC000738330856 1045051916 /nfs/dbraw/zinc/05/19/16/1045051916.db2.gz JISLDNSHLCWVMT-PKOBYXMFSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCc2cccs2)CC[N@H+]1Cc1ccccc1 ZINC000738330856 1045051926 /nfs/dbraw/zinc/05/19/26/1045051926.db2.gz JISLDNSHLCWVMT-PKOBYXMFSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)CCc2cccs2)CC[NH+]1Cc1ccccc1 ZINC000738330856 1045051942 /nfs/dbraw/zinc/05/19/42/1045051942.db2.gz JISLDNSHLCWVMT-PKOBYXMFSA-N 2 1 328.525 4.276 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)CCc2cccs2)CC[NH+]1Cc1ccccc1 ZINC000738330856 1045051946 /nfs/dbraw/zinc/05/19/46/1045051946.db2.gz JISLDNSHLCWVMT-PKOBYXMFSA-N 2 1 328.525 4.276 20 0 EIADMP Cc1nc([C@@H](C)[N@H+]2CC[C@@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000923480072 1045131915 /nfs/dbraw/zinc/13/19/15/1045131915.db2.gz DULRNROEFBNKEI-ZIAGYGMSSA-N 2 1 333.863 4.035 20 0 EIADMP C[C@@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC([C@H]2CCC[NH2+]CC2)CC1 ZINC000923508525 1045140836 /nfs/dbraw/zinc/14/08/36/1045140836.db2.gz WJUKUOYVHMPILF-HOTGVXAUSA-N 2 1 333.520 4.135 20 0 EIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000237441553 1045385695 /nfs/dbraw/zinc/38/56/95/1045385695.db2.gz LGVMMCLYPWNYCV-CYBMUJFWSA-N 2 1 326.406 4.230 20 0 EIADMP CCc1c(C)[nH+]c2ccccc2c1N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000443965645 1045450291 /nfs/dbraw/zinc/45/02/91/1045450291.db2.gz WDLPJWGATYASAM-MRXNPFEDSA-N 2 1 334.467 4.223 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccnc(Cl)c2)cc1F ZINC000153718156 1045460404 /nfs/dbraw/zinc/46/04/04/1045460404.db2.gz UPWXHAJWVUQRGA-GFCCVEGCSA-N 2 1 344.821 4.219 20 0 EIADMP Fc1ccc(Cl)cc1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000393751483 1045490272 /nfs/dbraw/zinc/49/02/72/1045490272.db2.gz RXEQTZSSAMOXQC-MRXNPFEDSA-N 2 1 332.850 4.091 20 0 EIADMP Fc1ccc(Cl)cc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000393751483 1045490277 /nfs/dbraw/zinc/49/02/77/1045490277.db2.gz RXEQTZSSAMOXQC-MRXNPFEDSA-N 2 1 332.850 4.091 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC([NH2+]Cc3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170156948 1045782278 /nfs/dbraw/zinc/78/22/78/1045782278.db2.gz IRFWZRNFGWTUSD-KDOFPFPSSA-N 2 1 340.433 4.448 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCSc1ccccc1 ZINC000397977360 1045818756 /nfs/dbraw/zinc/81/87/56/1045818756.db2.gz KZLAHAZGPLXGSG-GHTZIAJQSA-N 2 1 340.536 4.279 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCCCC1(F)F ZINC000398023824 1045823129 /nfs/dbraw/zinc/82/31/29/1045823129.db2.gz LEWJMHBYEPLOIJ-NEWSRXKRSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCCCC1(F)F ZINC000398023826 1045824119 /nfs/dbraw/zinc/82/41/19/1045824119.db2.gz LEWJMHBYEPLOIJ-QRQLOZEOSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1nc(-c2ccccc2)cs1 ZINC000246813608 1045831453 /nfs/dbraw/zinc/83/14/53/1045831453.db2.gz AVBIPIAMXGBBRG-XIRDDKMYSA-N 2 1 327.497 4.088 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](CC)c2ccc(F)cc2)[C@H](C)C1 ZINC000246825186 1045833631 /nfs/dbraw/zinc/83/36/31/1045833631.db2.gz ADSMFFUVCAJAEV-UXPWSPDFSA-N 2 1 336.495 4.003 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1cncc(F)c1 ZINC000247004129 1045837199 /nfs/dbraw/zinc/83/71/99/1045837199.db2.gz KVWHHRTWTGHHJN-IAGOWNOFSA-N 2 1 341.474 4.303 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000247123254 1045840771 /nfs/dbraw/zinc/84/07/71/1045840771.db2.gz RFTIWVPMOVTUCU-RTBURBONSA-N 2 1 340.515 4.178 20 0 EIADMP Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C3CCC3)C1)CCC2 ZINC000248392815 1045868109 /nfs/dbraw/zinc/86/81/09/1045868109.db2.gz DHDHOQQKKDMISZ-JLJPHGGASA-N 2 1 333.545 4.072 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cncc3ccccc32)C1 ZINC000769148840 1045883252 /nfs/dbraw/zinc/88/32/52/1045883252.db2.gz TZMAOXHUIXPEAV-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cncc3ccccc32)C1 ZINC000769148840 1045883254 /nfs/dbraw/zinc/88/32/54/1045883254.db2.gz TZMAOXHUIXPEAV-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cncc3ccccc32)C1 ZINC000769148840 1045883259 /nfs/dbraw/zinc/88/32/59/1045883259.db2.gz TZMAOXHUIXPEAV-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cncc3ccccc32)C1 ZINC000769148840 1045883257 /nfs/dbraw/zinc/88/32/57/1045883257.db2.gz TZMAOXHUIXPEAV-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP c1ccc(N2CCCCC2)c(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000769466600 1045982850 /nfs/dbraw/zinc/98/28/50/1045982850.db2.gz MVOXVKOZZRNBCA-NRFANRHFSA-N 2 1 341.543 4.127 20 0 EIADMP c1ccc(N2CCCCC2)c(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000769466600 1045982867 /nfs/dbraw/zinc/98/28/67/1045982867.db2.gz MVOXVKOZZRNBCA-NRFANRHFSA-N 2 1 341.543 4.127 20 0 EIADMP Cc1cccc(COc2ccc([C@H](C)[NH2+]C3CC[NH+](C)CC3)cc2)c1 ZINC000161523541 1046005390 /nfs/dbraw/zinc/00/53/90/1046005390.db2.gz DFPQUWUZHAGPDH-SFHVURJKSA-N 2 1 338.495 4.319 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(F)c(Br)c2)CC1 ZINC000037236935 1046092288 /nfs/dbraw/zinc/09/22/88/1046092288.db2.gz VLHMIHOBVLYGOA-LBPRGKRZSA-N 2 1 343.284 4.113 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000261932084 1046166187 /nfs/dbraw/zinc/16/61/87/1046166187.db2.gz LROFGFGVTRBGQM-SJORKVTESA-N 2 1 343.540 4.419 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@@H](C)c3ccc(C)c(C)c3)CC2)nc(C)[nH+]1 ZINC000162259431 1046166220 /nfs/dbraw/zinc/16/62/20/1046166220.db2.gz MGWWQIZQKJPJHS-KRWDZBQOSA-N 2 1 338.499 4.030 20 0 EIADMP C[NH2+]C[C@@H]1CCC[N@@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000262052729 1046173813 /nfs/dbraw/zinc/17/38/13/1046173813.db2.gz ZVFWEQXMRAYNRA-INIZCTEOSA-N 2 1 344.449 4.028 20 0 EIADMP CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000476006309 1046196494 /nfs/dbraw/zinc/19/64/94/1046196494.db2.gz BCSIFLTXAXHIBN-DLBZAZTESA-N 2 1 345.531 4.166 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2N(C)C)c1 ZINC000123976467 1046209557 /nfs/dbraw/zinc/20/95/57/1046209557.db2.gz KLTJIGWBZVBNRL-MRXNPFEDSA-N 2 1 343.490 4.194 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CC(C)(C)OC2(C)C)CC1 ZINC000125175612 1046292210 /nfs/dbraw/zinc/29/22/10/1046292210.db2.gz VLODVMLGVFQSCA-QFBILLFUSA-N 2 1 330.516 4.148 20 0 EIADMP CCOc1ccc([C@@H]2CCC[N@@H+]2CCCCn2cc[nH+]c2C)cc1 ZINC000125430159 1046307329 /nfs/dbraw/zinc/30/73/29/1046307329.db2.gz IJVGSZJERBOTJE-FQEVSTJZSA-N 2 1 327.472 4.208 20 0 EIADMP CCOc1ccc([C@@H]2CCC[N@H+]2CCCCn2cc[nH+]c2C)cc1 ZINC000125430159 1046307348 /nfs/dbraw/zinc/30/73/48/1046307348.db2.gz IJVGSZJERBOTJE-FQEVSTJZSA-N 2 1 327.472 4.208 20 0 EIADMP C[C@H]([NH2+]CCc1cc2ccccc2o1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508701203 1046333683 /nfs/dbraw/zinc/33/36/83/1046333683.db2.gz SHLPOKPKYKPLSH-GHTZIAJQSA-N 2 1 348.490 4.476 20 0 EIADMP COCc1ccccc1/C=C(\C)CN(C)CC[C@@H]1CCCC[N@H+]1C ZINC000508742996 1046493124 /nfs/dbraw/zinc/49/31/24/1046493124.db2.gz IOKVETOHESQPCX-RHYRFBSLSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000508742996 1046493132 /nfs/dbraw/zinc/49/31/32/1046493132.db2.gz IOKVETOHESQPCX-RHYRFBSLSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(\C)C[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000508742996 1046493139 /nfs/dbraw/zinc/49/31/39/1046493139.db2.gz IOKVETOHESQPCX-RHYRFBSLSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC000508742996 1046493149 /nfs/dbraw/zinc/49/31/49/1046493149.db2.gz IOKVETOHESQPCX-RHYRFBSLSA-N 2 1 330.516 4.043 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC000508742996 1046493152 /nfs/dbraw/zinc/49/31/52/1046493152.db2.gz IOKVETOHESQPCX-RHYRFBSLSA-N 2 1 330.516 4.043 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCOc2c(Cl)cc(C)cc21 ZINC000126741304 1046521113 /nfs/dbraw/zinc/52/11/13/1046521113.db2.gz WLRPJKHYBKVJGB-GOSISDBHSA-N 2 1 347.890 4.437 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000536652413 1046595180 /nfs/dbraw/zinc/59/51/80/1046595180.db2.gz JHVSRCXGPOCXNW-UHFFFAOYSA-N 2 1 339.321 4.001 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cc(C)c(C)cc2OC(F)F)C[C@@H]1C ZINC000536662080 1046632479 /nfs/dbraw/zinc/63/24/79/1046632479.db2.gz NSCXMZUIAFZNCO-DOTOQJQBSA-N 2 1 340.458 4.209 20 0 EIADMP COc1ccc(-c2ccccc2)cc1CN(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000536661960 1046632641 /nfs/dbraw/zinc/63/26/41/1046632641.db2.gz JKENQNLPXJFYDB-LAUBAEHRSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@H+](C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000536661960 1046632650 /nfs/dbraw/zinc/63/26/50/1046632650.db2.gz JKENQNLPXJFYDB-LAUBAEHRSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000536661960 1046632659 /nfs/dbraw/zinc/63/26/59/1046632659.db2.gz JKENQNLPXJFYDB-LAUBAEHRSA-N 2 1 338.495 4.277 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cc(C)c(Br)s2)C[C@@H]1C ZINC000536662003 1046633618 /nfs/dbraw/zinc/63/36/18/1046633618.db2.gz JXYWTJNXUBXDQY-QWHCGFSZSA-N 2 1 345.350 4.124 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(Br)s2)C[C@@H]1C ZINC000536662003 1046633626 /nfs/dbraw/zinc/63/36/26/1046633626.db2.gz JXYWTJNXUBXDQY-QWHCGFSZSA-N 2 1 345.350 4.124 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(Br)s2)C[C@@H]1C ZINC000536662003 1046633637 /nfs/dbraw/zinc/63/36/37/1046633637.db2.gz JXYWTJNXUBXDQY-QWHCGFSZSA-N 2 1 345.350 4.124 20 0 EIADMP COc1cccc(-c2ccc(C[NH2+]C3CC[NH+](C4CC4)CC3)cc2)c1 ZINC000459412094 1046636781 /nfs/dbraw/zinc/63/67/81/1046636781.db2.gz MSUYRIORNBGNTN-UHFFFAOYSA-N 2 1 336.479 4.079 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536666735 1046641962 /nfs/dbraw/zinc/64/19/62/1046641962.db2.gz MQIWBHWDMFXXTL-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536666735 1046641981 /nfs/dbraw/zinc/64/19/81/1046641981.db2.gz MQIWBHWDMFXXTL-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536666735 1046641996 /nfs/dbraw/zinc/64/19/96/1046641996.db2.gz MQIWBHWDMFXXTL-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536666735 1046642005 /nfs/dbraw/zinc/64/20/05/1046642005.db2.gz MQIWBHWDMFXXTL-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000536666735 1046642010 /nfs/dbraw/zinc/64/20/10/1046642010.db2.gz MQIWBHWDMFXXTL-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+]C/C=C/c2ccc(OCc3ccccc3)cc2)CC1 ZINC000459459374 1046699143 /nfs/dbraw/zinc/69/91/43/1046699143.db2.gz HKMIXVYQPAXEBN-VMPITWQZSA-N 2 1 348.490 4.130 20 0 EIADMP Cc1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc(C)c1O ZINC000379615156 1046700827 /nfs/dbraw/zinc/70/08/27/1046700827.db2.gz AFXKGXWHSUNYHN-NQIIRXRSSA-N 2 1 338.495 4.152 20 0 EIADMP C[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000459474218 1046720314 /nfs/dbraw/zinc/72/03/14/1046720314.db2.gz CKMOOIORDNYPOK-UNMCSNQZSA-N 2 1 335.495 4.034 20 0 EIADMP CCCn1ccnc1CCC[N@@H+](C)Cc1ccc(OC)c(Cl)c1 ZINC000191495945 1046723634 /nfs/dbraw/zinc/72/36/34/1046723634.db2.gz REHHJDJAQWGXBO-UHFFFAOYSA-N 2 1 335.879 4.020 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(OC)c(Cl)c1 ZINC000191495945 1046723642 /nfs/dbraw/zinc/72/36/42/1046723642.db2.gz REHHJDJAQWGXBO-UHFFFAOYSA-N 2 1 335.879 4.020 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(OC)c(Cl)c1 ZINC000191495945 1046723655 /nfs/dbraw/zinc/72/36/55/1046723655.db2.gz REHHJDJAQWGXBO-UHFFFAOYSA-N 2 1 335.879 4.020 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3ncccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379644945 1046736537 /nfs/dbraw/zinc/73/65/37/1046736537.db2.gz HLTZUMXKXGYXQU-XMSQKQJNSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc3ncccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379644945 1046736548 /nfs/dbraw/zinc/73/65/48/1046736548.db2.gz HLTZUMXKXGYXQU-XMSQKQJNSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cnc3ccccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379659201 1046751218 /nfs/dbraw/zinc/75/12/18/1046751218.db2.gz ZCQMMTVUJVWULD-AVRDEDQJSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cnc3ccccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379659201 1046751232 /nfs/dbraw/zinc/75/12/32/1046751232.db2.gz ZCQMMTVUJVWULD-AVRDEDQJSA-N 2 1 345.490 4.378 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379657621 1046760008 /nfs/dbraw/zinc/76/00/08/1046760008.db2.gz UAPVFNOKVQHUJN-BBTUJRGHSA-N 2 1 338.495 4.399 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379657621 1046760021 /nfs/dbraw/zinc/76/00/21/1046760021.db2.gz UAPVFNOKVQHUJN-BBTUJRGHSA-N 2 1 338.495 4.399 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000536833506 1046809782 /nfs/dbraw/zinc/80/97/82/1046809782.db2.gz PTOCXSMJNMKQNP-QYZOEREBSA-N 2 1 332.532 4.145 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)cc1 ZINC000536831016 1046824688 /nfs/dbraw/zinc/82/46/88/1046824688.db2.gz DQUGMCSTNDFSMJ-QKYXUNIQSA-N 2 1 341.499 4.425 20 0 EIADMP CC(C)CCC[C@@H](C)[NH2+][C@H]1CC[C@H](N2CC[NH+](CC3CC3)CC2)CC1 ZINC001170063874 1046865944 /nfs/dbraw/zinc/86/59/44/1046865944.db2.gz ILTIBLXJFOHICE-CEMLEFRQSA-N 2 1 349.607 4.130 20 0 EIADMP COc1ccc([C@H]([NH2+]CCCC[N@H+]2CCCC[C@H]2C)C2CC2)cc1 ZINC000536947126 1046877005 /nfs/dbraw/zinc/87/70/05/1046877005.db2.gz KCKJLLIOMZRTIG-DYESRHJHSA-N 2 1 330.516 4.391 20 0 EIADMP COc1ccc([C@@H]([NH2+]CCCC[N@H+]2CCC[C@H](C)C2)C2CC2)cc1 ZINC000536946957 1046877493 /nfs/dbraw/zinc/87/74/93/1046877493.db2.gz BRUZMNDYWFAMTK-UWJYYQICSA-N 2 1 330.516 4.248 20 0 EIADMP COc1ccccc1[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)C1CCCC1 ZINC000537016902 1046888571 /nfs/dbraw/zinc/88/85/71/1046888571.db2.gz ZETMDPSXBMXEPC-KKSFZXQISA-N 2 1 341.499 4.357 20 0 EIADMP CC(C)[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(F)cn1 ZINC000497868098 1047140736 /nfs/dbraw/zinc/14/07/36/1047140736.db2.gz NCHZGTDXJKDSPA-FUHIMQAGSA-N 2 1 335.511 4.266 20 0 EIADMP C[C@@H](CC[NH2+][C@@H]1CCc2nc(Cl)ccc21)[N@H+](C)Cc1ccccc1 ZINC000806141305 1047168530 /nfs/dbraw/zinc/16/85/30/1047168530.db2.gz IEHKDHURDUODOM-MAUKXSAKSA-N 2 1 343.902 4.223 20 0 EIADMP C[C@@H](CC[NH2+][C@@H]1CCc2nc(Cl)ccc21)[N@@H+](C)Cc1ccccc1 ZINC000806141305 1047168552 /nfs/dbraw/zinc/16/85/52/1047168552.db2.gz IEHKDHURDUODOM-MAUKXSAKSA-N 2 1 343.902 4.223 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1cc[nH]c(=O)c1 ZINC000788525003 1047200006 /nfs/dbraw/zinc/20/00/06/1047200006.db2.gz AEIGLMZUEHZTQM-IAGOWNOFSA-N 2 1 339.483 4.012 20 0 EIADMP CCc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000789363100 1047409073 /nfs/dbraw/zinc/40/90/73/1047409073.db2.gz RZLCJOKAFNLNHH-ZHRRBRCNSA-N 2 1 349.478 4.127 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@H]3CCCC34CCCC4)CC2)cc1 ZINC000556061240 1047428455 /nfs/dbraw/zinc/42/84/55/1047428455.db2.gz SYRRWNJTSFZQCP-NRFANRHFSA-N 2 1 326.528 4.396 20 0 EIADMP Cc1cccc2c(CC[NH2+][C@@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)c[nH]c21 ZINC000556094493 1047446667 /nfs/dbraw/zinc/44/66/67/1047446667.db2.gz YIBDYVAFIWUWRI-IFMALSPDSA-N 2 1 347.506 4.444 20 0 EIADMP Cc1cccc2c(CC[NH2+][C@@H]3CC[N@H+](C)[C@@H](c4ccccc4)C3)c[nH]c21 ZINC000556094493 1047446672 /nfs/dbraw/zinc/44/66/72/1047446672.db2.gz YIBDYVAFIWUWRI-IFMALSPDSA-N 2 1 347.506 4.444 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)CCS1 ZINC000897788146 1047482966 /nfs/dbraw/zinc/48/29/66/1047482966.db2.gz CCRSPCXHWVEFCA-NMLBUPMWSA-N 2 1 344.568 4.303 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@H]2[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000129754739 1047502334 /nfs/dbraw/zinc/50/23/34/1047502334.db2.gz ZVDGAYLDCXNRIA-YLJYHZDGSA-N 2 1 340.511 4.287 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]C[C@H]3CCc4ccccc43)C2)c1 ZINC000790050335 1047511146 /nfs/dbraw/zinc/51/11/46/1047511146.db2.gz ZJWDZGJUZPPMQQ-PKOBYXMFSA-N 2 1 340.536 4.280 20 0 EIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]C[C@H]3CCc4ccccc43)C2)c1 ZINC000790050335 1047511129 /nfs/dbraw/zinc/51/11/29/1047511129.db2.gz ZJWDZGJUZPPMQQ-PKOBYXMFSA-N 2 1 340.536 4.280 20 0 EIADMP FC1(F)CC[C@@H](CC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000898016711 1047532637 /nfs/dbraw/zinc/53/26/37/1047532637.db2.gz ATVYBJXUSTVZET-SFHVURJKSA-N 2 1 336.470 4.109 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cnn(CC2CCC2)c1 ZINC000898178576 1047575705 /nfs/dbraw/zinc/57/57/05/1047575705.db2.gz CQCSQMQKYSHNOS-QGZVFWFLSA-N 2 1 344.547 4.131 20 0 EIADMP Cc1ccc([C@H](O)C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)cc1 ZINC000763432481 1047753036 /nfs/dbraw/zinc/75/30/36/1047753036.db2.gz MBSRKARZGUVNEJ-DENIHFKCSA-N 2 1 344.543 4.005 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cccc(Cl)n2)CC1 ZINC000763434330 1047808670 /nfs/dbraw/zinc/80/86/70/1047808670.db2.gz WBGXIVMDGPLCAG-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccc(Cl)n2)CC1 ZINC000763434330 1047808675 /nfs/dbraw/zinc/80/86/75/1047808675.db2.gz WBGXIVMDGPLCAG-INIZCTEOSA-N 2 1 335.923 4.212 20 0 EIADMP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC000556590218 1047830901 /nfs/dbraw/zinc/83/09/01/1047830901.db2.gz TWXKLECJMUBYKM-MOXQZVSFSA-N 2 1 344.543 4.289 20 0 EIADMP C[N@H+](Cc1ccc(Cl)cn1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001136930383 1047912577 /nfs/dbraw/zinc/91/25/77/1047912577.db2.gz PENSUWMSXLHBKB-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP Cc1ccc2c(C[N@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c[nH]c2c1 ZINC001136973101 1048016552 /nfs/dbraw/zinc/01/65/52/1048016552.db2.gz MGYQAXVHZNRHQX-IBGZPJMESA-N 2 1 325.500 4.317 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@@H]3CCC[C@@H]4C[C@@H]43)cc2)CC1 ZINC000825033137 1048021915 /nfs/dbraw/zinc/02/19/15/1048021915.db2.gz IERATDXUQFARJL-JRGCBEDISA-N 2 1 327.516 4.065 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CC=C(C)CC3)CC2)cs1 ZINC000556829684 1048043614 /nfs/dbraw/zinc/04/36/14/1048043614.db2.gz QSISGKKZEUYDRR-QGZVFWFLSA-N 2 1 333.545 4.006 20 0 EIADMP CC[N@H+](CCC[NH+](C)C)Cc1ccc(Cl)c(OC(F)(F)F)c1 ZINC001143362077 1048115842 /nfs/dbraw/zinc/11/58/42/1048115842.db2.gz LMSZEIWPAJYUOF-UHFFFAOYSA-N 2 1 338.801 4.012 20 0 EIADMP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(Cl)c(OC(F)(F)F)c1 ZINC001143362077 1048115845 /nfs/dbraw/zinc/11/58/45/1048115845.db2.gz LMSZEIWPAJYUOF-UHFFFAOYSA-N 2 1 338.801 4.012 20 0 EIADMP COc1ccc(C[N@@H+](C(C)C)C2CCN(C)CC2)cc1C(F)(F)F ZINC001143646287 1048134603 /nfs/dbraw/zinc/13/46/03/1048134603.db2.gz MEOSVJWIPNOGKC-UHFFFAOYSA-N 2 1 344.421 4.019 20 0 EIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170763697 1048159277 /nfs/dbraw/zinc/15/92/77/1048159277.db2.gz AXLRHIVEQJLEAN-OWZKRDHZSA-N 2 1 330.491 4.157 20 0 EIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170763697 1048159285 /nfs/dbraw/zinc/15/92/85/1048159285.db2.gz AXLRHIVEQJLEAN-OWZKRDHZSA-N 2 1 330.491 4.157 20 0 EIADMP Cc1c(F)cc(F)cc1C[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001143768106 1048188618 /nfs/dbraw/zinc/18/86/18/1048188618.db2.gz YXISBFZNJMVLQG-GOSISDBHSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1c(F)cc(F)cc1C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001143768106 1048188625 /nfs/dbraw/zinc/18/86/25/1048188625.db2.gz YXISBFZNJMVLQG-GOSISDBHSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1c(F)cc(F)cc1C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001143768106 1048188631 /nfs/dbraw/zinc/18/86/31/1048188631.db2.gz YXISBFZNJMVLQG-GOSISDBHSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1c(F)cc(F)cc1C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001143768106 1048188637 /nfs/dbraw/zinc/18/86/37/1048188637.db2.gz YXISBFZNJMVLQG-GOSISDBHSA-N 2 1 344.449 4.227 20 0 EIADMP Fc1ccc(CN[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c(F)c1 ZINC000499147321 1048349501 /nfs/dbraw/zinc/34/95/01/1048349501.db2.gz PALLXCNVDKDQCY-ACDBMABISA-N 2 1 342.433 4.250 20 0 EIADMP Fc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(F)c1 ZINC000499147321 1048349522 /nfs/dbraw/zinc/34/95/22/1048349522.db2.gz PALLXCNVDKDQCY-ACDBMABISA-N 2 1 342.433 4.250 20 0 EIADMP Fc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c(F)c1 ZINC000499147321 1048349539 /nfs/dbraw/zinc/34/95/39/1048349539.db2.gz PALLXCNVDKDQCY-ACDBMABISA-N 2 1 342.433 4.250 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCOC2CCCCC2)C3)cc1 ZINC000499147824 1048355619 /nfs/dbraw/zinc/35/56/19/1048355619.db2.gz QTWSIFAEBHATIJ-WKCHPHFGSA-N 2 1 342.527 4.121 20 0 EIADMP C[N@@H+](C1CCC([NH3+])CC1)[C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171143553 1048444605 /nfs/dbraw/zinc/44/46/05/1048444605.db2.gz IQYDDNQYRZURMP-YMAMQOFZSA-N 2 1 327.299 4.052 20 0 EIADMP CC(C)Oc1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000809738632 1048509615 /nfs/dbraw/zinc/50/96/15/1048509615.db2.gz CJWPNAAIINEGPR-UHFFFAOYSA-N 2 1 326.484 4.167 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(OCC3CC3)cc2)cc1 ZINC000809738715 1048510511 /nfs/dbraw/zinc/51/05/11/1048510511.db2.gz GIYYCRZFZIWWSG-UHFFFAOYSA-N 2 1 338.495 4.169 20 0 EIADMP C[C@H](NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccccc1SC(C)(C)C ZINC000815576097 1048516960 /nfs/dbraw/zinc/51/69/60/1048516960.db2.gz JIEIFKOYYBCREI-GVDBMIGSSA-N 2 1 348.556 4.091 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CN2CCC[C@@H]2CO1)c1ccccc1SC(C)(C)C ZINC000815576097 1048516976 /nfs/dbraw/zinc/51/69/76/1048516976.db2.gz JIEIFKOYYBCREI-GVDBMIGSSA-N 2 1 348.556 4.091 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc1O ZINC000810214480 1048682060 /nfs/dbraw/zinc/68/20/60/1048682060.db2.gz YQFFQMOEWUUBDO-INIZCTEOSA-N 2 1 346.515 4.096 20 0 EIADMP [NH3+]CCCCCC[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000846223928 1048843759 /nfs/dbraw/zinc/84/37/59/1048843759.db2.gz QLNWOGBLEMYBTG-LBPRGKRZSA-N 2 1 331.323 4.167 20 0 EIADMP CCc1ccc[nH+]c1N([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001170644446 1049273183 /nfs/dbraw/zinc/27/31/83/1049273183.db2.gz NNKSTZPQFGFOIG-NSKBAKJYSA-N 2 1 335.495 4.276 20 0 EIADMP COC1CCC(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000348097487 1049415574 /nfs/dbraw/zinc/41/55/74/1049415574.db2.gz PNNOXTOBUCMQKV-XRTORIHISA-N 2 1 327.472 4.037 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(Cc2ccccc2F)CC1 ZINC000348175669 1049471981 /nfs/dbraw/zinc/47/19/81/1049471981.db2.gz YWQMUKQUKXJONF-UHFFFAOYSA-N 2 1 329.463 4.066 20 0 EIADMP C[N@H+]1CCC[C@@H](CN[C@@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809858 1049553984 /nfs/dbraw/zinc/55/39/84/1049553984.db2.gz JKVFQGSTGJAMRY-KXBFYZLASA-N 2 1 332.875 4.148 20 0 EIADMP CN1CCC[C@@H](C[NH2+][C@@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809858 1049553998 /nfs/dbraw/zinc/55/39/98/1049553998.db2.gz JKVFQGSTGJAMRY-KXBFYZLASA-N 2 1 332.875 4.148 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809858 1049554024 /nfs/dbraw/zinc/55/40/24/1049554024.db2.gz JKVFQGSTGJAMRY-KXBFYZLASA-N 2 1 332.875 4.148 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809858 1049554047 /nfs/dbraw/zinc/55/40/47/1049554047.db2.gz JKVFQGSTGJAMRY-KXBFYZLASA-N 2 1 332.875 4.148 20 0 EIADMP Fc1cc(F)c2c(c1)C[C@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001171381935 1049575388 /nfs/dbraw/zinc/57/53/88/1049575388.db2.gz VZKRYRLXMKFBAI-RTBURBONSA-N 2 1 348.481 4.163 20 0 EIADMP Fc1cc(F)c2c(c1)C[C@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001171381935 1049575401 /nfs/dbraw/zinc/57/54/01/1049575401.db2.gz VZKRYRLXMKFBAI-RTBURBONSA-N 2 1 348.481 4.163 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171382822 1049579779 /nfs/dbraw/zinc/57/97/79/1049579779.db2.gz NCBIFYMSGSSTNA-GOSISDBHSA-N 2 1 336.470 4.018 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccccc2Oc2cccnc2)[C@H](C)C1 ZINC000081096779 1049625164 /nfs/dbraw/zinc/62/51/64/1049625164.db2.gz AWSHODHLRMKYBK-XLIONFOSSA-N 2 1 339.483 4.036 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2Oc2cccnc2)[C@H](C)C1 ZINC000081096779 1049625178 /nfs/dbraw/zinc/62/51/78/1049625178.db2.gz AWSHODHLRMKYBK-XLIONFOSSA-N 2 1 339.483 4.036 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2Oc2cccnc2)[C@H](C)C1 ZINC000081096779 1049625190 /nfs/dbraw/zinc/62/51/90/1049625190.db2.gz AWSHODHLRMKYBK-XLIONFOSSA-N 2 1 339.483 4.036 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2Oc2cccnc2)[C@H](C)C1 ZINC000081096779 1049625205 /nfs/dbraw/zinc/62/52/05/1049625205.db2.gz AWSHODHLRMKYBK-XLIONFOSSA-N 2 1 339.483 4.036 20 0 EIADMP CC1(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)CC(F)(F)C1 ZINC000716691667 1049701765 /nfs/dbraw/zinc/70/17/65/1049701765.db2.gz JICNGSHUMMIDBZ-KSZLIROESA-N 2 1 334.454 4.065 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)[C@@H](C)C1 ZINC000245426610 1049720934 /nfs/dbraw/zinc/72/09/34/1049720934.db2.gz LMOVSLVEFVKZSF-KSSFIOAISA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Cl)c3cccnc23)[C@@H](C)C1 ZINC000245426610 1049720947 /nfs/dbraw/zinc/72/09/47/1049720947.db2.gz LMOVSLVEFVKZSF-KSSFIOAISA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c3cccnc23)[C@@H](C)C1 ZINC000245426610 1049720953 /nfs/dbraw/zinc/72/09/53/1049720953.db2.gz LMOVSLVEFVKZSF-KSSFIOAISA-N 2 1 331.891 4.050 20 0 EIADMP CCC(CC)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cccc(F)c2C1 ZINC001170975624 1049729875 /nfs/dbraw/zinc/72/98/75/1049729875.db2.gz YEASFUVOIWDTJE-BHIYHBOVSA-N 2 1 332.507 4.444 20 0 EIADMP Cc1cccc2c1CC[C@@H]([N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557401 1049755267 /nfs/dbraw/zinc/75/52/67/1049755267.db2.gz APYGVZYFYLSYRR-VAMGGRTRSA-N 2 1 328.544 4.470 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1nccs1 ZINC000245535883 1049769570 /nfs/dbraw/zinc/76/95/70/1049769570.db2.gz KWYADWNEKOKMNQ-IXDOHACOSA-N 2 1 343.540 4.472 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1nccs1 ZINC000245535883 1049769573 /nfs/dbraw/zinc/76/95/73/1049769573.db2.gz KWYADWNEKOKMNQ-IXDOHACOSA-N 2 1 343.540 4.472 20 0 EIADMP Cc1ccc(CC[C@@H](C)[NH+]2CCC([NH3+])(c3ccccc3F)CC2)cc1 ZINC001171667747 1049773915 /nfs/dbraw/zinc/77/39/15/1049773915.db2.gz XWUBVEVLHRTSRY-GOSISDBHSA-N 2 1 340.486 4.405 20 0 EIADMP COc1ccc([C@H]2CCC[N@H+]2C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171637892 1049778940 /nfs/dbraw/zinc/77/89/40/1049778940.db2.gz RFFPGFWIMOVNKM-LJQANCHMSA-N 2 1 330.516 4.484 20 0 EIADMP C[C@H]1C[C@@H](n2cc(CCC[NH3+])c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC001171724897 1049784702 /nfs/dbraw/zinc/78/47/02/1049784702.db2.gz DWJZEQKCPYGLPQ-GHTZIAJQSA-N 2 1 347.506 4.368 20 0 EIADMP C[NH2+]Cc1ccc2c(ccn2[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC001171744481 1049789540 /nfs/dbraw/zinc/78/95/40/1049789540.db2.gz HARYVHNJWSHJRN-UWJYYQICSA-N 2 1 333.479 4.196 20 0 EIADMP CCO[C@@H](CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)C ZINC000245652586 1049812739 /nfs/dbraw/zinc/81/27/39/1049812739.db2.gz CWXFAGRQCRRPFQ-LRSLUSHPSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CCCC[C@@H]1[NH+](C)C ZINC001171959605 1049823731 /nfs/dbraw/zinc/82/37/31/1049823731.db2.gz CNBSIJZAZFVCGU-JQFCIGGWSA-N 2 1 328.422 4.099 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCCc2ccncc2)CC[N@H+]1Cc1ccccc1 ZINC001171965607 1049826743 /nfs/dbraw/zinc/82/67/43/1049826743.db2.gz IJYUGEAMADSSQJ-NRFANRHFSA-N 2 1 337.511 4.047 20 0 EIADMP CCCC[N@@H+](CC)CCN[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171967848 1049827541 /nfs/dbraw/zinc/82/75/41/1049827541.db2.gz NOUADJDYHAGQCJ-OAQYLSRUSA-N 2 1 345.575 4.141 20 0 EIADMP CCCC[NH+](CC)CCN[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171967848 1049827544 /nfs/dbraw/zinc/82/75/44/1049827544.db2.gz NOUADJDYHAGQCJ-OAQYLSRUSA-N 2 1 345.575 4.141 20 0 EIADMP CCCC[NH+](CC)CCN[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171967848 1049827546 /nfs/dbraw/zinc/82/75/46/1049827546.db2.gz NOUADJDYHAGQCJ-OAQYLSRUSA-N 2 1 345.575 4.141 20 0 EIADMP COc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)cc1 ZINC001171969230 1049833904 /nfs/dbraw/zinc/83/39/04/1049833904.db2.gz UOYVCPCSIIQBEJ-FQEVSTJZSA-N 2 1 338.495 4.228 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCCCCCCCO)CC[N@H+]1Cc1ccccc1 ZINC001171974587 1049835806 /nfs/dbraw/zinc/83/58/06/1049835806.db2.gz IAQCLUDBHGWDBE-OAQYLSRUSA-N 2 1 346.559 4.352 20 0 EIADMP CC[NH+](CC)C1CC[NH+]([C@@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171974381 1049835858 /nfs/dbraw/zinc/83/58/58/1049835858.db2.gz SZJDWRFETSTYIW-HNNXBMFYSA-N 2 1 342.449 4.443 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CCc3ncccc32)CC[N@H+]1Cc1ccccc1 ZINC001171977186 1049837049 /nfs/dbraw/zinc/83/70/49/1049837049.db2.gz YCEKTBGYEMBUJN-GHTZIAJQSA-N 2 1 335.495 4.102 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)s1 ZINC001171983194 1049838620 /nfs/dbraw/zinc/83/86/20/1049838620.db2.gz NKOJMFSFTUWPNF-SFHVURJKSA-N 2 1 343.540 4.293 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)s1 ZINC001171983194 1049838622 /nfs/dbraw/zinc/83/86/22/1049838622.db2.gz NKOJMFSFTUWPNF-SFHVURJKSA-N 2 1 343.540 4.293 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2CCCc3ccncc32)CC[N@H+]1Cc1ccccc1 ZINC001171978816 1049838764 /nfs/dbraw/zinc/83/87/64/1049838764.db2.gz LXYKHVYJZMYIQL-IFMALSPDSA-N 2 1 349.522 4.492 20 0 EIADMP CC1(C)C[C@H](n2ncc3cccc(C[NH3+])c32)CC[N@H+]1Cc1ccccc1 ZINC001171982086 1049839261 /nfs/dbraw/zinc/83/92/61/1049839261.db2.gz HCNRTDDKFHTOLZ-HXUWFJFHSA-N 2 1 348.494 4.111 20 0 EIADMP COCC[C@H]1CCCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984116 1049840054 /nfs/dbraw/zinc/84/00/54/1049840054.db2.gz ICURRNLFHPMSIM-RTWAWAEBSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@H]1CCCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984116 1049840055 /nfs/dbraw/zinc/84/00/55/1049840055.db2.gz ICURRNLFHPMSIM-RTWAWAEBSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@H]1CCCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984116 1049840056 /nfs/dbraw/zinc/84/00/56/1049840056.db2.gz ICURRNLFHPMSIM-RTWAWAEBSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@H]1CCCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984116 1049840058 /nfs/dbraw/zinc/84/00/58/1049840058.db2.gz ICURRNLFHPMSIM-RTWAWAEBSA-N 2 1 344.543 4.321 20 0 EIADMP Oc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001172060688 1049842419 /nfs/dbraw/zinc/84/24/19/1049842419.db2.gz BJISDRZABXJWFJ-WKCHPHFGSA-N 2 1 336.479 4.068 20 0 EIADMP CCCO[C@@H]1CC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076487 1049844151 /nfs/dbraw/zinc/84/41/51/1049844151.db2.gz ZOQFPJVFVLRDEC-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP CCCO[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172076487 1049844154 /nfs/dbraw/zinc/84/41/54/1049844154.db2.gz ZOQFPJVFVLRDEC-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP CCCO[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172076487 1049844158 /nfs/dbraw/zinc/84/41/58/1049844158.db2.gz ZOQFPJVFVLRDEC-CIAFKFPVSA-N 2 1 342.527 4.073 20 0 EIADMP CC[N@H+](Cc1cccnc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074670 1049844813 /nfs/dbraw/zinc/84/48/13/1049844813.db2.gz JXAUWNISXCPPCH-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP CC[N@@H+](Cc1cccnc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074670 1049844817 /nfs/dbraw/zinc/84/48/17/1049844817.db2.gz JXAUWNISXCPPCH-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP CC[NH+](Cc1cccnc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172074670 1049844822 /nfs/dbraw/zinc/84/48/22/1049844822.db2.gz JXAUWNISXCPPCH-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP CC[NH+](Cc1cccnc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172074670 1049844824 /nfs/dbraw/zinc/84/48/24/1049844824.db2.gz JXAUWNISXCPPCH-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP C[N@@H+](CCc1ccccn1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172080070 1049846769 /nfs/dbraw/zinc/84/67/69/1049846769.db2.gz SSKHAOUFIRGTJI-NUNAXRQHSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1ccccn1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172080070 1049846773 /nfs/dbraw/zinc/84/67/73/1049846773.db2.gz SSKHAOUFIRGTJI-NUNAXRQHSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1ccccn1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172080070 1049846774 /nfs/dbraw/zinc/84/67/74/1049846774.db2.gz SSKHAOUFIRGTJI-NUNAXRQHSA-N 2 1 349.522 4.142 20 0 EIADMP CCN(Cc1ccccn1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172082773 1049848087 /nfs/dbraw/zinc/84/80/87/1049848087.db2.gz LTHOYXXGFUYFJQ-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP CC[N@H+](Cc1ccccn1)[C@@H]1C[C@H]2CCC[C@@H](C1)N2Cc1ccccc1 ZINC001172082773 1049848090 /nfs/dbraw/zinc/84/80/90/1049848090.db2.gz LTHOYXXGFUYFJQ-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP CC[N@@H+](Cc1ccccn1)[C@@H]1C[C@H]2CCC[C@@H](C1)N2Cc1ccccc1 ZINC001172082773 1049848091 /nfs/dbraw/zinc/84/80/91/1049848091.db2.gz LTHOYXXGFUYFJQ-NUNAXRQHSA-N 2 1 349.522 4.489 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccncc1 ZINC001172066625 1049851185 /nfs/dbraw/zinc/85/11/85/1049851185.db2.gz JPPHKUJKYSZQNR-CIQXWFTPSA-N 2 1 335.495 4.318 20 0 EIADMP FC1(F)C[C@@H]2C[N@H+]([C@H]3C[C@H]4CCC[C@@H](C3)[NH+]4Cc3ccccc3)C[C@@H]21 ZINC001172068506 1049853145 /nfs/dbraw/zinc/85/31/45/1049853145.db2.gz JFWVPBFSZWNNEP-SLHNCBLASA-N 2 1 346.465 4.159 20 0 EIADMP FC1(F)C[C@@H]2C[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4Cc3ccccc3)C[C@@H]21 ZINC001172068506 1049853148 /nfs/dbraw/zinc/85/31/48/1049853148.db2.gz JFWVPBFSZWNNEP-SLHNCBLASA-N 2 1 346.465 4.159 20 0 EIADMP FC1(F)C[C@@H]2C[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4Cc3ccccc3)C[C@@H]21 ZINC001172068506 1049853151 /nfs/dbraw/zinc/85/31/51/1049853151.db2.gz JFWVPBFSZWNNEP-SLHNCBLASA-N 2 1 346.465 4.159 20 0 EIADMP CCCC(O)(CCC)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245777046 1049853150 /nfs/dbraw/zinc/85/31/50/1049853150.db2.gz YGWYMWBIMYDRSF-MZADTFQBSA-N 2 1 344.543 4.103 20 0 EIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172134763 1049854377 /nfs/dbraw/zinc/85/43/77/1049854377.db2.gz ZHYKRJWUDAJQBJ-BJWYYQGGSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172134763 1049854381 /nfs/dbraw/zinc/85/43/81/1049854381.db2.gz ZHYKRJWUDAJQBJ-BJWYYQGGSA-N 2 1 327.299 4.441 20 0 EIADMP C[NH+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172134763 1049854383 /nfs/dbraw/zinc/85/43/83/1049854383.db2.gz ZHYKRJWUDAJQBJ-BJWYYQGGSA-N 2 1 327.299 4.441 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Br)cc1 ZINC001172104769 1049856663 /nfs/dbraw/zinc/85/66/63/1049856663.db2.gz FZVDUDLMWFEPMS-YYQUZTFQSA-N 2 1 337.305 4.115 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Br)cc1 ZINC001172104769 1049856670 /nfs/dbraw/zinc/85/66/70/1049856670.db2.gz FZVDUDLMWFEPMS-YYQUZTFQSA-N 2 1 337.305 4.115 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCSCc1ccccc1Cl)C2 ZINC001172108154 1049857066 /nfs/dbraw/zinc/85/70/66/1049857066.db2.gz QHXHCNJNKVCHOD-OSYLJGHBSA-N 2 1 338.948 4.178 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Oc3ccc(Cl)cc3)CC1)C2 ZINC001172116732 1049858528 /nfs/dbraw/zinc/85/85/28/1049858528.db2.gz CNFQQVHUKZVHOY-PIIMJCKOSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Oc3ccc(Cl)cc3)CC1)C2 ZINC001172116732 1049858530 /nfs/dbraw/zinc/85/85/30/1049858530.db2.gz CNFQQVHUKZVHOY-PIIMJCKOSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3ccc(C(F)(F)F)cc3)CC1)C2 ZINC001172119002 1049858756 /nfs/dbraw/zinc/85/87/56/1049858756.db2.gz USVQQUOBKOFQPG-BJWYYQGGSA-N 2 1 338.417 4.299 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3ccc(C(F)(F)F)cc3)CC1)C2 ZINC001172119002 1049858758 /nfs/dbraw/zinc/85/87/58/1049858758.db2.gz USVQQUOBKOFQPG-BJWYYQGGSA-N 2 1 338.417 4.299 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(CCc3ccccc3)CC1)C2 ZINC001172121493 1049858790 /nfs/dbraw/zinc/85/87/90/1049858790.db2.gz KAFCVGQFZRTYPH-ZBYYUNFXSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(CCc3ccccc3)CC1)C2 ZINC001172121493 1049858792 /nfs/dbraw/zinc/85/87/92/1049858792.db2.gz KAFCVGQFZRTYPH-ZBYYUNFXSA-N 2 1 326.528 4.347 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3c1cccc3Br)C2 ZINC001172112810 1049858804 /nfs/dbraw/zinc/85/88/04/1049858804.db2.gz AHZHMCYMNUDEHV-KYZVSKTDSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3c1cccc3Br)C2 ZINC001172112810 1049858807 /nfs/dbraw/zinc/85/88/07/1049858807.db2.gz AHZHMCYMNUDEHV-KYZVSKTDSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3ccc(C(F)(F)F)cc31)C2 ZINC001172110675 1049859249 /nfs/dbraw/zinc/85/92/49/1049859249.db2.gz LIWXPSIRGKURKA-KYHPRHEASA-N 2 1 338.417 4.298 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3ccc(C(F)(F)F)cc31)C2 ZINC001172110675 1049859252 /nfs/dbraw/zinc/85/92/52/1049859252.db2.gz LIWXPSIRGKURKA-KYHPRHEASA-N 2 1 338.417 4.298 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccccn1 ZINC000245836541 1049859934 /nfs/dbraw/zinc/85/99/34/1049859934.db2.gz AQWCYSGSEPENMI-CEXWTWQISA-N 2 1 337.511 4.410 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccn1 ZINC000245836541 1049859935 /nfs/dbraw/zinc/85/99/35/1049859935.db2.gz AQWCYSGSEPENMI-CEXWTWQISA-N 2 1 337.511 4.410 20 0 EIADMP C[C@H](Cc1ccoc1)Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000823555625 1049860636 /nfs/dbraw/zinc/86/06/36/1049860636.db2.gz ZHXCXMUYLHNMFN-QGZVFWFLSA-N 2 1 341.499 4.101 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171024668 1049869275 /nfs/dbraw/zinc/86/92/75/1049869275.db2.gz GCKYUOWWTVTAOQ-KBAYOESNSA-N 2 1 332.919 4.322 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@@H]2CSc3ccccc3C2)CC1 ZINC001172200074 1049869410 /nfs/dbraw/zinc/86/94/10/1049869410.db2.gz GGSULAYCOMXABS-WDSOQIARSA-N 2 1 330.541 4.218 20 0 EIADMP COCCC[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccccc2SC)CC1 ZINC001172254485 1049872442 /nfs/dbraw/zinc/87/24/42/1049872442.db2.gz NRFOFDXLPUISLP-LJQANCHMSA-N 2 1 348.556 4.046 20 0 EIADMP COCCC[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccccc2SC)CC1 ZINC001172254485 1049872443 /nfs/dbraw/zinc/87/24/43/1049872443.db2.gz NRFOFDXLPUISLP-LJQANCHMSA-N 2 1 348.556 4.046 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338327 1049887614 /nfs/dbraw/zinc/88/76/14/1049887614.db2.gz YITITDVMSAJPDY-QIJZPMMNSA-N 2 1 332.532 4.352 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338329 1049887790 /nfs/dbraw/zinc/88/77/90/1049887790.db2.gz YITITDVMSAJPDY-VURPSTOHSA-N 2 1 332.532 4.352 20 0 EIADMP CC[C@H](CC(C)C)[N@@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001172407122 1049898544 /nfs/dbraw/zinc/89/85/44/1049898544.db2.gz NFRKDORYPSIGFB-WSWWRLHASA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001172407122 1049898548 /nfs/dbraw/zinc/89/85/48/1049898548.db2.gz NFRKDORYPSIGFB-WSWWRLHASA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001172407122 1049898553 /nfs/dbraw/zinc/89/85/53/1049898553.db2.gz NFRKDORYPSIGFB-WSWWRLHASA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001172407122 1049898556 /nfs/dbraw/zinc/89/85/56/1049898556.db2.gz NFRKDORYPSIGFB-WSWWRLHASA-N 2 1 343.559 4.439 20 0 EIADMP CC[C@H](CC(C)C)[NH+]1CCC2(CC1)C[N@@H+](Cc1ccccc1)CCO2 ZINC001172398020 1049906749 /nfs/dbraw/zinc/90/67/49/1049906749.db2.gz MTKKZRKVMGGYMO-OAQYLSRUSA-N 2 1 344.543 4.178 20 0 EIADMP CC(C)OCC[C@@H](C)[N@@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001172439234 1049912336 /nfs/dbraw/zinc/91/23/36/1049912336.db2.gz AFGPMKKDASSXIK-XUWGEKFYSA-N 2 1 344.543 4.318 20 0 EIADMP Cc1ccccc1C[N@H+]([C@@H](C)CCOC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172445805 1049914185 /nfs/dbraw/zinc/91/41/85/1049914185.db2.gz UDMHMQMOYQQXPX-JBACZVJFSA-N 2 1 332.532 4.271 20 0 EIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172554398 1049931397 /nfs/dbraw/zinc/93/13/97/1049931397.db2.gz UYXOIMXOFYZDMU-TZIWHRDSSA-N 2 1 335.495 4.285 20 0 EIADMP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1CCC[N@@H+](C)CC1 ZINC001172576997 1049932659 /nfs/dbraw/zinc/93/26/59/1049932659.db2.gz QLAKXGGTKDLWKQ-OCCSQVGLSA-N 2 1 330.850 4.013 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000246252180 1049937423 /nfs/dbraw/zinc/93/74/23/1049937423.db2.gz WKDZRVQOBNPRSP-CABCVRRESA-N 2 1 326.406 4.184 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000246252185 1049937721 /nfs/dbraw/zinc/93/77/21/1049937721.db2.gz WKDZRVQOBNPRSP-GJZGRUSLSA-N 2 1 326.406 4.184 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@@H](C)C1 ZINC000246263800 1049942138 /nfs/dbraw/zinc/94/21/38/1049942138.db2.gz AADPSAOILARXLX-DOTOQJQBSA-N 2 1 335.561 4.053 20 0 EIADMP [NH3+]C1(c2cccnc2)CC[NH+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172537406 1049943642 /nfs/dbraw/zinc/94/36/42/1049943642.db2.gz POYGGFPBSKIWPJ-TZIWHRDSSA-N 2 1 335.495 4.058 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172655264 1049957415 /nfs/dbraw/zinc/95/74/15/1049957415.db2.gz TZUCLZCDMLFRAX-FXAWDEMLSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172655264 1049957422 /nfs/dbraw/zinc/95/74/22/1049957422.db2.gz TZUCLZCDMLFRAX-FXAWDEMLSA-N 2 1 344.543 4.223 20 0 EIADMP Clc1ccc2c(c1)C[C@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001172716990 1049963818 /nfs/dbraw/zinc/96/38/18/1049963818.db2.gz CQOYCAKNRKWRDN-WOJBJXKFSA-N 2 1 332.919 4.148 20 0 EIADMP CC(C)[N@@H+](C)Cc1nn(C2CCC3(CCCC3)CC2)c2c1CC[NH2+]C2 ZINC001172726098 1049966685 /nfs/dbraw/zinc/96/66/85/1049966685.db2.gz KQVLIOKGJWRCFM-UHFFFAOYSA-N 2 1 344.547 4.045 20 0 EIADMP C[N@@H+](C1CCOCC1)C1CC[NH+](C2CCC3(CCCC3)CC2)CC1 ZINC001172730095 1049969040 /nfs/dbraw/zinc/96/90/40/1049969040.db2.gz VLZLGCHQSPFQMJ-UHFFFAOYSA-N 2 1 334.548 4.065 20 0 EIADMP CC(C)OC(=O)CC[C@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172750808 1049970840 /nfs/dbraw/zinc/97/08/40/1049970840.db2.gz GFCIBTMYAMZHNG-LNLFQRSKSA-N 2 1 338.536 4.011 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248410271 1050055139 /nfs/dbraw/zinc/05/51/39/1050055139.db2.gz XWFVSDGZTDXWMT-RMJJICAUSA-N 2 1 344.543 4.430 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000249163588 1050093360 /nfs/dbraw/zinc/09/33/60/1050093360.db2.gz ZXQGROWEKLXDSQ-KSZLIROESA-N 2 1 340.433 4.219 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828485 1050166612 /nfs/dbraw/zinc/16/66/12/1050166612.db2.gz MOVPGRFNCOBVAM-VABKMULXSA-N 2 1 349.522 4.019 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828349 1050166814 /nfs/dbraw/zinc/16/68/14/1050166814.db2.gz LDVPTFAARPEPCI-VABKMULXSA-N 2 1 349.522 4.019 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2ccc(-c3ccccc3)o2)C1 ZINC001177294059 1050177231 /nfs/dbraw/zinc/17/72/31/1050177231.db2.gz CVIISVXVNXEHOJ-HDICACEKSA-N 2 1 326.484 4.404 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccc(-c3ccccc3)o2)C1 ZINC001177294059 1050177244 /nfs/dbraw/zinc/17/72/44/1050177244.db2.gz CVIISVXVNXEHOJ-HDICACEKSA-N 2 1 326.484 4.404 20 0 EIADMP Cc1cc(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc2cccnc12 ZINC001177299697 1050179480 /nfs/dbraw/zinc/17/94/80/1050179480.db2.gz ZJVOVDCXQYQILJ-SFHVURJKSA-N 2 1 325.500 4.287 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001177268448 1050183650 /nfs/dbraw/zinc/18/36/50/1050183650.db2.gz ZBYIBISSYQCFGE-WAGURGNTSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001177268448 1050183656 /nfs/dbraw/zinc/18/36/56/1050183656.db2.gz ZBYIBISSYQCFGE-WAGURGNTSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172848088 1050186000 /nfs/dbraw/zinc/18/60/00/1050186000.db2.gz QAXZUNQXGPYOIJ-BPUTZDHNSA-N 2 1 338.898 4.392 20 0 EIADMP C[C@H](Cc1c(F)cccc1Cl)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001172847823 1050186834 /nfs/dbraw/zinc/18/68/34/1050186834.db2.gz NCXMEPVOGOVRHV-CQSZACIVSA-N 2 1 338.898 4.394 20 0 EIADMP C[C@@H](Cc1ccc(F)cc1Cl)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001172860345 1050198421 /nfs/dbraw/zinc/19/84/21/1050198421.db2.gz CMWHILMRNJKCCY-LSDHHAIUSA-N 2 1 326.887 4.251 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C/C=C/c2c(C)cc(C)cc2C)cn1 ZINC001177362727 1050204270 /nfs/dbraw/zinc/20/42/70/1050204270.db2.gz DWKBZIFWGZVLBL-AATRIKPKSA-N 2 1 346.478 4.304 20 0 EIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccc(Oc3ccc(Cl)cc3)cc2)CC[C@H]1F ZINC001206187035 1050266842 /nfs/dbraw/zinc/26/68/42/1050266842.db2.gz SPPOBVFIHDKCNA-MOPGFXCFSA-N 2 1 348.849 4.394 20 0 EIADMP CCCOC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001173092096 1050284414 /nfs/dbraw/zinc/28/44/14/1050284414.db2.gz IVVUORPUCJZCFT-PMJAUZGISA-N 2 1 344.543 4.367 20 0 EIADMP CCCOC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001173092096 1050284427 /nfs/dbraw/zinc/28/44/27/1050284427.db2.gz IVVUORPUCJZCFT-PMJAUZGISA-N 2 1 344.543 4.367 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](C)Cc2ncccc2C(F)(F)F)CC1 ZINC001173110289 1050306934 /nfs/dbraw/zinc/30/69/34/1050306934.db2.gz QXMXWMHKJKHDDE-UHFFFAOYSA-N 2 1 343.437 4.185 20 0 EIADMP CCCOC1CCC([NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC001173099765 1050322628 /nfs/dbraw/zinc/32/26/28/1050322628.db2.gz SFACDBXDMQZTFD-UHFFFAOYSA-N 2 1 344.543 4.321 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1F ZINC001177919736 1050329287 /nfs/dbraw/zinc/32/92/87/1050329287.db2.gz PHBBNQCMXZDDBH-HNAYVOBHSA-N 2 1 348.487 4.069 20 0 EIADMP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ccc1F ZINC001177919736 1050329294 /nfs/dbraw/zinc/32/92/94/1050329294.db2.gz PHBBNQCMXZDDBH-HNAYVOBHSA-N 2 1 348.487 4.069 20 0 EIADMP C[C@@H](CC[NH2+]Cc1nccc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC001177962877 1050332291 /nfs/dbraw/zinc/33/22/91/1050332291.db2.gz UZQRYYUOPCASER-SFHVURJKSA-N 2 1 333.479 4.235 20 0 EIADMP C[C@@H](CC[NH2+]Cc1nccc2ccccc21)[N@@H+](C)Cc1ccccc1 ZINC001177962877 1050332295 /nfs/dbraw/zinc/33/22/95/1050332295.db2.gz UZQRYYUOPCASER-SFHVURJKSA-N 2 1 333.479 4.235 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173198161 1050342863 /nfs/dbraw/zinc/34/28/63/1050342863.db2.gz PCWCUJDIATVAOR-JSOIOWGOSA-N 2 1 330.516 4.231 20 0 EIADMP [NH3+][C@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC[C@H]1F ZINC001206196734 1050381498 /nfs/dbraw/zinc/38/14/98/1050381498.db2.gz CQPHKYSIVRZHES-MOPGFXCFSA-N 2 1 332.850 4.268 20 0 EIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC[C@H]1F ZINC001206196734 1050381517 /nfs/dbraw/zinc/38/15/17/1050381517.db2.gz CQPHKYSIVRZHES-MOPGFXCFSA-N 2 1 332.850 4.268 20 0 EIADMP CCSC[C@@H](C)[NH+]1CCC([NH3+])(c2ccccc2C(F)(F)F)CC1 ZINC001173296813 1050399744 /nfs/dbraw/zinc/39/97/44/1050399744.db2.gz WXVYAQFKMQJJEZ-CYBMUJFWSA-N 2 1 346.462 4.097 20 0 EIADMP CCSC[C@@H](C)[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001173303189 1050401840 /nfs/dbraw/zinc/40/18/40/1050401840.db2.gz FKPMXAKRRRHNRG-MRXNPFEDSA-N 2 1 338.586 4.178 20 0 EIADMP Fc1ccccc1C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001178285382 1050427852 /nfs/dbraw/zinc/42/78/52/1050427852.db2.gz QAXIYOGTYUTDBU-JAXLGGSGSA-N 2 1 338.470 4.216 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2c1CCC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001178331335 1050438857 /nfs/dbraw/zinc/43/88/57/1050438857.db2.gz QCNMOXNMEMRELY-XMSQKQJNSA-N 2 1 334.507 4.176 20 0 EIADMP CCSC[C@@H](C)[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001173316898 1050438750 /nfs/dbraw/zinc/43/87/50/1050438750.db2.gz ZXJXFAKGJBTVDR-QUCCMNQESA-N 2 1 332.557 4.116 20 0 EIADMP CCSC[C@@H](C)[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001173316898 1050438755 /nfs/dbraw/zinc/43/87/55/1050438755.db2.gz ZXJXFAKGJBTVDR-QUCCMNQESA-N 2 1 332.557 4.116 20 0 EIADMP CCSC[C@@H](C)[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001173316898 1050438759 /nfs/dbraw/zinc/43/87/59/1050438759.db2.gz ZXJXFAKGJBTVDR-QUCCMNQESA-N 2 1 332.557 4.116 20 0 EIADMP Cc1ccccc1N(C)c1ccc(C[N@@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)cc1 ZINC001206200337 1050454471 /nfs/dbraw/zinc/45/44/71/1050454471.db2.gz RDIFAKHMJAFRJT-UXHICEINSA-N 2 1 341.474 4.024 20 0 EIADMP C[N@@H+](C1Cc2cc(F)c(F)cc2C1)C1CC[NH+](C2CCCCC2)CC1 ZINC001173481575 1050461784 /nfs/dbraw/zinc/46/17/84/1050461784.db2.gz MZFZEPMIYUYRPZ-UHFFFAOYSA-N 2 1 348.481 4.161 20 0 EIADMP COc1ccc(C[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1OCC(C)C ZINC001178462390 1050473554 /nfs/dbraw/zinc/47/35/54/1050473554.db2.gz DNDWCRJKBPNZPJ-GOSISDBHSA-N 2 1 348.531 4.084 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC001173539960 1050475419 /nfs/dbraw/zinc/47/54/19/1050475419.db2.gz VDHGRYNDANWJNF-UKRRQHHQSA-N 2 1 329.315 4.246 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC001173544986 1050477147 /nfs/dbraw/zinc/47/71/47/1050477147.db2.gz VDHGRYNDANWJNF-HIFRSBDPSA-N 2 1 329.315 4.246 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+]C3CCc4ccccc4CC3)C2)cc1 ZINC001178609377 1050518583 /nfs/dbraw/zinc/51/85/83/1050518583.db2.gz GKFRPYXKHZZZBR-HXUWFJFHSA-N 2 1 334.507 4.046 20 0 EIADMP C[N@H+]1CCc2ccc(Nc3cccc(C[NH+]4CCCCC4)c3)cc2C1 ZINC001204128287 1050525643 /nfs/dbraw/zinc/52/56/43/1050525643.db2.gz RQYXNVDQWRZKET-UHFFFAOYSA-N 2 1 335.495 4.404 20 0 EIADMP C[NH+]1CCC2(CC[N@H+](C3CCC4(CCc5ccccc54)CC3)C2)CC1 ZINC001173689170 1050544471 /nfs/dbraw/zinc/54/44/71/1050544471.db2.gz HGMXHIVWNPIOCQ-UHFFFAOYSA-N 2 1 338.539 4.231 20 0 EIADMP COCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCCCC1 ZINC001178868245 1050575159 /nfs/dbraw/zinc/57/51/59/1050575159.db2.gz QBSWRXNTCXRYEI-FPOVZHCZSA-N 2 1 344.543 4.226 20 0 EIADMP COCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCCCC1 ZINC001178868245 1050575178 /nfs/dbraw/zinc/57/51/78/1050575178.db2.gz QBSWRXNTCXRYEI-FPOVZHCZSA-N 2 1 344.543 4.226 20 0 EIADMP c1c2cnccc2oc1C[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC001178868879 1050575458 /nfs/dbraw/zinc/57/54/58/1050575458.db2.gz XXYNSPUPDNLXDR-LJQANCHMSA-N 2 1 349.478 4.220 20 0 EIADMP c1c2cnccc2oc1C[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC001178868879 1050575469 /nfs/dbraw/zinc/57/54/69/1050575469.db2.gz XXYNSPUPDNLXDR-LJQANCHMSA-N 2 1 349.478 4.220 20 0 EIADMP CC(C)(C)[C@H]1CCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001178932291 1050583292 /nfs/dbraw/zinc/58/32/92/1050583292.db2.gz YHIUAQCCBZWWJF-SFTDATJTSA-N 2 1 328.544 4.498 20 0 EIADMP CC(C)(C)[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001178932289 1050584455 /nfs/dbraw/zinc/58/44/55/1050584455.db2.gz YHIUAQCCBZWWJF-NHCUHLMSSA-N 2 1 328.544 4.498 20 0 EIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001179015470 1050611357 /nfs/dbraw/zinc/61/13/57/1050611357.db2.gz BFXNBSAUVWDFFI-PTUXOGIPSA-N 2 1 336.523 4.190 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CCN(C/C(Cl)=C/Cl)CC1 ZINC000763521799 1050618205 /nfs/dbraw/zinc/61/82/05/1050618205.db2.gz WBZYVDCEIRWLHZ-BOPFTXTBSA-N 2 1 327.299 4.149 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000763521799 1050618218 /nfs/dbraw/zinc/61/82/18/1050618218.db2.gz WBZYVDCEIRWLHZ-BOPFTXTBSA-N 2 1 327.299 4.149 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000763521799 1050618230 /nfs/dbraw/zinc/61/82/30/1050618230.db2.gz WBZYVDCEIRWLHZ-BOPFTXTBSA-N 2 1 327.299 4.149 20 0 EIADMP COC[C@@H](CC(C)(C)C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001179034369 1050622143 /nfs/dbraw/zinc/62/21/43/1050622143.db2.gz FCKNKYXZSNDFQU-VQTJNVASSA-N 2 1 344.543 4.224 20 0 EIADMP COC[C@@H](CC(C)(C)C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001179034369 1050622153 /nfs/dbraw/zinc/62/21/53/1050622153.db2.gz FCKNKYXZSNDFQU-VQTJNVASSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001179338363 1050679244 /nfs/dbraw/zinc/67/92/44/1050679244.db2.gz GKMNTOZAAUPNIX-CVDCTZTESA-N 2 1 348.534 4.292 20 0 EIADMP C[N@@H+](Cc1ccc2ccccc2n1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110043 1050787298 /nfs/dbraw/zinc/78/72/98/1050787298.db2.gz WLSXWBSRGODDMN-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[N@H+](Cc1ccc2ccccc2n1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110043 1050787307 /nfs/dbraw/zinc/78/73/07/1050787307.db2.gz WLSXWBSRGODDMN-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2ccccc2n1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076110043 1050787315 /nfs/dbraw/zinc/78/73/15/1050787315.db2.gz WLSXWBSRGODDMN-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2ccccc2n1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076110043 1050787327 /nfs/dbraw/zinc/78/73/27/1050787327.db2.gz WLSXWBSRGODDMN-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[C@]1(C[N@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCCS1 ZINC001179864191 1050809542 /nfs/dbraw/zinc/80/95/42/1050809542.db2.gz UUAYLZCESMAYMU-NHCUHLMSSA-N 2 1 344.568 4.260 20 0 EIADMP C[C@]1(C[NH+]2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)CCCS1 ZINC001179864191 1050809549 /nfs/dbraw/zinc/80/95/49/1050809549.db2.gz UUAYLZCESMAYMU-NHCUHLMSSA-N 2 1 344.568 4.260 20 0 EIADMP C[C@]1(C[NH+]2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CCCS1 ZINC001179864191 1050809554 /nfs/dbraw/zinc/80/95/54/1050809554.db2.gz UUAYLZCESMAYMU-NHCUHLMSSA-N 2 1 344.568 4.260 20 0 EIADMP CC[NH+]1CCC(C[N@@H+]2Cc3ccccc3[C@H](c3ccccc3)C2)CC1 ZINC001179969298 1050851651 /nfs/dbraw/zinc/85/16/51/1050851651.db2.gz AFLRUMXUSJPAKG-QHCPKHFHSA-N 2 1 334.507 4.366 20 0 EIADMP Cn1cc[nH+]c1CC1CC[NH+]([C@@H]2CCc3c2cccc3Cl)CC1 ZINC000152816108 1050861770 /nfs/dbraw/zinc/86/17/70/1050861770.db2.gz WYHGIPYHMWMMGZ-GOSISDBHSA-N 2 1 329.875 4.016 20 0 EIADMP CC[N@@H+](CC1CC[NH+](CC)CC1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC001180064422 1050870813 /nfs/dbraw/zinc/87/08/13/1050870813.db2.gz IMPGRCSWYQLWCJ-OAQYLSRUSA-N 2 1 334.523 4.447 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(OCC3CC3)cc2)CC1 ZINC001180125420 1050892246 /nfs/dbraw/zinc/89/22/46/1050892246.db2.gz ZCEULUQSKYVMCI-UHFFFAOYSA-N 2 1 344.543 4.419 20 0 EIADMP Cc1cc(C)cc(CC[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001180350251 1050964868 /nfs/dbraw/zinc/96/48/68/1050964868.db2.gz WYNODVIKEGDCLT-NZQKXSOJSA-N 2 1 336.523 4.346 20 0 EIADMP CO[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001180350278 1050965391 /nfs/dbraw/zinc/96/53/91/1050965391.db2.gz XOTYMGOJWPLFAR-STZQEDGTSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H]1Cc2[nH+]cn(Cc3ccc(C[NH+]4CCCCC4)cc3)c2C[C@@H]1C ZINC001189407653 1050984579 /nfs/dbraw/zinc/98/45/79/1050984579.db2.gz GSCOJZRYHVDWNN-ROUUACIJSA-N 2 1 337.511 4.288 20 0 EIADMP C[C@@H]1Cc2c([nH+]cn2Cc2ccc(C[NH+]3CCCCC3)cc2)C[C@@H]1C ZINC001189407654 1050986304 /nfs/dbraw/zinc/98/63/04/1050986304.db2.gz GSCOJZRYHVDWNN-ZWKOTPCHSA-N 2 1 337.511 4.288 20 0 EIADMP COc1ccc(SCC[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001180795288 1051080886 /nfs/dbraw/zinc/08/08/86/1051080886.db2.gz UOTZOKJBQUHDPF-IAGOWNOFSA-N 2 1 348.556 4.030 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000620513429 1051148458 /nfs/dbraw/zinc/14/84/58/1051148458.db2.gz IUZGOKZMODHIKM-HXUWFJFHSA-N 2 1 330.516 4.077 20 0 EIADMP Fc1cccc(/C=C/C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC001181256567 1051201200 /nfs/dbraw/zinc/20/12/00/1051201200.db2.gz QVHAZCWOZVDDJH-GQCTYLIASA-N 2 1 339.458 4.251 20 0 EIADMP Cc1ccc(CC[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC001181314039 1051205419 /nfs/dbraw/zinc/20/54/19/1051205419.db2.gz BWGZBRFXRXATBA-HSZRJFAPSA-N 2 1 336.523 4.348 20 0 EIADMP CC(C)[N@@H+](CC[C@H]1CCC[NH+]1C)Cc1cccc(C(F)(F)F)c1 ZINC001190661408 1051235141 /nfs/dbraw/zinc/23/51/41/1051235141.db2.gz SEQDIYCDXGBEJX-QGZVFWFLSA-N 2 1 328.422 4.400 20 0 EIADMP CC(C)[NH+](CC[C@H]1CCC[N@@H+]1C)Cc1cccc(C(F)(F)F)c1 ZINC001190661408 1051235152 /nfs/dbraw/zinc/23/51/52/1051235152.db2.gz SEQDIYCDXGBEJX-QGZVFWFLSA-N 2 1 328.422 4.400 20 0 EIADMP CC(C)[NH+](CC[C@H]1CCC[N@H+]1C)Cc1cccc(C(F)(F)F)c1 ZINC001190661408 1051235165 /nfs/dbraw/zinc/23/51/65/1051235165.db2.gz SEQDIYCDXGBEJX-QGZVFWFLSA-N 2 1 328.422 4.400 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CC[N@@H+]1C ZINC000153991835 1051256232 /nfs/dbraw/zinc/25/62/32/1051256232.db2.gz ZDRAUEKUEALHPC-GZOSKZMVSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CC[N@H+]1C ZINC000153991835 1051256241 /nfs/dbraw/zinc/25/62/41/1051256241.db2.gz ZDRAUEKUEALHPC-GZOSKZMVSA-N 2 1 340.433 4.414 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc(OC(C)(C)C)c2)CC1 ZINC001190818327 1051282983 /nfs/dbraw/zinc/28/29/83/1051282983.db2.gz JMNOAHMPAHTVIL-UHFFFAOYSA-N 2 1 332.532 4.416 20 0 EIADMP C([C@@H]1CCCC12CCOCC2)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190827430 1051286274 /nfs/dbraw/zinc/28/62/74/1051286274.db2.gz PJTAUJRJEHNSQW-SFTDATJTSA-N 2 1 348.575 4.171 20 0 EIADMP FC(F)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310070914 1051371820 /nfs/dbraw/zinc/37/18/20/1051371820.db2.gz DFNSNYOZLBPBBD-SFHVURJKSA-N 2 1 330.422 4.236 20 0 EIADMP CS[C@H]1CC[N@@H+](C[C@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001182063340 1051388040 /nfs/dbraw/zinc/38/80/40/1051388040.db2.gz TXTZABLRTDWYBG-PZJWPPBQSA-N 2 1 346.584 4.362 20 0 EIADMP CS[C@H]1CC[NH+](C[C@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC001182063340 1051388054 /nfs/dbraw/zinc/38/80/54/1051388054.db2.gz TXTZABLRTDWYBG-PZJWPPBQSA-N 2 1 346.584 4.362 20 0 EIADMP CS[C@H]1CC[NH+](C[C@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001182063340 1051388061 /nfs/dbraw/zinc/38/80/61/1051388061.db2.gz TXTZABLRTDWYBG-PZJWPPBQSA-N 2 1 346.584 4.362 20 0 EIADMP C/C=C\COc1ccc(CC[C@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC001182248549 1051441156 /nfs/dbraw/zinc/44/11/56/1051441156.db2.gz ACTTZACVUAOEKS-UINFQJAVSA-N 2 1 344.543 4.284 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](CCCOc2cccc3ccccc32)C1 ZINC001191367698 1051443199 /nfs/dbraw/zinc/44/31/99/1051443199.db2.gz TYJIEXNRAVVIMV-LJQANCHMSA-N 2 1 340.511 4.272 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](CCCOc2cccc3ccccc32)C1 ZINC001191367698 1051443208 /nfs/dbraw/zinc/44/32/08/1051443208.db2.gz TYJIEXNRAVVIMV-LJQANCHMSA-N 2 1 340.511 4.272 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](CCCOc2cccc3ccccc32)C1 ZINC001191367698 1051443216 /nfs/dbraw/zinc/44/32/16/1051443216.db2.gz TYJIEXNRAVVIMV-LJQANCHMSA-N 2 1 340.511 4.272 20 0 EIADMP COc1ccc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)cc1C ZINC001191550825 1051485890 /nfs/dbraw/zinc/48/58/90/1051485890.db2.gz MNCYHIQYUCQHHO-LJQANCHMSA-N 2 1 344.543 4.480 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1cncs1 ZINC000157012305 1051589959 /nfs/dbraw/zinc/58/99/59/1051589959.db2.gz KTIASLZVAOEJFO-MRXNPFEDSA-N 2 1 329.513 4.226 20 0 EIADMP Cc1[nH+]c2c(NC3=CC[N@H+](Cc4ccccc4)CC3)cccn2c1C ZINC001175505397 1051634220 /nfs/dbraw/zinc/63/42/20/1051634220.db2.gz OTNVHVZOSSLIGJ-UHFFFAOYSA-N 2 1 332.451 4.153 20 0 EIADMP Cc1[nH+]c2c(NC3=CC[N@@H+](Cc4ccccc4)CC3)cccn2c1C ZINC001175505397 1051634230 /nfs/dbraw/zinc/63/42/30/1051634230.db2.gz OTNVHVZOSSLIGJ-UHFFFAOYSA-N 2 1 332.451 4.153 20 0 EIADMP CCC(CC)(C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)SC ZINC000775511595 1051659599 /nfs/dbraw/zinc/65/95/99/1051659599.db2.gz DUIDCTFIHDIIPZ-PKOBYXMFSA-N 2 1 334.573 4.408 20 0 EIADMP C[C@H]1[C@H](c2ccccc2)c2ccccc2CC[N@H+]1CCCn1ccnc1 ZINC001192334253 1051691956 /nfs/dbraw/zinc/69/19/56/1051691956.db2.gz GKCQQYDYDSECCJ-WMZHIEFXSA-N 2 1 345.490 4.352 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NC[C@@H]2CC[N@H+]2C2CCCCC2)CC1 ZINC001182918237 1051747344 /nfs/dbraw/zinc/74/73/44/1051747344.db2.gz KMLSZNISQLRKIH-COPCDDAFSA-N 2 1 347.591 4.026 20 0 EIADMP C[C@H]1CC[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)CC[C@H]1C[NH3+] ZINC001205602230 1051756836 /nfs/dbraw/zinc/75/68/36/1051756836.db2.gz HUAYSQCOFGMPIQ-RYUDHWBXSA-N 2 1 334.813 4.166 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1CCC(Cc2ccccc2)CC1)c1cccnc1 ZINC001192870406 1051818949 /nfs/dbraw/zinc/81/89/49/1051818949.db2.gz UKEFGYZLCXUSNA-LJQANCHMSA-N 2 1 337.511 4.077 20 0 EIADMP FC(F)(F)C1CCC([NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)CC1 ZINC001183379006 1051840450 /nfs/dbraw/zinc/84/04/50/1051840450.db2.gz HXAAFMLJXRDFED-VMBOVVBDSA-N 2 1 332.454 4.494 20 0 EIADMP FC(F)(F)C1CCC([NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)CC1 ZINC001183379006 1051840452 /nfs/dbraw/zinc/84/04/52/1051840452.db2.gz HXAAFMLJXRDFED-VMBOVVBDSA-N 2 1 332.454 4.494 20 0 EIADMP Cc1sccc1C[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001183696662 1051884887 /nfs/dbraw/zinc/88/48/87/1051884887.db2.gz MZEFFEPPZFOALM-UXHICEINSA-N 2 1 326.509 4.010 20 0 EIADMP Cc1sccc1C[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001183696662 1051884891 /nfs/dbraw/zinc/88/48/91/1051884891.db2.gz MZEFFEPPZFOALM-UXHICEINSA-N 2 1 326.509 4.010 20 0 EIADMP Cc1sccc1C[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001183696662 1051884894 /nfs/dbraw/zinc/88/48/94/1051884894.db2.gz MZEFFEPPZFOALM-UXHICEINSA-N 2 1 326.509 4.010 20 0 EIADMP Cc1sccc1C[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001183696662 1051884900 /nfs/dbraw/zinc/88/49/00/1051884900.db2.gz MZEFFEPPZFOALM-UXHICEINSA-N 2 1 326.509 4.010 20 0 EIADMP CCCOc1cccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC001193251619 1051892708 /nfs/dbraw/zinc/89/27/08/1051892708.db2.gz VFFRQDNUKCHGGU-PKOBYXMFSA-N 2 1 330.516 4.218 20 0 EIADMP C[C@H]1CCCC[C@H]1C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263197 1051987812 /nfs/dbraw/zinc/98/78/12/1051987812.db2.gz QYJJLQWTRJERCO-UVUJQTEASA-N 2 1 326.528 4.267 20 0 EIADMP C[C@H]1CCCC[C@H]1C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263197 1051987819 /nfs/dbraw/zinc/98/78/19/1051987819.db2.gz QYJJLQWTRJERCO-UVUJQTEASA-N 2 1 326.528 4.267 20 0 EIADMP C[C@H]1CCCC[C@H]1C[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263197 1051987824 /nfs/dbraw/zinc/98/78/24/1051987824.db2.gz QYJJLQWTRJERCO-UVUJQTEASA-N 2 1 326.528 4.267 20 0 EIADMP COc1cccc(C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)c2ccccc2)c1 ZINC000166339799 1052091117 /nfs/dbraw/zinc/09/11/17/1052091117.db2.gz RDWWKJWOKFOJKX-WEYGHZABSA-N 2 1 338.495 4.051 20 0 EIADMP COc1cccc(C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)c2ccccc2)c1 ZINC000166339799 1052091128 /nfs/dbraw/zinc/09/11/28/1052091128.db2.gz RDWWKJWOKFOJKX-WEYGHZABSA-N 2 1 338.495 4.051 20 0 EIADMP c1ccc(CC[NH+]2CCC(Nc3cccc4cc[nH+]cc43)CC2)cc1 ZINC000327208122 1052111279 /nfs/dbraw/zinc/11/12/79/1052111279.db2.gz QLFSXGZVFXLKTF-UHFFFAOYSA-N 2 1 331.463 4.354 20 0 EIADMP C[C@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1C[C@H]2C[NH+](C)C[C@@]2(C)C1 ZINC001176639903 1052148708 /nfs/dbraw/zinc/14/87/08/1052148708.db2.gz JXXHSLPQCHETAO-JUXOCIIHSA-N 2 1 336.479 4.423 20 0 EIADMP C[C@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1C[C@H]2C[NH+](C)C[C@@]2(C)C1 ZINC001176639903 1052148713 /nfs/dbraw/zinc/14/87/13/1052148713.db2.gz JXXHSLPQCHETAO-JUXOCIIHSA-N 2 1 336.479 4.423 20 0 EIADMP C[C@H](c1ccc(Oc2ccccc2)cc1)[NH+]1C[C@H]2C[N@H+](C)C[C@@]2(C)C1 ZINC001176639903 1052148720 /nfs/dbraw/zinc/14/87/20/1052148720.db2.gz JXXHSLPQCHETAO-JUXOCIIHSA-N 2 1 336.479 4.423 20 0 EIADMP C[C@H](c1ccc(Oc2ccccc2)cc1)[NH+]1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC001176639903 1052148726 /nfs/dbraw/zinc/14/87/26/1052148726.db2.gz JXXHSLPQCHETAO-JUXOCIIHSA-N 2 1 336.479 4.423 20 0 EIADMP C[N@H+]1C[C@]23C[NH+](CCCCc4cccc(Cl)c4)C[C@@]2(C1)CCCC3 ZINC001177015688 1052218112 /nfs/dbraw/zinc/21/81/12/1052218112.db2.gz MRFPSULRWPGVEZ-OYRHEFFESA-N 2 1 346.946 4.471 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1OCC ZINC000623339361 1052627983 /nfs/dbraw/zinc/62/79/83/1052627983.db2.gz WNGHTURHUOWGAX-RDJZCZTQSA-N 2 1 334.504 4.007 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1OCC ZINC000623339361 1052627984 /nfs/dbraw/zinc/62/79/84/1052627984.db2.gz WNGHTURHUOWGAX-RDJZCZTQSA-N 2 1 334.504 4.007 20 0 EIADMP COc1cc([C@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348636 1052629086 /nfs/dbraw/zinc/62/90/86/1052629086.db2.gz FIHOIIMJFARUEN-FUHWJXTLSA-N 2 1 348.531 4.253 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348636 1052629094 /nfs/dbraw/zinc/62/90/94/1052629094.db2.gz FIHOIIMJFARUEN-FUHWJXTLSA-N 2 1 348.531 4.253 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC3c4ccccc4C2c2ccccc23)CC[N@H+]1C ZINC000177839443 1052691826 /nfs/dbraw/zinc/69/18/26/1052691826.db2.gz HKSRUBZRQXHUFG-SHDPVSIFSA-N 2 1 346.518 4.356 20 0 EIADMP C[C@@H]1C[C@@H](NC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@H+]1C ZINC000178606557 1052710216 /nfs/dbraw/zinc/71/02/16/1052710216.db2.gz BVCFPAQWUIFOCA-KUHUBIRLSA-N 2 1 330.422 4.127 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC[N@@H+]1C ZINC000179598272 1052743022 /nfs/dbraw/zinc/74/30/22/1052743022.db2.gz QWFCCIPQIIGIAQ-JCURWCKSSA-N 2 1 326.406 4.229 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC[N@H+]1C ZINC000179598272 1052743024 /nfs/dbraw/zinc/74/30/24/1052743024.db2.gz QWFCCIPQIIGIAQ-JCURWCKSSA-N 2 1 326.406 4.229 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)CC1 ZINC000180405349 1052798862 /nfs/dbraw/zinc/79/88/62/1052798862.db2.gz MMLBWKXQXVALIU-ZDUSSCGKSA-N 2 1 330.394 4.109 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)CC1 ZINC000180405366 1052799076 /nfs/dbraw/zinc/79/90/76/1052799076.db2.gz MMLBWKXQXVALIU-CYBMUJFWSA-N 2 1 330.394 4.109 20 0 EIADMP CC[C@H](C)c1ccc([C@@H](C)[NH2+]CCCCN2CC[NH+](CC)CC2)cc1 ZINC000623861781 1052824539 /nfs/dbraw/zinc/82/45/39/1052824539.db2.gz CHJIOPAQVVMQSB-VQTJNVASSA-N 2 1 345.575 4.268 20 0 EIADMP Cc1ccc(Br)cc1[C@@H](C)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000623855184 1052826840 /nfs/dbraw/zinc/82/68/40/1052826840.db2.gz SKRUNPOGLJHJBN-CYBMUJFWSA-N 2 1 337.305 4.035 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(F)cc1C(F)(F)F ZINC000623886647 1052833254 /nfs/dbraw/zinc/83/32/54/1052833254.db2.gz HRWBXPJOKJCLBM-VXGBXAGGSA-N 2 1 343.368 4.336 20 0 EIADMP COc1ccc([C@H]([NH2+]C[C@H]2CCCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000624121678 1052867401 /nfs/dbraw/zinc/86/74/01/1052867401.db2.gz AUPOUYYBTFCHBJ-XMSQKQJNSA-N 2 1 338.495 4.106 20 0 EIADMP COc1ccc([C@H]([NH2+]C[C@H]2CCCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000624121678 1052867404 /nfs/dbraw/zinc/86/74/04/1052867404.db2.gz AUPOUYYBTFCHBJ-XMSQKQJNSA-N 2 1 338.495 4.106 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000181570559 1052888415 /nfs/dbraw/zinc/88/84/15/1052888415.db2.gz WUVAPZRMHLEVFK-OAHLLOKOSA-N 2 1 345.462 4.250 20 0 EIADMP Cc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c2ccccc2n1 ZINC000185694738 1053020561 /nfs/dbraw/zinc/02/05/61/1053020561.db2.gz MEMZAHOUNBGOPK-ROUUACIJSA-N 2 1 337.511 4.286 20 0 EIADMP FC1(F)CCCC[C@@H]1C[N@H+]1C[C@@H]2CC[NH+](Cc3ccccc3)C[C@H]2C1 ZINC000381874511 1053110443 /nfs/dbraw/zinc/11/04/43/1053110443.db2.gz JUQCFDHXBDZFCH-SLFFLAALSA-N 2 1 348.481 4.266 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1C[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC000381874511 1053110471 /nfs/dbraw/zinc/11/04/71/1053110471.db2.gz JUQCFDHXBDZFCH-SLFFLAALSA-N 2 1 348.481 4.266 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC000381874511 1053110489 /nfs/dbraw/zinc/11/04/89/1053110489.db2.gz JUQCFDHXBDZFCH-SLFFLAALSA-N 2 1 348.481 4.266 20 0 EIADMP C[C@H]([NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000850466522 1053244053 /nfs/dbraw/zinc/24/40/53/1053244053.db2.gz LIFWFJAOLZKADK-JTSKRJEESA-N 2 1 349.478 4.391 20 0 EIADMP C[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000850466522 1053244069 /nfs/dbraw/zinc/24/40/69/1053244069.db2.gz LIFWFJAOLZKADK-JTSKRJEESA-N 2 1 349.478 4.391 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+][C@H]3CCC[C@@H]3Cc3ccccn3)CC2)cc1 ZINC000850543146 1053303550 /nfs/dbraw/zinc/30/35/50/1053303550.db2.gz ZAOGKQZBUZJSRL-OFNKIYASSA-N 2 1 349.522 4.047 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCC[N@H+](C)C(C)C)ccc1SC(F)F ZINC000764805211 1053318002 /nfs/dbraw/zinc/31/80/02/1053318002.db2.gz DCTOWTSPGXPNST-CYBMUJFWSA-N 2 1 346.487 4.391 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C)ccc1SC(F)F ZINC000764805211 1053318018 /nfs/dbraw/zinc/31/80/18/1053318018.db2.gz DCTOWTSPGXPNST-CYBMUJFWSA-N 2 1 346.487 4.391 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000764829329 1053318917 /nfs/dbraw/zinc/31/89/17/1053318917.db2.gz WEPLCKDGNPTICB-CQSZACIVSA-N 2 1 328.422 4.476 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866226380 1053656665 /nfs/dbraw/zinc/65/66/65/1053656665.db2.gz MUOWNIFSXISNAN-CYBMUJFWSA-N 2 1 335.879 4.252 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc2c(c1)CCCO2 ZINC000853248802 1053659262 /nfs/dbraw/zinc/65/92/62/1053659262.db2.gz JYYNSFQWTKNIIT-ORYQWCPZSA-N 2 1 336.479 4.156 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](c2ccccn2)C(C)C)cc1F ZINC000866241391 1053661027 /nfs/dbraw/zinc/66/10/27/1053661027.db2.gz AMYURWDHMRUVJC-HXUWFJFHSA-N 2 1 338.430 4.202 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)CCc2cncc3ccccc32)C1 ZINC000866260911 1053666235 /nfs/dbraw/zinc/66/62/35/1053666235.db2.gz PHORDZFIMHHLHA-OALUTQOASA-N 2 1 339.527 4.266 20 0 EIADMP CC[C@H](CO)[N@H+](CCCn1cc[nH+]c1C)C1CCC(C(C)(C)C)CC1 ZINC001196419056 1053667350 /nfs/dbraw/zinc/66/73/50/1053667350.db2.gz JPUAKVWCHOCRLO-IOJLRTSASA-N 2 1 349.563 4.259 20 0 EIADMP CC[C@H](CO)[N@@H+](CCCn1cc[nH+]c1C)C1CCC(C(C)(C)C)CC1 ZINC001196419056 1053667354 /nfs/dbraw/zinc/66/73/54/1053667354.db2.gz JPUAKVWCHOCRLO-IOJLRTSASA-N 2 1 349.563 4.259 20 0 EIADMP C[C@H](CCc1cncc2ccccc21)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000866273825 1053673062 /nfs/dbraw/zinc/67/30/62/1053673062.db2.gz CCAOKMFPQPJOBO-ZNDGOPKYSA-N 2 1 337.511 4.161 20 0 EIADMP C[C@H](CCc1cncc2ccccc21)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000866273825 1053673066 /nfs/dbraw/zinc/67/30/66/1053673066.db2.gz CCAOKMFPQPJOBO-ZNDGOPKYSA-N 2 1 337.511 4.161 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000866272388 1053673522 /nfs/dbraw/zinc/67/35/22/1053673522.db2.gz NQVWOWRJHZLXCP-POAQFYNOSA-N 2 1 343.540 4.137 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000866272388 1053673528 /nfs/dbraw/zinc/67/35/28/1053673528.db2.gz NQVWOWRJHZLXCP-POAQFYNOSA-N 2 1 343.540 4.137 20 0 EIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000765704717 1053851626 /nfs/dbraw/zinc/85/16/26/1053851626.db2.gz ZEQKDTGUVDKPLU-REWPJTCUSA-N 2 1 334.507 4.137 20 0 EIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1cccc(C(F)(F)F)c1 ZINC001197285104 1053875660 /nfs/dbraw/zinc/87/56/60/1053875660.db2.gz MZZSELRRORTARD-UHFFFAOYSA-N 2 1 328.422 4.403 20 0 EIADMP CC(C)(C)SCCC[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001197912119 1054031707 /nfs/dbraw/zinc/03/17/07/1054031707.db2.gz WASQUCWOYIMBHT-WOJBJXKFSA-N 2 1 346.584 4.362 20 0 EIADMP CC(C)(C)SCCC[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001197912119 1054031716 /nfs/dbraw/zinc/03/17/16/1054031716.db2.gz WASQUCWOYIMBHT-WOJBJXKFSA-N 2 1 346.584 4.362 20 0 EIADMP CC(C)(C)SCCC[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001197912119 1054031726 /nfs/dbraw/zinc/03/17/26/1054031726.db2.gz WASQUCWOYIMBHT-WOJBJXKFSA-N 2 1 346.584 4.362 20 0 EIADMP CC(C)[N@@H+](C)Cc1cc(O[C@H]2CC[NH+](C[C@@H](C)C(C)(C)C)C2)ccn1 ZINC000856558423 1054084750 /nfs/dbraw/zinc/08/47/50/1054084750.db2.gz IGNGOVBHKKLAIH-XLIONFOSSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@H]2CC[N@H+](C[C@@H](C)C(C)(C)C)C2)ccn1 ZINC000856558423 1054084764 /nfs/dbraw/zinc/08/47/64/1054084764.db2.gz IGNGOVBHKKLAIH-XLIONFOSSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@H]2CC[N@@H+](C[C@@H](C)C(C)(C)C)C2)ccn1 ZINC000856558423 1054084778 /nfs/dbraw/zinc/08/47/78/1054084778.db2.gz IGNGOVBHKKLAIH-XLIONFOSSA-N 2 1 347.547 4.057 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCOC3(CCCC3)C2)CC1 ZINC000872025609 1054341385 /nfs/dbraw/zinc/34/13/85/1054341385.db2.gz QBDJOTDILLFBJN-NRFANRHFSA-N 2 1 342.527 4.041 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(O)ccc2F)c1 ZINC000872027619 1054342713 /nfs/dbraw/zinc/34/27/13/1054342713.db2.gz KZGCRUNXFCHKSA-OAHLLOKOSA-N 2 1 330.447 4.222 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(O)ccc2F)c1 ZINC000872027619 1054342734 /nfs/dbraw/zinc/34/27/34/1054342734.db2.gz KZGCRUNXFCHKSA-OAHLLOKOSA-N 2 1 330.447 4.222 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)c1 ZINC000872026462 1054345296 /nfs/dbraw/zinc/34/52/96/1054345296.db2.gz BIRSYYQICMPVIH-HXUWFJFHSA-N 2 1 330.516 4.108 20 0 EIADMP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]Cc2nccs2)cc1 ZINC001199170370 1054357694 /nfs/dbraw/zinc/35/76/94/1054357694.db2.gz HRMDOITWMCYYSF-UHFFFAOYSA-N 2 1 337.492 4.162 20 0 EIADMP c1ccc2c(c1)CC[N@H+](CCC[NH2+]Cc1ccc(C3CCC3)cc1)C2 ZINC001199238760 1054369727 /nfs/dbraw/zinc/36/97/27/1054369727.db2.gz SJWXUZNOMOKGOL-UHFFFAOYSA-N 2 1 334.507 4.492 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cnc2c(F)cccc2c1 ZINC001199336603 1054385935 /nfs/dbraw/zinc/38/59/35/1054385935.db2.gz SPYIPINMRUAGEI-INIZCTEOSA-N 2 1 329.463 4.118 20 0 EIADMP CCC1(CC)CCC([NH2+]Cc2ccc(-n3cc[nH+]c3C)nc2)CC1 ZINC001199473107 1054412431 /nfs/dbraw/zinc/41/24/31/1054412431.db2.gz TURHPCSLGKVBMC-UHFFFAOYSA-N 2 1 326.488 4.414 20 0 EIADMP Cc1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)ccn1 ZINC000858169032 1054432265 /nfs/dbraw/zinc/43/22/65/1054432265.db2.gz VXHVOYYYRINMCP-FRIKZZABSA-N 2 1 335.495 4.065 20 0 EIADMP CC(C)(C)[C@@]1(C[NH3+])CC[N@@H+](Cc2cnc(-c3cccs3)s2)C1 ZINC000873222897 1054508946 /nfs/dbraw/zinc/50/89/46/1054508946.db2.gz DLELFUQHTRMCGA-QGZVFWFLSA-N 2 1 335.542 4.069 20 0 EIADMP C[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccns1 ZINC000858576979 1054522521 /nfs/dbraw/zinc/52/25/21/1054522521.db2.gz OFEMFFWEPFKHSK-FAEJEUNOSA-N 2 1 329.513 4.237 20 0 EIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000347560382 1054639577 /nfs/dbraw/zinc/63/95/77/1054639577.db2.gz RDBMOITUCCHDMY-UHFFFAOYSA-N 2 1 340.446 4.082 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2nc3ccccc3o2)C[N@H+]1Cc1ccccc1 ZINC001201492516 1054819213 /nfs/dbraw/zinc/81/92/13/1054819213.db2.gz QHDZOIDOAGCAKO-PKOBYXMFSA-N 2 1 349.478 4.218 20 0 EIADMP CC[C@@H](C)C[NH+]1CCC2(CC[N@@H+](Cc3cccc(OC)c3)C2)CC1 ZINC001201510285 1054823805 /nfs/dbraw/zinc/82/38/05/1054823805.db2.gz ZBYNIWRGXBOFEI-GOSISDBHSA-N 2 1 330.516 4.029 20 0 EIADMP CCC[C@@H](C)C[NH+]1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001201544138 1054837805 /nfs/dbraw/zinc/83/78/05/1054837805.db2.gz NJJNBRABSAJMRM-HXUWFJFHSA-N 2 1 344.543 4.098 20 0 EIADMP CC(C)Cc1ncc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)s1 ZINC001201858024 1054923186 /nfs/dbraw/zinc/92/31/86/1054923186.db2.gz XIDJIHZXUSTLGR-UHFFFAOYSA-N 2 1 335.561 4.086 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)C(C)(C)c2ccccc2)cn1 ZINC000126310837 1055004038 /nfs/dbraw/zinc/00/40/38/1055004038.db2.gz UXMFXCCCAFIKGL-MRXNPFEDSA-N 2 1 334.467 4.032 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000877189854 1055034223 /nfs/dbraw/zinc/03/42/23/1055034223.db2.gz UEKUEJWILVRZRZ-KGLIPLIRSA-N 2 1 347.890 4.224 20 0 EIADMP C[C@@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000877189854 1055034237 /nfs/dbraw/zinc/03/42/37/1055034237.db2.gz UEKUEJWILVRZRZ-KGLIPLIRSA-N 2 1 347.890 4.224 20 0 EIADMP Cc1cc([NH+]2CCCCCC2)ccc1N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000671766317 1055071574 /nfs/dbraw/zinc/07/15/74/1055071574.db2.gz CWVSLAHOOGJBMC-RBUKOAKNSA-N 2 1 327.516 4.414 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc2c(ccnc2Cl)o1 ZINC000877528451 1055071680 /nfs/dbraw/zinc/07/16/80/1055071680.db2.gz AFUHWCNCEWCLIV-UHFFFAOYSA-N 2 1 346.862 4.152 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc2c(ccnc2Cl)o1 ZINC000877528451 1055071693 /nfs/dbraw/zinc/07/16/93/1055071693.db2.gz AFUHWCNCEWCLIV-UHFFFAOYSA-N 2 1 346.862 4.152 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CC[C@H]3CCSC3)CC[N@@H+]2C2CC2)cc1 ZINC000877661647 1055102295 /nfs/dbraw/zinc/10/22/95/1055102295.db2.gz DTLXRJAVMCMWGO-QRFRQXIXSA-N 2 1 330.541 4.087 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CC[C@H]3CCSC3)CC[N@H+]2C2CC2)cc1 ZINC000877661647 1055102306 /nfs/dbraw/zinc/10/23/06/1055102306.db2.gz DTLXRJAVMCMWGO-QRFRQXIXSA-N 2 1 330.541 4.087 20 0 EIADMP NC(CCC(F)(F)F)=[NH+]OCc1cccc(C[NH+]2CCCCC2)c1 ZINC000863491206 1055214099 /nfs/dbraw/zinc/21/40/99/1055214099.db2.gz MKKLOYKSOBAHNK-UHFFFAOYSA-N 2 1 343.393 4.013 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C12CCC2)[C@@H](C)c1ccccc1C(F)(F)F ZINC000863542681 1055223595 /nfs/dbraw/zinc/22/35/95/1055223595.db2.gz SPQGIQVTUNFHJR-DVOMOZLQSA-N 2 1 326.406 4.072 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000878511830 1055330120 /nfs/dbraw/zinc/33/01/20/1055330120.db2.gz HHQDEDACAKLCPU-UXHICEINSA-N 2 1 341.499 4.078 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000878511830 1055330146 /nfs/dbraw/zinc/33/01/46/1055330146.db2.gz HHQDEDACAKLCPU-UXHICEINSA-N 2 1 341.499 4.078 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000474710958 1055997780 /nfs/dbraw/zinc/99/77/80/1055997780.db2.gz JZUPHWQZICZLLK-NUWOQIAWSA-N 2 1 334.470 4.454 20 0 EIADMP CCCC[NH+]1CCC([NH2+]Cc2cc(C)c(OC(F)F)c(C)c2)CC1 ZINC000742722895 1058738006 /nfs/dbraw/zinc/73/80/06/1058738006.db2.gz ATMAUKMLGDPXCR-UHFFFAOYSA-N 2 1 340.458 4.259 20 0 EIADMP CC[N@H+](C[C@@H]1CC1(Cl)Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000743873775 1059200246 /nfs/dbraw/zinc/20/02/46/1059200246.db2.gz VCRGOBKRBQMJMO-IRXDYDNUSA-N 2 1 341.326 4.024 20 0 EIADMP CC[N@@H+](C[C@@H]1CC1(Cl)Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000743873775 1059200267 /nfs/dbraw/zinc/20/02/67/1059200267.db2.gz VCRGOBKRBQMJMO-IRXDYDNUSA-N 2 1 341.326 4.024 20 0 EIADMP CC[NH+](C[C@@H]1CC1(Cl)Cl)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000743873775 1059200271 /nfs/dbraw/zinc/20/02/71/1059200271.db2.gz VCRGOBKRBQMJMO-IRXDYDNUSA-N 2 1 341.326 4.024 20 0 EIADMP CC[NH+](C[C@@H]1CC1(Cl)Cl)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000743873775 1059200298 /nfs/dbraw/zinc/20/02/98/1059200298.db2.gz VCRGOBKRBQMJMO-IRXDYDNUSA-N 2 1 341.326 4.024 20 0 EIADMP COc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000392742274 1060306945 /nfs/dbraw/zinc/30/69/45/1060306945.db2.gz SWMYUUHESBRBFL-RZUBCFFCSA-N 2 1 336.479 4.001 20 0 EIADMP COc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000392742274 1060306972 /nfs/dbraw/zinc/30/69/72/1060306972.db2.gz SWMYUUHESBRBFL-RZUBCFFCSA-N 2 1 336.479 4.001 20 0 EIADMP Fc1cccc2c1C[N@H+](Cc1ccc(C[NH+]3CCCCC3)cc1)CC2 ZINC001168894504 1060490809 /nfs/dbraw/zinc/49/08/09/1060490809.db2.gz RQGWPJKFRNJKKU-UHFFFAOYSA-N 2 1 338.470 4.370 20 0 EIADMP Fc1cccc2c1C[N@@H+](Cc1ccc(C[NH+]3CCCCC3)cc1)CC2 ZINC001168894504 1060490823 /nfs/dbraw/zinc/49/08/23/1060490823.db2.gz RQGWPJKFRNJKKU-UHFFFAOYSA-N 2 1 338.470 4.370 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](NCc1cccc(OCC3CCCCC3)c1)C2 ZINC001169108065 1060658439 /nfs/dbraw/zinc/65/84/39/1060658439.db2.gz NVHNJUNBTOJGFD-MZADTFQBSA-N 2 1 342.527 4.361 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1cccc(OCC3CCCCC3)c1)C2 ZINC001169108065 1060658449 /nfs/dbraw/zinc/65/84/49/1060658449.db2.gz NVHNJUNBTOJGFD-MZADTFQBSA-N 2 1 342.527 4.361 20 0 EIADMP 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 1060660604 /nfs/dbraw/zinc/66/06/04/1060660604.db2.gz OMLXCFHNMAOCEV-NRSFXHEJSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CC[C@@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141064 1060660610 /nfs/dbraw/zinc/66/06/10/1060660610.db2.gz OMLXCFHNMAOCEV-NRSFXHEJSA-N 2 1 338.417 4.120 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CC[C@@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141064 1060660618 /nfs/dbraw/zinc/66/06/18/1060660618.db2.gz OMLXCFHNMAOCEV-NRSFXHEJSA-N 2 1 338.417 4.120 20 0 EIADMP C[N@H+]1CC[C@H](c2ccc(N[C@@H]3CC(C)(C)C[C@@](C)(C[NH3+])C3)cc2)C1 ZINC001169148768 1060668738 /nfs/dbraw/zinc/66/87/38/1060668738.db2.gz ZYHNFNMFNAQZES-DSKINZAPSA-N 2 1 329.532 4.061 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](n1cc(C3CC[NH2+]CC3)c3ccc(F)cc31)C2 ZINC001169153692 1060670531 /nfs/dbraw/zinc/67/05/31/1060670531.db2.gz LEZOIPXEZNJUGX-PIIMJCKOSA-N 2 1 341.474 4.045 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](n1cc(C3CC[NH2+]CC3)c3ccc(F)cc31)C2 ZINC001169153690 1060671353 /nfs/dbraw/zinc/67/13/53/1060671353.db2.gz LEZOIPXEZNJUGX-BCDXTJNWSA-N 2 1 341.474 4.045 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccccc2NC(=O)OC(C)(C)C)CC1 ZINC001169230264 1060706632 /nfs/dbraw/zinc/70/66/32/1060706632.db2.gz URTIGADPJVBRNP-OAHLLOKOSA-N 2 1 347.503 4.169 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@H](C)C3)C[C@H]2C)CC1 ZINC001169233951 1060706989 /nfs/dbraw/zinc/70/69/89/1060706989.db2.gz YRCMSQTYZSKORT-NVLJRBADSA-N 3 1 349.607 4.019 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(Cc3cccc(C(F)(F)F)c3)CCC2)CC1 ZINC001169241607 1060716917 /nfs/dbraw/zinc/71/69/17/1060716917.db2.gz WTKQEXKCOMCRSK-UHFFFAOYSA-N 2 1 340.433 4.245 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccc(SC(F)(F)F)cc2)CC1 ZINC001169244775 1060718810 /nfs/dbraw/zinc/71/88/10/1060718810.db2.gz WMEVOELZUGIBLD-GFCCVEGCSA-N 2 1 332.435 4.433 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cccnc32)C1 ZINC000078704632 217105425 /nfs/dbraw/zinc/10/54/25/217105425.db2.gz BRTAYIONMNVZOM-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cccc3cccnc32)C1 ZINC000078704632 217105427 /nfs/dbraw/zinc/10/54/27/217105427.db2.gz BRTAYIONMNVZOM-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cccc3cccnc32)C1 ZINC000078704632 217105430 /nfs/dbraw/zinc/10/54/30/217105430.db2.gz BRTAYIONMNVZOM-RBUKOAKNSA-N 2 1 337.511 4.321 20 0 EIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000078847304 217134007 /nfs/dbraw/zinc/13/40/07/217134007.db2.gz RMNSWSDTZCVFLZ-LLGFUMIMSA-N 2 1 348.506 4.098 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(C)c(Br)s2)C1 ZINC001345412329 1019792701 /nfs/dbraw/zinc/79/27/01/1019792701.db2.gz QBHJNYXOAXMQRZ-QWHCGFSZSA-N 2 1 345.350 4.202 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)C1CCOCC1 ZINC000532192759 1032080443 /nfs/dbraw/zinc/08/04/43/1032080443.db2.gz KTJZSDOJBXNXNT-PGRDOPGGSA-N 2 1 344.543 4.356 20 0 EIADMP CC[NH+](CC)CC1CC[NH+](Cc2csc(-c3ccsc3)n2)CC1 ZINC000536629813 1032081480 /nfs/dbraw/zinc/08/14/80/1032081480.db2.gz DNUYCSVQOJTZNC-UHFFFAOYSA-N 2 1 349.569 4.425 20 0 EIADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@H]1c1ccccn1 ZINC000536629699 1032082062 /nfs/dbraw/zinc/08/20/62/1032082062.db2.gz HDAKSFJVZSDTBU-NRFANRHFSA-N 2 1 337.511 4.377 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@H]1c1ccccn1 ZINC000536629699 1032082080 /nfs/dbraw/zinc/08/20/80/1032082080.db2.gz HDAKSFJVZSDTBU-NRFANRHFSA-N 2 1 337.511 4.377 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000536629699 1032082096 /nfs/dbraw/zinc/08/20/96/1032082096.db2.gz HDAKSFJVZSDTBU-NRFANRHFSA-N 2 1 337.511 4.377 20 0 EIADMP C[NH+](Cc1ccccc1)CC(C)(C)C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000536629699 1032082111 /nfs/dbraw/zinc/08/21/11/1032082111.db2.gz HDAKSFJVZSDTBU-NRFANRHFSA-N 2 1 337.511 4.377 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Br)cc2)C1 ZINC000532214761 1032096120 /nfs/dbraw/zinc/09/61/20/1032096120.db2.gz LCFFWJGJKWZARJ-LSDHHAIUSA-N 2 1 339.321 4.220 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)C[C@H](C)O1 ZINC000648431538 1032294131 /nfs/dbraw/zinc/29/41/31/1032294131.db2.gz BPAXAJQZSBWTCE-WGMWDUQUSA-N 2 1 344.543 4.497 20 0 EIADMP C[C@@H](NCc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1nccs1 ZINC000245544160 1032297059 /nfs/dbraw/zinc/29/70/59/1032297059.db2.gz UFFZWDWDZDWJQF-JKSUJKDBSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1nccs1 ZINC000245544160 1032297071 /nfs/dbraw/zinc/29/70/71/1032297071.db2.gz UFFZWDWDZDWJQF-JKSUJKDBSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1nccs1 ZINC000245544160 1032297083 /nfs/dbraw/zinc/29/70/83/1032297083.db2.gz UFFZWDWDZDWJQF-JKSUJKDBSA-N 2 1 329.513 4.226 20 0 EIADMP CC(C)Oc1ccc2[nH+]ccc(N3CCC[C@H](c4[nH]cc[nH+]4)C3)c2c1 ZINC000450307960 1032409363 /nfs/dbraw/zinc/40/93/63/1032409363.db2.gz IRWCKHXGJBLZHP-HNNXBMFYSA-N 2 1 336.439 4.129 20 0 EIADMP CCC(CC)[C@@H](CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1)OC ZINC000533008864 1032438470 /nfs/dbraw/zinc/43/84/70/1032438470.db2.gz DSSFIGMGUKZLFD-OAQYLSRUSA-N 2 1 332.532 4.082 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529575085 1032456008 /nfs/dbraw/zinc/45/60/08/1032456008.db2.gz PTTVBMCICXBFGK-WMZOPIPTSA-N 2 1 336.470 4.312 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(Cl)c(OC)c2)c1 ZINC000623403307 1032457457 /nfs/dbraw/zinc/45/74/57/1032457457.db2.gz RJLBCBTUDKXMRC-UHFFFAOYSA-N 2 1 332.875 4.090 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]CC2=Cc3ccccc3OC2)CC1 ZINC000102423012 1032534795 /nfs/dbraw/zinc/53/47/95/1032534795.db2.gz KYCVSOYEWQQEOY-UHFFFAOYSA-N 2 1 348.490 4.025 20 0 EIADMP CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(OC(F)F)cc1 ZINC000178705733 1032544178 /nfs/dbraw/zinc/54/41/78/1032544178.db2.gz YLYBCDIAWBCDMB-SUMWQHHRSA-N 2 1 337.414 4.170 20 0 EIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000178704058 1032544233 /nfs/dbraw/zinc/54/42/33/1032544233.db2.gz MAJNGMHTKGTTQP-OLZOCXBDSA-N 2 1 334.533 4.241 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(OC(F)F)cc1 ZINC000178705709 1032544647 /nfs/dbraw/zinc/54/46/47/1032544647.db2.gz YLYBCDIAWBCDMB-CXAGYDPISA-N 2 1 337.414 4.170 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512391652 1032630675 /nfs/dbraw/zinc/63/06/75/1032630675.db2.gz OQRMBXGTHIMDQY-VQIMIIECSA-N 2 1 342.527 4.143 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512391652 1032630698 /nfs/dbraw/zinc/63/06/98/1032630698.db2.gz OQRMBXGTHIMDQY-VQIMIIECSA-N 2 1 342.527 4.143 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000512431539 1032750092 /nfs/dbraw/zinc/75/00/92/1032750092.db2.gz FRRFSOJGORFCNI-QGZVFWFLSA-N 2 1 349.478 4.293 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000432792862 1032812095 /nfs/dbraw/zinc/81/20/95/1032812095.db2.gz MYXWFJYZZIPHFQ-NRFANRHFSA-N 2 1 338.495 4.278 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000432792862 1032812096 /nfs/dbraw/zinc/81/20/96/1032812096.db2.gz MYXWFJYZZIPHFQ-NRFANRHFSA-N 2 1 338.495 4.278 20 0 EIADMP COc1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1OCCC(C)C ZINC000432794719 1032819276 /nfs/dbraw/zinc/81/92/76/1032819276.db2.gz URGLHCNYCYIKTR-LJQANCHMSA-N 2 1 348.531 4.036 20 0 EIADMP COc1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1OCCC(C)C ZINC000432794719 1032819277 /nfs/dbraw/zinc/81/92/77/1032819277.db2.gz URGLHCNYCYIKTR-LJQANCHMSA-N 2 1 348.531 4.036 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613707 1019463509 /nfs/dbraw/zinc/46/35/09/1019463509.db2.gz YMUBJSLFCPVHKF-ZFWWWQNUSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@H](C[N@@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613707 1019463529 /nfs/dbraw/zinc/46/35/29/1019463529.db2.gz YMUBJSLFCPVHKF-ZFWWWQNUSA-N 2 1 327.299 4.125 20 0 EIADMP C[NH+]1CCC[C@H](C[N@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613707 1019463556 /nfs/dbraw/zinc/46/35/56/1019463556.db2.gz YMUBJSLFCPVHKF-ZFWWWQNUSA-N 2 1 327.299 4.125 20 0 EIADMP CC[C@H](N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1nc(C)cs1 ZINC000274895910 1019841953 /nfs/dbraw/zinc/84/19/53/1019841953.db2.gz KEXFROIPLNLWLA-UHOSZYNNSA-N 2 1 343.540 4.403 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C(F)F)nc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000631108896 1019974646 /nfs/dbraw/zinc/97/46/46/1019974646.db2.gz IBFWDCZZCOPVOM-QAPCUYQASA-N 2 1 345.437 4.019 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](CSc1ccccc1)C(C)C ZINC000180626954 1020156899 /nfs/dbraw/zinc/15/68/99/1020156899.db2.gz RVTJMSBHSHNRAY-LJQANCHMSA-N 2 1 331.529 4.378 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000398153889 1020505044 /nfs/dbraw/zinc/50/50/44/1020505044.db2.gz QCFBOHSOHMNLFQ-QVYZHRQISA-N 2 1 334.507 4.433 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CC(c2ccccc2)C1 ZINC000398153889 1020505059 /nfs/dbraw/zinc/50/50/59/1020505059.db2.gz QCFBOHSOHMNLFQ-QVYZHRQISA-N 2 1 334.507 4.433 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000398190515 1020527193 /nfs/dbraw/zinc/52/71/93/1020527193.db2.gz ZETGDMONIDYTNF-KSSFIOAISA-N 2 1 334.916 4.402 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000398190515 1020527203 /nfs/dbraw/zinc/52/72/03/1020527203.db2.gz ZETGDMONIDYTNF-KSSFIOAISA-N 2 1 334.916 4.402 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+]Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000340438187 1021026048 /nfs/dbraw/zinc/02/60/48/1021026048.db2.gz ASOSVIXJLYJLCW-UHFFFAOYSA-N 2 1 349.356 4.260 20 0 EIADMP C([C@H]1CCC[N@@H+](CC2([C@H]3CCCCO3)CCC2)C1)[NH+]1CCCCCC1 ZINC001167326741 1021129295 /nfs/dbraw/zinc/12/92/95/1021129295.db2.gz PZNQJMKXBZEGJD-NHCUHLMSSA-N 2 1 348.575 4.314 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2COCc3ccccc32)cc1 ZINC000340521905 1021184656 /nfs/dbraw/zinc/18/46/56/1021184656.db2.gz XESKBYAAOSXDJA-VFNWGFHPSA-N 2 1 333.435 4.103 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)s1 ZINC000376165594 1021640224 /nfs/dbraw/zinc/64/02/24/1021640224.db2.gz ZQUICPWTRUDVGG-VHSSKADRSA-N 2 1 329.513 4.104 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC000414103514 1021858937 /nfs/dbraw/zinc/85/89/37/1021858937.db2.gz DUXDLFYWESCUCR-OKZBNKHCSA-N 2 1 330.516 4.307 20 0 EIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000584537350 1022012414 /nfs/dbraw/zinc/01/24/14/1022012414.db2.gz AWZXBADEPATLCR-QGZVFWFLSA-N 2 1 337.389 4.112 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1csc(-c2ccccc2)n1 ZINC000414169532 1022018325 /nfs/dbraw/zinc/01/83/25/1022018325.db2.gz BGFOFIAVLFHPPW-JKSUJKDBSA-N 2 1 329.513 4.193 20 0 EIADMP COc1ccc(CC[N@@H+](CC[C@H]2CCC[NH+]2C)CC(C)(C)C)cc1 ZINC001167401618 1022029988 /nfs/dbraw/zinc/02/99/88/1022029988.db2.gz BKCSBGDTZOKJNO-LJQANCHMSA-N 2 1 332.532 4.070 20 0 EIADMP COc1ccc(CC[NH+](CC[C@H]2CCC[N@@H+]2C)CC(C)(C)C)cc1 ZINC001167401618 1022030006 /nfs/dbraw/zinc/03/00/06/1022030006.db2.gz BKCSBGDTZOKJNO-LJQANCHMSA-N 2 1 332.532 4.070 20 0 EIADMP COc1ccc(CC[NH+](CC[C@H]2CCC[N@H+]2C)CC(C)(C)C)cc1 ZINC001167401618 1022030023 /nfs/dbraw/zinc/03/00/23/1022030023.db2.gz BKCSBGDTZOKJNO-LJQANCHMSA-N 2 1 332.532 4.070 20 0 EIADMP COc1ccsc1[C@H](C)NCC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000471580443 1022062661 /nfs/dbraw/zinc/06/26/61/1022062661.db2.gz IFUKFAYONTXUKZ-CVEARBPZSA-N 2 1 332.513 4.318 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000471580443 1022062690 /nfs/dbraw/zinc/06/26/90/1022062690.db2.gz IFUKFAYONTXUKZ-CVEARBPZSA-N 2 1 332.513 4.318 20 0 EIADMP COc1ccsc1[C@@H](C)NCC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000471580445 1022064023 /nfs/dbraw/zinc/06/40/23/1022064023.db2.gz IFUKFAYONTXUKZ-HZPDHXFCSA-N 2 1 332.513 4.318 20 0 EIADMP COc1ccsc1[C@@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000471580445 1022064058 /nfs/dbraw/zinc/06/40/58/1022064058.db2.gz IFUKFAYONTXUKZ-HZPDHXFCSA-N 2 1 332.513 4.318 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000398097550 1022220823 /nfs/dbraw/zinc/22/08/23/1022220823.db2.gz KWUSLTALRXMGNE-OXQOHEQNSA-N 2 1 328.887 4.340 20 0 EIADMP CCc1onc(C)c1C[NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000892574369 1022258060 /nfs/dbraw/zinc/25/80/60/1022258060.db2.gz ZKHCEEVNHVJEJN-MRXNPFEDSA-N 2 1 341.499 4.210 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)sc1C ZINC000892579611 1022300956 /nfs/dbraw/zinc/30/09/56/1022300956.db2.gz BQCLNSMXRRRTQB-OAHLLOKOSA-N 2 1 343.540 4.424 20 0 EIADMP Cc1nc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)sc1C ZINC000892579611 1022300975 /nfs/dbraw/zinc/30/09/75/1022300975.db2.gz BQCLNSMXRRRTQB-OAHLLOKOSA-N 2 1 343.540 4.424 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3cc4ccccc4[nH]3)CC2)n2c1CCCC2 ZINC000684026788 1022377578 /nfs/dbraw/zinc/37/75/78/1022377578.db2.gz MZTJCHYCCXKTIT-UHFFFAOYSA-N 2 1 334.467 4.080 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000564435591 1022395096 /nfs/dbraw/zinc/39/50/96/1022395096.db2.gz JMNJOAOUXSCSLL-LSDHHAIUSA-N 2 1 328.422 4.130 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(C(C)C)nc1C ZINC000339125775 1022630169 /nfs/dbraw/zinc/63/01/69/1022630169.db2.gz SAYCSVAKJPUQLN-UHFFFAOYSA-N 2 1 328.504 4.185 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(C(C)C)nc1C ZINC000339125775 1022630193 /nfs/dbraw/zinc/63/01/93/1022630193.db2.gz SAYCSVAKJPUQLN-UHFFFAOYSA-N 2 1 328.504 4.185 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000374542761 1022785331 /nfs/dbraw/zinc/78/53/31/1022785331.db2.gz HSYDIUXRGOTNOZ-ACRUOGEOSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000374542761 1022785362 /nfs/dbraw/zinc/78/53/62/1022785362.db2.gz HSYDIUXRGOTNOZ-ACRUOGEOSA-N 2 1 344.543 4.080 20 0 EIADMP c1ccc(C[N@H+]2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3C[NH+]2Cc2ccccc2)cc1 ZINC000656404132 1022846060 /nfs/dbraw/zinc/84/60/60/1022846060.db2.gz WYQSTLLFJCLBJL-BJESRGMDSA-N 2 1 332.491 4.029 20 0 EIADMP c1ccc(C[NH+]2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3C[N@@H+]2Cc2ccccc2)cc1 ZINC000656404132 1022846061 /nfs/dbraw/zinc/84/60/61/1022846061.db2.gz WYQSTLLFJCLBJL-BJESRGMDSA-N 2 1 332.491 4.029 20 0 EIADMP c1ccc(C[NH+]2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3C[N@H+]2Cc2ccccc2)cc1 ZINC000656404132 1022846063 /nfs/dbraw/zinc/84/60/63/1022846063.db2.gz WYQSTLLFJCLBJL-BJESRGMDSA-N 2 1 332.491 4.029 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000581131479 1022846922 /nfs/dbraw/zinc/84/69/22/1022846922.db2.gz RKORXKPMNUBNIJ-XUVXKRRUSA-N 2 1 344.568 4.447 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000581131479 1022846927 /nfs/dbraw/zinc/84/69/27/1022846927.db2.gz RKORXKPMNUBNIJ-XUVXKRRUSA-N 2 1 344.568 4.447 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3cc(N)ccc32)C[C@@H]1c1ccccc1 ZINC000423369633 1022861168 /nfs/dbraw/zinc/86/11/68/1022861168.db2.gz SUBYGKHTHQEKMK-ILWGZMRPSA-N 2 1 335.495 4.071 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCc3cc(N)ccc32)C[C@@H]1c1ccccc1 ZINC000423369633 1022861172 /nfs/dbraw/zinc/86/11/72/1022861172.db2.gz SUBYGKHTHQEKMK-ILWGZMRPSA-N 2 1 335.495 4.071 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000545461204 1022870834 /nfs/dbraw/zinc/87/08/34/1022870834.db2.gz SEMYOSDJWXHMQS-UIAACRFSSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC[N@H+]1C ZINC000545461204 1022870838 /nfs/dbraw/zinc/87/08/38/1022870838.db2.gz SEMYOSDJWXHMQS-UIAACRFSSA-N 2 1 343.902 4.091 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1c1ccccc1)C1CCC(C(F)(F)F)CC1 ZINC000423497999 1022927804 /nfs/dbraw/zinc/92/78/04/1022927804.db2.gz AVVDITJPSCFLFJ-IMXXYGAVSA-N 2 1 340.433 4.089 20 0 EIADMP Cc1nc(C)c([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)s1 ZINC000178224711 1023072026 /nfs/dbraw/zinc/07/20/26/1023072026.db2.gz XWMRDFNXFLRCEQ-LSDHHAIUSA-N 2 1 331.529 4.321 20 0 EIADMP Cc1nc(C)c([C@@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)s1 ZINC000178224711 1023072034 /nfs/dbraw/zinc/07/20/34/1023072034.db2.gz XWMRDFNXFLRCEQ-LSDHHAIUSA-N 2 1 331.529 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)s1 ZINC000178224722 1023073098 /nfs/dbraw/zinc/07/30/98/1023073098.db2.gz XWMRDFNXFLRCEQ-GJZGRUSLSA-N 2 1 331.529 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)s1 ZINC000178224722 1023073107 /nfs/dbraw/zinc/07/31/07/1023073107.db2.gz XWMRDFNXFLRCEQ-GJZGRUSLSA-N 2 1 331.529 4.321 20 0 EIADMP Cc1noc(C)c1CCC[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000166172224 1023084078 /nfs/dbraw/zinc/08/40/78/1023084078.db2.gz FYBMAYIYFVWEDR-AWEZNQCLSA-N 2 1 338.455 4.069 20 0 EIADMP C[C@@H]([NH2+]CCCOC1CCCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548162961 1023097134 /nfs/dbraw/zinc/09/71/34/1023097134.db2.gz GGJHBQXIDWBDBC-TZIWHRDSSA-N 2 1 344.543 4.226 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)c(F)c1 ZINC000376612310 1023236052 /nfs/dbraw/zinc/23/60/52/1023236052.db2.gz VAXVXLAEDOSKRV-QOKNQOGYSA-N 2 1 345.462 4.176 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)[C@@H]3C[C@H]3c3cccs3)CC2)[nH+]c1 ZINC000417310236 1023256010 /nfs/dbraw/zinc/25/60/10/1023256010.db2.gz JVZSUWXYELHATF-RYQLBKOJSA-N 2 1 341.524 4.202 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417338816 1023272749 /nfs/dbraw/zinc/27/27/49/1023272749.db2.gz ZFWHXMSZUDDDLK-RSPOEFSDSA-N 2 1 340.536 4.352 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000310714685 1023427343 /nfs/dbraw/zinc/42/73/43/1023427343.db2.gz VKIBXSTUSBWXDC-LJQANCHMSA-N 2 1 348.494 4.045 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1F ZINC000415078610 1023429556 /nfs/dbraw/zinc/42/95/56/1023429556.db2.gz IZJNASHAPFCDBA-YLJYHZDGSA-N 2 1 326.459 4.186 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1F ZINC000415078606 1023429817 /nfs/dbraw/zinc/42/98/17/1023429817.db2.gz IZJNASHAPFCDBA-PXNSSMCTSA-N 2 1 326.459 4.186 20 0 EIADMP FC(F)(F)c1ccccc1CC[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415087157 1023436879 /nfs/dbraw/zinc/43/68/79/1023436879.db2.gz VMJLSIWNOHDVOU-MJGOQNOKSA-N 2 1 348.412 4.331 20 0 EIADMP c1ccc([C@H]2C[C@@H]([NH2+]CCOc3ccc4ccccc4c3)CC[NH2+]2)cc1 ZINC000415086976 1023436971 /nfs/dbraw/zinc/43/69/71/1023436971.db2.gz SJQINOZRQMWVLN-JTHBVZDNSA-N 2 1 346.474 4.302 20 0 EIADMP C[N@@H+]1CC[C@H](C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)[C@@H]1c1cccs1 ZINC000377386051 1023503694 /nfs/dbraw/zinc/50/36/94/1023503694.db2.gz LWZHUUPMJVUIDJ-YQFWSFKMSA-N 2 1 338.586 4.251 20 0 EIADMP C[N@H+]1CC[C@H](C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)[C@@H]1c1cccs1 ZINC000377386051 1023503701 /nfs/dbraw/zinc/50/37/01/1023503701.db2.gz LWZHUUPMJVUIDJ-YQFWSFKMSA-N 2 1 338.586 4.251 20 0 EIADMP c1csc(-c2nc(C[N@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cs2)c1 ZINC000656783989 1023529466 /nfs/dbraw/zinc/52/94/66/1023529466.db2.gz BYPICGGRUOXIQK-OAHLLOKOSA-N 2 1 347.553 4.083 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCNc1ccc(C[NH+]2CCCC[C@@H]2C)cn1 ZINC001167750757 1023617353 /nfs/dbraw/zinc/61/73/53/1023617353.db2.gz BHEUNUPTUGBTLM-MOPGFXCFSA-N 2 1 344.547 4.132 20 0 EIADMP C[C@@H]1CCCC[NH+]1CCCNc1ccc(C[N@@H+]2CCCC[C@@H]2C)cn1 ZINC001167750757 1023617358 /nfs/dbraw/zinc/61/73/58/1023617358.db2.gz BHEUNUPTUGBTLM-MOPGFXCFSA-N 2 1 344.547 4.132 20 0 EIADMP C[C@@H]1CCCC[NH+]1CCCNc1ccc(C[N@H+]2CCCC[C@@H]2C)cn1 ZINC001167750757 1023617361 /nfs/dbraw/zinc/61/73/61/1023617361.db2.gz BHEUNUPTUGBTLM-MOPGFXCFSA-N 2 1 344.547 4.132 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(NCCC[N@@H+]2CCCC[C@H]2C)nc1 ZINC001167750760 1023617601 /nfs/dbraw/zinc/61/76/01/1023617601.db2.gz BHEUNUPTUGBTLM-RTBURBONSA-N 2 1 344.547 4.132 20 0 EIADMP C[C@@H]1CCCC[NH+]1CCCNc1ccc(C[N@@H+]2CCCC[C@H]2C)cn1 ZINC001167750760 1023617606 /nfs/dbraw/zinc/61/76/06/1023617606.db2.gz BHEUNUPTUGBTLM-RTBURBONSA-N 2 1 344.547 4.132 20 0 EIADMP C[C@@H]1CCCC[NH+]1CCCNc1ccc(C[N@H+]2CCCC[C@H]2C)cn1 ZINC001167750760 1023617609 /nfs/dbraw/zinc/61/76/09/1023617609.db2.gz BHEUNUPTUGBTLM-RTBURBONSA-N 2 1 344.547 4.132 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCNc1ccnc(NC(=O)OC(C)(C)C)c1 ZINC001167753549 1023630978 /nfs/dbraw/zinc/63/09/78/1023630978.db2.gz POHVYVCNSNOTSL-HNNXBMFYSA-N 2 1 348.491 4.105 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCCNc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001167753549 1023630985 /nfs/dbraw/zinc/63/09/85/1023630985.db2.gz POHVYVCNSNOTSL-HNNXBMFYSA-N 2 1 348.491 4.105 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCNc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001167753549 1023630987 /nfs/dbraw/zinc/63/09/87/1023630987.db2.gz POHVYVCNSNOTSL-HNNXBMFYSA-N 2 1 348.491 4.105 20 0 EIADMP C[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1cscn1 ZINC000581737911 1023658532 /nfs/dbraw/zinc/65/85/32/1023658532.db2.gz WEHQICVRNBCLHV-FAEJEUNOSA-N 2 1 329.513 4.237 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(OCCC(C)C)cc1 ZINC000236784685 1023717594 /nfs/dbraw/zinc/71/75/94/1023717594.db2.gz DGLBSLBXVKITFS-QGZVFWFLSA-N 2 1 329.488 4.042 20 0 EIADMP COc1ccc(F)c(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1 ZINC000549760772 1033156416 /nfs/dbraw/zinc/15/64/16/1033156416.db2.gz BROPSHVLSSPLIX-IFXJQAMLSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(F)c(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1 ZINC000549760772 1033156427 /nfs/dbraw/zinc/15/64/27/1033156427.db2.gz BROPSHVLSSPLIX-IFXJQAMLSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390609498 1023718488 /nfs/dbraw/zinc/71/84/88/1023718488.db2.gz WLVMGDUBEOQWJB-OAQYLSRUSA-N 2 1 338.495 4.086 20 0 EIADMP COc1ccccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390609498 1023718493 /nfs/dbraw/zinc/71/84/93/1023718493.db2.gz WLVMGDUBEOQWJB-OAQYLSRUSA-N 2 1 338.495 4.086 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)CC1 ZINC000510468839 1023774408 /nfs/dbraw/zinc/77/44/08/1023774408.db2.gz HRMCIYRDIRXEER-UHFFFAOYSA-N 2 1 340.458 4.211 20 0 EIADMP Fc1ccc(/C=C\C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000511784734 1023881328 /nfs/dbraw/zinc/88/13/28/1023881328.db2.gz HTRSVHHRMMMBJK-BQHGXPCASA-N 2 1 342.433 4.090 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000157850190 1023894788 /nfs/dbraw/zinc/89/47/88/1023894788.db2.gz HZENDPIAMANXQQ-LJQANCHMSA-N 3 1 335.580 4.028 20 0 EIADMP COc1cccc([C@@H](C)[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000430710904 1023966597 /nfs/dbraw/zinc/96/65/97/1023966597.db2.gz UYBMRFRSVCJWNL-UYAOXDASSA-N 2 1 338.495 4.210 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)CCCOc2ccc(Cl)c(C)c2)C1 ZINC000510653326 1024172844 /nfs/dbraw/zinc/17/28/44/1024172844.db2.gz RERWBZBBXGVHGA-DLBZAZTESA-N 2 1 338.923 4.127 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000301216790 1033191691 /nfs/dbraw/zinc/19/16/91/1033191691.db2.gz ZGYBRBIMGYDIHW-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510699554 1024251909 /nfs/dbraw/zinc/25/19/09/1024251909.db2.gz BZSMHBUQTFDQRG-NVXWUHKLSA-N 2 1 342.449 4.348 20 0 EIADMP Cc1cc(OCCC[C@@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)ccc1Cl ZINC000510711446 1024280046 /nfs/dbraw/zinc/28/00/46/1024280046.db2.gz COXMMVPJNFMTPI-MRXNPFEDSA-N 2 1 336.907 4.047 20 0 EIADMP CCCC[N@H+](Cc1nc(C(C)(C)[NH3+])no1)[C@@H](CC)c1ccccc1 ZINC000431074713 1024551546 /nfs/dbraw/zinc/55/15/46/1024551546.db2.gz XIKCUQRNNMYOSP-INIZCTEOSA-N 2 1 330.476 4.017 20 0 EIADMP CCCC[N@@H+](Cc1nc(C(C)(C)[NH3+])no1)[C@@H](CC)c1ccccc1 ZINC000431074713 1024551570 /nfs/dbraw/zinc/55/15/70/1024551570.db2.gz XIKCUQRNNMYOSP-INIZCTEOSA-N 2 1 330.476 4.017 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccccc1Br ZINC000164612176 1024705279 /nfs/dbraw/zinc/70/52/79/1024705279.db2.gz TYRXJVSZWVAGRX-ZDUSSCGKSA-N 2 1 336.277 4.085 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(F)c(Cl)c1Cl ZINC000432248407 1024751666 /nfs/dbraw/zinc/75/16/66/1024751666.db2.gz ZKWNCDBHYLAFTB-JTQLQIEISA-N 2 1 330.234 4.063 20 0 EIADMP Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000190703804 1024784951 /nfs/dbraw/zinc/78/49/51/1024784951.db2.gz RFJBVROPQUJUDB-UHFFFAOYSA-N 2 1 348.849 4.070 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000548482338 1024826489 /nfs/dbraw/zinc/82/64/89/1024826489.db2.gz GDXCIRCCZXLUCZ-HFSMHLIXSA-N 2 1 340.511 4.409 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000548482337 1024826821 /nfs/dbraw/zinc/82/68/21/1024826821.db2.gz GDXCIRCCZXLUCZ-FBBABVLZSA-N 2 1 340.511 4.409 20 0 EIADMP COC1(C[C@@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000510937504 1024849889 /nfs/dbraw/zinc/84/98/89/1024849889.db2.gz YDNHPOCWMOPHTQ-QUCCMNQESA-N 2 1 344.543 4.224 20 0 EIADMP COC1(C[C@@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000510937504 1024849892 /nfs/dbraw/zinc/84/98/92/1024849892.db2.gz YDNHPOCWMOPHTQ-QUCCMNQESA-N 2 1 344.543 4.224 20 0 EIADMP COc1ccc([C@H]2CCCC[C@H]2[NH2+]CCCn2cc[nH+]c2C)cc1F ZINC000510931974 1024851163 /nfs/dbraw/zinc/85/11/63/1024851163.db2.gz UGXRTASUEFWWCK-IEBWSBKVSA-N 2 1 345.462 4.045 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1N(C)C ZINC000093946459 1024852071 /nfs/dbraw/zinc/85/20/71/1024852071.db2.gz CUYBRDVHVHKPSK-KRWDZBQOSA-N 2 1 329.532 4.200 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCc3ccccc32)[C@H]1c1cccs1 ZINC000247972805 1024868513 /nfs/dbraw/zinc/86/85/13/1024868513.db2.gz HNFQAAFVRZQAHY-KPFFTGBYSA-N 2 1 326.509 4.408 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCc3ccccc32)[C@H]1c1cccs1 ZINC000247972805 1024868520 /nfs/dbraw/zinc/86/85/20/1024868520.db2.gz HNFQAAFVRZQAHY-KPFFTGBYSA-N 2 1 326.509 4.408 20 0 EIADMP Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)Cc1cccc2c1CC[NH2+]C2 ZINC000662278577 1025025858 /nfs/dbraw/zinc/02/58/58/1025025858.db2.gz HELVGZNCAONQGR-OAHLLOKOSA-N 2 1 343.540 4.414 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccnc3ccccc23)C1 ZINC000535825428 1025072548 /nfs/dbraw/zinc/07/25/48/1025072548.db2.gz DYOWQYBFBGKSDB-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccnc3ccccc23)C1 ZINC000535825428 1025072558 /nfs/dbraw/zinc/07/25/58/1025072558.db2.gz DYOWQYBFBGKSDB-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccnc3ccccc23)C1 ZINC000535825428 1025072565 /nfs/dbraw/zinc/07/25/65/1025072565.db2.gz DYOWQYBFBGKSDB-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccnc3ccccc23)C1 ZINC000535825428 1025072568 /nfs/dbraw/zinc/07/25/68/1025072568.db2.gz DYOWQYBFBGKSDB-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CCCc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000684613738 1025088385 /nfs/dbraw/zinc/08/83/85/1025088385.db2.gz KWQZEZWWMMSKHA-GUYCJALGSA-N 2 1 329.315 4.246 20 0 EIADMP FC(F)(F)C1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000563123490 1025191834 /nfs/dbraw/zinc/19/18/34/1025191834.db2.gz UXPJCDARAPNBTQ-INIZCTEOSA-N 2 1 338.417 4.116 20 0 EIADMP FC(F)(F)C1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000563123490 1025191846 /nfs/dbraw/zinc/19/18/46/1025191846.db2.gz UXPJCDARAPNBTQ-INIZCTEOSA-N 2 1 338.417 4.116 20 0 EIADMP c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467856 1025396963 /nfs/dbraw/zinc/39/69/63/1025396963.db2.gz IHXZCJNXTRBZSS-QUCCMNQESA-N 2 1 340.511 4.145 20 0 EIADMP c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467856 1025396982 /nfs/dbraw/zinc/39/69/82/1025396982.db2.gz IHXZCJNXTRBZSS-QUCCMNQESA-N 2 1 340.511 4.145 20 0 EIADMP COc1cccc2cc([C@@H](C)NC[C@@H]3CCC[N@@H+](CC4CC4)C3)oc21 ZINC000663467547 1025408382 /nfs/dbraw/zinc/40/83/82/1025408382.db2.gz GOGKQEJZHYMFEI-WBVHZDCISA-N 2 1 342.483 4.214 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)oc21 ZINC000663467547 1025408397 /nfs/dbraw/zinc/40/83/97/1025408397.db2.gz GOGKQEJZHYMFEI-WBVHZDCISA-N 2 1 342.483 4.214 20 0 EIADMP COc1cccc2cc([C@@H](C)[NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)oc21 ZINC000663467547 1025408410 /nfs/dbraw/zinc/40/84/10/1025408410.db2.gz GOGKQEJZHYMFEI-WBVHZDCISA-N 2 1 342.483 4.214 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(C)(C)CC(F)(F)F ZINC000663477441 1025434257 /nfs/dbraw/zinc/43/42/57/1025434257.db2.gz FDWWVHJJBAQBPN-WBVHZDCISA-N 2 1 342.449 4.465 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(C)(C)CC(F)(F)F ZINC000663477441 1025434267 /nfs/dbraw/zinc/43/42/67/1025434267.db2.gz FDWWVHJJBAQBPN-WBVHZDCISA-N 2 1 342.449 4.465 20 0 EIADMP C[C@H]1C[N@H+](CCC[NH2+]Cc2cc(-c3ccccc3)cs2)CCCO1 ZINC000432352162 1025728228 /nfs/dbraw/zinc/72/82/28/1025728228.db2.gz WCXDNBAKLIFWEO-KRWDZBQOSA-N 2 1 344.524 4.006 20 0 EIADMP CC(C)[NH+](CCC[NH2+]Cc1ccc(OC(F)(F)F)cc1)C(C)C ZINC000467762954 1025730465 /nfs/dbraw/zinc/73/04/65/1025730465.db2.gz FFPSNFRAWMJNDR-UHFFFAOYSA-N 2 1 332.410 4.184 20 0 EIADMP Clc1ccc(-c2nc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)cs2)cc1 ZINC000262041160 1025824880 /nfs/dbraw/zinc/82/48/80/1025824880.db2.gz PEKSGUHNEWTVQS-UHFFFAOYSA-N 2 1 347.915 4.039 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1c1ccc(C(=O)OC)cc1 ZINC001167836397 1025847098 /nfs/dbraw/zinc/84/70/98/1025847098.db2.gz ZHBCKCYUTFODNU-XLIONFOSSA-N 2 1 346.515 4.121 20 0 EIADMP C[C@@H](c1cccc(F)c1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278952029 1025860506 /nfs/dbraw/zinc/86/05/06/1025860506.db2.gz VUNCGMSOUJWSPG-HNNXBMFYSA-N 2 1 327.447 4.299 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000432409160 1025878508 /nfs/dbraw/zinc/87/85/08/1025878508.db2.gz FGQFWCAWVCEDBS-ROUUACIJSA-N 2 1 348.531 4.015 20 0 EIADMP CCn1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)cn1 ZINC000157652741 1025908423 /nfs/dbraw/zinc/90/84/23/1025908423.db2.gz LMFYQAPROZAPJH-ZWKOTPCHSA-N 2 1 340.515 4.128 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1cc2ccccc2s1 ZINC000432425677 1025920966 /nfs/dbraw/zinc/92/09/66/1025920966.db2.gz WLPDSZJATQFXPX-HOTGVXAUSA-N 2 1 332.513 4.053 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1cc2ccccc2s1 ZINC000432425677 1025921012 /nfs/dbraw/zinc/92/10/12/1025921012.db2.gz WLPDSZJATQFXPX-HOTGVXAUSA-N 2 1 332.513 4.053 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CCCO1 ZINC000432433117 1025969395 /nfs/dbraw/zinc/96/93/95/1025969395.db2.gz ZORANQBABCGQMQ-UWJYYQICSA-N 2 1 348.506 4.148 20 0 EIADMP c1cc2c(cccc2C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)s1 ZINC001167970408 1026047494 /nfs/dbraw/zinc/04/74/94/1026047494.db2.gz JXMLAVFQLFPBQW-AYHJJNSGSA-N 2 1 326.509 4.396 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(C)c(Br)s2)C1 ZINC000512130023 1026078620 /nfs/dbraw/zinc/07/86/20/1026078620.db2.gz MNMSTUIGANKHDT-STQMWFEESA-N 2 1 345.350 4.202 20 0 EIADMP CCOc1ccc(C[NH2+]Cc2cccc(C[N@@H+](C)CC)c2)c(C)c1 ZINC000657347540 1026212418 /nfs/dbraw/zinc/21/24/18/1026212418.db2.gz BCWJNROWVGBUCR-UHFFFAOYSA-N 2 1 326.484 4.135 20 0 EIADMP Fc1ccccc1C1(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CCC1 ZINC001167974840 1026214785 /nfs/dbraw/zinc/21/47/85/1026214785.db2.gz BHEULGLMNPQNJQ-AYHJJNSGSA-N 2 1 328.475 4.200 20 0 EIADMP Fc1ccccc1C1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CCC1 ZINC001167974840 1026214798 /nfs/dbraw/zinc/21/47/98/1026214798.db2.gz BHEULGLMNPQNJQ-AYHJJNSGSA-N 2 1 328.475 4.200 20 0 EIADMP Fc1ccccc1C1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CCC1 ZINC001167974840 1026214811 /nfs/dbraw/zinc/21/48/11/1026214811.db2.gz BHEULGLMNPQNJQ-AYHJJNSGSA-N 2 1 328.475 4.200 20 0 EIADMP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)Cc1ccccc1F ZINC001167977523 1026332546 /nfs/dbraw/zinc/33/25/46/1026332546.db2.gz DEMSNQHRHPWCGY-IHWFROFDSA-N 2 1 344.518 4.389 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)c1 ZINC000657367576 1026334012 /nfs/dbraw/zinc/33/40/12/1026334012.db2.gz QWGJNAUVYPIZOI-INIZCTEOSA-N 2 1 344.524 4.210 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000280783291 1026424337 /nfs/dbraw/zinc/42/43/37/1026424337.db2.gz IJRUURCXEVPJDD-CZIWCDLHSA-N 2 1 326.406 4.025 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cccc3[nH]ccc32)C1 ZINC000512210338 1026471021 /nfs/dbraw/zinc/47/10/21/1026471021.db2.gz CRSIVWJQOHJUJC-MSOLQXFVSA-N 2 1 325.500 4.254 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cccc3[nH]ccc32)C1 ZINC000512210338 1026471032 /nfs/dbraw/zinc/47/10/32/1026471032.db2.gz CRSIVWJQOHJUJC-MSOLQXFVSA-N 2 1 325.500 4.254 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000512210338 1026471043 /nfs/dbraw/zinc/47/10/43/1026471043.db2.gz CRSIVWJQOHJUJC-MSOLQXFVSA-N 2 1 325.500 4.254 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc3ccccc3s2)[C@H](C)C1 ZINC000132698301 1026566002 /nfs/dbraw/zinc/56/60/02/1026566002.db2.gz ITARHSAFPBFCMO-APWZRJJASA-N 2 1 346.540 4.128 20 0 EIADMP CO[C@H](CC(C)C)C[N@@H+](C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC001167571826 1026584178 /nfs/dbraw/zinc/58/41/78/1026584178.db2.gz BAVWZTYANQEMTE-CEWLAPEOSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001167571826 1026584184 /nfs/dbraw/zinc/58/41/84/1026584184.db2.gz BAVWZTYANQEMTE-CEWLAPEOSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001167571826 1026584192 /nfs/dbraw/zinc/58/41/92/1026584192.db2.gz BAVWZTYANQEMTE-CEWLAPEOSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001167571826 1026584205 /nfs/dbraw/zinc/58/42/05/1026584205.db2.gz BAVWZTYANQEMTE-CEWLAPEOSA-N 2 1 332.532 4.032 20 0 EIADMP CO[C@H](CC(C)C)C[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001167571826 1026584213 /nfs/dbraw/zinc/58/42/13/1026584213.db2.gz BAVWZTYANQEMTE-CEWLAPEOSA-N 2 1 332.532 4.032 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000119805537 1026654464 /nfs/dbraw/zinc/65/44/64/1026654464.db2.gz YGHQNAKVMHCOAZ-KRWDZBQOSA-N 3 1 348.494 4.093 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)CCOc2cc(Cl)ccc2Cl)CC1 ZINC000507316558 1026739087 /nfs/dbraw/zinc/73/90/87/1026739087.db2.gz MMAWCQYBNNYICF-UHFFFAOYSA-N 2 1 345.314 4.177 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCOc2cc(Cl)ccc2Cl)CC1 ZINC000507316558 1026739100 /nfs/dbraw/zinc/73/91/00/1026739100.db2.gz MMAWCQYBNNYICF-UHFFFAOYSA-N 2 1 345.314 4.177 20 0 EIADMP [NH3+][C@@H]1C[C@H](NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000261629364 1026755816 /nfs/dbraw/zinc/75/58/16/1026755816.db2.gz VTYNMQHREBQRHS-PMOQBDJRSA-N 2 1 349.522 4.023 20 0 EIADMP CCc1ccc([C@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)s1 ZINC000163539118 1026762307 /nfs/dbraw/zinc/76/23/07/1026762307.db2.gz IVGCEHOBWRWFGY-HNNXBMFYSA-N 2 1 329.513 4.334 20 0 EIADMP C[C@H]([NH2+]C1(C[NH2+][C@@H](C)[C@@H]2CCCOC2)CCCC1)c1ccccc1 ZINC000507533209 1026830207 /nfs/dbraw/zinc/83/02/07/1026830207.db2.gz NPUBOLSZZXUYTE-CMKODMSKSA-N 2 1 330.516 4.055 20 0 EIADMP C[C@H]1CC[C@H]([NH2+]C2CC[NH+](CCc3ccncc3)CC2)c2ccccc21 ZINC000152871921 1026858650 /nfs/dbraw/zinc/85/86/50/1026858650.db2.gz AVNMKKTZVGXIQZ-MBSDFSHPSA-N 2 1 349.522 4.317 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000125430708 1026872101 /nfs/dbraw/zinc/87/21/01/1026872101.db2.gz FZEXLQYGMXEMEX-UHFFFAOYSA-N 2 1 325.378 4.123 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000125430708 1026872109 /nfs/dbraw/zinc/87/21/09/1026872109.db2.gz FZEXLQYGMXEMEX-UHFFFAOYSA-N 2 1 325.378 4.123 20 0 EIADMP FC(F)(F)c1cscc1C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000582634572 1026885616 /nfs/dbraw/zinc/88/56/16/1026885616.db2.gz AJEWBTUHZCBOEW-UHFFFAOYSA-N 2 1 332.435 4.264 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000474477199 1027111246 /nfs/dbraw/zinc/11/12/46/1027111246.db2.gz RCBBSSSKCCLRQH-OTWHNJEPSA-N 2 1 332.532 4.431 20 0 EIADMP CS[C@@H]1CCCC[NH+](CC[C@H](C)[N@@H+]2CCCC[C@H](SC)C2)C1 ZINC000441107024 1027275549 /nfs/dbraw/zinc/27/55/49/1027275549.db2.gz WNMUZKYXZQAXDA-KSZLIROESA-N 2 1 344.634 4.200 20 0 EIADMP CS[C@@H]1CCCC[NH+](CC[C@H](C)[N@H+]2CCCC[C@H](SC)C2)C1 ZINC000441107024 1027275590 /nfs/dbraw/zinc/27/55/90/1027275590.db2.gz WNMUZKYXZQAXDA-KSZLIROESA-N 2 1 344.634 4.200 20 0 EIADMP C[N@@H+]1CC[C@H]2[C@@H](CCCN2c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000302709303 1027368762 /nfs/dbraw/zinc/36/87/62/1027368762.db2.gz DEQSBXCXEQAZNW-GUYCJALGSA-N 2 1 349.400 4.174 20 0 EIADMP C[N@H+]1CC[C@H]2[C@@H](CCCN2c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000302709303 1027368780 /nfs/dbraw/zinc/36/87/80/1027368780.db2.gz DEQSBXCXEQAZNW-GUYCJALGSA-N 2 1 349.400 4.174 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc2c1OC(C)(C)C2 ZINC000582813997 1027403446 /nfs/dbraw/zinc/40/34/46/1027403446.db2.gz WOKQBRIWPQKNGC-UHFFFAOYSA-N 2 1 341.499 4.071 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc2c1OC(C)(C)C2 ZINC000582813997 1027403460 /nfs/dbraw/zinc/40/34/60/1027403460.db2.gz WOKQBRIWPQKNGC-UHFFFAOYSA-N 2 1 341.499 4.071 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)C[C@H]1c1ccccc1 ZINC000453353989 1027423434 /nfs/dbraw/zinc/42/34/34/1027423434.db2.gz OABKIFVURGNWTK-RTWAWAEBSA-N 2 1 338.470 4.326 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)C[C@H]1c1ccccc1 ZINC000453353989 1027423440 /nfs/dbraw/zinc/42/34/40/1027423440.db2.gz OABKIFVURGNWTK-RTWAWAEBSA-N 2 1 338.470 4.326 20 0 EIADMP Clc1ccc(CCC[N@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cc1 ZINC000441410726 1027529042 /nfs/dbraw/zinc/52/90/42/1027529042.db2.gz LTMXLAKPEYUKPX-YLJYHZDGSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441410726 1027529045 /nfs/dbraw/zinc/52/90/45/1027529045.db2.gz LTMXLAKPEYUKPX-YLJYHZDGSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441410726 1027529057 /nfs/dbraw/zinc/52/90/57/1027529057.db2.gz LTMXLAKPEYUKPX-YLJYHZDGSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000441410726 1027529060 /nfs/dbraw/zinc/52/90/60/1027529060.db2.gz LTMXLAKPEYUKPX-YLJYHZDGSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000441410726 1027529072 /nfs/dbraw/zinc/52/90/72/1027529072.db2.gz LTMXLAKPEYUKPX-YLJYHZDGSA-N 2 1 332.919 4.221 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000320915256 1027563361 /nfs/dbraw/zinc/56/33/61/1027563361.db2.gz DOOGLPPWFUVPDY-UKPHBRMFSA-N 2 1 326.406 4.230 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCOCC1)c1ccc(Cl)cc1 ZINC000112517326 1027580192 /nfs/dbraw/zinc/58/01/92/1027580192.db2.gz KJDLKTZHBOHHKF-MRXNPFEDSA-N 2 1 344.886 4.023 20 0 EIADMP COc1ccccc1[C@@H](C)[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167994658 1027755349 /nfs/dbraw/zinc/75/53/49/1027755349.db2.gz JFIYWTJBUNKOHB-YJJAZYOBSA-N 2 1 328.500 4.093 20 0 EIADMP COc1ccccc1[C@@H](C)[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167994658 1027755365 /nfs/dbraw/zinc/75/53/65/1027755365.db2.gz JFIYWTJBUNKOHB-YJJAZYOBSA-N 2 1 328.500 4.093 20 0 EIADMP COc1ccccc1[C@@H](C)[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167994658 1027755380 /nfs/dbraw/zinc/75/53/80/1027755380.db2.gz JFIYWTJBUNKOHB-YJJAZYOBSA-N 2 1 328.500 4.093 20 0 EIADMP COc1ccccc1[C@@H](C)[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167994658 1027755394 /nfs/dbraw/zinc/75/53/94/1027755394.db2.gz JFIYWTJBUNKOHB-YJJAZYOBSA-N 2 1 328.500 4.093 20 0 EIADMP CCc1nc([C@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cs1 ZINC000162321484 1027856350 /nfs/dbraw/zinc/85/63/50/1027856350.db2.gz DOTLMCVMHDGIHE-GJZGRUSLSA-N 2 1 347.528 4.058 20 0 EIADMP c1cc(-c2ccc(C[NH+]3CCC([NH+]4CCCC4)CC3)cc2)cs1 ZINC000444588883 1027877024 /nfs/dbraw/zinc/87/70/24/1027877024.db2.gz HAZXFIHUKTWAOR-UHFFFAOYSA-N 2 1 326.509 4.475 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2)cc1F ZINC000153716689 1027885468 /nfs/dbraw/zinc/88/54/68/1027885468.db2.gz GUBAOGKNYZAQDG-LBPRGKRZSA-N 2 1 345.368 4.449 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCOc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000583099512 1028002383 /nfs/dbraw/zinc/00/23/83/1028002383.db2.gz MMBSJDPBDQVICB-QUCCMNQESA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCOc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000583099512 1028002402 /nfs/dbraw/zinc/00/24/02/1028002402.db2.gz MMBSJDPBDQVICB-QUCCMNQESA-N 2 1 344.886 4.144 20 0 EIADMP CC(C)COc1ccccc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000441449614 1028003007 /nfs/dbraw/zinc/00/30/07/1028003007.db2.gz PNUDYZQXPZSECH-LJQANCHMSA-N 2 1 330.516 4.029 20 0 EIADMP CC(C)COc1ccccc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000441449614 1028003017 /nfs/dbraw/zinc/00/30/17/1028003017.db2.gz PNUDYZQXPZSECH-LJQANCHMSA-N 2 1 330.516 4.029 20 0 EIADMP FC(F)(F)Oc1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000523439399 1028113952 /nfs/dbraw/zinc/11/39/52/1028113952.db2.gz YMHKIEBFCGVTFR-INIZCTEOSA-N 2 1 342.405 4.036 20 0 EIADMP FC(F)(F)Oc1ccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000523439399 1028113961 /nfs/dbraw/zinc/11/39/61/1028113961.db2.gz YMHKIEBFCGVTFR-INIZCTEOSA-N 2 1 342.405 4.036 20 0 EIADMP FC(F)(F)Oc1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000523439400 1028115863 /nfs/dbraw/zinc/11/58/63/1028115863.db2.gz YMHKIEBFCGVTFR-MRXNPFEDSA-N 2 1 342.405 4.036 20 0 EIADMP FC(F)(F)Oc1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000523439400 1028115882 /nfs/dbraw/zinc/11/58/82/1028115882.db2.gz YMHKIEBFCGVTFR-MRXNPFEDSA-N 2 1 342.405 4.036 20 0 EIADMP Fc1cccc(Oc2ccc(CN[C@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000443962587 1028123752 /nfs/dbraw/zinc/12/37/52/1028123752.db2.gz GNDYALXWRHLSGA-RBUKOAKNSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000443962587 1028123763 /nfs/dbraw/zinc/12/37/63/1028123763.db2.gz GNDYALXWRHLSGA-RBUKOAKNSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000443962587 1028123779 /nfs/dbraw/zinc/12/37/79/1028123779.db2.gz GNDYALXWRHLSGA-RBUKOAKNSA-N 2 1 340.442 4.334 20 0 EIADMP COc1ccc(C[N@@H+](Cc2cc(-n3ccnc3)cs2)C2CC2)cc1 ZINC000346129813 1028269541 /nfs/dbraw/zinc/26/95/41/1028269541.db2.gz HQOIWGIUMJVSRI-UHFFFAOYSA-N 2 1 339.464 4.107 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000346142377 1028279237 /nfs/dbraw/zinc/27/92/37/1028279237.db2.gz AOJUBABFKQVVIY-UHFFFAOYSA-N 2 1 338.430 4.125 20 0 EIADMP CC(C)=CCC[C@H](C)[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000162739988 1028317569 /nfs/dbraw/zinc/31/75/69/1028317569.db2.gz RCEHILKCGSFJQL-INIZCTEOSA-N 2 1 333.520 4.228 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+](Cc1cccc(C(F)(F)F)c1)C(C)C ZINC000346314511 1028381447 /nfs/dbraw/zinc/38/14/47/1028381447.db2.gz RCXBQSHXGFCUEK-UHFFFAOYSA-N 2 1 325.378 4.121 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1cccc(C(F)(F)F)c1)C(C)C ZINC000346314511 1028381465 /nfs/dbraw/zinc/38/14/65/1028381465.db2.gz RCXBQSHXGFCUEK-UHFFFAOYSA-N 2 1 325.378 4.121 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CCC12CCOCC2 ZINC000548794489 1028696450 /nfs/dbraw/zinc/69/64/50/1028696450.db2.gz HYECITHUGVEMOS-RXVVDRJESA-N 2 1 342.527 4.110 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc(C(F)(F)F)c2)CC1 ZINC000524156207 1028723458 /nfs/dbraw/zinc/72/34/58/1028723458.db2.gz UTQOETKUFUZBIG-UHFFFAOYSA-N 2 1 328.422 4.258 20 0 EIADMP Cc1nc(-c2ccccc2)oc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000639473119 1028807525 /nfs/dbraw/zinc/80/75/25/1028807525.db2.gz FOUPGTCNCWTLDP-UHFFFAOYSA-N 2 1 341.499 4.202 20 0 EIADMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000347001250 1028836670 /nfs/dbraw/zinc/83/66/70/1028836670.db2.gz GVNOGJMJNKQWEU-UKRRQHHQSA-N 2 1 334.410 4.000 20 0 EIADMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000347001251 1028838018 /nfs/dbraw/zinc/83/80/18/1028838018.db2.gz GVNOGJMJNKQWEU-ZFWWWQNUSA-N 2 1 334.410 4.000 20 0 EIADMP CC(C)C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000647302039 1028993333 /nfs/dbraw/zinc/99/33/33/1028993333.db2.gz PKUBGQGLNVZYJC-UNMCSNQZSA-N 2 1 337.511 4.281 20 0 EIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](c3cccnc3)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168053365 1029160114 /nfs/dbraw/zinc/16/01/14/1029160114.db2.gz OEOPTENAXNXTEN-IYRWYFENSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@H](c3cccnc3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053365 1029160128 /nfs/dbraw/zinc/16/01/28/1029160128.db2.gz OEOPTENAXNXTEN-IYRWYFENSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3cccnc3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053365 1029160135 /nfs/dbraw/zinc/16/01/35/1029160135.db2.gz OEOPTENAXNXTEN-IYRWYFENSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@@H](c3cccnc3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053367 1029161401 /nfs/dbraw/zinc/16/14/01/1029161401.db2.gz OEOPTENAXNXTEN-WOIUINJBSA-N 2 1 349.522 4.313 20 0 EIADMP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1csc(-c2ccccc2)n1 ZINC000650755873 1029183576 /nfs/dbraw/zinc/18/35/76/1029183576.db2.gz OPZHNSDTQRUAAY-HNNXBMFYSA-N 2 1 337.492 4.380 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000247057236 1029234427 /nfs/dbraw/zinc/23/44/27/1029234427.db2.gz NPHJKQROAITBMN-NYVOZVTQSA-N 2 1 334.507 4.423 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@@]3(CC3(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168058825 1029374315 /nfs/dbraw/zinc/37/43/15/1029374315.db2.gz CPEDYAHEHKEJCY-GPMSIDNRSA-N 2 1 334.454 4.159 20 0 EIADMP CC(C)O[C@@H](C[NH+]1CCC([NH+]2CCCCC2)CC1)c1ccccc1 ZINC000428446838 1029422437 /nfs/dbraw/zinc/42/24/37/1029422437.db2.gz KRQLYQCRILMNAB-NRFANRHFSA-N 2 1 330.516 4.103 20 0 EIADMP C[C@@H](CCc1ccsc1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475265284 1029474986 /nfs/dbraw/zinc/47/49/86/1029474986.db2.gz IAKYENKSBAKLTK-FXAWDEMLSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@@H]1[C@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000475278833 1029485537 /nfs/dbraw/zinc/48/55/37/1029485537.db2.gz XFRGCHVCJFGVPL-CVNLYIMZSA-N 2 1 334.507 4.290 20 0 EIADMP C[C@@H](CCc1ccc(F)cc1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475270416 1029486615 /nfs/dbraw/zinc/48/66/15/1029486615.db2.gz SEXAYVRXHQITJI-GHTZIAJQSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H](CC[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000446758578 1029572266 /nfs/dbraw/zinc/57/22/66/1029572266.db2.gz JUGMXEJCQWCTGH-LJQANCHMSA-N 2 1 337.511 4.424 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000657824295 1029586743 /nfs/dbraw/zinc/58/67/43/1029586743.db2.gz GBALABRUNDMWJB-GFCCVEGCSA-N 2 1 348.840 4.364 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)cc1 ZINC000584140660 1029639951 /nfs/dbraw/zinc/63/99/51/1029639951.db2.gz SBADXBSZNSHYNR-LAUBAEHRSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)cc1 ZINC000584140660 1029639958 /nfs/dbraw/zinc/63/99/58/1029639958.db2.gz SBADXBSZNSHYNR-LAUBAEHRSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000584140660 1029639963 /nfs/dbraw/zinc/63/99/63/1029639963.db2.gz SBADXBSZNSHYNR-LAUBAEHRSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000584140660 1029639965 /nfs/dbraw/zinc/63/99/65/1029639965.db2.gz SBADXBSZNSHYNR-LAUBAEHRSA-N 2 1 338.495 4.134 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Br)cc1F ZINC000446938968 1029646641 /nfs/dbraw/zinc/64/66/41/1029646641.db2.gz YSRODOJNOGTRRN-UBHSHLNASA-N 2 1 343.284 4.112 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@@H]([NH3+])C[C@H]3C)s2)cc1 ZINC000584180407 1029661967 /nfs/dbraw/zinc/66/19/67/1029661967.db2.gz MJDFJSHPRBEJAO-RHSMWYFYSA-N 2 1 329.513 4.245 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@@H]([NH3+])C[C@H]3C)s2)cc1 ZINC000584180407 1029661973 /nfs/dbraw/zinc/66/19/73/1029661973.db2.gz MJDFJSHPRBEJAO-RHSMWYFYSA-N 2 1 329.513 4.245 20 0 EIADMP c1ccc([C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)[C@H]2CCCO2)cc1 ZINC000584188390 1029665145 /nfs/dbraw/zinc/66/51/45/1029665145.db2.gz FAMZOTAYDYSAJN-FGZHOGPDSA-N 2 1 342.527 4.293 20 0 EIADMP CC(C)[NH+]1CCC(Nc2cc[nH+]c3cc(Br)ccc23)CC1 ZINC000301317174 1029705658 /nfs/dbraw/zinc/70/56/58/1029705658.db2.gz OGNKLQMZWXAVIP-UHFFFAOYSA-N 2 1 348.288 4.282 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1cccc(C2CC2)c1 ZINC000708502468 1029743940 /nfs/dbraw/zinc/74/39/40/1029743940.db2.gz HNSCXKKPRRKWIP-JPYJTQIMSA-N 2 1 334.507 4.422 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNCc1ccc(Cl)cc1F ZINC000708519306 1029744118 /nfs/dbraw/zinc/74/41/18/1029744118.db2.gz HNRPWTURFWUPRO-CRAIPNDOSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)cc1F ZINC000708519306 1029744125 /nfs/dbraw/zinc/74/41/25/1029744125.db2.gz HNRPWTURFWUPRO-CRAIPNDOSA-N 2 1 346.877 4.337 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)cc1F ZINC000708519306 1029744138 /nfs/dbraw/zinc/74/41/38/1029744138.db2.gz HNRPWTURFWUPRO-CRAIPNDOSA-N 2 1 346.877 4.337 20 0 EIADMP COc1cccc2c(N3CCC[C@@H]([NH+]4CCCC4)CC3)cc(C)[nH+]c12 ZINC000301652880 1029783181 /nfs/dbraw/zinc/78/31/81/1029783181.db2.gz GYUKUASYLQLQDR-QGZVFWFLSA-N 2 1 339.483 4.007 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)c2c1 ZINC000301763402 1029805930 /nfs/dbraw/zinc/80/59/30/1029805930.db2.gz GOJMHBLYQYLONF-KUHUBIRLSA-N 2 1 341.886 4.341 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000301763402 1029805935 /nfs/dbraw/zinc/80/59/35/1029805935.db2.gz GOJMHBLYQYLONF-KUHUBIRLSA-N 2 1 341.886 4.341 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccc(F)cn1 ZINC000092748919 1029944932 /nfs/dbraw/zinc/94/49/32/1029944932.db2.gz KGRJRDVULYWJQA-KRWDZBQOSA-N 2 1 341.474 4.448 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccc(F)cn1 ZINC000092746372 1029946167 /nfs/dbraw/zinc/94/61/67/1029946167.db2.gz PVPIIGFIHMYYPB-KRWDZBQOSA-N 2 1 341.474 4.303 20 0 EIADMP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000657875693 1030142349 /nfs/dbraw/zinc/14/23/49/1030142349.db2.gz HSGZOLSWTBAQGI-GXTWGEPZSA-N 2 1 348.840 4.221 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657877297 1030154983 /nfs/dbraw/zinc/15/49/83/1030154983.db2.gz PUYOODWCPKWMGA-NWDGAFQWSA-N 2 1 345.712 4.095 20 0 EIADMP FC1(F)CC[C@@H](C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC000450981581 1030159387 /nfs/dbraw/zinc/15/93/87/1030159387.db2.gz IYLQQWYUBYFUKN-RTBURBONSA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC[C@@H](C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC000450981581 1030159395 /nfs/dbraw/zinc/15/93/95/1030159395.db2.gz IYLQQWYUBYFUKN-RTBURBONSA-N 2 1 334.454 4.020 20 0 EIADMP FC1(F)CC[C@@H](C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC000450981581 1030159409 /nfs/dbraw/zinc/15/94/09/1030159409.db2.gz IYLQQWYUBYFUKN-RTBURBONSA-N 2 1 334.454 4.020 20 0 EIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@H]1CCOc2ccccc21 ZINC000685456694 1030334857 /nfs/dbraw/zinc/33/48/57/1030334857.db2.gz JAROUSWNDBVKGC-HXUWFJFHSA-N 2 1 338.495 4.136 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2[nH]nc3ccccc32)CC1)CC(C)C ZINC000685462660 1030340169 /nfs/dbraw/zinc/34/01/69/1030340169.db2.gz SJAXQSRFTVARFG-UHFFFAOYSA-N 2 1 342.531 4.143 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2n[nH]c3ccccc32)CC1)CC(C)C ZINC000685462660 1030340186 /nfs/dbraw/zinc/34/01/86/1030340186.db2.gz SJAXQSRFTVARFG-UHFFFAOYSA-N 2 1 342.531 4.143 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2n[nH]c3ccccc32)CC1)CC(C)C ZINC000685462660 1030340209 /nfs/dbraw/zinc/34/02/09/1030340209.db2.gz SJAXQSRFTVARFG-UHFFFAOYSA-N 2 1 342.531 4.143 20 0 EIADMP Brc1cccc2c1CC[C@H]2[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000530371262 1030340419 /nfs/dbraw/zinc/34/04/19/1030340419.db2.gz NVXFUPJHSWHBOF-WTNGLUPJSA-N 2 1 349.316 4.043 20 0 EIADMP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2nc(-c3ccccc3)c[nH]2)cc1 ZINC000447855470 1030381169 /nfs/dbraw/zinc/38/11/69/1030381169.db2.gz RIRLXPLGMBHZFV-UHFFFAOYSA-N 2 1 348.494 4.208 20 0 EIADMP C([C@H]1CCC2(CCCC2)O1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000530410444 1030382395 /nfs/dbraw/zinc/38/23/95/1030382395.db2.gz SOSOOMKJSPFJDI-VQTJNVASSA-N 2 1 334.548 4.066 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cc2cnccc2o1 ZINC000657896615 1030401111 /nfs/dbraw/zinc/40/11/11/1030401111.db2.gz AIQIARRBKIVAQB-OAHLLOKOSA-N 2 1 327.472 4.276 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1cc2cnccc2o1 ZINC000657898542 1030406973 /nfs/dbraw/zinc/40/69/73/1030406973.db2.gz DBMULIXHZUMEJH-DLBZAZTESA-N 2 1 337.467 4.389 20 0 EIADMP C[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1cc2cnccc2o1 ZINC000657898542 1030406979 /nfs/dbraw/zinc/40/69/79/1030406979.db2.gz DBMULIXHZUMEJH-DLBZAZTESA-N 2 1 337.467 4.389 20 0 EIADMP CCOC1CCC([NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000657904430 1030437024 /nfs/dbraw/zinc/43/70/24/1030437024.db2.gz SAFGSMCRPDUAEE-MYWSLZCHSA-N 2 1 327.472 4.179 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccnn1C1CCC1 ZINC000925205976 1030583889 /nfs/dbraw/zinc/58/38/89/1030583889.db2.gz KVIHBIAKBBRQKQ-INIZCTEOSA-N 2 1 330.520 4.056 20 0 EIADMP Cc1c([C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cnn1C(C)C ZINC000191238401 1030610645 /nfs/dbraw/zinc/61/06/45/1030610645.db2.gz YRFVMLANRNVRKA-INIZCTEOSA-N 2 1 332.536 4.078 20 0 EIADMP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000548851783 1030633020 /nfs/dbraw/zinc/63/30/20/1030633020.db2.gz FHCPGEDZZOCZAD-IPJDOKCGSA-N 2 1 326.406 4.040 20 0 EIADMP Oc1cccc2c1CCC[C@H]2[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000191640170 1030634091 /nfs/dbraw/zinc/63/40/91/1030634091.db2.gz JQBTZXYBZSKXDL-OAQYLSRUSA-N 2 1 336.479 4.024 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccc(F)cc1 ZINC000398037980 1030691608 /nfs/dbraw/zinc/69/16/08/1030691608.db2.gz QOMYXALHUONLMM-LLGFUMIMSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccc(F)cc1 ZINC000398037980 1030691629 /nfs/dbraw/zinc/69/16/29/1030691629.db2.gz QOMYXALHUONLMM-LLGFUMIMSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccc(C(F)F)nc1 ZINC000658041827 1030794269 /nfs/dbraw/zinc/79/42/69/1030794269.db2.gz JCVLEWJOVVTAMN-QGTPRVQTSA-N 2 1 345.437 4.015 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc(F)ccc1F ZINC000122310161 1030798569 /nfs/dbraw/zinc/79/85/69/1030798569.db2.gz FQVUUBUVSGEBJT-LJQANCHMSA-N 2 1 348.437 4.146 20 0 EIADMP CCC(CC)(C[NH2+][C@@H]1CCC12CCOCC2)[NH2+][C@@H](C)c1ccccc1 ZINC000548859476 1030821392 /nfs/dbraw/zinc/82/13/92/1030821392.db2.gz JOBALWFAWQKZAL-AZUAARDMSA-N 2 1 344.543 4.445 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)c1 ZINC000658210000 1030884538 /nfs/dbraw/zinc/88/45/38/1030884538.db2.gz STMJUKSRYSHICC-MAUKXSAKSA-N 2 1 336.545 4.027 20 0 EIADMP C[C@]1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)CC1(F)F ZINC000658219636 1030885543 /nfs/dbraw/zinc/88/55/43/1030885543.db2.gz CJANBTSUOQPLGU-ZSYWTGECSA-N 2 1 334.454 4.065 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCc3ccc(O)cc32)CC1 ZINC000658242559 1030899859 /nfs/dbraw/zinc/89/98/59/1030899859.db2.gz ZXVSECYLLURXMR-IPHXSNPTSA-N 2 1 328.500 4.012 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCc4ccc(O)cc43)CC2)C1 ZINC000658241844 1030901171 /nfs/dbraw/zinc/90/11/71/1030901171.db2.gz VUAVROFXFMIZIT-FYINFDKHSA-N 2 1 328.500 4.012 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000658265851 1030916760 /nfs/dbraw/zinc/91/67/60/1030916760.db2.gz VJQIMJFKXNFMLG-OXHPOLQJSA-N 2 1 348.481 4.455 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC2(CC2(F)F)CC1 ZINC000658265851 1030916780 /nfs/dbraw/zinc/91/67/80/1030916780.db2.gz VJQIMJFKXNFMLG-OXHPOLQJSA-N 2 1 348.481 4.455 20 0 EIADMP Cc1ccc([C@@H]([NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)C2CCCC2)cc1 ZINC000658293428 1030958376 /nfs/dbraw/zinc/95/83/76/1030958376.db2.gz HBENFHXERQMNHM-VXKWHMMOSA-N 2 1 342.527 4.069 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCSc2ccc(Cl)cc2)[C@H](C)C1 ZINC001167686154 1031027169 /nfs/dbraw/zinc/02/71/69/1031027169.db2.gz OICXACFCFZZISX-PBHICJAKSA-N 2 1 326.937 4.094 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCSc2ccc(Cl)cc2)[C@H](C)C1 ZINC001167686154 1031027189 /nfs/dbraw/zinc/02/71/89/1031027189.db2.gz OICXACFCFZZISX-PBHICJAKSA-N 2 1 326.937 4.094 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCSc2ccc(Cl)cc2)[C@H](C)C1 ZINC001167686154 1031027208 /nfs/dbraw/zinc/02/72/08/1031027208.db2.gz OICXACFCFZZISX-PBHICJAKSA-N 2 1 326.937 4.094 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)CCOc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000531378172 1031140881 /nfs/dbraw/zinc/14/08/81/1031140881.db2.gz DGFJXBFNTLNZHK-KBPBESRZSA-N 2 1 345.314 4.177 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCOc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000531378172 1031140902 /nfs/dbraw/zinc/14/09/02/1031140902.db2.gz DGFJXBFNTLNZHK-KBPBESRZSA-N 2 1 345.314 4.177 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCOc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000531378172 1031140913 /nfs/dbraw/zinc/14/09/13/1031140913.db2.gz DGFJXBFNTLNZHK-KBPBESRZSA-N 2 1 345.314 4.177 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCOc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000531378172 1031140922 /nfs/dbraw/zinc/14/09/22/1031140922.db2.gz DGFJXBFNTLNZHK-KBPBESRZSA-N 2 1 345.314 4.177 20 0 EIADMP Cc1csc(CCCC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)n1 ZINC000340226450 1031199300 /nfs/dbraw/zinc/19/93/00/1031199300.db2.gz QPWKZNZDZPKPPB-RTBURBONSA-N 2 1 343.540 4.199 20 0 EIADMP Cc1csc(CCCC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)n1 ZINC000340226450 1031199312 /nfs/dbraw/zinc/19/93/12/1031199312.db2.gz QPWKZNZDZPKPPB-RTBURBONSA-N 2 1 343.540 4.199 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(CO)c2)cc1 ZINC000305672204 1031215329 /nfs/dbraw/zinc/21/53/29/1031215329.db2.gz XPOIYOKZABIRBF-HOTGVXAUSA-N 2 1 335.451 4.085 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)c(OCCC)c1 ZINC000532505307 1031224385 /nfs/dbraw/zinc/22/43/85/1031224385.db2.gz AWDAVHVZWRZAKF-MSOLQXFVSA-N 2 1 348.531 4.257 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)c(OCCC)c1 ZINC000532505307 1031224393 /nfs/dbraw/zinc/22/43/93/1031224393.db2.gz AWDAVHVZWRZAKF-MSOLQXFVSA-N 2 1 348.531 4.257 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)C2CCOCC2)CC[N@@H+]1Cc1ccccc1 ZINC000897451801 1031343166 /nfs/dbraw/zinc/34/31/66/1031343166.db2.gz QCJCPMQDXFCAAO-RXVVDRJESA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)C2CCOCC2)CC[N@H+]1Cc1ccccc1 ZINC000897451801 1031343178 /nfs/dbraw/zinc/34/31/78/1031343178.db2.gz QCJCPMQDXFCAAO-RXVVDRJESA-N 2 1 344.543 4.082 20 0 EIADMP CSCC1CCC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000294651423 1031354190 /nfs/dbraw/zinc/35/41/90/1031354190.db2.gz BVIKORSUEYKNQR-UHFFFAOYSA-N 2 1 332.557 4.162 20 0 EIADMP CCc1ccc(C[NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)o1 ZINC000531602954 1031406734 /nfs/dbraw/zinc/40/67/34/1031406734.db2.gz PNCBHILCMLEUFH-QGZVFWFLSA-N 2 1 326.484 4.364 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@H]3CCOC4(CCC4)C3)cc2)C1 ZINC000449074137 1031425168 /nfs/dbraw/zinc/42/51/68/1031425168.db2.gz BLRAZDRQHRYDEV-RXVVDRJESA-N 2 1 342.527 4.110 20 0 EIADMP Clc1ccc(C2=CC[C@@H]([NH2+]C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000449071763 1031425257 /nfs/dbraw/zinc/42/52/57/1031425257.db2.gz ONRBCPMEJHMDPU-GOSISDBHSA-N 2 1 330.903 4.492 20 0 EIADMP Cc1cnc(C[NH2+]Cc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)s1 ZINC000449083504 1031438489 /nfs/dbraw/zinc/43/84/89/1031438489.db2.gz UJUHEIBBUFJMHN-IYBDPMFKSA-N 2 1 343.540 4.219 20 0 EIADMP Cc1cnc(C[NH2+]Cc2ccc(C[N@@H+]3C[C@H](C)C[C@H](C)C3)cc2)s1 ZINC000449083504 1031438504 /nfs/dbraw/zinc/43/85/04/1031438504.db2.gz UJUHEIBBUFJMHN-IYBDPMFKSA-N 2 1 343.540 4.219 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1cccc(O)c1 ZINC000449129591 1031466289 /nfs/dbraw/zinc/46/62/89/1031466289.db2.gz CSAIJQUWEVHKKB-ZWKOTPCHSA-N 2 1 338.495 4.138 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000531738283 1031515317 /nfs/dbraw/zinc/51/53/17/1031515317.db2.gz FUHJTXZAAOBUOM-XNJGSVPQSA-N 2 1 329.315 4.244 20 0 EIADMP COc1cccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@H]3C)cc2)c1 ZINC000531725042 1031526658 /nfs/dbraw/zinc/52/66/58/1031526658.db2.gz GKOGDKVOLNRRMT-DRSNIGMVSA-N 2 1 338.495 4.181 20 0 EIADMP COCC1CCC([NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000449216234 1031549437 /nfs/dbraw/zinc/54/94/37/1031549437.db2.gz QQJAFAMENNRVIF-NTYOPAKOSA-N 2 1 344.543 4.082 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccccc2Oc2cccnc2)C[C@@H]1C ZINC000531140006 1031582965 /nfs/dbraw/zinc/58/29/65/1031582965.db2.gz SFKMHDRSDYQSHV-HKUYNNGSSA-N 2 1 339.483 4.179 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2Oc2cccnc2)C[C@@H]1C ZINC000531140006 1031582978 /nfs/dbraw/zinc/58/29/78/1031582978.db2.gz SFKMHDRSDYQSHV-HKUYNNGSSA-N 2 1 339.483 4.179 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2Oc2cccnc2)C[C@@H]1C ZINC000531140006 1031582989 /nfs/dbraw/zinc/58/29/89/1031582989.db2.gz SFKMHDRSDYQSHV-HKUYNNGSSA-N 2 1 339.483 4.179 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2Oc2cccnc2)C[C@@H]1C ZINC000531140006 1031583001 /nfs/dbraw/zinc/58/30/01/1031583001.db2.gz SFKMHDRSDYQSHV-HKUYNNGSSA-N 2 1 339.483 4.179 20 0 EIADMP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc3cc[nH]c3n2)CC1 ZINC000449334904 1031652575 /nfs/dbraw/zinc/65/25/75/1031652575.db2.gz KFPSZOPOVKGYDU-UHFFFAOYSA-N 2 1 342.531 4.332 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000449556688 1031843226 /nfs/dbraw/zinc/84/32/26/1031843226.db2.gz NLUNPHRZRHYZBH-IHWFROFDSA-N 2 1 336.479 4.077 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ncccc1F ZINC000528823587 1031877069 /nfs/dbraw/zinc/87/70/69/1031877069.db2.gz LNQGMELWYDLBHE-INIZCTEOSA-N 2 1 327.447 4.057 20 0 EIADMP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1F ZINC000453359698 1031889614 /nfs/dbraw/zinc/88/96/14/1031889614.db2.gz QFNHWAAPNACHMS-VCOHRLAKSA-N 2 1 346.490 4.075 20 0 EIADMP CCN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000531980330 1031928223 /nfs/dbraw/zinc/92/82/23/1031928223.db2.gz ZZLICZRAQDKBBY-UYAOXDASSA-N 2 1 337.511 4.417 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccccc1OC(F)(F)F ZINC000453418666 1031951268 /nfs/dbraw/zinc/95/12/68/1031951268.db2.gz YPYJMNSLYIUWPI-ZDUSSCGKSA-N 2 1 330.394 4.110 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]CCCC[N@@H+](C)C3CC3)c(C)c2c1 ZINC000453419329 1031976645 /nfs/dbraw/zinc/97/66/45/1031976645.db2.gz YUHNVSKYXOPYOG-OAHLLOKOSA-N 2 1 330.472 4.275 20 0 EIADMP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000152482539 1031985882 /nfs/dbraw/zinc/98/58/82/1031985882.db2.gz VEJXYTHYOAXBBJ-ZBEGNZNMSA-N 2 1 325.283 4.055 20 0 EIADMP CCc1ccc(C[N@@H+](C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)nc1 ZINC000549866454 1033490031 /nfs/dbraw/zinc/49/00/31/1033490031.db2.gz XNIPHBHOTAENEA-GCJKJVERSA-N 2 1 337.511 4.129 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccns1 ZINC000924865679 1033542960 /nfs/dbraw/zinc/54/29/60/1033542960.db2.gz IKTRPXKUNAWYGY-MRXNPFEDSA-N 2 1 329.513 4.370 20 0 EIADMP CC(C)Oc1ccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000512831764 1034028667 /nfs/dbraw/zinc/02/86/67/1034028667.db2.gz DNTGUKHDIYOVHM-KDURUIRLSA-N 2 1 332.532 4.322 20 0 EIADMP C[C@H](C[NH2+]Cc1ccc(-c2ccccc2Cl)o1)C[NH+]1CCCC1 ZINC000513077594 1034497260 /nfs/dbraw/zinc/49/72/60/1034497260.db2.gz WNUGEZSJJXBQKC-OAHLLOKOSA-N 2 1 332.875 4.422 20 0 EIADMP COCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCCC1 ZINC000513341517 1034889042 /nfs/dbraw/zinc/88/90/42/1034889042.db2.gz WCMYHAZKHGUJAR-PZJWPPBQSA-N 2 1 344.543 4.226 20 0 EIADMP COCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCCC1 ZINC000513341517 1034889046 /nfs/dbraw/zinc/88/90/46/1034889046.db2.gz WCMYHAZKHGUJAR-PZJWPPBQSA-N 2 1 344.543 4.226 20 0 EIADMP COCc1ccccc1/C=C(/C)C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000509927401 1035011309 /nfs/dbraw/zinc/01/13/09/1035011309.db2.gz PEMNIHHGUWXXOG-RVPSJEOCSA-N 2 1 344.543 4.338 20 0 EIADMP C[NH+](C)[C@@H](CNc1cc[nH+]c2ccc(Cl)cc12)c1ccsc1 ZINC000513650291 1035078030 /nfs/dbraw/zinc/07/80/30/1035078030.db2.gz LUBVUBHJMAGHGX-KRWDZBQOSA-N 2 1 331.872 4.086 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501378235 1035432846 /nfs/dbraw/zinc/43/28/46/1035432846.db2.gz PACLTWOMMVQFQZ-DYQZNNLLSA-N 2 1 343.559 4.456 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@H+]1C ZINC000501465710 1035449505 /nfs/dbraw/zinc/44/95/05/1035449505.db2.gz GLQWXKQJLVHTFW-FOIQADDNSA-N 2 1 344.449 4.169 20 0 EIADMP Cc1cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)ccc1C(F)(F)F ZINC000414439529 1035456393 /nfs/dbraw/zinc/45/63/93/1035456393.db2.gz LDTBDVRWXAQYCJ-XYPWUTKMSA-N 2 1 326.406 4.071 20 0 EIADMP Cc1cc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)ccc1C(F)(F)F ZINC000414439529 1035456401 /nfs/dbraw/zinc/45/64/01/1035456401.db2.gz LDTBDVRWXAQYCJ-XYPWUTKMSA-N 2 1 326.406 4.071 20 0 EIADMP Cc1cc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)ccc1C(F)(F)F ZINC000414439529 1035456406 /nfs/dbraw/zinc/45/64/06/1035456406.db2.gz LDTBDVRWXAQYCJ-XYPWUTKMSA-N 2 1 326.406 4.071 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SC(F)F)cc2)C1 ZINC000151137008 1035508856 /nfs/dbraw/zinc/50/88/56/1035508856.db2.gz WJAHMMKECJIULY-UONOGXRCSA-N 2 1 328.472 4.384 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420327446 1035533609 /nfs/dbraw/zinc/53/36/09/1035533609.db2.gz LDPLGFBKDPYTHZ-BMFZPTHFSA-N 2 1 326.406 4.088 20 0 EIADMP Brc1ccc([C@H]2CCC[N@H+]2CCC2CC[NH2+]CC2)s1 ZINC000420377147 1035559596 /nfs/dbraw/zinc/55/95/96/1035559596.db2.gz RRLZEZOMUWZFPB-CYBMUJFWSA-N 2 1 343.334 4.037 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(F)c2ccccc21 ZINC000568768695 1035695052 /nfs/dbraw/zinc/69/50/52/1035695052.db2.gz DRFFOXOECVKAOF-IRXDYDNUSA-N 2 1 344.474 4.130 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(F)c2ccccc21 ZINC000568768695 1035695070 /nfs/dbraw/zinc/69/50/70/1035695070.db2.gz DRFFOXOECVKAOF-IRXDYDNUSA-N 2 1 344.474 4.130 20 0 EIADMP c1cnc2c(c1)cccc2C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491053937 1035798782 /nfs/dbraw/zinc/79/87/82/1035798782.db2.gz ACMSWCCASFFPOM-LJQANCHMSA-N 2 1 337.511 4.323 20 0 EIADMP Cc1ccc(F)cc1C[N@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC000491151666 1035818749 /nfs/dbraw/zinc/81/87/49/1035818749.db2.gz XTDQGMCBIHMRGP-UHFFFAOYSA-N 2 1 326.459 4.231 20 0 EIADMP Cc1ccc(F)cc1CN(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000491151666 1035818753 /nfs/dbraw/zinc/81/87/53/1035818753.db2.gz XTDQGMCBIHMRGP-UHFFFAOYSA-N 2 1 326.459 4.231 20 0 EIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@H](C(F)(F)F)[C@H](C[NH3+])C2)c(C)c1 ZINC000629561781 1035830955 /nfs/dbraw/zinc/83/09/55/1035830955.db2.gz KKJWUZKTAKQDHN-XHSDSOJGSA-N 2 1 328.422 4.132 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cnn(C2CCCC2)c1 ZINC000502727536 1036586908 /nfs/dbraw/zinc/58/69/08/1036586908.db2.gz NRVMEIMBNUTJDW-ROUUACIJSA-N 2 1 332.536 4.303 20 0 EIADMP Cc1cc(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)cc(C)n1 ZINC000421848313 1036824707 /nfs/dbraw/zinc/82/47/07/1036824707.db2.gz AGXJSCJHPLWQBP-UHFFFAOYSA-N 2 1 337.511 4.231 20 0 EIADMP CCOc1ccc([C@H]2CCC[N@H+]2C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168392697 1036852677 /nfs/dbraw/zinc/85/26/77/1036852677.db2.gz SBRLOHALUCJXJE-OAQYLSRUSA-N 2 1 328.500 4.097 20 0 EIADMP FC1(F)CCC(C[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000503043879 1036884191 /nfs/dbraw/zinc/88/41/91/1036884191.db2.gz AUSUJBAESDVYOR-SLFFLAALSA-N 2 1 348.481 4.312 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cccc3[nH]ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000503123233 1036921254 /nfs/dbraw/zinc/92/12/54/1036921254.db2.gz RMWSXKGBFUCZLY-WIYYLYMNSA-N 2 1 347.506 4.353 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2cccc3[nH]ccc32)CC[N@H+]1Cc1ccccc1 ZINC000503123233 1036921265 /nfs/dbraw/zinc/92/12/65/1036921265.db2.gz RMWSXKGBFUCZLY-WIYYLYMNSA-N 2 1 347.506 4.353 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000271742244 1037002588 /nfs/dbraw/zinc/00/25/88/1037002588.db2.gz QLBLMUSTWUUYTN-MNOVXSKESA-N 2 1 341.286 4.067 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)oc1C ZINC000669699104 1037017418 /nfs/dbraw/zinc/01/74/18/1037017418.db2.gz HKBRCQWTEDSGDM-YLJYHZDGSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000669699104 1037017435 /nfs/dbraw/zinc/01/74/35/1037017435.db2.gz HKBRCQWTEDSGDM-YLJYHZDGSA-N 2 1 326.484 4.459 20 0 EIADMP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000271868080 1037042845 /nfs/dbraw/zinc/04/28/45/1037042845.db2.gz LWGUHTCFYQMMPJ-QGZVFWFLSA-N 2 1 336.479 4.275 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000272298518 1037153790 /nfs/dbraw/zinc/15/37/90/1037153790.db2.gz CQSNDLYVCGUPSE-HXUWFJFHSA-N 2 1 327.447 4.337 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCCOc2ccc(Cl)cc2)CC1 ZINC000590786469 1037167013 /nfs/dbraw/zinc/16/70/13/1037167013.db2.gz BJEDEDKARNFROQ-UHFFFAOYSA-N 2 1 338.923 4.161 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCc2cc(Cl)ccc2Cl)CC1 ZINC000487854764 1037262438 /nfs/dbraw/zinc/26/24/38/1037262438.db2.gz CYENBCYPNLFFPV-UHFFFAOYSA-N 2 1 329.315 4.341 20 0 EIADMP Oc1ccc(C2CCC([NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)CC2)cc1 ZINC000668820336 1037352181 /nfs/dbraw/zinc/35/21/81/1037352181.db2.gz UGHIPQHHVRVQEF-JSOIOWGOSA-N 2 1 342.527 4.130 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)o1 ZINC000604415097 1037382499 /nfs/dbraw/zinc/38/24/99/1037382499.db2.gz OAHFDVUXJNGCQP-OAHLLOKOSA-N 2 1 330.447 4.216 20 0 EIADMP Brc1ccc2c(N[C@H]3CC[N@@H+]4CCC[C@H]4C3)cc[nH+]c2c1 ZINC000604757126 1037529554 /nfs/dbraw/zinc/52/95/54/1037529554.db2.gz VPNPQULDXMIWLN-KBPBESRZSA-N 2 1 346.272 4.036 20 0 EIADMP Brc1ccc2c(N[C@H]3CC[N@H+]4CCC[C@H]4C3)cc[nH+]c2c1 ZINC000604757126 1037529582 /nfs/dbraw/zinc/52/95/82/1037529582.db2.gz VPNPQULDXMIWLN-KBPBESRZSA-N 2 1 346.272 4.036 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CS1 ZINC000488430796 1037589268 /nfs/dbraw/zinc/58/92/68/1037589268.db2.gz ZHFNGWDYEUDJLM-GTAWCEEGSA-N 2 1 332.557 4.159 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CS1 ZINC000488430796 1037589285 /nfs/dbraw/zinc/58/92/85/1037589285.db2.gz ZHFNGWDYEUDJLM-GTAWCEEGSA-N 2 1 332.557 4.159 20 0 EIADMP C/C(=C\c1ccccc1)C[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000488459043 1037600867 /nfs/dbraw/zinc/60/08/67/1037600867.db2.gz NCNAKZCMSKCHLL-UEAVEIDSSA-N 2 1 334.507 4.244 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CS[C@H](C(C)C)C2)CC1 ZINC000488449918 1037607180 /nfs/dbraw/zinc/60/71/80/1037607180.db2.gz PJYSOXGRURLBFB-UXHICEINSA-N 2 1 332.557 4.079 20 0 EIADMP [NH3+]C[C@@H]1CC[N@@H+](Cc2ccccc2Oc2ccc(F)cc2Cl)C1 ZINC000414649874 1037663428 /nfs/dbraw/zinc/66/34/28/1037663428.db2.gz COMMKEKLYZXLFH-ZDUSSCGKSA-N 2 1 334.822 4.052 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCSc2ccccc2)C1 ZINC000605151023 1037694522 /nfs/dbraw/zinc/69/45/22/1037694522.db2.gz ZBNXNYDZWXHKGP-OALUTQOASA-N 2 1 332.557 4.365 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCSc2ccccc2)C1 ZINC000605151023 1037694529 /nfs/dbraw/zinc/69/45/29/1037694529.db2.gz ZBNXNYDZWXHKGP-OALUTQOASA-N 2 1 332.557 4.365 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCSc2ccccc2)C1 ZINC000605151023 1037694542 /nfs/dbraw/zinc/69/45/42/1037694542.db2.gz ZBNXNYDZWXHKGP-OALUTQOASA-N 2 1 332.557 4.365 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCSc2ccccc2)C1 ZINC000605151023 1037694551 /nfs/dbraw/zinc/69/45/51/1037694551.db2.gz ZBNXNYDZWXHKGP-OALUTQOASA-N 2 1 332.557 4.365 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000513787596 1037712498 /nfs/dbraw/zinc/71/24/98/1037712498.db2.gz BLMGIIJUIBCZBP-NSHGMRRFSA-N 2 1 340.511 4.430 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000513787596 1037712512 /nfs/dbraw/zinc/71/25/12/1037712512.db2.gz BLMGIIJUIBCZBP-NSHGMRRFSA-N 2 1 340.511 4.430 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000513787596 1037712528 /nfs/dbraw/zinc/71/25/28/1037712528.db2.gz BLMGIIJUIBCZBP-NSHGMRRFSA-N 2 1 340.511 4.430 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)Cc1c(Cl)cccc1Cl ZINC000513787388 1037720082 /nfs/dbraw/zinc/72/00/82/1037720082.db2.gz YDPBDOSTEAXBAW-CHWSQXEVSA-N 2 1 340.298 4.355 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC34CCCC4)CC2)oc1C ZINC000573976975 1037799192 /nfs/dbraw/zinc/79/91/92/1037799192.db2.gz NMFCBUGNVSGWSJ-LJQANCHMSA-N 2 1 345.531 4.206 20 0 EIADMP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H](C)c3c[nH+]ccc3N)cc2)cs1 ZINC000422810749 1037838427 /nfs/dbraw/zinc/83/84/27/1037838427.db2.gz UTOPXWJYMIIFMM-STQMWFEESA-N 2 1 338.480 4.338 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(CN[C@@H]3C[C@@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866967 1037848662 /nfs/dbraw/zinc/84/86/62/1037848662.db2.gz RGZOJHFOMMLFJE-NLSFWIRASA-N 2 1 349.522 4.153 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3C[C@@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866967 1037848668 /nfs/dbraw/zinc/84/86/68/1037848668.db2.gz RGZOJHFOMMLFJE-NLSFWIRASA-N 3 1 349.522 4.153 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+][C@@H]3C[C@@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866967 1037848674 /nfs/dbraw/zinc/84/86/74/1037848674.db2.gz RGZOJHFOMMLFJE-NLSFWIRASA-N 3 1 349.522 4.153 20 0 EIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CCc3c2cccc3Br)c2ccccc21 ZINC000422952737 1037887180 /nfs/dbraw/zinc/88/71/80/1037887180.db2.gz DDCQBHJTTIWDQH-FGTMMUONSA-N 2 1 343.268 4.171 20 0 EIADMP CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423035488 1037916433 /nfs/dbraw/zinc/91/64/33/1037916433.db2.gz JPKYSYYYCCIZJS-FTNBBQJZSA-N 2 1 330.859 4.150 20 0 EIADMP C[C@@H]([NH2+]CCc1cccc2[nH]ccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000503903619 1037975798 /nfs/dbraw/zinc/97/57/98/1037975798.db2.gz RDJZNOIOIUYCQB-NQIIRXRSSA-N 2 1 347.506 4.211 20 0 EIADMP CC[N@@H+](Cc1cnc(-c2ccc(C)cc2)s1)[C@@H]1CCC[NH2+]CC1 ZINC000414718368 1037982792 /nfs/dbraw/zinc/98/27/92/1037982792.db2.gz RLSVYADJCFVCTD-QGZVFWFLSA-N 2 1 329.513 4.083 20 0 EIADMP C[C@H]([NH2+]C1CC[NH2+]CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423178710 1038034933 /nfs/dbraw/zinc/03/49/33/1038034933.db2.gz GLDNXTMEHBAVJH-VIFPVBQESA-N 2 1 340.311 4.127 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCC[NH2+]Cc2cccnc2)c2ccccc12 ZINC000423191851 1038046913 /nfs/dbraw/zinc/04/69/13/1038046913.db2.gz UIJWTSOODIZFGY-KRWDZBQOSA-N 2 1 349.478 4.074 20 0 EIADMP Cc1ccsc1C[N@@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000414725638 1038057911 /nfs/dbraw/zinc/05/79/11/1038057911.db2.gz WPOBZUZQWCXBEP-QGZVFWFLSA-N 2 1 332.538 4.262 20 0 EIADMP Cc1cccc(C)c1OCCC[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000606447865 1038066444 /nfs/dbraw/zinc/06/64/44/1038066444.db2.gz IOHLNUHWUFGOFQ-HXUWFJFHSA-N 2 1 330.516 4.023 20 0 EIADMP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Br)c(F)c1 ZINC000489489138 1038079281 /nfs/dbraw/zinc/07/92/81/1038079281.db2.gz YSWKSRZVKYCRKM-UBHSHLNASA-N 2 1 343.284 4.112 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000423356668 1038172777 /nfs/dbraw/zinc/17/27/77/1038172777.db2.gz RBSSQOBAVIGSIL-MQNAVGNWSA-N 2 1 349.522 4.146 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000423356668 1038172797 /nfs/dbraw/zinc/17/27/97/1038172797.db2.gz RBSSQOBAVIGSIL-MQNAVGNWSA-N 2 1 349.522 4.146 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc2c1CCCN2 ZINC000423422166 1038213219 /nfs/dbraw/zinc/21/32/19/1038213219.db2.gz YKFWFZVBRHMVBX-PGRDOPGGSA-N 2 1 349.522 4.045 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000423444790 1038225184 /nfs/dbraw/zinc/22/51/84/1038225184.db2.gz MCXAKZSBEREZHE-XMSQKQJNSA-N 2 1 349.522 4.045 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000490173783 1038369570 /nfs/dbraw/zinc/36/95/70/1038369570.db2.gz XVENYHLMWDTRJC-IBGZPJMESA-N 2 1 343.833 4.363 20 0 EIADMP Cc1ccc(-c2nc(C[N@@H+]3CC4(C[C@H]3C)CC[NH2+]CC4)cs2)cc1 ZINC000424284649 1038794238 /nfs/dbraw/zinc/79/42/38/1038794238.db2.gz DLHGDIAWHCCYRJ-MRXNPFEDSA-N 2 1 341.524 4.083 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](Cc2ccncc2)c2cccs2)C1 ZINC000424311948 1038798461 /nfs/dbraw/zinc/79/84/61/1038798461.db2.gz LNZKKMFZBSLTNU-RBUKOAKNSA-N 2 1 343.540 4.137 20 0 EIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000480772779 1038810036 /nfs/dbraw/zinc/81/00/36/1038810036.db2.gz GOTWPMAUYRBWQB-HOCLYGCPSA-N 2 1 338.948 4.285 20 0 EIADMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H](CC2CC2)c2ccccc2)C[C@H](C)O1 ZINC000539071188 1038820963 /nfs/dbraw/zinc/82/09/63/1038820963.db2.gz FRCBNMYLFVGSSE-UEXGIBASSA-N 2 1 330.516 4.007 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC2=Cc3ccccc3OC2)cc1 ZINC000086279331 1038856225 /nfs/dbraw/zinc/85/62/25/1038856225.db2.gz UHSHHLNFDSOYPW-MRXNPFEDSA-N 2 1 345.446 4.307 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168364907 1038866905 /nfs/dbraw/zinc/86/69/05/1038866905.db2.gz JSLZNGZKYFHZNV-MEMLXQNLSA-N 3 1 347.591 4.013 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCCC2)C2CCN(CC3CC3)CC2)CC1 ZINC001168364907 1038866907 /nfs/dbraw/zinc/86/69/07/1038866907.db2.gz JSLZNGZKYFHZNV-MEMLXQNLSA-N 2 1 347.591 4.013 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)C2CCN(CC3CC3)CC2)CC1 ZINC001168364907 1038866911 /nfs/dbraw/zinc/86/69/11/1038866911.db2.gz JSLZNGZKYFHZNV-MEMLXQNLSA-N 2 1 347.591 4.013 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccnn1C1CCC1 ZINC000924686351 1038873693 /nfs/dbraw/zinc/87/36/93/1038873693.db2.gz RIRRRKPVNDTVEF-KSZLIROESA-N 2 1 332.536 4.017 20 0 EIADMP CC(C)(C[NH2+]Cc1cnc(-c2ccsc2)s1)C[NH+]1CCCC1 ZINC000480925774 1038877266 /nfs/dbraw/zinc/87/72/66/1038877266.db2.gz IYWPTWGFKSXCLI-UHFFFAOYSA-N 2 1 335.542 4.083 20 0 EIADMP COc1ccc([C@@H]([NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)C2CC2)cc1 ZINC000539215681 1038886079 /nfs/dbraw/zinc/88/60/79/1038886079.db2.gz BZBQSDINQUHZDR-UTKZUKDTSA-N 2 1 330.516 4.104 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[N@@H+]1C ZINC000537615490 1038894255 /nfs/dbraw/zinc/89/42/55/1038894255.db2.gz WEEFGGHKBIBXNL-PBHICJAKSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[N@H+]1C ZINC000537615490 1038894258 /nfs/dbraw/zinc/89/42/58/1038894258.db2.gz WEEFGGHKBIBXNL-PBHICJAKSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[NH+]1C ZINC000537615490 1038894263 /nfs/dbraw/zinc/89/42/63/1038894263.db2.gz WEEFGGHKBIBXNL-PBHICJAKSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[NH+]1C ZINC000537615490 1038894265 /nfs/dbraw/zinc/89/42/65/1038894265.db2.gz WEEFGGHKBIBXNL-PBHICJAKSA-N 2 1 332.488 4.469 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000462107928 1038911189 /nfs/dbraw/zinc/91/11/89/1038911189.db2.gz JBZRSKKPICQGMG-DAXOMENPSA-N 2 1 329.315 4.387 20 0 EIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000462107928 1038911236 /nfs/dbraw/zinc/91/12/36/1038911236.db2.gz JBZRSKKPICQGMG-DAXOMENPSA-N 2 1 329.315 4.387 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](COc2ccccc2)c2ccccc2)CC1 ZINC000539263489 1038916418 /nfs/dbraw/zinc/91/64/18/1038916418.db2.gz WABAANMKEWVDAR-QFIPXVFZSA-N 2 1 338.495 4.271 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555232556 1038999364 /nfs/dbraw/zinc/99/93/64/1038999364.db2.gz HVPRVHXZAGIKNW-OHCFRWENSA-N 2 1 348.534 4.333 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC[N@H+]1C ZINC000477855748 1039137065 /nfs/dbraw/zinc/13/70/65/1039137065.db2.gz IIFFFLGGDGYIIG-FZMZJTMJSA-N 2 1 340.298 4.090 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3cccc(Cl)c3F)CCCC2)CC[N@H+]1C ZINC000477864120 1039143293 /nfs/dbraw/zinc/14/32/93/1039143293.db2.gz ZUZJOOCGZVMZSM-CABCVRRESA-N 2 1 338.898 4.363 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)CC[N@@H+]1C ZINC000513830999 1039311529 /nfs/dbraw/zinc/31/15/29/1039311529.db2.gz IGXRHLLXUZDFMM-ZIFCJYIRSA-N 2 1 328.500 4.285 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)CC[N@H+]1C ZINC000513830999 1039311544 /nfs/dbraw/zinc/31/15/44/1039311544.db2.gz IGXRHLLXUZDFMM-ZIFCJYIRSA-N 2 1 328.500 4.285 20 0 EIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000481437277 1039410120 /nfs/dbraw/zinc/41/01/20/1039410120.db2.gz PSCSWKLSIACWAN-ZDUSSCGKSA-N 2 1 335.561 4.417 20 0 EIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000550831438 1039510962 /nfs/dbraw/zinc/51/09/62/1039510962.db2.gz WMUCORBEYIMIIT-HNNXBMFYSA-N 2 1 332.875 4.420 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000550831438 1039510988 /nfs/dbraw/zinc/51/09/88/1039510988.db2.gz WMUCORBEYIMIIT-HNNXBMFYSA-N 2 1 332.875 4.420 20 0 EIADMP C[N@H+]1CC[C@@]2(CC[NH+](C3CCC(c4ccc(Cl)cc4)CC3)C2)C1 ZINC001168348483 1039553122 /nfs/dbraw/zinc/55/31/22/1039553122.db2.gz YYMGVMMQXNYNHE-LYBXBRPPSA-N 2 1 332.919 4.394 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@@H+](C3CCC(c4ccc(Cl)cc4)CC3)C2)C1 ZINC001168348483 1039553138 /nfs/dbraw/zinc/55/31/38/1039553138.db2.gz YYMGVMMQXNYNHE-LYBXBRPPSA-N 2 1 332.919 4.394 20 0 EIADMP C[NH+]1CC[C@@]2(CC[N@H+](C3CCC(c4ccc(Cl)cc4)CC3)C2)C1 ZINC001168348483 1039553155 /nfs/dbraw/zinc/55/31/55/1039553155.db2.gz YYMGVMMQXNYNHE-LYBXBRPPSA-N 2 1 332.919 4.394 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)CCOc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000429781288 1039732363 /nfs/dbraw/zinc/73/23/63/1039732363.db2.gz SLHKRVDIHLAAPB-CJNGLKHVSA-N 2 1 345.314 4.034 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)CCOc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000429781288 1039732397 /nfs/dbraw/zinc/73/23/97/1039732397.db2.gz SLHKRVDIHLAAPB-CJNGLKHVSA-N 2 1 345.314 4.034 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCOc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000429781288 1039732417 /nfs/dbraw/zinc/73/24/17/1039732417.db2.gz SLHKRVDIHLAAPB-CJNGLKHVSA-N 2 1 345.314 4.034 20 0 EIADMP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCc2c1cc(Cl)cc2Br ZINC000534792806 1039787012 /nfs/dbraw/zinc/78/70/12/1039787012.db2.gz DDAOQFSTCYADDG-BONVTDFDSA-N 2 1 345.712 4.020 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC[N@@H+]1C ZINC000481740607 1039803698 /nfs/dbraw/zinc/80/36/98/1039803698.db2.gz MUTHHPPYNRGWLB-GQWLDOHISA-N 2 1 344.449 4.321 20 0 EIADMP c1[nH+]c(C2CC[NH+]([C@H]3CCCc4ccccc43)CC2)n2c1CCCC2 ZINC000434689055 1039811909 /nfs/dbraw/zinc/81/19/09/1039811909.db2.gz SNVYQHYCMPCNTK-NRFANRHFSA-N 2 1 335.495 4.476 20 0 EIADMP CCc1oc2ccccc2c1C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000537649740 1039823833 /nfs/dbraw/zinc/82/38/33/1039823833.db2.gz ZFNJIMPSULKWNR-KRWDZBQOSA-N 2 1 326.484 4.159 20 0 EIADMP CCc1oc2ccccc2c1C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000537649740 1039823838 /nfs/dbraw/zinc/82/38/38/1039823838.db2.gz ZFNJIMPSULKWNR-KRWDZBQOSA-N 2 1 326.484 4.159 20 0 EIADMP CCc1oc2ccccc2c1C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000537649740 1039823840 /nfs/dbraw/zinc/82/38/40/1039823840.db2.gz ZFNJIMPSULKWNR-KRWDZBQOSA-N 2 1 326.484 4.159 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)s2)C[C@H]1c1ccccc1 ZINC000551012531 1039872932 /nfs/dbraw/zinc/87/29/32/1039872932.db2.gz RPYKINXGHQDCQT-RDJZCZTQSA-N 2 1 334.916 4.369 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)s2)C[C@H]1c1ccccc1 ZINC000551012531 1039872935 /nfs/dbraw/zinc/87/29/35/1039872935.db2.gz RPYKINXGHQDCQT-RDJZCZTQSA-N 2 1 334.916 4.369 20 0 EIADMP Cc1ccc(OCCC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551029567 1039886305 /nfs/dbraw/zinc/88/63/05/1039886305.db2.gz KCUJOOBLRJDYPF-IRLDBZIGSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1ccc(OCCC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551029567 1039886306 /nfs/dbraw/zinc/88/63/06/1039886306.db2.gz KCUJOOBLRJDYPF-IRLDBZIGSA-N 2 1 338.495 4.189 20 0 EIADMP COc1ccc2cc(C[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)ccc2c1 ZINC000535081761 1039920917 /nfs/dbraw/zinc/92/09/17/1039920917.db2.gz HVMAHGDSOHUCPS-UHFFFAOYSA-N 2 1 340.511 4.401 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1cccc(F)c1 ZINC000482133276 1040029818 /nfs/dbraw/zinc/02/98/18/1040029818.db2.gz IXPFWZXKRSIRKW-HOTGVXAUSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(F)c1 ZINC000482133276 1040029838 /nfs/dbraw/zinc/02/98/38/1040029838.db2.gz IXPFWZXKRSIRKW-HOTGVXAUSA-N 2 1 332.488 4.450 20 0 EIADMP Cc1cc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)ccc1F ZINC000435058991 1040040882 /nfs/dbraw/zinc/04/08/82/1040040882.db2.gz GSNUYCKFYNOLRU-UHFFFAOYSA-N 2 1 327.447 4.047 20 0 EIADMP Clc1cccc(Cl)c1CCC[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000482242600 1040096829 /nfs/dbraw/zinc/09/68/29/1040096829.db2.gz UEZDIMZSLIVIRF-UONOGXRCSA-N 2 1 327.299 4.142 20 0 EIADMP CSC1(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000514697400 1040150723 /nfs/dbraw/zinc/15/07/23/1040150723.db2.gz OOOXJCLXFBHTAQ-HKUYNNGSSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000514697400 1040150732 /nfs/dbraw/zinc/15/07/32/1040150732.db2.gz OOOXJCLXFBHTAQ-HKUYNNGSSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000514697400 1040150755 /nfs/dbraw/zinc/15/07/55/1040150755.db2.gz OOOXJCLXFBHTAQ-HKUYNNGSSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000514697400 1040150771 /nfs/dbraw/zinc/15/07/71/1040150771.db2.gz OOOXJCLXFBHTAQ-HKUYNNGSSA-N 2 1 332.557 4.257 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccccc2OC(F)(F)F)C1 ZINC000482341207 1040188464 /nfs/dbraw/zinc/18/84/64/1040188464.db2.gz CWSYSTDUTCLBEU-LSDHHAIUSA-N 2 1 344.421 4.356 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccccc2OC(F)(F)F)C1 ZINC000482341207 1040188475 /nfs/dbraw/zinc/18/84/75/1040188475.db2.gz CWSYSTDUTCLBEU-LSDHHAIUSA-N 2 1 344.421 4.356 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC3(CCCC3)O2)CC[N@@H+]1Cc1ccccc1 ZINC000379655501 1040318150 /nfs/dbraw/zinc/31/81/50/1040318150.db2.gz MBXNYHLZRZDSLD-NRSPTQNISA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC3(CCCC3)O2)CC[N@H+]1Cc1ccccc1 ZINC000379655501 1040318164 /nfs/dbraw/zinc/31/81/64/1040318164.db2.gz MBXNYHLZRZDSLD-NRSPTQNISA-N 2 1 342.527 4.121 20 0 EIADMP c1ccc(C[C@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C2CC2)cc1 ZINC000479462200 1040371672 /nfs/dbraw/zinc/37/16/72/1040371672.db2.gz FPIKYDSQQWXYQU-GGAORHGYSA-N 2 1 334.507 4.119 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cncn2C(C)C)CC1)CC(C)C ZINC000425378865 1040381489 /nfs/dbraw/zinc/38/14/89/1040381489.db2.gz KHHLGSDGPVCLLN-UHFFFAOYSA-N 2 1 334.552 4.044 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(Br)c2C)C[C@@H]1C ZINC000535585289 1040386086 /nfs/dbraw/zinc/38/60/86/1040386086.db2.gz LMYGJAYGHLZJDU-BBRMVZONSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(Br)c2C)C[C@@H]1C ZINC000535585289 1040386109 /nfs/dbraw/zinc/38/61/09/1040386109.db2.gz LMYGJAYGHLZJDU-BBRMVZONSA-N 2 1 339.321 4.062 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(Br)c2C)C[C@@H]1C ZINC000535585289 1040386127 /nfs/dbraw/zinc/38/61/27/1040386127.db2.gz LMYGJAYGHLZJDU-BBRMVZONSA-N 2 1 339.321 4.062 20 0 EIADMP COc1cc(-c2ccccc2)ccc1C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995714 1040393234 /nfs/dbraw/zinc/39/32/34/1040393234.db2.gz XPTQPKXHHOLZRO-FQEVSTJZSA-N 2 1 336.479 4.127 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Sc2ccccc2)CC[N@@H+]1C ZINC000482639578 1040403112 /nfs/dbraw/zinc/40/31/12/1040403112.db2.gz DRJZPEZXEKOMTC-AEFFLSMTSA-N 2 1 326.509 4.410 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Sc2ccccc2)CC[N@H+]1C ZINC000482639578 1040403116 /nfs/dbraw/zinc/40/31/16/1040403116.db2.gz DRJZPEZXEKOMTC-AEFFLSMTSA-N 2 1 326.509 4.410 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(F)c1F ZINC000539546535 1040533669 /nfs/dbraw/zinc/53/36/69/1040533669.db2.gz QXHPFYWFPKHXKL-AEFFLSMTSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc(F)c1F ZINC000539546535 1040533689 /nfs/dbraw/zinc/53/36/89/1040533689.db2.gz QXHPFYWFPKHXKL-AEFFLSMTSA-N 2 1 344.449 4.180 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@H+](Cc2cccc(SCc3ccccc3)c2)C1 ZINC000553875569 1040601854 /nfs/dbraw/zinc/60/18/54/1040601854.db2.gz MJTJXWYQTOYWLA-HXUWFJFHSA-N 2 1 340.536 4.362 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2cccc(SCc3ccccc3)c2)C1 ZINC000553875569 1040601868 /nfs/dbraw/zinc/60/18/68/1040601868.db2.gz MJTJXWYQTOYWLA-HXUWFJFHSA-N 2 1 340.536 4.362 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000539610335 1040606869 /nfs/dbraw/zinc/60/68/69/1040606869.db2.gz WLINRYDIPYYXMG-BNEJOLLZSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000539610335 1040606872 /nfs/dbraw/zinc/60/68/72/1040606872.db2.gz WLINRYDIPYYXMG-BNEJOLLZSA-N 2 1 340.433 4.414 20 0 EIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(F)c(C(F)(F)F)c3)C2)CC1 ZINC000515253918 1040610384 /nfs/dbraw/zinc/61/03/84/1040610384.db2.gz AICRCZSQWYZKES-OAHLLOKOSA-N 2 1 344.396 4.008 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000568169276 1040648407 /nfs/dbraw/zinc/64/84/07/1040648407.db2.gz GDVQLXDCTCRSAR-UHFFFAOYSA-N 2 1 337.389 4.036 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000568169276 1040648420 /nfs/dbraw/zinc/64/84/20/1040648420.db2.gz GDVQLXDCTCRSAR-UHFFFAOYSA-N 2 1 337.389 4.036 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3cc(C)c(F)c(C)c3)CC2)[nH+]1 ZINC000483160745 1040749590 /nfs/dbraw/zinc/74/95/90/1040749590.db2.gz ZYOVPLNVNVMBAM-KRWDZBQOSA-N 2 1 341.474 4.466 20 0 EIADMP C[N@@H+](Cc1ccnn1-c1cc[nH+]cc1)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000668235277 1040819792 /nfs/dbraw/zinc/81/97/92/1040819792.db2.gz HRDSXDUIDXKPBP-LEWJYISDSA-N 2 1 332.451 4.035 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000539834799 1040828652 /nfs/dbraw/zinc/82/86/52/1040828652.db2.gz FZURXILMAVCPNV-WBMJQRKESA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000539834799 1040828666 /nfs/dbraw/zinc/82/86/66/1040828666.db2.gz FZURXILMAVCPNV-WBMJQRKESA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000539834799 1040828673 /nfs/dbraw/zinc/82/86/73/1040828673.db2.gz FZURXILMAVCPNV-WBMJQRKESA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000539849474 1040838541 /nfs/dbraw/zinc/83/85/41/1040838541.db2.gz HNMAUJKJOFFVIE-HNNXBMFYSA-N 2 1 332.875 4.374 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000539849474 1040838545 /nfs/dbraw/zinc/83/85/45/1040838545.db2.gz HNMAUJKJOFFVIE-HNNXBMFYSA-N 2 1 332.875 4.374 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000539849474 1040838552 /nfs/dbraw/zinc/83/85/52/1040838552.db2.gz HNMAUJKJOFFVIE-HNNXBMFYSA-N 2 1 332.875 4.374 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000539849474 1040838558 /nfs/dbraw/zinc/83/85/58/1040838558.db2.gz HNMAUJKJOFFVIE-HNNXBMFYSA-N 2 1 332.875 4.374 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2nc3ccccc3o2)CC1)CC1CC1 ZINC000537847821 1040853194 /nfs/dbraw/zinc/85/31/94/1040853194.db2.gz VHDMLBLNWILBAY-UHFFFAOYSA-N 2 1 341.499 4.162 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCOc3ccc4ccccc4c3)CC[C@@H]21 ZINC000483479440 1040872435 /nfs/dbraw/zinc/87/24/35/1040872435.db2.gz DWSGJCBCXCTQIF-UNMCSNQZSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCOc3ccc4ccccc4c3)CC[C@@H]21 ZINC000483479440 1040872441 /nfs/dbraw/zinc/87/24/41/1040872441.db2.gz DWSGJCBCXCTQIF-UNMCSNQZSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCOc3ccc4ccccc4c3)CC[C@@H]21 ZINC000483479440 1040872450 /nfs/dbraw/zinc/87/24/50/1040872450.db2.gz DWSGJCBCXCTQIF-UNMCSNQZSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCSc3ccccc3Cl)CC[C@H]21 ZINC000483504616 1040876463 /nfs/dbraw/zinc/87/64/63/1040876463.db2.gz RVVJURMMKKTPKA-NVXWUHKLSA-N 2 1 338.948 4.238 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCSc3ccccc3Cl)CC[C@@H]21 ZINC000483504618 1040877144 /nfs/dbraw/zinc/87/71/44/1040877144.db2.gz RVVJURMMKKTPKA-RDJZCZTQSA-N 2 1 338.948 4.238 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@@H](C[NH2+][C@H](c3ccccn3)C3CC3)C2)cc1 ZINC000903083769 1040896178 /nfs/dbraw/zinc/89/61/78/1040896178.db2.gz NDVOZGDKPUNBCY-UGKGYDQZSA-N 2 1 335.495 4.035 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H](c3ccccn3)C3CC3)C2)cc1 ZINC000903083769 1040896183 /nfs/dbraw/zinc/89/61/83/1040896183.db2.gz NDVOZGDKPUNBCY-UGKGYDQZSA-N 2 1 335.495 4.035 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CCc1ccc(Oc2ccc(F)cc2)cc1 ZINC000537938877 1040900969 /nfs/dbraw/zinc/90/09/69/1040900969.db2.gz UUEVICWWFTXIIJ-IERDGZPVSA-N 2 1 342.458 4.090 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1cscn1 ZINC000537944567 1040912447 /nfs/dbraw/zinc/91/24/47/1040912447.db2.gz GHSOJDIGEDRANI-XYJFISCASA-N 2 1 329.513 4.094 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)[C@H](C)C1 ZINC000537989796 1040963613 /nfs/dbraw/zinc/96/36/13/1040963613.db2.gz FCLMZIYQTIDAFK-GCJKJVERSA-N 2 1 338.495 4.086 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc(OC(F)F)c1 ZINC000515710542 1040996413 /nfs/dbraw/zinc/99/64/13/1040996413.db2.gz RBTNMGAEWYVYEO-UHFFFAOYSA-N 2 1 348.437 4.372 20 0 EIADMP CC(C)[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1cccnc1 ZINC000538063621 1041033101 /nfs/dbraw/zinc/03/31/01/1041033101.db2.gz VQSHVYMDCSZDSV-QFIPXVFZSA-N 2 1 337.511 4.075 20 0 EIADMP FC(F)(F)c1cc(Cl)cc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000436284954 1041034410 /nfs/dbraw/zinc/03/44/10/1041034410.db2.gz CGHBUHQHXCIOJS-CABCVRRESA-N 2 1 332.797 4.075 20 0 EIADMP FC(F)(F)c1cc(Cl)cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000436284954 1041034418 /nfs/dbraw/zinc/03/44/18/1041034418.db2.gz CGHBUHQHXCIOJS-CABCVRRESA-N 2 1 332.797 4.075 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C ZINC000480176387 1041039507 /nfs/dbraw/zinc/03/95/07/1041039507.db2.gz DDMHWXZXZPMEMI-OAHLLOKOSA-N 2 1 331.529 4.499 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000480176387 1041039521 /nfs/dbraw/zinc/03/95/21/1041039521.db2.gz DDMHWXZXZPMEMI-OAHLLOKOSA-N 2 1 331.529 4.499 20 0 EIADMP FC(F)(F)c1cc(Cl)cc(C[NH2+]C2CC[NH+](C3CCC3)CC2)c1 ZINC000436272540 1041041436 /nfs/dbraw/zinc/04/14/36/1041041436.db2.gz HABJVYBCMJCOKD-UHFFFAOYSA-N 2 1 346.824 4.465 20 0 EIADMP C([NH2+]C1CCC2(CCOCC2)CC1)[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436296301 1041063265 /nfs/dbraw/zinc/06/32/65/1041063265.db2.gz RDYPIIUIANJKJW-HXUWFJFHSA-N 2 1 334.548 4.113 20 0 EIADMP 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 1041077960 /nfs/dbraw/zinc/07/79/60/1041077960.db2.gz NTILICQRBKONJP-AQDKSWOWSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000480208932 1041081570 /nfs/dbraw/zinc/08/15/70/1041081570.db2.gz LDRZBTVZHNGRJS-UGKGYDQZSA-N 2 1 334.507 4.218 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000540141006 1041160210 /nfs/dbraw/zinc/16/02/10/1041160210.db2.gz VIKRDUYHGRUDGB-SVFBPWRDSA-N 2 1 340.511 4.491 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000540148276 1041195779 /nfs/dbraw/zinc/19/57/79/1041195779.db2.gz YKEWNEZPRJDYCY-OXJNMPFZSA-N 2 1 326.509 4.268 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CCOC)c1cccc(Cl)c1 ZINC000924659568 1041232679 /nfs/dbraw/zinc/23/26/79/1041232679.db2.gz LVJGWEJFAJWALK-XVLXNVKGSA-N 2 1 336.907 4.023 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@H]3CCC[C@H]([NH+](C)C)C3)c(C)c2c1 ZINC000484470380 1041247343 /nfs/dbraw/zinc/24/73/43/1041247343.db2.gz SUOIRRBGUYCXMX-JYJNAYRXSA-N 2 1 330.472 4.273 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)c1 ZINC000484485145 1041256636 /nfs/dbraw/zinc/25/66/36/1041256636.db2.gz JBPWCEQQCPPJEN-SOUVJXGZSA-N 2 1 326.431 4.120 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cc1N(C)C ZINC000484479971 1041273916 /nfs/dbraw/zinc/27/39/16/1041273916.db2.gz ZYFQBIPHCHUHGW-MRXNPFEDSA-N 2 1 347.522 4.339 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)cc1 ZINC000463084691 1041334529 /nfs/dbraw/zinc/33/45/29/1041334529.db2.gz JWXQZLBUXGSBBT-GOSISDBHSA-N 2 1 340.486 4.492 20 0 EIADMP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1cncc(C(F)(F)F)c1 ZINC000463126809 1041350076 /nfs/dbraw/zinc/35/00/76/1041350076.db2.gz LOSWHICVPHTANZ-NVXWUHKLSA-N 2 1 343.437 4.091 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000540301590 1041351707 /nfs/dbraw/zinc/35/17/07/1041351707.db2.gz LQUYJOUCDUESDK-PXAZEXFGSA-N 2 1 327.299 4.376 20 0 EIADMP C[N@H+]1CC[C@@H](NC2(c3ccc(C(F)(F)F)cc3)CC2)CC1(C)C ZINC000623561036 1041360414 /nfs/dbraw/zinc/36/04/14/1041360414.db2.gz ZQBMZUUOEFWIJR-OAHLLOKOSA-N 2 1 326.406 4.157 20 0 EIADMP CN1CC[C@@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)CC1(C)C ZINC000623561036 1041360425 /nfs/dbraw/zinc/36/04/25/1041360425.db2.gz ZQBMZUUOEFWIJR-OAHLLOKOSA-N 2 1 326.406 4.157 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)CC1(C)C ZINC000623561036 1041360438 /nfs/dbraw/zinc/36/04/38/1041360438.db2.gz ZQBMZUUOEFWIJR-OAHLLOKOSA-N 2 1 326.406 4.157 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)CC1(C)C ZINC000623561036 1041360443 /nfs/dbraw/zinc/36/04/43/1041360443.db2.gz ZQBMZUUOEFWIJR-OAHLLOKOSA-N 2 1 326.406 4.157 20 0 EIADMP C[NH+]1CCC([NH2+][C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)CC1 ZINC000540318868 1041366039 /nfs/dbraw/zinc/36/60/39/1041366039.db2.gz TUTIUBSGKBUAEO-INIZCTEOSA-N 2 1 346.824 4.494 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000463146464 1041368362 /nfs/dbraw/zinc/36/83/62/1041368362.db2.gz BVMHKLPJZOLJGL-XMSQKQJNSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCCc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000463146464 1041368376 /nfs/dbraw/zinc/36/83/76/1041368376.db2.gz BVMHKLPJZOLJGL-XMSQKQJNSA-N 2 1 340.486 4.401 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463137449 1041373207 /nfs/dbraw/zinc/37/32/07/1041373207.db2.gz QZDDPCOHFMNSSW-PXNSSMCTSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463137449 1041373216 /nfs/dbraw/zinc/37/32/16/1041373216.db2.gz QZDDPCOHFMNSSW-PXNSSMCTSA-N 2 1 326.459 4.011 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCC[C@@H]1Oc1cccc(C)c1 ZINC000484659670 1041380092 /nfs/dbraw/zinc/38/00/92/1041380092.db2.gz YSIORNHYRKEWQG-RTWAWAEBSA-N 2 1 341.499 4.260 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCC[C@@H]1Oc1cccc(C)c1 ZINC000484659671 1041380817 /nfs/dbraw/zinc/38/08/17/1041380817.db2.gz YSIORNHYRKEWQG-SFTDATJTSA-N 2 1 341.499 4.260 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC000667706286 1041422621 /nfs/dbraw/zinc/42/26/21/1041422621.db2.gz WBQTYGYDSJMMNF-RTBURBONSA-N 2 1 341.524 4.035 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1N(C)C ZINC000480638492 1041450974 /nfs/dbraw/zinc/45/09/74/1041450974.db2.gz IXZQRFUQUVQIIR-DLBZAZTESA-N 2 1 335.511 4.197 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000516214730 1041466641 /nfs/dbraw/zinc/46/66/41/1041466641.db2.gz XIOJVDBSJZGDME-KGLIPLIRSA-N 2 1 339.405 4.240 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c(OC)ccc3ccccc32)C[C@H]1C ZINC000538717253 1041487082 /nfs/dbraw/zinc/48/70/82/1041487082.db2.gz NWMOKQDDPBYJLK-SJLPKXTDSA-N 2 1 326.484 4.153 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c(OC)ccc3ccccc32)C[C@H]1C ZINC000538717253 1041487089 /nfs/dbraw/zinc/48/70/89/1041487089.db2.gz NWMOKQDDPBYJLK-SJLPKXTDSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c(OC)ccc3ccccc32)C[C@H]1C ZINC000538717253 1041487096 /nfs/dbraw/zinc/48/70/96/1041487096.db2.gz NWMOKQDDPBYJLK-SJLPKXTDSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c(OC)ccc3ccccc32)C[C@H]1C ZINC000538717253 1041487101 /nfs/dbraw/zinc/48/71/01/1041487101.db2.gz NWMOKQDDPBYJLK-SJLPKXTDSA-N 2 1 326.484 4.153 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCCC2CCOCC2)CC1 ZINC000463289867 1041490317 /nfs/dbraw/zinc/49/03/17/1041490317.db2.gz QJOXBEJMVBDZBX-UHFFFAOYSA-N 2 1 344.543 4.037 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3cccc(OCC)c3o2)C1 ZINC000540596479 1041552006 /nfs/dbraw/zinc/55/20/06/1041552006.db2.gz BBVPPGDGWVAGES-HZPDHXFCSA-N 2 1 330.472 4.214 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3cccc(OCC)c3o2)C1 ZINC000540596479 1041552015 /nfs/dbraw/zinc/55/20/15/1041552015.db2.gz BBVPPGDGWVAGES-HZPDHXFCSA-N 2 1 330.472 4.214 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000540607270 1041559710 /nfs/dbraw/zinc/55/97/10/1041559710.db2.gz MCPBMULMMGNOMV-CRAIPNDOSA-N 2 1 339.310 4.481 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccccc3Cl)s2)CC1 ZINC000540645022 1041585329 /nfs/dbraw/zinc/58/53/29/1041585329.db2.gz YEDVYXMOPUDKNJ-UHFFFAOYSA-N 2 1 332.900 4.420 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1Nc1ccc(C[NH+]2CCCC[C@H]2C)cc1 ZINC000540699942 1041614926 /nfs/dbraw/zinc/61/49/26/1041614926.db2.gz RRMSCPHOFKVVRT-NEYJZJCJSA-N 2 1 329.532 4.202 20 0 EIADMP C[C@@H]1C[NH+](C)[C@H](C)C[C@H]1Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000540699942 1041614930 /nfs/dbraw/zinc/61/49/30/1041614930.db2.gz RRMSCPHOFKVVRT-NEYJZJCJSA-N 2 1 329.532 4.202 20 0 EIADMP C[C@@H]1C[NH+](C)[C@H](C)C[C@H]1Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000540699942 1041614931 /nfs/dbraw/zinc/61/49/31/1041614931.db2.gz RRMSCPHOFKVVRT-NEYJZJCJSA-N 2 1 329.532 4.202 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000539040595 1041616824 /nfs/dbraw/zinc/61/68/24/1041616824.db2.gz DNZHJXOMVWBMAS-ZIFCJYIRSA-N 2 1 341.474 4.172 20 0 EIADMP C[C@@H]([NH2+]CCc1ccc(F)cc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000516802131 1041763781 /nfs/dbraw/zinc/76/37/81/1041763781.db2.gz LSPNPISOOLLEDR-VQIMIIECSA-N 2 1 344.449 4.008 20 0 EIADMP CSC1(C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000516822416 1041774140 /nfs/dbraw/zinc/77/41/40/1041774140.db2.gz RHMOIXYPNLBTRD-IEBWSBKVSA-N 2 1 332.557 4.162 20 0 EIADMP C[C@@H](Cc1ccsc1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000541234370 1041859855 /nfs/dbraw/zinc/85/98/55/1041859855.db2.gz DXGODMGBKMCXES-FXAWDEMLSA-N 2 1 328.525 4.133 20 0 EIADMP C[C@@H](Cc1ccsc1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000541234370 1041859857 /nfs/dbraw/zinc/85/98/57/1041859857.db2.gz DXGODMGBKMCXES-FXAWDEMLSA-N 2 1 328.525 4.133 20 0 EIADMP C[C@@H](Cc1ccsc1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000541234370 1041859858 /nfs/dbraw/zinc/85/98/58/1041859858.db2.gz DXGODMGBKMCXES-FXAWDEMLSA-N 2 1 328.525 4.133 20 0 EIADMP Cc1cc(NC2CC[NH+](C(C)C)CC2)c[nH+]c1N1CCCC[C@@H]1C ZINC000541254552 1041869903 /nfs/dbraw/zinc/86/99/03/1041869903.db2.gz CGRZUWWYBYFOMM-KRWDZBQOSA-N 2 1 330.520 4.054 20 0 EIADMP Cc1ccsc1CC[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508722733 1041918325 /nfs/dbraw/zinc/91/83/25/1041918325.db2.gz UGQANSABYXSSDN-IEBWSBKVSA-N 2 1 328.525 4.099 20 0 EIADMP CC(C)c1cnc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)s1 ZINC000541535553 1041999740 /nfs/dbraw/zinc/99/97/40/1041999740.db2.gz FKWCHDJMZJJHCW-UHFFFAOYSA-N 2 1 335.561 4.355 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCn1c2ccccc2c2ccccc21 ZINC000541571139 1042019428 /nfs/dbraw/zinc/01/94/28/1042019428.db2.gz OSXMEAVDWABZPZ-UWVAXJGDSA-N 2 1 335.495 4.113 20 0 EIADMP Fc1ccc2c(c1)CC[C@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001168438777 1042062048 /nfs/dbraw/zinc/06/20/48/1042062048.db2.gz ODZJDEQHKCYARD-RTWAWAEBSA-N 2 1 330.491 4.023 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)C1 ZINC000438119937 1042062329 /nfs/dbraw/zinc/06/23/29/1042062329.db2.gz LAFTUKSKZIACIF-MSYGRNIXSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000438119937 1042062330 /nfs/dbraw/zinc/06/23/30/1042062330.db2.gz LAFTUKSKZIACIF-MSYGRNIXSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000438119937 1042062336 /nfs/dbraw/zinc/06/23/36/1042062336.db2.gz LAFTUKSKZIACIF-MSYGRNIXSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC000438119937 1042062342 /nfs/dbraw/zinc/06/23/42/1042062342.db2.gz LAFTUKSKZIACIF-MSYGRNIXSA-N 2 1 338.539 4.446 20 0 EIADMP C[C@]1(c2ccccc2)CC[C@H]([NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC000438119937 1042062344 /nfs/dbraw/zinc/06/23/44/1042062344.db2.gz LAFTUKSKZIACIF-MSYGRNIXSA-N 2 1 338.539 4.446 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CC[C@H](Cc4ccccc4)C3)CC2)[nH+]1 ZINC000438193662 1042084942 /nfs/dbraw/zinc/08/49/42/1042084942.db2.gz UJHTUQOQLPUSAH-IFMALSPDSA-N 2 1 349.522 4.360 20 0 EIADMP C[N@@H+](Cc1ccc(Cl)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464843661 1042193391 /nfs/dbraw/zinc/19/33/91/1042193391.db2.gz XJVNPTYLVZGIGO-LJQANCHMSA-N 2 1 328.887 4.294 20 0 EIADMP C[N@H+](Cc1ccc(Cl)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464843661 1042193394 /nfs/dbraw/zinc/19/33/94/1042193394.db2.gz XJVNPTYLVZGIGO-LJQANCHMSA-N 2 1 328.887 4.294 20 0 EIADMP C[NH+](Cc1ccc(Cl)cc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464843661 1042193398 /nfs/dbraw/zinc/19/33/98/1042193398.db2.gz XJVNPTYLVZGIGO-LJQANCHMSA-N 2 1 328.887 4.294 20 0 EIADMP C[NH+](Cc1ccc(Cl)cc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464843661 1042193403 /nfs/dbraw/zinc/19/34/03/1042193403.db2.gz XJVNPTYLVZGIGO-LJQANCHMSA-N 2 1 328.887 4.294 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CC2(c3cccc(F)c3F)CCCC2)[C@@H](C)C1 ZINC000426055483 1042237411 /nfs/dbraw/zinc/23/74/11/1042237411.db2.gz RTVYBQCKDDKSGR-MAUKXSAKSA-N 2 1 336.470 4.097 20 0 EIADMP C[N@H+](Cc1cc(Cl)cs1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000426158729 1042351033 /nfs/dbraw/zinc/35/10/33/1042351033.db2.gz DYNGCNNMHSEZCE-UHFFFAOYSA-N 2 1 335.904 4.145 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)ccc2C1 ZINC001168442474 1042505880 /nfs/dbraw/zinc/50/58/80/1042505880.db2.gz VMGFSJAHRAAOKM-PCCBWWKXSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@@H]1CCc2cc(F)ccc2C1 ZINC001168442474 1042505882 /nfs/dbraw/zinc/50/58/82/1042505882.db2.gz VMGFSJAHRAAOKM-PCCBWWKXSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@@H]1CCc2cc(F)ccc2C1 ZINC001168442474 1042505887 /nfs/dbraw/zinc/50/58/87/1042505887.db2.gz VMGFSJAHRAAOKM-PCCBWWKXSA-N 2 1 330.491 4.022 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2cc(F)ccc2C1 ZINC001168442469 1042506326 /nfs/dbraw/zinc/50/63/26/1042506326.db2.gz VMGFSJAHRAAOKM-ACRUOGEOSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@H]1CCc2cc(F)ccc2C1 ZINC001168442469 1042506334 /nfs/dbraw/zinc/50/63/34/1042506334.db2.gz VMGFSJAHRAAOKM-ACRUOGEOSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@H]1CCc2cc(F)ccc2C1 ZINC001168442469 1042506341 /nfs/dbraw/zinc/50/63/41/1042506341.db2.gz VMGFSJAHRAAOKM-ACRUOGEOSA-N 2 1 330.491 4.022 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)[C@H](C)C1 ZINC000492335646 1042611246 /nfs/dbraw/zinc/61/12/46/1042611246.db2.gz SQMUEZOROOSWCW-QAPCUYQASA-N 2 1 338.923 4.289 20 0 EIADMP C[C@H]([NH2+]CCOC1CCCCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492398270 1042634754 /nfs/dbraw/zinc/63/47/54/1042634754.db2.gz GVDWKSMOSKSGOY-FPOVZHCZSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492427284 1042649526 /nfs/dbraw/zinc/64/95/26/1042649526.db2.gz YRWKSXRUOHNWSJ-WAGURGNTSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@H]([NH2+][C@@H]1CSc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310241570 1042832388 /nfs/dbraw/zinc/83/23/88/1042832388.db2.gz LUQHJMUOCXVFCP-XKGZKEIXSA-N 2 1 338.520 4.334 20 0 EIADMP C[C@H]([NH2+][C@@H]1CSc2ccccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310241570 1042832389 /nfs/dbraw/zinc/83/23/89/1042832389.db2.gz LUQHJMUOCXVFCP-XKGZKEIXSA-N 2 1 338.520 4.334 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1 ZINC000177371408 1042835982 /nfs/dbraw/zinc/83/59/82/1042835982.db2.gz MLCNDENILSQPLH-VPWXQRGCSA-N 2 1 344.524 4.490 20 0 EIADMP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000177371408 1042835984 /nfs/dbraw/zinc/83/59/84/1042835984.db2.gz MLCNDENILSQPLH-VPWXQRGCSA-N 2 1 344.524 4.490 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)c1 ZINC001143585813 1042852393 /nfs/dbraw/zinc/85/23/93/1042852393.db2.gz HFIPGPRILCCFFD-UHFFFAOYSA-N 2 1 342.458 4.215 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2ncccc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311524983 1042861168 /nfs/dbraw/zinc/86/11/68/1042861168.db2.gz JZUIOWKBHLHJBI-PGRDOPGGSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1OC(F)(F)F ZINC000178254098 1042861926 /nfs/dbraw/zinc/86/19/26/1042861926.db2.gz GSRNHJLJUFPQSH-CYBMUJFWSA-N 2 1 342.405 4.110 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCCCCOc2ccccc2)CC1 ZINC000525864918 1042946028 /nfs/dbraw/zinc/94/60/28/1042946028.db2.gz APADBXRPIBFKQP-UHFFFAOYSA-N 2 1 332.532 4.288 20 0 EIADMP C[C@@H]1CC([NH2+]Cc2cccc(F)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168005029 1042954258 /nfs/dbraw/zinc/95/42/58/1042954258.db2.gz DZAJJHRMXAMKMU-IAGOWNOFSA-N 2 1 326.459 4.357 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1F ZINC000183191816 1043040145 /nfs/dbraw/zinc/04/01/45/1043040145.db2.gz YGYSTDJZWHMUBS-ZMSDIMECSA-N 2 1 334.479 4.138 20 0 EIADMP C[C@@H]([NH2+]Cc1ccnc2ccccc12)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000388842127 1043061606 /nfs/dbraw/zinc/06/16/06/1043061606.db2.gz YFOLSSDRRPBLHW-WIYYLYMNSA-N 2 1 345.490 4.235 20 0 EIADMP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3cc(O)cc(F)c3)c2)CC1 ZINC000185518206 1043193931 /nfs/dbraw/zinc/19/39/31/1043193931.db2.gz BRFYAZLTTJUBEF-UHFFFAOYSA-N 2 1 342.458 4.053 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3ccc(F)cc3Cl)CCCC2)CC[N@H+]1C ZINC000427882715 1043247248 /nfs/dbraw/zinc/24/72/48/1043247248.db2.gz ANQQNIRAJHNZNV-GDBMZVCRSA-N 2 1 338.898 4.363 20 0 EIADMP Brc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CCC2 ZINC000356682446 1043253604 /nfs/dbraw/zinc/25/36/04/1043253604.db2.gz SDWNQWRLVNSSAD-SOLBZPMBSA-N 2 1 349.316 4.043 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC000674005842 1043270883 /nfs/dbraw/zinc/27/08/83/1043270883.db2.gz NXNIZRRXKDTREH-UHFFFAOYSA-N 2 1 342.449 4.443 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccnn2-c2ccccc2)c1 ZINC000281344588 1043276028 /nfs/dbraw/zinc/27/60/28/1043276028.db2.gz UXWNVOMZYGNKGA-SFHVURJKSA-N 2 1 348.494 4.175 20 0 EIADMP CCC(CC)(CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1)[NH2+][C@@H](C)c1ccccc1 ZINC000166661969 1043308116 /nfs/dbraw/zinc/30/81/16/1043308116.db2.gz WRZUJMMFRNHBCC-CEWLAPEOSA-N 2 1 343.559 4.112 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(C(F)(F)F)c1 ZINC000166754984 1043310881 /nfs/dbraw/zinc/31/08/81/1043310881.db2.gz DOSNPMUHLBNOBR-ZTFGCOKTSA-N 2 1 340.433 4.415 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc2ccccc2c1 ZINC000674049510 1043350993 /nfs/dbraw/zinc/35/09/93/1043350993.db2.gz PMUFPWXOQHSRON-HTAPYJJXSA-N 2 1 338.495 4.134 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1cccc2ccccc21 ZINC000674048911 1043351261 /nfs/dbraw/zinc/35/12/61/1043351261.db2.gz FUMCKJDZLJBPNB-XLIONFOSSA-N 2 1 338.495 4.134 20 0 EIADMP [NH3+][C@@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2C(F)(F)F)CC1 ZINC001205102922 1043396231 /nfs/dbraw/zinc/39/62/31/1043396231.db2.gz WKICSPCEONWRQF-GFCCVEGCSA-N 2 1 340.311 4.037 20 0 EIADMP [NH3+][C@@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2C(F)(F)F)CC1 ZINC001205102922 1043396237 /nfs/dbraw/zinc/39/62/37/1043396237.db2.gz WKICSPCEONWRQF-GFCCVEGCSA-N 2 1 340.311 4.037 20 0 EIADMP CC[NH+](CC)CCCC[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012057 1043421371 /nfs/dbraw/zinc/42/13/71/1043421371.db2.gz VIRBCXOXTHATHH-VTYHHJSWSA-N 3 1 345.575 4.140 20 0 EIADMP CC[NH+](CC)CCCC[NH2+][C@@H]1C[C@@H](C)N(Cc2ccccc2)[C@@H](C)C1 ZINC001168012057 1043421390 /nfs/dbraw/zinc/42/13/90/1043421390.db2.gz VIRBCXOXTHATHH-VTYHHJSWSA-N 2 1 345.575 4.140 20 0 EIADMP CCCc1csc(C[NH2+]Cc2cccc(C[NH+](CC)CC)c2)n1 ZINC000494382468 1043458735 /nfs/dbraw/zinc/45/87/35/1043458735.db2.gz DTICXFLESNOKNW-UHFFFAOYSA-N 2 1 331.529 4.227 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccccn1 ZINC000639219170 1043656500 /nfs/dbraw/zinc/65/65/00/1043656500.db2.gz QBVWCDXCMANZTK-FPOVZHCZSA-N 2 1 349.522 4.317 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccccn1 ZINC000639219170 1043656503 /nfs/dbraw/zinc/65/65/03/1043656503.db2.gz QBVWCDXCMANZTK-FPOVZHCZSA-N 2 1 349.522 4.317 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCCC[C@H]1[C@H]1CCOC1)[N@@H+](C)Cc1ccccc1 ZINC000474035179 1043697496 /nfs/dbraw/zinc/69/74/96/1043697496.db2.gz OWLPQOXPLDYQJO-RYFAJOAYSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1cccc(NC[C@@H]2CC[N@H+](C[C@@H]3CCC4(CCCCC4)O3)C2)[nH+]1 ZINC000190973079 1043757462 /nfs/dbraw/zinc/75/74/62/1043757462.db2.gz KFZDXKRMGIGMTG-OALUTQOASA-N 2 1 343.515 4.006 20 0 EIADMP Cc1cccc(NC[C@@H]2CC[N@@H+](C[C@@H]3CCC4(CCCCC4)O3)C2)[nH+]1 ZINC000190973079 1043757480 /nfs/dbraw/zinc/75/74/80/1043757480.db2.gz KFZDXKRMGIGMTG-OALUTQOASA-N 2 1 343.515 4.006 20 0 EIADMP COCCC[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000442633205 1043774700 /nfs/dbraw/zinc/77/47/00/1043774700.db2.gz CDGXCWBEZAATNH-FXAWDEMLSA-N 2 1 336.495 4.148 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cnn1C(C)(C)C ZINC000191178400 1043788983 /nfs/dbraw/zinc/78/89/83/1043788983.db2.gz XVXXDQCIOXZNSA-DLBZAZTESA-N 2 1 334.552 4.109 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000172626942 1043809851 /nfs/dbraw/zinc/80/98/51/1043809851.db2.gz FMTNZNAXVAZLKT-RBUKOAKNSA-N 2 1 338.495 4.343 20 0 EIADMP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000172626942 1043809852 /nfs/dbraw/zinc/80/98/52/1043809852.db2.gz FMTNZNAXVAZLKT-RBUKOAKNSA-N 2 1 338.495 4.343 20 0 EIADMP C[C@@H](CC[NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1)[N@@H+](C)Cc1ccccc1 ZINC000442761580 1043825354 /nfs/dbraw/zinc/82/53/54/1043825354.db2.gz CLGFFSRCVFZRFL-HKUYNNGSSA-N 2 1 347.506 4.135 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000191550240 1043826306 /nfs/dbraw/zinc/82/63/06/1043826306.db2.gz VFIVEOUOCMHTAC-DLBZAZTESA-N 2 1 340.433 4.199 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442773381 1043830652 /nfs/dbraw/zinc/83/06/52/1043830652.db2.gz CLULFFYLKZQREO-RDJZCZTQSA-N 2 1 337.389 4.136 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000442804912 1043838407 /nfs/dbraw/zinc/83/84/07/1043838407.db2.gz YIZJPBBMUHFTCE-GCJKJVERSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000442804912 1043838412 /nfs/dbraw/zinc/83/84/12/1043838412.db2.gz YIZJPBBMUHFTCE-GCJKJVERSA-N 2 1 347.506 4.211 20 0 EIADMP Fc1ccc2oc(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)nc2c1 ZINC000674904715 1043923819 /nfs/dbraw/zinc/92/38/19/1043923819.db2.gz XUQYIPHUNWZPGK-UHFFFAOYSA-N 2 1 345.462 4.055 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000443012399 1043965521 /nfs/dbraw/zinc/96/55/21/1043965521.db2.gz SFAMASHQKLKHSP-ALOPSCKCSA-N 2 1 326.406 4.119 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cnc(-c3ccco3)s2)C1 ZINC000193007318 1043990794 /nfs/dbraw/zinc/99/07/94/1043990794.db2.gz JQPAICRKGJTQBL-IYBDPMFKSA-N 2 1 347.528 4.251 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCC1CCOCC1 ZINC000521834696 1044026298 /nfs/dbraw/zinc/02/62/98/1044026298.db2.gz LYQNHOJBJRFMFZ-NRFANRHFSA-N 2 1 344.543 4.084 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCC1CCOCC1 ZINC000521834696 1044026315 /nfs/dbraw/zinc/02/63/15/1044026315.db2.gz LYQNHOJBJRFMFZ-NRFANRHFSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@]1(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1(F)F ZINC000658223141 1044073467 /nfs/dbraw/zinc/07/34/67/1044073467.db2.gz SPHGYKJKOYLGLR-FCGDIQPGSA-N 2 1 334.454 4.207 20 0 EIADMP Cc1cc(F)cc(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC001143589589 1044306509 /nfs/dbraw/zinc/30/65/09/1044306509.db2.gz DCPWNECCWRONBS-JOCHJYFZSA-N 2 1 338.470 4.232 20 0 EIADMP Cc1cc(F)cc(C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC001143589589 1044306522 /nfs/dbraw/zinc/30/65/22/1044306522.db2.gz DCPWNECCWRONBS-JOCHJYFZSA-N 2 1 338.470 4.232 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC001143589589 1044306535 /nfs/dbraw/zinc/30/65/35/1044306535.db2.gz DCPWNECCWRONBS-JOCHJYFZSA-N 2 1 338.470 4.232 20 0 EIADMP Cc1cc(F)cc(C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1 ZINC001143589589 1044306543 /nfs/dbraw/zinc/30/65/43/1044306543.db2.gz DCPWNECCWRONBS-JOCHJYFZSA-N 2 1 338.470 4.232 20 0 EIADMP C[C@@H]1CC([NH2+]C2(c3ccncc3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168017987 1044321672 /nfs/dbraw/zinc/32/16/72/1044321672.db2.gz YJUOOQRWEDLDMA-QZTJIDSGSA-N 2 1 335.495 4.102 20 0 EIADMP FC(F)(F)C1CCC(C[NH2+][C@@H]2CC[N@H+](CC3CCCC3)C2)CC1 ZINC000466361661 1044323592 /nfs/dbraw/zinc/32/35/92/1044323592.db2.gz BZJOPGIARWWGOZ-BDVYOWHSSA-N 2 1 332.454 4.209 20 0 EIADMP FC(F)(F)C1CCC(C[NH2+][C@@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC000466361661 1044323597 /nfs/dbraw/zinc/32/35/97/1044323597.db2.gz BZJOPGIARWWGOZ-BDVYOWHSSA-N 2 1 332.454 4.209 20 0 EIADMP Cc1cccc2c1OCC[C@H]2[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1 ZINC000474087310 1044435182 /nfs/dbraw/zinc/43/51/82/1044435182.db2.gz FJVONOHHJIQSFL-MAODMQOUSA-N 2 1 342.527 4.451 20 0 EIADMP Cc1cccc2c1OCC[C@H]2[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000474090873 1044454003 /nfs/dbraw/zinc/45/40/03/1044454003.db2.gz UVLFWPAXNINBND-OZOXKJRCSA-N 2 1 342.527 4.451 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000177813927 1044511071 /nfs/dbraw/zinc/51/10/71/1044511071.db2.gz AUJBTEVOZPLMSN-WMLDXEAASA-N 2 1 328.422 4.053 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000177813927 1044511090 /nfs/dbraw/zinc/51/10/90/1044511090.db2.gz AUJBTEVOZPLMSN-WMLDXEAASA-N 2 1 328.422 4.053 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC[NH+]1C ZINC000177813927 1044511103 /nfs/dbraw/zinc/51/11/03/1044511103.db2.gz AUJBTEVOZPLMSN-WMLDXEAASA-N 2 1 328.422 4.053 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC[NH+]1C ZINC000177813927 1044511124 /nfs/dbraw/zinc/51/11/24/1044511124.db2.gz AUJBTEVOZPLMSN-WMLDXEAASA-N 2 1 328.422 4.053 20 0 EIADMP CC(C)c1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000675881463 1044553067 /nfs/dbraw/zinc/55/30/67/1044553067.db2.gz LRNOFJIJGBTORW-UTKZUKDTSA-N 2 1 330.516 4.104 20 0 EIADMP CC(C)Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000675882955 1044555945 /nfs/dbraw/zinc/55/59/45/1044555945.db2.gz VUICZTCSZLWQLP-XMSQKQJNSA-N 2 1 344.543 4.179 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](C/C=C/c2ccncc2)CC1 ZINC000494984910 1044569257 /nfs/dbraw/zinc/56/92/57/1044569257.db2.gz HQEDPDXVFVUXNP-OQBYNLHGSA-N 2 1 327.516 4.071 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCOC2CCCCC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168024250 1044605972 /nfs/dbraw/zinc/60/59/72/1044605972.db2.gz CVCIEVNMCLJBMT-CEQLMSFQSA-N 2 1 344.543 4.367 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCC(F)(F)F)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168026917 1044722484 /nfs/dbraw/zinc/72/24/84/1044722484.db2.gz MFIUOLWXAVQICU-SCAQPMJSSA-N 2 1 328.422 4.360 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cncc(Cl)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168028700 1044749704 /nfs/dbraw/zinc/74/97/04/1044749704.db2.gz QGEUYLAMUQNHSJ-CWPLJXCYSA-N 2 1 343.902 4.266 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cncc(Cl)c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168028700 1044749716 /nfs/dbraw/zinc/74/97/16/1044749716.db2.gz QGEUYLAMUQNHSJ-CWPLJXCYSA-N 2 1 343.902 4.266 20 0 EIADMP Cc1ccc(CCC[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)cn1 ZINC000474278099 1044836764 /nfs/dbraw/zinc/83/67/64/1044836764.db2.gz OAHJTUGDBCSJKP-HXUWFJFHSA-N 2 1 343.559 4.299 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)[C@@H]1CCCOC1 ZINC000895663396 1044842060 /nfs/dbraw/zinc/84/20/60/1044842060.db2.gz KPSUGSYYLBWXJN-KRXUUXHPSA-N 2 1 342.527 4.149 20 0 EIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)[C@@H]1CCCOC1 ZINC000895663396 1044842062 /nfs/dbraw/zinc/84/20/62/1044842062.db2.gz KPSUGSYYLBWXJN-KRXUUXHPSA-N 2 1 342.527 4.149 20 0 EIADMP CCc1ccc([C@H](CC(C)C)[NH2+]C2CC[NH+](CCOC)CC2)cc1 ZINC000671658795 1044891542 /nfs/dbraw/zinc/89/15/42/1044891542.db2.gz VTAPRZAOZWASOC-NRFANRHFSA-N 2 1 332.532 4.037 20 0 EIADMP Fc1ccccc1C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000191692333 1044909227 /nfs/dbraw/zinc/90/92/27/1044909227.db2.gz MMVIOGWRHDDVQC-JOCHJYFZSA-N 2 1 338.470 4.326 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCSC3(CCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000922840725 1044985716 /nfs/dbraw/zinc/98/57/16/1044985716.db2.gz RJVWJYMFLONMBP-MISYRCLQSA-N 2 1 344.568 4.447 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCSC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000922840725 1044985731 /nfs/dbraw/zinc/98/57/31/1044985731.db2.gz RJVWJYMFLONMBP-MISYRCLQSA-N 2 1 344.568 4.447 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCSc3ccccc3)C2)CC1 ZINC000303673294 1045052547 /nfs/dbraw/zinc/05/25/47/1045052547.db2.gz HBDKRNACANSUNW-LJQANCHMSA-N 2 1 332.557 4.223 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCSc3ccccc3)C2)CC1 ZINC000303673294 1045052564 /nfs/dbraw/zinc/05/25/64/1045052564.db2.gz HBDKRNACANSUNW-LJQANCHMSA-N 2 1 332.557 4.223 20 0 EIADMP c1ccc([C@@H]2C[C@@H](N[C@@H]3CC[N@H+]4CCC[C@H]4C3)c3ccccc3O2)cc1 ZINC000922887095 1045084037 /nfs/dbraw/zinc/08/40/37/1045084037.db2.gz YXDDQWCLAJJRSN-XZYOPWHXSA-N 2 1 348.490 4.468 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)c3ccccc3O2)cc1 ZINC000922887095 1045084050 /nfs/dbraw/zinc/08/40/50/1045084050.db2.gz YXDDQWCLAJJRSN-XZYOPWHXSA-N 2 1 348.490 4.468 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)c3ccccc3O2)cc1 ZINC000922887095 1045084064 /nfs/dbraw/zinc/08/40/64/1045084064.db2.gz YXDDQWCLAJJRSN-XZYOPWHXSA-N 2 1 348.490 4.468 20 0 EIADMP CCc1ccc(C[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cn1 ZINC000347777727 1045105866 /nfs/dbraw/zinc/10/58/66/1045105866.db2.gz JDQVHASJEZGXAN-PGRDOPGGSA-N 2 1 337.511 4.129 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)oc1-c1ccc(Cl)cc1 ZINC000923494884 1045134904 /nfs/dbraw/zinc/13/49/04/1045134904.db2.gz PYRMSXMOXSPFOQ-NOLJZWGESA-N 2 1 347.890 4.281 20 0 EIADMP FC(F)(F)CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc2c(c1)C[NH2+]CC2 ZINC000923525373 1045147619 /nfs/dbraw/zinc/14/76/19/1045147619.db2.gz GHXYLKOVVKKQAW-DODVFSASSA-N 2 1 338.417 4.028 20 0 EIADMP C[C@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)c1cccc2ccccc21 ZINC000495478654 1045154062 /nfs/dbraw/zinc/15/40/62/1045154062.db2.gz DGWCXVOJPCNJOJ-SFHVURJKSA-N 2 1 338.495 4.135 20 0 EIADMP c1cc2c(s1)CCC[C@H]2[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000236586158 1045360784 /nfs/dbraw/zinc/36/07/84/1045360784.db2.gz RUIPUVWWORYVGO-HXUWFJFHSA-N 2 1 340.536 4.422 20 0 EIADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)o1 ZINC000237466669 1045386759 /nfs/dbraw/zinc/38/67/59/1045386759.db2.gz LMQRTQDPUWGUKD-SLYNCCJLSA-N 2 1 338.495 4.057 20 0 EIADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)o1 ZINC000237466669 1045386769 /nfs/dbraw/zinc/38/67/69/1045386769.db2.gz LMQRTQDPUWGUKD-SLYNCCJLSA-N 2 1 338.495 4.057 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000237549554 1045388297 /nfs/dbraw/zinc/38/82/97/1045388297.db2.gz ABWYIOOICXBBPA-QANKJYHBSA-N 2 1 340.433 4.476 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000237549554 1045388301 /nfs/dbraw/zinc/38/83/01/1045388301.db2.gz ABWYIOOICXBBPA-QANKJYHBSA-N 2 1 340.433 4.476 20 0 EIADMP Fc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1Cl ZINC000237768758 1045395261 /nfs/dbraw/zinc/39/52/61/1045395261.db2.gz UQDCAHDDNCNCAB-UHFFFAOYSA-N 2 1 346.877 4.276 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000915681643 1045447272 /nfs/dbraw/zinc/44/72/72/1045447272.db2.gz FMOHFPITTWQQBT-UXHICEINSA-N 2 1 330.516 4.362 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000398025057 1045823349 /nfs/dbraw/zinc/82/33/49/1045823349.db2.gz CATARXGKWSWIJB-KGVIQGDOSA-N 2 1 338.495 4.256 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000398025057 1045823352 /nfs/dbraw/zinc/82/33/52/1045823352.db2.gz CATARXGKWSWIJB-KGVIQGDOSA-N 2 1 338.495 4.256 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCCCC1(F)F ZINC000398023822 1045823823 /nfs/dbraw/zinc/82/38/23/1045823823.db2.gz LEWJMHBYEPLOIJ-BHIYHBOVSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCCCC1(F)F ZINC000398023825 1045823842 /nfs/dbraw/zinc/82/38/42/1045823842.db2.gz LEWJMHBYEPLOIJ-NZSAHSFTSA-N 2 1 336.470 4.312 20 0 EIADMP Oc1cccc2c1CCC[C@H]2[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000792186511 1045876590 /nfs/dbraw/zinc/87/65/90/1045876590.db2.gz OLCIPFPAJKWRQF-OAQYLSRUSA-N 2 1 342.527 4.404 20 0 EIADMP CSC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000248649017 1045880302 /nfs/dbraw/zinc/88/03/02/1045880302.db2.gz KGPNXZIBTZZEPT-REPLKXPHSA-N 2 1 330.541 4.057 20 0 EIADMP C[C@H]([NH3+])c1ccc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001170332207 1046001555 /nfs/dbraw/zinc/00/15/55/1046001555.db2.gz ASSFCYMDTWCVNS-IRNNPGBSSA-N 2 1 335.495 4.314 20 0 EIADMP Cc1cc2[nH+]ccn2cc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001170333862 1046004854 /nfs/dbraw/zinc/00/48/54/1046004854.db2.gz WOFXFUZFXPURLF-OWZKRDHZSA-N 2 1 346.478 4.250 20 0 EIADMP [NH3+][C@H]1CCc2c1cccc2N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001170336815 1046005505 /nfs/dbraw/zinc/00/55/05/1046005505.db2.gz FUZMTIXHVKRNCN-VWNVYAMZSA-N 2 1 347.506 4.240 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2sc(-c3cccnc3)nc2C)CC1 ZINC000161628101 1046011762 /nfs/dbraw/zinc/01/17/62/1046011762.db2.gz LPUZIWXRONBOLK-AWEZNQCLSA-N 2 1 344.528 4.039 20 0 EIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc2c(c1)CCCO2 ZINC000153973108 1046015846 /nfs/dbraw/zinc/01/58/46/1046015846.db2.gz BAYZIPXPBFGFNV-LJQANCHMSA-N 2 1 327.472 4.038 20 0 EIADMP CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000769871856 1046099715 /nfs/dbraw/zinc/09/97/15/1046099715.db2.gz ZVRLCWVXZPOYOS-OAHLLOKOSA-N 2 1 329.488 4.236 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@@H](CC(C)C)c2ccccc2)cn1 ZINC000792923560 1046109209 /nfs/dbraw/zinc/10/92/09/1046109209.db2.gz VTGYAGMUCUCCCU-OAQYLSRUSA-N 2 1 348.494 4.495 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@@H](C)c3cccc(C)c3C)CC2)nc(C)[nH+]1 ZINC000162236956 1046157682 /nfs/dbraw/zinc/15/76/82/1046157682.db2.gz TXPJLANFUUJBAF-KRWDZBQOSA-N 2 1 338.499 4.030 20 0 EIADMP Cc1ccccc1COc1ccc([C@@H](C)[NH2+]CCc2c[nH+]cn2C)cc1 ZINC000530355281 1046168345 /nfs/dbraw/zinc/16/83/45/1046168345.db2.gz YKBQUTUALZHGNX-GOSISDBHSA-N 2 1 349.478 4.201 20 0 EIADMP C[NH2+]CCC1CC[NH+](Cc2csc(Nc3ccc(C)cc3)n2)CC1 ZINC000262003703 1046173856 /nfs/dbraw/zinc/17/38/56/1046173856.db2.gz QNBATJMHUADSDF-UHFFFAOYSA-N 2 1 344.528 4.017 20 0 EIADMP CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000476006310 1046196458 /nfs/dbraw/zinc/19/64/58/1046196458.db2.gz BCSIFLTXAXHIBN-IAGOWNOFSA-N 2 1 345.531 4.166 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)C(c1ccccc1)c1ccccc1 ZINC000124380079 1046235842 /nfs/dbraw/zinc/23/58/42/1046235842.db2.gz MFHDJIAQENILBZ-RTBURBONSA-N 2 1 334.507 4.281 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CC(C)(C)OC2(C)C)CC1 ZINC000125175900 1046291326 /nfs/dbraw/zinc/29/13/26/1046291326.db2.gz VLODVMLGVFQSCA-VQIMIIECSA-N 2 1 330.516 4.148 20 0 EIADMP COCCC1(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCCC1 ZINC000508699887 1046327338 /nfs/dbraw/zinc/32/73/38/1046327338.db2.gz OYYMIPPBIMEFEE-TZIWHRDSSA-N 2 1 344.543 4.084 20 0 EIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccccc2OC(F)F)C1 ZINC000125821567 1046351442 /nfs/dbraw/zinc/35/14/42/1046351442.db2.gz JYFCWYIYDOYHQT-GJZGRUSLSA-N 2 1 326.431 4.059 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccccc2OC(F)F)C1 ZINC000125821567 1046351458 /nfs/dbraw/zinc/35/14/58/1046351458.db2.gz JYFCWYIYDOYHQT-GJZGRUSLSA-N 2 1 326.431 4.059 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2ccccc2COC)C[C@@H]1C ZINC000508719529 1046378868 /nfs/dbraw/zinc/37/88/68/1046378868.db2.gz NYAFEXDQTIJWHJ-VDKPFWJGSA-N 2 1 330.516 4.041 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C(C)=C/c2ccccc2COC)C[C@@H]1C ZINC000508719529 1046378883 /nfs/dbraw/zinc/37/88/83/1046378883.db2.gz NYAFEXDQTIJWHJ-VDKPFWJGSA-N 2 1 330.516 4.041 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C(C)=C/c2ccccc2COC)C[C@@H]1C ZINC000508719529 1046378901 /nfs/dbraw/zinc/37/89/01/1046378901.db2.gz NYAFEXDQTIJWHJ-VDKPFWJGSA-N 2 1 330.516 4.041 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@@H]3C(C)C)CC2)oc1C ZINC000162744819 1046493083 /nfs/dbraw/zinc/49/30/83/1046493083.db2.gz YOBDTQKQDLFBNS-WOJBJXKFSA-N 2 1 347.547 4.308 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CCN(Cc2cc(C)c(C)cc2OC(F)F)C1 ZINC000536663328 1046632945 /nfs/dbraw/zinc/63/29/45/1046632945.db2.gz FMSOENBCRRZMDE-MRXNPFEDSA-N 2 1 340.458 4.069 20 0 EIADMP CCOc1ccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000536673520 1046657293 /nfs/dbraw/zinc/65/72/93/1046657293.db2.gz YJVXHBHEQGHSPB-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CCOc1ccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000536673520 1046657302 /nfs/dbraw/zinc/65/73/02/1046657302.db2.gz YJVXHBHEQGHSPB-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CCOc1ccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000536673520 1046657313 /nfs/dbraw/zinc/65/73/13/1046657313.db2.gz YJVXHBHEQGHSPB-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP c1ccc(C[C@@H](C[NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000459435874 1046667655 /nfs/dbraw/zinc/66/76/55/1046667655.db2.gz XNZWQLMXCXHEID-NRFANRHFSA-N 2 1 334.507 4.229 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)[C@@H](C)C1 ZINC000536682263 1046684425 /nfs/dbraw/zinc/68/44/25/1046684425.db2.gz BJCDJJXDORATLU-KKSFZXQISA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc3cc(OC)ccc3c2)[C@@H](C)C1 ZINC000536682263 1046684435 /nfs/dbraw/zinc/68/44/35/1046684435.db2.gz BJCDJJXDORATLU-KKSFZXQISA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc3cc(OC)ccc3c2)[C@@H](C)C1 ZINC000536682263 1046684450 /nfs/dbraw/zinc/68/44/50/1046684450.db2.gz BJCDJJXDORATLU-KKSFZXQISA-N 2 1 326.484 4.011 20 0 EIADMP Cc1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc(C)c1O ZINC000379615154 1046702055 /nfs/dbraw/zinc/70/20/55/1046702055.db2.gz AFXKGXWHSUNYHN-GHTZIAJQSA-N 2 1 338.495 4.152 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCOc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379624694 1046715953 /nfs/dbraw/zinc/71/59/53/1046715953.db2.gz JRDUVMUTZSYSOT-PZJWPPBQSA-N 2 1 338.495 4.098 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCCOc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379624694 1046715970 /nfs/dbraw/zinc/71/59/70/1046715970.db2.gz JRDUVMUTZSYSOT-PZJWPPBQSA-N 2 1 338.495 4.098 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379625308 1046716071 /nfs/dbraw/zinc/71/60/71/1046716071.db2.gz KPWJNFOUVJPFLV-LVCYWYKZSA-N 2 1 340.486 4.399 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379625308 1046716084 /nfs/dbraw/zinc/71/60/84/1046716084.db2.gz KPWJNFOUVJPFLV-LVCYWYKZSA-N 2 1 340.486 4.399 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC000379647794 1046740757 /nfs/dbraw/zinc/74/07/57/1046740757.db2.gz LDHKQHFRDZSORX-LEOXJPRUSA-N 2 1 334.507 4.187 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC000379647794 1046740771 /nfs/dbraw/zinc/74/07/71/1046740771.db2.gz LDHKQHFRDZSORX-LEOXJPRUSA-N 2 1 334.507 4.187 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3c2cccc3F)CC[N@@H+]1Cc1ccccc1 ZINC000379655811 1046759761 /nfs/dbraw/zinc/75/97/61/1046759761.db2.gz NEORSYVVVRCJQZ-CDMIOBSGSA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3c2cccc3F)CC[N@H+]1Cc1ccccc1 ZINC000379655811 1046759776 /nfs/dbraw/zinc/75/97/76/1046759776.db2.gz NEORSYVVVRCJQZ-CDMIOBSGSA-N 2 1 338.470 4.456 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1 ZINC000536858198 1046827537 /nfs/dbraw/zinc/82/75/37/1046827537.db2.gz PSWKXBKDNBPPHB-RYUDHWBXSA-N 2 1 326.271 4.485 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc(OC)cc3)cc2)[C@@H](C)C1 ZINC000536874133 1046837046 /nfs/dbraw/zinc/83/70/46/1046837046.db2.gz CJHDNVFGNKGAKV-HTAPYJJXSA-N 2 1 338.495 4.182 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000459723561 1046864547 /nfs/dbraw/zinc/86/45/47/1046864547.db2.gz ADDZODQHPOSTON-LJISPDSOSA-N 2 1 326.937 4.215 20 0 EIADMP CC(C)CCC[C@@H](C)[NH+]1CCC2(CC1)C[N@H+](Cc1ccoc1)CCO2 ZINC001170077260 1047048709 /nfs/dbraw/zinc/04/87/09/1047048709.db2.gz HQRJJENVDAYDIY-LJQANCHMSA-N 2 1 348.531 4.161 20 0 EIADMP CC(C)CCC[C@@H](C)[NH+]1CCC2(CC1)C[N@@H+](Cc1ccoc1)CCO2 ZINC001170077260 1047048726 /nfs/dbraw/zinc/04/87/26/1047048726.db2.gz HQRJJENVDAYDIY-LJQANCHMSA-N 2 1 348.531 4.161 20 0 EIADMP C[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000788011366 1047078401 /nfs/dbraw/zinc/07/84/01/1047078401.db2.gz FXPWGXGAANVHQF-QGZVFWFLSA-N 2 1 327.299 4.472 20 0 EIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000537303719 1047085383 /nfs/dbraw/zinc/08/53/83/1047085383.db2.gz IVOYGQAYMOPURI-STQMWFEESA-N 2 1 343.298 4.001 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3ccc(Cl)nc32)c1 ZINC000788643679 1047246486 /nfs/dbraw/zinc/24/64/86/1047246486.db2.gz KVJUNDPGPRUFDZ-GOSISDBHSA-N 2 1 343.902 4.352 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c(C)o1 ZINC000556064116 1047430438 /nfs/dbraw/zinc/43/04/38/1047430438.db2.gz UCCNHDDYVMBLGJ-PXNSSMCTSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c(C)o1 ZINC000556064116 1047430443 /nfs/dbraw/zinc/43/04/43/1047430443.db2.gz UCCNHDDYVMBLGJ-PXNSSMCTSA-N 2 1 326.484 4.112 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(F)c(Cl)c2)C[C@H]1c1ccccc1 ZINC000556075925 1047431674 /nfs/dbraw/zinc/43/16/74/1047431674.db2.gz FPJVBJONXCFATE-APWZRJJASA-N 2 1 332.850 4.404 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc(F)c(Cl)c2)C[C@H]1c1ccccc1 ZINC000556075925 1047431681 /nfs/dbraw/zinc/43/16/81/1047431681.db2.gz FPJVBJONXCFATE-APWZRJJASA-N 2 1 332.850 4.404 20 0 EIADMP COc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556103676 1047454589 /nfs/dbraw/zinc/45/45/89/1047454589.db2.gz ULFRTTDSRNYXDU-JRGCBEDISA-N 2 1 336.479 4.108 20 0 EIADMP COc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556103676 1047454593 /nfs/dbraw/zinc/45/45/93/1047454593.db2.gz ULFRTTDSRNYXDU-JRGCBEDISA-N 2 1 336.479 4.108 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000129651144 1047456556 /nfs/dbraw/zinc/45/65/56/1047456556.db2.gz MGBXCGXGFDUUGO-YHUYYLMFSA-N 2 1 332.454 4.350 20 0 EIADMP C[C@H]1CC[C@H]([NH+]2CCC([NH3+])(c3ccccc3C(F)(F)F)CC2)C1 ZINC001170119645 1047473133 /nfs/dbraw/zinc/47/31/33/1047473133.db2.gz ZJEBULXZCJTYRV-KBPBESRZSA-N 2 1 326.406 4.144 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC23CC3)cc1 ZINC000897746465 1047481658 /nfs/dbraw/zinc/48/16/58/1047481658.db2.gz KLMSQLZLNSAWDZ-UMQXSMKFSA-N 2 1 342.552 4.200 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC23CC3)cc1 ZINC000897746465 1047481661 /nfs/dbraw/zinc/48/16/61/1047481661.db2.gz KLMSQLZLNSAWDZ-UMQXSMKFSA-N 2 1 342.552 4.200 20 0 EIADMP C[C@H]([NH2+][C@H]1CCSC(C)(C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000897796003 1047485181 /nfs/dbraw/zinc/48/51/81/1047485181.db2.gz VUSHWYNCVIPERR-UHOSZYNNSA-N 2 1 332.557 4.161 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000129754494 1047500411 /nfs/dbraw/zinc/50/04/11/1047500411.db2.gz ZVDGAYLDCXNRIA-PXNSSMCTSA-N 2 1 340.511 4.287 20 0 EIADMP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000129803323 1047509316 /nfs/dbraw/zinc/50/93/16/1047509316.db2.gz OOAHYCYVKPMSAQ-MGPQQGTHSA-N 2 1 327.299 4.141 20 0 EIADMP COC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCC(C)CC1 ZINC000556178737 1047539210 /nfs/dbraw/zinc/53/92/10/1047539210.db2.gz MYQNURRZZDHKRU-WWFYLNGCSA-N 2 1 330.516 4.007 20 0 EIADMP COC1(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCC(C)CC1 ZINC000556178737 1047539221 /nfs/dbraw/zinc/53/92/21/1047539221.db2.gz MYQNURRZZDHKRU-WWFYLNGCSA-N 2 1 330.516 4.007 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1ccncc1F ZINC000556235738 1047601158 /nfs/dbraw/zinc/60/11/58/1047601158.db2.gz GTDFTCVXINKQGG-IRXDYDNUSA-N 2 1 341.474 4.446 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+][C@H](c3ccncc3)C3CC3)CC23CC3)cc1 ZINC000898319175 1047622410 /nfs/dbraw/zinc/62/24/10/1047622410.db2.gz AGVIOLJACPGLIP-YADHBBJMSA-N 2 1 347.506 4.320 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+][C@H](c3ccncc3)C3CC3)CC23CC3)cc1 ZINC000898319175 1047622419 /nfs/dbraw/zinc/62/24/19/1047622419.db2.gz AGVIOLJACPGLIP-YADHBBJMSA-N 2 1 347.506 4.320 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccncc1F ZINC000556241199 1047623635 /nfs/dbraw/zinc/62/36/35/1047623635.db2.gz YSBDEDSIXPVPCS-KRWDZBQOSA-N 2 1 341.474 4.448 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C12CCCC2 ZINC000550665545 1047810727 /nfs/dbraw/zinc/81/07/27/1047810727.db2.gz MGCTYYAAMPUSHJ-JSXRDJHFSA-N 2 1 342.527 4.149 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C12CCCC2 ZINC000550665545 1047810730 /nfs/dbraw/zinc/81/07/30/1047810730.db2.gz MGCTYYAAMPUSHJ-JSXRDJHFSA-N 2 1 342.527 4.149 20 0 EIADMP CC(C)[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1cccnc1 ZINC000550678469 1047816612 /nfs/dbraw/zinc/81/66/12/1047816612.db2.gz GVAHBLMKQNWKHW-FSSWDIPSSA-N 2 1 337.511 4.246 20 0 EIADMP CC(C)[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1cccnc1 ZINC000550678469 1047816615 /nfs/dbraw/zinc/81/66/15/1047816615.db2.gz GVAHBLMKQNWKHW-FSSWDIPSSA-N 2 1 337.511 4.246 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(Br)c(F)c2)CC1 ZINC000131020402 1047821143 /nfs/dbraw/zinc/82/11/43/1047821143.db2.gz XNKNGOIOZKTEEH-GFCCVEGCSA-N 2 1 343.284 4.113 20 0 EIADMP COc1ccccc1C[N@@H+]([C@H]1C[C@@H]2[C@H](C1)C2(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170738474 1047965811 /nfs/dbraw/zinc/96/58/11/1047965811.db2.gz MSDAQQRAEUUGSV-CCQCEHTISA-N 2 1 342.527 4.202 20 0 EIADMP Cc1ccc2c(C[N@@H+](C)C[C@H]3CC[NH+](Cc4ccccc4)C3)c[nH]c2c1 ZINC001136974636 1048005913 /nfs/dbraw/zinc/00/59/13/1048005913.db2.gz GYPYLKYHJZLMED-HXUWFJFHSA-N 2 1 347.506 4.430 20 0 EIADMP Cc1ccc2c(C[NH+](C)C[C@H]3CC[N@H+](Cc4ccccc4)C3)c[nH]c2c1 ZINC001136974636 1048005930 /nfs/dbraw/zinc/00/59/30/1048005930.db2.gz GYPYLKYHJZLMED-HXUWFJFHSA-N 2 1 347.506 4.430 20 0 EIADMP Cc1ccc2c(C[NH+](C)C[C@H]3CC[N@@H+](Cc4ccccc4)C3)c[nH]c2c1 ZINC001136974636 1048005939 /nfs/dbraw/zinc/00/59/39/1048005939.db2.gz GYPYLKYHJZLMED-HXUWFJFHSA-N 2 1 347.506 4.430 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@H]2CCC[C@@H]21 ZINC000556886240 1048106371 /nfs/dbraw/zinc/10/63/71/1048106371.db2.gz KDZMNKMJCSMBSV-AOIWGVFYSA-N 2 1 347.572 4.196 20 0 EIADMP CCn1c2ccccc2nc1[C@@H]1CCC[N@H+]1CCCCCCC[NH3+] ZINC000844221941 1048225323 /nfs/dbraw/zinc/22/53/23/1048225323.db2.gz OSHKXHSAYDNMMN-IBGZPJMESA-N 2 1 328.504 4.102 20 0 EIADMP Cc1cc(N2CC[NH+](Cc3cccc(C(F)(F)F)c3C)CC2)cc[nH+]1 ZINC001143929344 1048298718 /nfs/dbraw/zinc/29/87/18/1048298718.db2.gz HKVLZARCNJOBCY-UHFFFAOYSA-N 2 1 349.400 4.039 20 0 EIADMP C[C@H](CC[N@H+]1CCC[C@@]2(CC2(F)F)C1)[NH+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437257 1048333515 /nfs/dbraw/zinc/33/35/15/1048333515.db2.gz MTLKTALOLQNCTL-OAGGEKHMSA-N 2 1 348.428 4.007 20 0 EIADMP C[C@H](CC[NH+]1CCC[C@@]2(CC2(F)F)C1)[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437257 1048333533 /nfs/dbraw/zinc/33/35/33/1048333533.db2.gz MTLKTALOLQNCTL-OAGGEKHMSA-N 2 1 348.428 4.007 20 0 EIADMP C[C@H](CC[NH+]1CCC[C@@]2(CC2(F)F)C1)[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437257 1048333550 /nfs/dbraw/zinc/33/35/50/1048333550.db2.gz MTLKTALOLQNCTL-OAGGEKHMSA-N 2 1 348.428 4.007 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000499149849 1048358432 /nfs/dbraw/zinc/35/84/32/1048358432.db2.gz UXTHIQFBKQPVCX-IEBWSBKVSA-N 2 1 341.886 4.226 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000499149849 1048358443 /nfs/dbraw/zinc/35/84/43/1048358443.db2.gz UXTHIQFBKQPVCX-IEBWSBKVSA-N 2 1 341.886 4.226 20 0 EIADMP C[N@@H+](C1CCC([NH3+])CC1)[C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171143548 1048442590 /nfs/dbraw/zinc/44/25/90/1048442590.db2.gz IQYDDNQYRZURMP-NRXISQOPSA-N 2 1 327.299 4.052 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cncc2ccccc21 ZINC000809739856 1048513253 /nfs/dbraw/zinc/51/32/53/1048513253.db2.gz VDIKFNANMWIEKW-UHFFFAOYSA-N 2 1 333.479 4.319 20 0 EIADMP C[N@@H+](CC1CC[NH+](C)CC1)[C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171163042 1048600083 /nfs/dbraw/zinc/60/00/83/1048600083.db2.gz MFYPSUXROBIXCN-MRXNPFEDSA-N 2 1 341.326 4.124 20 0 EIADMP C[C@H]([NH2+]CC[C@]1(C)C[C@]1(F)Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000846036811 1048800985 /nfs/dbraw/zinc/80/09/85/1048800985.db2.gz MKEGJTXCXXRTEE-JCHJZTRSSA-N 2 1 338.898 4.191 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)[C@](C)(O)c2ccccc2)cc1 ZINC000846044071 1048804114 /nfs/dbraw/zinc/80/41/14/1048804114.db2.gz NTMNZXRLVRSWAG-JKSBSHDWSA-N 2 1 349.478 4.128 20 0 EIADMP Cc1cc(C[NH2+]C2CC[NH+](C)CC2)ccc1Oc1ccc(F)cc1 ZINC000237168663 1048892037 /nfs/dbraw/zinc/89/20/37/1048892037.db2.gz VVILJAFFRSNYHI-UHFFFAOYSA-N 2 1 328.431 4.110 20 0 EIADMP Cc1cc[nH+]c(C)c1N([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001170646605 1049306333 /nfs/dbraw/zinc/30/63/33/1049306333.db2.gz FWEUVAKHTLKHMJ-NSKBAKJYSA-N 2 1 335.495 4.331 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCO[C@H]2CC(C)C)cc1 ZINC000348195758 1049467107 /nfs/dbraw/zinc/46/71/07/1049467107.db2.gz YHEDXTFPPFFMPP-DQLDELGASA-N 2 1 341.499 4.425 20 0 EIADMP C[C@H]([NH3+])c1ncc(-c2ccccc2)n1-c1cccc(C2=[NH+]CCC2)c1 ZINC001170686450 1049578856 /nfs/dbraw/zinc/57/88/56/1049578856.db2.gz RFYUHPKTAZUGPA-HNNXBMFYSA-N 2 1 330.435 4.142 20 0 EIADMP Fc1cccc2c1CC[C@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001171434019 1049674364 /nfs/dbraw/zinc/67/43/64/1049674364.db2.gz PMPLLEMGYBUIAV-OALUTQOASA-N 2 1 330.491 4.023 20 0 EIADMP C[N@@H+](Cc1ccc(-n2ccnc2)cc1)[C@@H]1CCc2c(F)cccc2C1 ZINC001171440382 1049692094 /nfs/dbraw/zinc/69/20/94/1049692094.db2.gz IGWKFKQYDDALFK-LJQANCHMSA-N 2 1 335.426 4.001 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001171549486 1049751665 /nfs/dbraw/zinc/75/16/65/1049751665.db2.gz BIQMJWUUJMPWAQ-OIBXWCBGSA-N 2 1 348.534 4.495 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001171549486 1049751670 /nfs/dbraw/zinc/75/16/70/1049751670.db2.gz BIQMJWUUJMPWAQ-OIBXWCBGSA-N 2 1 348.534 4.495 20 0 EIADMP C[NH+]1C(C)(C)CC([NH+]2CCC(C(=O)c3ccccc3)CC2)CC1(C)C ZINC001171628704 1049761313 /nfs/dbraw/zinc/76/13/13/1049761313.db2.gz GYIBMFLDFNXEIS-UHFFFAOYSA-N 2 1 342.527 4.233 20 0 EIADMP COc1ccccc1C1([NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)CCC1 ZINC001171626795 1049769395 /nfs/dbraw/zinc/76/93/95/1049769395.db2.gz BHYUVLUBUARCNF-UHFFFAOYSA-N 2 1 330.516 4.315 20 0 EIADMP COc1ccccc1[C@@H]1CCC[N@H+]1C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171638506 1049779063 /nfs/dbraw/zinc/77/90/63/1049779063.db2.gz ZSUMWZIEKATDDF-SFHVURJKSA-N 2 1 330.516 4.484 20 0 EIADMP COc1cccc([C@H]2CCC[N@H+]2C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171639567 1049779579 /nfs/dbraw/zinc/77/95/79/1049779579.db2.gz PGPRDRHHXAUKLQ-LJQANCHMSA-N 2 1 330.516 4.484 20 0 EIADMP COc1ccccc1C[C@H](C)[N@@H+](C)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642753 1049781031 /nfs/dbraw/zinc/78/10/31/1049781031.db2.gz MEYTYBSFHZVVGH-INIZCTEOSA-N 2 1 332.532 4.209 20 0 EIADMP C[C@@H]1C[C@@H](n2cc(CCC[NH3+])c3ccccc32)C[N@H+]1Cc1ccccc1 ZINC001171724900 1049785042 /nfs/dbraw/zinc/78/50/42/1049785042.db2.gz DWJZEQKCPYGLPQ-WIYYLYMNSA-N 2 1 347.506 4.368 20 0 EIADMP Cc1cc2cc(C[NH3+])ccc2n1[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC001171727134 1049785427 /nfs/dbraw/zinc/78/54/27/1049785427.db2.gz QCDLNLPDTIOJRR-IERDGZPVSA-N 2 1 333.479 4.244 20 0 EIADMP C[C@@H]1C[C@@H](n2c3ccccc3c3c2CC[NH2+]C3)C[N@H+]1Cc1ccccc1 ZINC001171758560 1049789198 /nfs/dbraw/zinc/78/91/98/1049789198.db2.gz YFEPCTJRVFZIBL-IEBWSBKVSA-N 2 1 345.490 4.123 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC[C@@H]2CC2(Cl)Cl)cc1 ZINC000822822751 1049801046 /nfs/dbraw/zinc/80/10/46/1049801046.db2.gz UFOWTNLYMCHATC-IUODEOHRSA-N 2 1 338.282 4.415 20 0 EIADMP CCO[C@H](CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)C ZINC000245652578 1049812525 /nfs/dbraw/zinc/81/25/25/1049812525.db2.gz CWXFAGRQCRRPFQ-CIAFKFPVSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)[NH+](CCN[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C(C)C ZINC001171969093 1049833620 /nfs/dbraw/zinc/83/36/20/1049833620.db2.gz TUKRJUZSORFGIB-NRFANRHFSA-N 2 1 345.575 4.138 20 0 EIADMP CC1(C)C[C@@H]([NH2+]C2(c3ccncc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171972012 1049834471 /nfs/dbraw/zinc/83/44/71/1049834471.db2.gz LMNIXGSDCCVALV-FQEVSTJZSA-N 2 1 335.495 4.104 20 0 EIADMP CC1(C)C[C@@H]([NH2+]C2(c3ccncc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171972012 1049834474 /nfs/dbraw/zinc/83/44/74/1049834474.db2.gz LMNIXGSDCCVALV-FQEVSTJZSA-N 2 1 335.495 4.104 20 0 EIADMP CC1(C)C[C@H](n2ccc3cc(C[NH3+])cnc32)CC[N@H+]1Cc1ccccc1 ZINC001171971364 1049835222 /nfs/dbraw/zinc/83/52/22/1049835222.db2.gz HCLIRKYLQIUHLV-HXUWFJFHSA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2CCCc3cccnc32)CC[N@@H+]1Cc1ccccc1 ZINC001171973097 1049836105 /nfs/dbraw/zinc/83/61/05/1049836105.db2.gz VTUCVXONHGCQMR-NHCUHLMSSA-N 2 1 349.522 4.492 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2CCCc3cccnc32)CC[N@H+]1Cc1ccccc1 ZINC001171973097 1049836108 /nfs/dbraw/zinc/83/61/08/1049836108.db2.gz VTUCVXONHGCQMR-NHCUHLMSSA-N 2 1 349.522 4.492 20 0 EIADMP CC1(C)C[C@H](Nc2ccc(C[NH3+])c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC001171978853 1049838715 /nfs/dbraw/zinc/83/87/15/1049838715.db2.gz MKHUWCKTXUDMJQ-LJQANCHMSA-N 2 1 341.474 4.140 20 0 EIADMP CC1(C)C[C@H]([NH+]2CC[C@]3(C2)CCCCO3)CC[N@H+]1Cc1ccccc1 ZINC001171981731 1049838922 /nfs/dbraw/zinc/83/89/22/1049838922.db2.gz NGCUDPYJFMHABE-IRLDBZIGSA-N 2 1 342.527 4.075 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CC[C@]3(C2)CCCCO3)CC[NH+]1Cc1ccccc1 ZINC001171981731 1049838926 /nfs/dbraw/zinc/83/89/26/1049838926.db2.gz NGCUDPYJFMHABE-IRLDBZIGSA-N 2 1 342.527 4.075 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CC[C@]3(C2)CCCCO3)CC[NH+]1Cc1ccccc1 ZINC001171981731 1049838928 /nfs/dbraw/zinc/83/89/28/1049838928.db2.gz NGCUDPYJFMHABE-IRLDBZIGSA-N 2 1 342.527 4.075 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CCCc3ncccc32)CC[N@H+]1Cc1ccccc1 ZINC001171982337 1049839338 /nfs/dbraw/zinc/83/93/38/1049839338.db2.gz HJOUFBCACLODOJ-SIKLNZKXSA-N 2 1 349.522 4.492 20 0 EIADMP C[NH2+]Cc1cccc(N[C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171986266 1049839701 /nfs/dbraw/zinc/83/97/01/1049839701.db2.gz GJNIZFLXRAPSQO-NRFANRHFSA-N 2 1 337.511 4.261 20 0 EIADMP COCC[C@H]1CCCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984115 1049839732 /nfs/dbraw/zinc/83/97/32/1049839732.db2.gz ICURRNLFHPMSIM-NHCUHLMSSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@H]1CCCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171984115 1049839736 /nfs/dbraw/zinc/83/97/36/1049839736.db2.gz ICURRNLFHPMSIM-NHCUHLMSSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@H]1CCCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984115 1049839738 /nfs/dbraw/zinc/83/97/38/1049839738.db2.gz ICURRNLFHPMSIM-NHCUHLMSSA-N 2 1 344.543 4.321 20 0 EIADMP COCC[C@H]1CCCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984115 1049839746 /nfs/dbraw/zinc/83/97/46/1049839746.db2.gz ICURRNLFHPMSIM-NHCUHLMSSA-N 2 1 344.543 4.321 20 0 EIADMP Cc1ccncc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172061096 1049842157 /nfs/dbraw/zinc/84/21/57/1049842157.db2.gz FNIOUNMDWPGFEB-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccncc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172061096 1049842158 /nfs/dbraw/zinc/84/21/58/1049842158.db2.gz FNIOUNMDWPGFEB-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@H]2CCc4ncccc42)C3)cc1 ZINC001172077022 1049845292 /nfs/dbraw/zinc/84/52/92/1049845292.db2.gz OGECTQHXZGKJCB-SRYPRDQNSA-N 2 1 347.506 4.244 20 0 EIADMP FC1(F)C[C@@]12CC[N@H+]([C@@H]1C[C@H]3CCC[C@@H](C1)[NH+]3Cc1ccccc1)C2 ZINC001172074408 1049845398 /nfs/dbraw/zinc/84/53/98/1049845398.db2.gz IRDZIINYEOOPCE-IYWMVGAKSA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)C[C@@]12CC[NH+]([C@@H]1C[C@H]3CCC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001172074408 1049845403 /nfs/dbraw/zinc/84/54/03/1049845403.db2.gz IRDZIINYEOOPCE-IYWMVGAKSA-N 2 1 346.465 4.303 20 0 EIADMP FC1(F)C[C@@]12CC[NH+]([C@@H]1C[C@H]3CCC[C@@H](C1)[N@@H+]3Cc1ccccc1)C2 ZINC001172074408 1049845406 /nfs/dbraw/zinc/84/54/06/1049845406.db2.gz IRDZIINYEOOPCE-IYWMVGAKSA-N 2 1 346.465 4.303 20 0 EIADMP c1cc2c(o1)CCN([C@@H]1C[C@H]3CCC[C@@H](C1)[N@@H+]3Cc1ccccc1)C2 ZINC001172081318 1049848074 /nfs/dbraw/zinc/84/80/74/1049848074.db2.gz FERKYOBUOFAEEA-WKCHPHFGSA-N 2 1 336.479 4.223 20 0 EIADMP FC1(F)CC(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172063059 1049850387 /nfs/dbraw/zinc/85/03/87/1049850387.db2.gz VWWMJEQYHJNPOU-REPLKXPHSA-N 2 1 334.454 4.207 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)n1C ZINC001172063932 1049851358 /nfs/dbraw/zinc/85/13/58/1049851358.db2.gz FCVXAMZXCIUHEX-MZADTFQBSA-N 2 1 337.511 4.009 20 0 EIADMP c1csc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172068447 1049852555 /nfs/dbraw/zinc/85/25/55/1049852555.db2.gz QUDDMHQPDZYSJR-REPLKXPHSA-N 2 1 326.509 4.423 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(Cc3ccccc3F)CCC1)C2 ZINC001172110604 1049856293 /nfs/dbraw/zinc/85/62/93/1049856293.db2.gz KVFJPFQXNVTHGN-LDLYASANSA-N 2 1 330.491 4.143 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Br)s1 ZINC001172103747 1049857331 /nfs/dbraw/zinc/85/73/31/1049857331.db2.gz XDUHJBGCTDZDSX-ZDEQEGDKSA-N 2 1 343.334 4.177 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H](Cc3ccc(F)cc3)C1)C2 ZINC001172120243 1049858720 /nfs/dbraw/zinc/85/87/20/1049858720.db2.gz BKGHHRHQISALQU-MJUUVYJYSA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H](Cc3ccc(F)cc3)C1)C2 ZINC001172120243 1049858723 /nfs/dbraw/zinc/85/87/23/1049858723.db2.gz BKGHHRHQISALQU-MJUUVYJYSA-N 2 1 330.491 4.096 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H](Cc3ccc(F)cc3)C1)C2 ZINC001172120243 1049858726 /nfs/dbraw/zinc/85/87/26/1049858726.db2.gz BKGHHRHQISALQU-MJUUVYJYSA-N 2 1 330.491 4.096 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H](Cc3ccc(F)cc3)C1)C2 ZINC001172120243 1049858731 /nfs/dbraw/zinc/85/87/31/1049858731.db2.gz BKGHHRHQISALQU-MJUUVYJYSA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(Cc3ccccc3Cl)CC1)C2 ZINC001172110945 1049859110 /nfs/dbraw/zinc/85/91/10/1049859110.db2.gz MDZOVINFCMWIJX-NNZMDNLPSA-N 2 1 332.919 4.268 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C[C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172114355 1049859391 /nfs/dbraw/zinc/85/93/91/1049859391.db2.gz QVDJJZHRLFMOAD-YSTOQKLRSA-N 2 1 332.919 4.439 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)[C@H]2CSc3ccccc3C2)CC1 ZINC001172203527 1049863628 /nfs/dbraw/zinc/86/36/28/1049863628.db2.gz XMQPAJKMAFMGFM-VAMGGRTRSA-N 2 1 344.568 4.466 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001172344324 1049890187 /nfs/dbraw/zinc/89/01/87/1049890187.db2.gz AOXQDIUGAREQQK-LGGPRVQUSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001172344324 1049890189 /nfs/dbraw/zinc/89/01/89/1049890189.db2.gz AOXQDIUGAREQQK-LGGPRVQUSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001172344324 1049890193 /nfs/dbraw/zinc/89/01/93/1049890193.db2.gz AOXQDIUGAREQQK-LGGPRVQUSA-N 2 1 344.543 4.034 20 0 EIADMP CC[C@@H](CC(C)C)[NH+]1CCC2(C[C@@H]([N@@H+](C)Cc3ccco3)CO2)CC1 ZINC001172402922 1049898517 /nfs/dbraw/zinc/89/85/17/1049898517.db2.gz PSRIQKLDUMVNBS-RBUKOAKNSA-N 2 1 348.531 4.160 20 0 EIADMP CC[C@@H](CC(C)C)[NH2+]C1CC[NH+](CCc2ccc(OC)cc2)CC1 ZINC001172394335 1049905428 /nfs/dbraw/zinc/90/54/28/1049905428.db2.gz RLOOQOPFPBOVFQ-IBGZPJMESA-N 2 1 332.532 4.116 20 0 EIADMP CC[C@@H](CC(C)C)[NH2+][C@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1[NH3+] ZINC001172394701 1049905831 /nfs/dbraw/zinc/90/58/31/1049905831.db2.gz YOXYNPCLXXNXMX-QYCGMCSNSA-N 2 1 334.507 4.388 20 0 EIADMP CC(C)COCC[C@@H](C)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001172470655 1049909391 /nfs/dbraw/zinc/90/93/91/1049909391.db2.gz GINSFAYUYXYRML-LJQANCHMSA-N 2 1 332.532 4.082 20 0 EIADMP CC(C)OCC[C@@H](C)[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001172446147 1049914370 /nfs/dbraw/zinc/91/43/70/1049914370.db2.gz ISHMXWZCLOJJIJ-UYAOXDASSA-N 2 1 348.531 4.160 20 0 EIADMP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@@H]1CCC[N@H+]1C ZINC001172568174 1049937870 /nfs/dbraw/zinc/93/78/70/1049937870.db2.gz OXUPDLNJZHBXJM-JSGCOSHPSA-N 2 1 330.850 4.013 20 0 EIADMP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001172568808 1049938259 /nfs/dbraw/zinc/93/82/59/1049938259.db2.gz UEGIPQGODLQJBS-LBPRGKRZSA-N 2 1 342.861 4.156 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2cc(C)ccc2C)OC[C@@H]1C ZINC000246270486 1049943087 /nfs/dbraw/zinc/94/30/87/1049943087.db2.gz MIXYFZLFKMLBDK-GHTZIAJQSA-N 2 1 341.499 4.051 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2cc(C)ccc2C)OC[C@@H]1C ZINC000246270486 1049943097 /nfs/dbraw/zinc/94/30/97/1049943097.db2.gz MIXYFZLFKMLBDK-GHTZIAJQSA-N 2 1 341.499 4.051 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172655266 1049956798 /nfs/dbraw/zinc/95/67/98/1049956798.db2.gz TZUCLZCDMLFRAX-XLIONFOSSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172655266 1049956809 /nfs/dbraw/zinc/95/68/09/1049956809.db2.gz TZUCLZCDMLFRAX-XLIONFOSSA-N 2 1 344.543 4.223 20 0 EIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C1CC(C)(C)OC(C)(C)C1 ZINC001172658886 1049958011 /nfs/dbraw/zinc/95/80/11/1049958011.db2.gz GKZXFLJVAXQIBF-LJQANCHMSA-N 2 1 344.543 4.177 20 0 EIADMP c1ccc(C[NH+]2CCOCC2)c(C[NH2+]C2CCC3(CCCC3)CC2)c1 ZINC001172725182 1049966919 /nfs/dbraw/zinc/96/69/19/1049966919.db2.gz PRAQKAVVUFRNKU-UHFFFAOYSA-N 2 1 342.527 4.111 20 0 EIADMP CC(C)N1CCOC[C@]2(CCC[N@H+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727173 1049967509 /nfs/dbraw/zinc/96/75/09/1049967509.db2.gz UWMJYHYTYAGFGO-JOCHJYFZSA-N 2 1 348.575 4.312 20 0 EIADMP CC(C)[N@@H+]1CCOC[C@]2(CCC[NH+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727173 1049967513 /nfs/dbraw/zinc/96/75/13/1049967513.db2.gz UWMJYHYTYAGFGO-JOCHJYFZSA-N 2 1 348.575 4.312 20 0 EIADMP CC(C)[N@H+]1CCOC[C@]2(CCC[NH+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727173 1049967514 /nfs/dbraw/zinc/96/75/14/1049967514.db2.gz UWMJYHYTYAGFGO-JOCHJYFZSA-N 2 1 348.575 4.312 20 0 EIADMP CC(C)[NH+]1CCOC[C@]2(CCC[N@@H+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727173 1049967519 /nfs/dbraw/zinc/96/75/19/1049967519.db2.gz UWMJYHYTYAGFGO-JOCHJYFZSA-N 2 1 348.575 4.312 20 0 EIADMP CC(C)[NH+]1CCOC[C@]2(CCC[N@H+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727173 1049967522 /nfs/dbraw/zinc/96/75/22/1049967522.db2.gz UWMJYHYTYAGFGO-JOCHJYFZSA-N 2 1 348.575 4.312 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCC[C@H]2n2cccn2)cc1 ZINC000247045262 1050010837 /nfs/dbraw/zinc/01/08/37/1050010837.db2.gz LYAZAMZVNCQRTN-ORYQWCPZSA-N 2 1 349.482 4.212 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000247105372 1050013213 /nfs/dbraw/zinc/01/32/13/1050013213.db2.gz SQZFCIIOPIMXMQ-ZQIUZPCESA-N 2 1 329.513 4.252 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000247105372 1050013222 /nfs/dbraw/zinc/01/32/22/1050013222.db2.gz SQZFCIIOPIMXMQ-ZQIUZPCESA-N 2 1 329.513 4.252 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000247105372 1050013228 /nfs/dbraw/zinc/01/32/28/1050013228.db2.gz SQZFCIIOPIMXMQ-ZQIUZPCESA-N 2 1 329.513 4.252 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)s1 ZINC000247228845 1050017658 /nfs/dbraw/zinc/01/76/58/1050017658.db2.gz YETUNGUXECERKN-RDJZCZTQSA-N 2 1 344.524 4.128 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)s1 ZINC000247228845 1050017668 /nfs/dbraw/zinc/01/76/68/1050017668.db2.gz YETUNGUXECERKN-RDJZCZTQSA-N 2 1 344.524 4.128 20 0 EIADMP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(OC)cc1 ZINC000248399827 1050053470 /nfs/dbraw/zinc/05/34/70/1050053470.db2.gz KIMIAYUJTQNZJD-MDKPJZGXSA-N 2 1 330.516 4.389 20 0 EIADMP FC(F)(F)C1CCC(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000248762409 1050077774 /nfs/dbraw/zinc/07/77/74/1050077774.db2.gz WIUANNIINMIKRO-HDWXEKECSA-N 2 1 344.465 4.304 20 0 EIADMP FC(F)(F)C1CCC(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000248762409 1050077777 /nfs/dbraw/zinc/07/77/77/1050077777.db2.gz WIUANNIINMIKRO-HDWXEKECSA-N 2 1 344.465 4.304 20 0 EIADMP FC(F)(F)C1CCC(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC000248762409 1050077781 /nfs/dbraw/zinc/07/77/81/1050077781.db2.gz WIUANNIINMIKRO-HDWXEKECSA-N 2 1 344.465 4.304 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248894208 1050083232 /nfs/dbraw/zinc/08/32/32/1050083232.db2.gz ZMTOUURPIPFELT-CMKODMSKSA-N 2 1 334.548 4.111 20 0 EIADMP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2ccc(-c3ccccc3)o2)C1 ZINC001177294062 1050177649 /nfs/dbraw/zinc/17/76/49/1050177649.db2.gz CVIISVXVNXEHOJ-ROUUACIJSA-N 2 1 326.484 4.404 20 0 EIADMP Cc1cc(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc2cccnc12 ZINC001177299696 1050180784 /nfs/dbraw/zinc/18/07/84/1050180784.db2.gz ZJVOVDCXQYQILJ-GOSISDBHSA-N 2 1 325.500 4.287 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCCC[C@@H]34)cc2)c1 ZINC001177303101 1050180873 /nfs/dbraw/zinc/18/08/73/1050180873.db2.gz CARGDNOLROFULN-RTWAWAEBSA-N 2 1 340.442 4.334 20 0 EIADMP Fc1cccc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+]4CCCC[C@@H]34)cc2)c1 ZINC001177303101 1050180877 /nfs/dbraw/zinc/18/08/77/1050180877.db2.gz CARGDNOLROFULN-RTWAWAEBSA-N 2 1 340.442 4.334 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C)CC2 ZINC001172843748 1050182080 /nfs/dbraw/zinc/18/20/80/1050182080.db2.gz OKODCFULFVWSGI-BHDDXSALSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C)CC2 ZINC001172843748 1050182088 /nfs/dbraw/zinc/18/20/88/1050182088.db2.gz OKODCFULFVWSGI-BHDDXSALSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([N@@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C)CC2 ZINC001172843748 1050182096 /nfs/dbraw/zinc/18/20/96/1050182096.db2.gz OKODCFULFVWSGI-BHDDXSALSA-N 2 1 326.528 4.191 20 0 EIADMP C[C@H](Cc1c(F)cccc1Cl)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172848089 1050186362 /nfs/dbraw/zinc/18/63/62/1050186362.db2.gz QAXZUNQXGPYOIJ-FVQBIDKESA-N 2 1 338.898 4.392 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H](C)Cc2c(F)cccc2Cl)CC1 ZINC001172851562 1050190811 /nfs/dbraw/zinc/19/08/11/1050190811.db2.gz APWSMVTYBKLFAF-HNNXBMFYSA-N 2 1 340.914 4.462 20 0 EIADMP CO[C@H]1CCC[C@@H]([N@@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172927986 1050238323 /nfs/dbraw/zinc/23/83/23/1050238323.db2.gz IETBPSYETATTOD-NCYKPQTJSA-N 2 1 330.516 4.025 20 0 EIADMP [NH3+][C@@H]1CC[N@@H+](Cc2ccc(Oc3ccc(Cl)cc3)cc2)CC[C@@H]1F ZINC001206187040 1050265819 /nfs/dbraw/zinc/26/58/19/1050265819.db2.gz SPPOBVFIHDKCNA-RBUKOAKNSA-N 2 1 348.849 4.394 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H](Oc3ccc(C)cc3)C2)CC1 ZINC001173112156 1050310948 /nfs/dbraw/zinc/31/09/48/1050310948.db2.gz RGUOUWLDKZGXCI-QETWGEEDSA-N 2 1 344.543 4.491 20 0 EIADMP C[C@H]1CCCC[C@@H]1CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001177860133 1050317925 /nfs/dbraw/zinc/31/79/25/1050317925.db2.gz RMLREGNFDYWCCW-PZJWPPBQSA-N 2 1 328.544 4.500 20 0 EIADMP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c(C)c1 ZINC001177920116 1050329024 /nfs/dbraw/zinc/32/90/24/1050329024.db2.gz QOWRSFDKPXFVTA-PXNSSMCTSA-N 2 1 344.524 4.238 20 0 EIADMP COc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c(C)c1 ZINC001177920116 1050329036 /nfs/dbraw/zinc/32/90/36/1050329036.db2.gz QOWRSFDKPXFVTA-PXNSSMCTSA-N 2 1 344.524 4.238 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(F)cc2F)[C@H]1c1cccs1 ZINC001177920848 1050330339 /nfs/dbraw/zinc/33/03/39/1050330339.db2.gz XGGLHODVPQTFAY-KSSFIOAISA-N 2 1 336.451 4.199 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(F)cc2F)[C@H]1c1cccs1 ZINC001177920848 1050330351 /nfs/dbraw/zinc/33/03/51/1050330351.db2.gz XGGLHODVPQTFAY-KSSFIOAISA-N 2 1 336.451 4.199 20 0 EIADMP CCc1ccc(C[C@@H](C)[NH+]2CCC3(CCn4c(C)c[nH+]c43)CC2)cc1 ZINC001173241198 1050397103 /nfs/dbraw/zinc/39/71/03/1050397103.db2.gz UHEDDJPIYJTKRN-QGZVFWFLSA-N 2 1 337.511 4.122 20 0 EIADMP CC[C@H]1CC[C@H]([NH+]2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)C1 ZINC001173278993 1050408504 /nfs/dbraw/zinc/40/85/04/1050408504.db2.gz NVMAZKALAOKVRT-ICSRJNTNSA-N 2 1 341.543 4.337 20 0 EIADMP [NH3+]C1(c2cccnc2)CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173340122 1050430070 /nfs/dbraw/zinc/43/00/70/1050430070.db2.gz ALFQHZIKJOCJLV-LJQANCHMSA-N 2 1 327.516 4.225 20 0 EIADMP Cc1ccccc1N(C)c1ccc(C[N@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)cc1 ZINC001206200341 1050455488 /nfs/dbraw/zinc/45/54/88/1050455488.db2.gz RDIFAKHMJAFRJT-WOJBJXKFSA-N 2 1 341.474 4.024 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1(C)C ZINC001178430250 1050455540 /nfs/dbraw/zinc/45/55/40/1050455540.db2.gz CUOSDILMSHZBOU-BVOGOJNSSA-N 2 1 344.543 4.221 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1(C)C ZINC001178430250 1050455548 /nfs/dbraw/zinc/45/55/48/1050455548.db2.gz CUOSDILMSHZBOU-BVOGOJNSSA-N 2 1 344.543 4.221 20 0 EIADMP C[C@H]([NH2+]Cc1cc2cc(F)ccc2o1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001178457878 1050473820 /nfs/dbraw/zinc/47/38/20/1050473820.db2.gz FUPRIRFMPMCBMP-LSDHHAIUSA-N 2 1 330.447 4.315 20 0 EIADMP C[C@H]([NH2+]Cc1cc2cc(F)ccc2o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001178457878 1050473830 /nfs/dbraw/zinc/47/38/30/1050473830.db2.gz FUPRIRFMPMCBMP-LSDHHAIUSA-N 2 1 330.447 4.315 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)CCc1ccc(Cl)c(Cl)c1 ZINC001173544205 1050476988 /nfs/dbraw/zinc/47/69/88/1050476988.db2.gz QEDLHRIHHYELCE-LBPRGKRZSA-N 2 1 326.271 4.109 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC001178463441 1050477739 /nfs/dbraw/zinc/47/77/39/1050477739.db2.gz PXZPQQLFEHBJEI-QGZVFWFLSA-N 2 1 326.484 4.203 20 0 EIADMP Cc1c[nH+]c(CC[NH3+])n1[C@H](C)CCc1ccc(Cl)c(Cl)c1 ZINC001173543279 1050477846 /nfs/dbraw/zinc/47/78/46/1050477846.db2.gz LAECLWVIUVVLLR-LLVKDONJSA-N 2 1 326.271 4.193 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001173548489 1050486039 /nfs/dbraw/zinc/48/60/39/1050486039.db2.gz CGMKKNLJRZBNCQ-KBXCAEBGSA-N 2 1 341.326 4.342 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC001173548489 1050486048 /nfs/dbraw/zinc/48/60/48/1050486048.db2.gz CGMKKNLJRZBNCQ-KBXCAEBGSA-N 2 1 341.326 4.342 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001173548489 1050486055 /nfs/dbraw/zinc/48/60/55/1050486055.db2.gz CGMKKNLJRZBNCQ-KBXCAEBGSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+]C2CCC3(CCc4ccccc43)CC2)C1 ZINC001173687804 1050539510 /nfs/dbraw/zinc/53/95/10/1050539510.db2.gz TZKDMTVMDFLNQY-HOHBBMLPSA-N 2 1 326.528 4.135 20 0 EIADMP C[N@@H+](C1CC1)C1CC[NH+](C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173691075 1050543953 /nfs/dbraw/zinc/54/39/53/1050543953.db2.gz FVXXEUKMRIOPSI-UHFFFAOYSA-N 2 1 338.539 4.372 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]CC[C@@H]3CCc4ccccc43)CC2)cc1 ZINC001178831706 1050567941 /nfs/dbraw/zinc/56/79/41/1050567941.db2.gz ZVBYOOIWXDJGHI-QFIPXVFZSA-N 2 1 348.534 4.403 20 0 EIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001179015456 1050610808 /nfs/dbraw/zinc/61/08/08/1050610808.db2.gz APRKCLBNCNZOKC-UXHICEINSA-N 2 1 340.511 4.321 20 0 EIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC001179015456 1050610820 /nfs/dbraw/zinc/61/08/20/1050610820.db2.gz APRKCLBNCNZOKC-UXHICEINSA-N 2 1 340.511 4.321 20 0 EIADMP COC[C@H](CC(C)(C)C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001179034368 1050622746 /nfs/dbraw/zinc/62/27/46/1050622746.db2.gz FCKNKYXZSNDFQU-UXHICEINSA-N 2 1 344.543 4.224 20 0 EIADMP COC[C@H](CC(C)(C)C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001179034368 1050622748 /nfs/dbraw/zinc/62/27/48/1050622748.db2.gz FCKNKYXZSNDFQU-UXHICEINSA-N 2 1 344.543 4.224 20 0 EIADMP CCO[C@@H](C[NH2+]Cc1ccccc1-c1ccc(C)cc1C)C[NH+](C)C ZINC001179559355 1050725582 /nfs/dbraw/zinc/72/55/82/1050725582.db2.gz GOHYIMIKYFHBDS-FQEVSTJZSA-N 2 1 340.511 4.027 20 0 EIADMP Clc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)o1 ZINC001179771853 1050767313 /nfs/dbraw/zinc/76/73/13/1050767313.db2.gz ONNNXMDUSDDZNF-FGTMMUONSA-N 2 1 344.886 4.323 20 0 EIADMP C[N@@H+](Cc1ccc2ccccc2n1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110042 1050786312 /nfs/dbraw/zinc/78/63/12/1050786312.db2.gz WLSXWBSRGODDMN-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[N@H+](Cc1ccc2ccccc2n1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110042 1050786329 /nfs/dbraw/zinc/78/63/29/1050786329.db2.gz WLSXWBSRGODDMN-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2ccccc2n1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076110042 1050786337 /nfs/dbraw/zinc/78/63/37/1050786337.db2.gz WLSXWBSRGODDMN-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1ccc2ccccc2n1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076110042 1050786350 /nfs/dbraw/zinc/78/63/50/1050786350.db2.gz WLSXWBSRGODDMN-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[C@]1(C[N@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCCS1 ZINC001179864192 1050809930 /nfs/dbraw/zinc/80/99/30/1050809930.db2.gz UUAYLZCESMAYMU-RTWAWAEBSA-N 2 1 344.568 4.260 20 0 EIADMP C[C@]1(C[NH+]2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)CCCS1 ZINC001179864192 1050809933 /nfs/dbraw/zinc/80/99/33/1050809933.db2.gz UUAYLZCESMAYMU-RTWAWAEBSA-N 2 1 344.568 4.260 20 0 EIADMP C[C@]1(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CCCS1 ZINC001179864192 1050809937 /nfs/dbraw/zinc/80/99/37/1050809937.db2.gz UUAYLZCESMAYMU-RTWAWAEBSA-N 2 1 344.568 4.260 20 0 EIADMP CC[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1CCC(OC)CC1 ZINC001179945233 1050828001 /nfs/dbraw/zinc/82/80/01/1050828001.db2.gz GFLSUABDPQGTIF-ATKRNPRHSA-N 2 1 344.543 4.036 20 0 EIADMP CC[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC1CCC(OC)CC1 ZINC001179945233 1050828004 /nfs/dbraw/zinc/82/80/04/1050828004.db2.gz GFLSUABDPQGTIF-ATKRNPRHSA-N 2 1 344.543 4.036 20 0 EIADMP CC[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC1CCC(OC)CC1 ZINC001179945233 1050828011 /nfs/dbraw/zinc/82/80/11/1050828011.db2.gz GFLSUABDPQGTIF-ATKRNPRHSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030502 1050860718 /nfs/dbraw/zinc/86/07/18/1050860718.db2.gz NRDOSSHPRXNNBK-UYAOXDASSA-N 2 1 342.527 4.098 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030502 1050860720 /nfs/dbraw/zinc/86/07/20/1050860720.db2.gz NRDOSSHPRXNNBK-UYAOXDASSA-N 2 1 342.527 4.098 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030502 1050860723 /nfs/dbraw/zinc/86/07/23/1050860723.db2.gz NRDOSSHPRXNNBK-UYAOXDASSA-N 2 1 342.527 4.098 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030502 1050860733 /nfs/dbraw/zinc/86/07/33/1050860733.db2.gz NRDOSSHPRXNNBK-UYAOXDASSA-N 2 1 342.527 4.098 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc3ccc(C)cc3[nH]2)CC1 ZINC001180125164 1050892149 /nfs/dbraw/zinc/89/21/49/1050892149.db2.gz TZQGOOFBLIFZMB-UHFFFAOYSA-N 2 1 327.516 4.420 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc3ccc(F)c(F)c3n2)CC1 ZINC001180166428 1050907876 /nfs/dbraw/zinc/90/78/76/1050907876.db2.gz NTJTWTCRFMXZLA-UHFFFAOYSA-N 2 1 347.453 4.065 20 0 EIADMP CC[C@H]1C[N@H+](C[C@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)CCO1 ZINC001180540014 1051029617 /nfs/dbraw/zinc/02/96/17/1051029617.db2.gz FKTXUWFYFRVGHF-UNMCSNQZSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@H]1C[N@@H+](C[C@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)CCO1 ZINC001180540014 1051029632 /nfs/dbraw/zinc/02/96/32/1051029632.db2.gz FKTXUWFYFRVGHF-UNMCSNQZSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@H]1C[NH+](C[C@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)CCO1 ZINC001180540014 1051029646 /nfs/dbraw/zinc/02/96/46/1051029646.db2.gz FKTXUWFYFRVGHF-UNMCSNQZSA-N 2 1 344.543 4.036 20 0 EIADMP CC[C@H]1C[NH+](C[C@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC001180540014 1051029664 /nfs/dbraw/zinc/02/96/64/1051029664.db2.gz FKTXUWFYFRVGHF-UNMCSNQZSA-N 2 1 344.543 4.036 20 0 EIADMP C[N@@H+](CC(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)C1CCCC1 ZINC001180630966 1051054496 /nfs/dbraw/zinc/05/44/96/1051054496.db2.gz UBLXTRMHGGMSRK-UHFFFAOYSA-N 2 1 342.508 4.446 20 0 EIADMP CC(C)(C)CC[C@H](CO)[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001181222400 1051189985 /nfs/dbraw/zinc/18/99/85/1051189985.db2.gz GZUYDSHNDGPZKT-SBHAEUEKSA-N 2 1 344.543 4.131 20 0 EIADMP CC(C)(C)CC[C@H](CO)[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001181222400 1051189990 /nfs/dbraw/zinc/18/99/90/1051189990.db2.gz GZUYDSHNDGPZKT-SBHAEUEKSA-N 2 1 344.543 4.131 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)c(OC)c2)c1 ZINC000153596986 1051202244 /nfs/dbraw/zinc/20/22/44/1051202244.db2.gz YNECNRLQPPUNHT-OAHLLOKOSA-N 2 1 330.447 4.137 20 0 EIADMP CC(C)c1ccc(CC[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001181349097 1051214165 /nfs/dbraw/zinc/21/41/65/1051214165.db2.gz KMVCVSOXXRSHGM-JOCHJYFZSA-N 2 1 336.523 4.464 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2c3ccccc3C[C@@H]2C)cc1F ZINC000153707728 1051217104 /nfs/dbraw/zinc/21/71/04/1051217104.db2.gz POPPWNBPDPTBKU-LHSJRXKWSA-N 2 1 335.426 4.343 20 0 EIADMP CCC(CC)(C[NH2+][C@@H](C)C1CCOCC1)[NH2+][C@H](C)c1ccccc1 ZINC000153896272 1051243292 /nfs/dbraw/zinc/24/32/92/1051243292.db2.gz XXUHAYGVUQGQQE-ZWKOTPCHSA-N 2 1 332.532 4.301 20 0 EIADMP CCCC[N@@H+](CC1(Br)CC1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001174983171 1051304955 /nfs/dbraw/zinc/30/49/55/1051304955.db2.gz FFWUXEFCJZAMLX-UHFFFAOYSA-N 2 1 345.369 4.325 20 0 EIADMP CS[C@@H]1CC[N@@H+](C[C@@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001182063338 1051389591 /nfs/dbraw/zinc/38/95/91/1051389591.db2.gz TXTZABLRTDWYBG-CTNGQTDRSA-N 2 1 346.584 4.362 20 0 EIADMP CS[C@@H]1CC[NH+](C[C@@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC001182063338 1051389596 /nfs/dbraw/zinc/38/95/96/1051389596.db2.gz TXTZABLRTDWYBG-CTNGQTDRSA-N 2 1 346.584 4.362 20 0 EIADMP CS[C@@H]1CC[NH+](C[C@@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001182063338 1051389600 /nfs/dbraw/zinc/38/96/00/1051389600.db2.gz TXTZABLRTDWYBG-CTNGQTDRSA-N 2 1 346.584 4.362 20 0 EIADMP C[C@H](CCc1ccccc1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191233024 1051405501 /nfs/dbraw/zinc/40/55/01/1051405501.db2.gz KEEDDUCXBREVGG-NFBKMPQASA-N 2 1 336.523 4.462 20 0 EIADMP C[C@H](CCc1ccccc1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001191233024 1051405511 /nfs/dbraw/zinc/40/55/11/1051405511.db2.gz KEEDDUCXBREVGG-NFBKMPQASA-N 2 1 336.523 4.462 20 0 EIADMP C[C@H](CCc1ccccc1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001191233024 1051405516 /nfs/dbraw/zinc/40/55/16/1051405516.db2.gz KEEDDUCXBREVGG-NFBKMPQASA-N 2 1 336.523 4.462 20 0 EIADMP CC(C)[C@@H]1CC[N@@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)C1 ZINC001191541332 1051478253 /nfs/dbraw/zinc/47/82/53/1051478253.db2.gz SKFVNYVOLJITTQ-JOCHJYFZSA-N 2 1 328.544 4.309 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2n2cccn2)cc1 ZINC000155980799 1051483225 /nfs/dbraw/zinc/48/32/25/1051483225.db2.gz LYAZAMZVNCQRTN-NDXORKPFSA-N 2 1 349.482 4.212 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCc2cccc(F)c2)CC1 ZINC001191550811 1051486571 /nfs/dbraw/zinc/48/65/71/1051486571.db2.gz MFFWAIPPKWYRLV-GOSISDBHSA-N 2 1 332.507 4.345 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCc2ccccc2F)CC1 ZINC001191550865 1051486942 /nfs/dbraw/zinc/48/69/42/1051486942.db2.gz NOWXUIUICXLKJG-SFHVURJKSA-N 2 1 332.507 4.345 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000774215121 1051516313 /nfs/dbraw/zinc/51/63/13/1051516313.db2.gz VHZWPKWQKMSUPB-ACDBMABISA-N 2 1 338.470 4.419 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000774215121 1051516326 /nfs/dbraw/zinc/51/63/26/1051516326.db2.gz VHZWPKWQKMSUPB-ACDBMABISA-N 2 1 338.470 4.419 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000774376580 1051569746 /nfs/dbraw/zinc/56/97/46/1051569746.db2.gz LBPALXFPRQREFY-LBPRGKRZSA-N 2 1 344.330 4.347 20 0 EIADMP CC(C)[N@@H+](Cc1cccc(CN2CCOCC2)c1)C1CCCCC1 ZINC001191871884 1051574639 /nfs/dbraw/zinc/57/46/39/1051574639.db2.gz ZZFIEDJGCLHKIF-UHFFFAOYSA-N 2 1 330.516 4.062 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000157155447 1051604626 /nfs/dbraw/zinc/60/46/26/1051604626.db2.gz NXUUIZKGTLWBGX-MRXNPFEDSA-N 2 1 329.488 4.500 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000775507540 1051648719 /nfs/dbraw/zinc/64/87/19/1051648719.db2.gz AFCGZGZPAULTTK-MJGOQNOKSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1cccc(F)c1C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000775507540 1051648725 /nfs/dbraw/zinc/64/87/25/1051648725.db2.gz AFCGZGZPAULTTK-MJGOQNOKSA-N 2 1 326.459 4.134 20 0 EIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@@H](C)Cc1ccccc1C(F)(F)F ZINC001182714016 1051681590 /nfs/dbraw/zinc/68/15/90/1051681590.db2.gz KAQYUEWASHVXBD-HNNXBMFYSA-N 2 1 330.438 4.204 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000158109537 1051711437 /nfs/dbraw/zinc/71/14/37/1051711437.db2.gz STNZCQWGZNPLOD-GJZGRUSLSA-N 2 1 348.437 4.434 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158122124 1051715329 /nfs/dbraw/zinc/71/53/29/1051715329.db2.gz ILBNBCXINLRJFN-DZGCQCFKSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000158122124 1051715339 /nfs/dbraw/zinc/71/53/39/1051715339.db2.gz ILBNBCXINLRJFN-DZGCQCFKSA-N 2 1 347.503 4.250 20 0 EIADMP COc1ccccc1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000158142213 1051720634 /nfs/dbraw/zinc/72/06/34/1051720634.db2.gz BJFQOAQJUJBIEY-ROUUACIJSA-N 2 1 338.495 4.355 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CC2(O)CCCCCC2)CC1)CC(C)C ZINC001192489293 1051756089 /nfs/dbraw/zinc/75/60/89/1051756089.db2.gz CTJDYAFFNRTUTL-UHFFFAOYSA-N 2 1 338.580 4.152 20 0 EIADMP Cc1nccn1CCC[N@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000159208321 1051822610 /nfs/dbraw/zinc/82/26/10/1051822610.db2.gz VROMFGHBCSKRLL-CYBMUJFWSA-N 2 1 325.378 4.293 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000159208321 1051822614 /nfs/dbraw/zinc/82/26/14/1051822614.db2.gz VROMFGHBCSKRLL-CYBMUJFWSA-N 2 1 325.378 4.293 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000159208321 1051822617 /nfs/dbraw/zinc/82/26/17/1051822617.db2.gz VROMFGHBCSKRLL-CYBMUJFWSA-N 2 1 325.378 4.293 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(Cl)cc1 ZINC001192910837 1051832155 /nfs/dbraw/zinc/83/21/55/1051832155.db2.gz XQYZOADOENEWSS-UHFFFAOYSA-N 2 1 343.902 4.474 20 0 EIADMP C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H](CC[NH+](C)C)c1cccnc1 ZINC001183919775 1051927895 /nfs/dbraw/zinc/92/78/95/1051927895.db2.gz PKMRJJOYQIAOBX-NQIIRXRSSA-N 2 1 339.527 4.420 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC(C)(C)CO1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001184045758 1051944252 /nfs/dbraw/zinc/94/42/52/1051944252.db2.gz QCTHVMYNINRUCM-JBACZVJFSA-N 2 1 344.543 4.082 20 0 EIADMP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000621768925 1051944496 /nfs/dbraw/zinc/94/44/96/1051944496.db2.gz WRLQDDHEMYHMCH-INDMIFKZSA-N 2 1 334.454 4.065 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1ccccc1OC(F)(F)F ZINC000163507202 1051992809 /nfs/dbraw/zinc/99/28/09/1051992809.db2.gz OEAXKKFSPCLZCO-UHFFFAOYSA-N 2 1 341.377 4.002 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1ccccc1OC(F)(F)F ZINC000163507202 1051992821 /nfs/dbraw/zinc/99/28/21/1051992821.db2.gz OEAXKKFSPCLZCO-UHFFFAOYSA-N 2 1 341.377 4.002 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000164484033 1052030843 /nfs/dbraw/zinc/03/08/43/1052030843.db2.gz JPKZWJHVLANGEH-LJQANCHMSA-N 2 1 328.500 4.287 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@H](C)C1 ZINC000164467630 1052031648 /nfs/dbraw/zinc/03/16/48/1052031648.db2.gz UPSCYLKKUSDFQV-CZUORRHYSA-N 2 1 349.569 4.042 20 0 EIADMP c1ccc(C[NH+]2C[C@@H]3C[N@H+](CCSC4CCCCC4)C[C@@H]3C2)cc1 ZINC001193990276 1052041571 /nfs/dbraw/zinc/04/15/71/1052041571.db2.gz MSZLVFSBGNAZCS-BGYRXZFFSA-N 2 1 344.568 4.116 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3C[NH+](CCSC4CCCCC4)C[C@@H]3C2)cc1 ZINC001193990276 1052041592 /nfs/dbraw/zinc/04/15/92/1052041592.db2.gz MSZLVFSBGNAZCS-BGYRXZFFSA-N 2 1 344.568 4.116 20 0 EIADMP c1ccc(C[N@@H+]2C[C@@H]3C[NH+](CCSC4CCCCC4)C[C@@H]3C2)cc1 ZINC001193990276 1052041603 /nfs/dbraw/zinc/04/16/03/1052041603.db2.gz MSZLVFSBGNAZCS-BGYRXZFFSA-N 2 1 344.568 4.116 20 0 EIADMP Cc1cc(C)c(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c(C)n1 ZINC001194270459 1052123410 /nfs/dbraw/zinc/12/34/10/1052123410.db2.gz XAJMMXKIDCGJKQ-QHCPKHFHSA-N 2 1 349.522 4.105 20 0 EIADMP Cc1cc(C)c(C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c(C)n1 ZINC001194270459 1052123420 /nfs/dbraw/zinc/12/34/20/1052123420.db2.gz XAJMMXKIDCGJKQ-QHCPKHFHSA-N 2 1 349.522 4.105 20 0 EIADMP Cc1cc(C)c(C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)c(C)n1 ZINC001194270459 1052123423 /nfs/dbraw/zinc/12/34/23/1052123423.db2.gz XAJMMXKIDCGJKQ-QHCPKHFHSA-N 2 1 349.522 4.105 20 0 EIADMP Cc1cc(C)c(C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c(C)n1 ZINC001194270459 1052123430 /nfs/dbraw/zinc/12/34/30/1052123430.db2.gz XAJMMXKIDCGJKQ-QHCPKHFHSA-N 2 1 349.522 4.105 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1ccccc1OCC1CC1)C1CCCCC1 ZINC001177065588 1052224173 /nfs/dbraw/zinc/22/41/73/1052224173.db2.gz BMQFXRYSADPWCX-UHFFFAOYSA-N 2 1 330.516 4.220 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1ccccc1OCC1CC1)C1CCCCC1 ZINC001177065588 1052224184 /nfs/dbraw/zinc/22/41/84/1052224184.db2.gz BMQFXRYSADPWCX-UHFFFAOYSA-N 2 1 330.516 4.220 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000379903739 1052565315 /nfs/dbraw/zinc/56/53/15/1052565315.db2.gz IIFFGIZEADSVOW-QWFCFKBJSA-N 2 1 326.484 4.101 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cnc(-c3ccccc3)[nH]2)c1 ZINC000175982154 1052603110 /nfs/dbraw/zinc/60/31/10/1052603110.db2.gz XKKAIGYNUJSVEB-UHFFFAOYSA-N 2 1 348.494 4.207 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2c[nH]c(-c3ccccc3)n2)c1 ZINC000175982154 1052603127 /nfs/dbraw/zinc/60/31/27/1052603127.db2.gz XKKAIGYNUJSVEB-UHFFFAOYSA-N 2 1 348.494 4.207 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2c[nH]c(-c3ccccc3)n2)c1 ZINC000175982154 1052603130 /nfs/dbraw/zinc/60/31/30/1052603130.db2.gz XKKAIGYNUJSVEB-UHFFFAOYSA-N 2 1 348.494 4.207 20 0 EIADMP CCCOc1ccc([C@@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1OC ZINC000623360116 1052632144 /nfs/dbraw/zinc/63/21/44/1052632144.db2.gz VYPOJYINYHAJPS-NVXWUHKLSA-N 2 1 334.504 4.007 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1OC ZINC000623360116 1052632147 /nfs/dbraw/zinc/63/21/47/1052632147.db2.gz VYPOJYINYHAJPS-NVXWUHKLSA-N 2 1 334.504 4.007 20 0 EIADMP CCCCOc1ccc([C@@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1OC ZINC000623362428 1052632924 /nfs/dbraw/zinc/63/29/24/1052632924.db2.gz STJQQECZJOAAQS-SJLPKXTDSA-N 2 1 348.531 4.398 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1OC ZINC000623362428 1052632933 /nfs/dbraw/zinc/63/29/33/1052632933.db2.gz STJQQECZJOAAQS-SJLPKXTDSA-N 2 1 348.531 4.398 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)c(C)c2c1 ZINC000623408062 1052648140 /nfs/dbraw/zinc/64/81/40/1052648140.db2.gz GPCNHOPDADLOEI-HUUCEWRRSA-N 2 1 330.472 4.273 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+][C@@H]3CC[N@@H+](C)C(C)(C)C3)c(C)c2c1 ZINC000623408062 1052648143 /nfs/dbraw/zinc/64/81/43/1052648143.db2.gz GPCNHOPDADLOEI-HUUCEWRRSA-N 2 1 330.472 4.273 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC1(C)C ZINC000623512572 1052667553 /nfs/dbraw/zinc/66/75/53/1052667553.db2.gz NDWUPDWBVIOXQX-DJIMGWMZSA-N 2 1 340.433 4.414 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)ccc1OCCC(C)C ZINC000177901143 1052693502 /nfs/dbraw/zinc/69/35/02/1052693502.db2.gz NSRHRRAVZVMZRL-AOIWGVFYSA-N 2 1 348.531 4.253 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1OCCC(C)C ZINC000177901143 1052693503 /nfs/dbraw/zinc/69/35/03/1052693503.db2.gz NSRHRRAVZVMZRL-AOIWGVFYSA-N 2 1 348.531 4.253 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000178707763 1052711663 /nfs/dbraw/zinc/71/16/63/1052711663.db2.gz RFLTZDHNXCPGFC-CHWSQXEVSA-N 2 1 341.377 4.077 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC[N@H+]1C ZINC000623898297 1052832233 /nfs/dbraw/zinc/83/22/33/1052832233.db2.gz FAOWKUYTOFTHMU-DFHBCGBQSA-N 2 1 331.891 4.271 20 0 EIADMP C[N@H+]1CC[C@@H](Nc2ccc(-c3ncc4n3CCCC4)cc2)CC1(C)C ZINC000623950498 1052841059 /nfs/dbraw/zinc/84/10/59/1052841059.db2.gz DTOZRGOCZMYQFQ-GOSISDBHSA-N 2 1 338.499 4.171 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(F)cc1C(F)(F)F ZINC000623998522 1052850165 /nfs/dbraw/zinc/85/01/65/1052850165.db2.gz VGRQYMPDUIEVFD-LBPRGKRZSA-N 2 1 332.385 4.370 20 0 EIADMP CC[C@H](C)Oc1cc(C[NH2+]CCC[N@@H+]2CCCC[C@H]2C)ccc1OC ZINC000624019691 1052853811 /nfs/dbraw/zinc/85/38/11/1052853811.db2.gz YIUNLZNOUJRHFS-MSOLQXFVSA-N 2 1 348.531 4.227 20 0 EIADMP CC[C@H](C)Oc1cc(C[NH2+]CCC[N@H+]2CCCC[C@H]2C)ccc1OC ZINC000624019691 1052853816 /nfs/dbraw/zinc/85/38/16/1052853816.db2.gz YIUNLZNOUJRHFS-MSOLQXFVSA-N 2 1 348.531 4.227 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000624124052 1052868613 /nfs/dbraw/zinc/86/86/13/1052868613.db2.gz VZJICWSWENQDBP-LJISPDSOSA-N 2 1 326.937 4.215 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]C[C@H](C)Cn3cc[nH+]c3C)oc21 ZINC000181693060 1052892795 /nfs/dbraw/zinc/89/27/95/1052892795.db2.gz UHRAIYOBJFDPCZ-LSDHHAIUSA-N 2 1 341.455 4.323 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000381151228 1053055340 /nfs/dbraw/zinc/05/53/40/1053055340.db2.gz ANTBRZLMBZOJLU-IEBWSBKVSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000381151228 1053055342 /nfs/dbraw/zinc/05/53/42/1053055342.db2.gz ANTBRZLMBZOJLU-IEBWSBKVSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000381151230 1053055796 /nfs/dbraw/zinc/05/57/96/1053055796.db2.gz ANTBRZLMBZOJLU-PKOBYXMFSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000381151230 1053055798 /nfs/dbraw/zinc/05/57/98/1053055798.db2.gz ANTBRZLMBZOJLU-PKOBYXMFSA-N 2 1 341.474 4.174 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000381796051 1053097025 /nfs/dbraw/zinc/09/70/25/1053097025.db2.gz BNLINQCEQLABKV-MTQWCTHYSA-N 2 1 348.481 4.312 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc2ccccc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382169301 1053151448 /nfs/dbraw/zinc/15/14/48/1053151448.db2.gz PKKQCTFSXKLHFD-GCJKJVERSA-N 2 1 345.490 4.235 20 0 EIADMP Cc1c([C@@H](C)NCCC[N@H+]2CCCC[C@@H]2C)cnn1-c1ccccc1 ZINC000764627583 1053238323 /nfs/dbraw/zinc/23/83/23/1053238323.db2.gz JKQFUUUMTAZEOM-ZWKOTPCHSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cnn1-c1ccccc1 ZINC000764627583 1053238343 /nfs/dbraw/zinc/23/83/43/1053238343.db2.gz JKQFUUUMTAZEOM-ZWKOTPCHSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1c([C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cnn1-c1ccccc1 ZINC000764627583 1053238359 /nfs/dbraw/zinc/23/83/59/1053238359.db2.gz JKQFUUUMTAZEOM-ZWKOTPCHSA-N 2 1 340.515 4.096 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000764961012 1053399791 /nfs/dbraw/zinc/39/97/91/1053399791.db2.gz GJEVUWXMXUFTJL-MOPGFXCFSA-N 2 1 332.532 4.118 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1C(F)(F)F ZINC000765140795 1053453679 /nfs/dbraw/zinc/45/36/79/1053453679.db2.gz FMLUGRGDIWVZAG-CYBMUJFWSA-N 2 1 326.406 4.230 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1c(Cl)n[nH]c1C1CC1 ZINC000921514304 1053562280 /nfs/dbraw/zinc/56/22/80/1053562280.db2.gz XYVYOWQUXFJVGS-UHFFFAOYSA-N 2 1 346.906 4.072 20 0 EIADMP c1cc2ccc(C[NH2+]C[C@H]3CCC[N@@H+](Cc4ccccc4)C3)cc2[nH]1 ZINC000386050271 1053574927 /nfs/dbraw/zinc/57/49/27/1053574927.db2.gz BUGQAOJMHWNZCK-HXUWFJFHSA-N 2 1 333.479 4.170 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866241121 1053660316 /nfs/dbraw/zinc/66/03/16/1053660316.db2.gz WPVWLVDNSSWZHI-IRLDBZIGSA-N 2 1 337.511 4.077 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866241121 1053660323 /nfs/dbraw/zinc/66/03/23/1053660323.db2.gz WPVWLVDNSSWZHI-IRLDBZIGSA-N 2 1 337.511 4.077 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000866281404 1053676401 /nfs/dbraw/zinc/67/64/01/1053676401.db2.gz HTYBNRFKIZIFIF-DXIQSLLYSA-N 2 1 337.511 4.045 20 0 EIADMP C[C@H](CCc1cccnc1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000866281404 1053676411 /nfs/dbraw/zinc/67/64/11/1053676411.db2.gz HTYBNRFKIZIFIF-DXIQSLLYSA-N 2 1 337.511 4.045 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866289192 1053679308 /nfs/dbraw/zinc/67/93/08/1053679308.db2.gz FGTUJARCQPWYPK-LBPRGKRZSA-N 2 1 335.879 4.395 20 0 EIADMP CSc1ccccc1[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccccc1 ZINC000866341228 1053695624 /nfs/dbraw/zinc/69/56/24/1053695624.db2.gz KUFFVCWRZONYLU-FQEVSTJZSA-N 2 1 337.492 4.064 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000386441160 1053730102 /nfs/dbraw/zinc/73/01/02/1053730102.db2.gz PULPQTXNCZANRX-KNQAVFIVSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000690007588 1053742169 /nfs/dbraw/zinc/74/21/69/1053742169.db2.gz SPBAGCJURPZFBJ-XLIONFOSSA-N 2 1 328.525 4.181 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C2CCC2)[C@@H]2CCOC2)cc1 ZINC000866512136 1053760880 /nfs/dbraw/zinc/76/08/80/1053760880.db2.gz ZXSBEFWVDQTWPR-NYSBEXSLSA-N 2 1 339.483 4.037 20 0 EIADMP CC(F)(F)C(C)(C)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000866543975 1053777226 /nfs/dbraw/zinc/77/72/26/1053777226.db2.gz CHJZQISPFGRNGJ-NNZMDNLPSA-N 2 1 336.470 4.453 20 0 EIADMP CCCCCCc1ccc(C[N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)s1 ZINC001205796586 1053825712 /nfs/dbraw/zinc/82/57/12/1053825712.db2.gz SGUOBTJAXWTBTL-AWEZNQCLSA-N 2 1 330.488 4.287 20 0 EIADMP CCCCCCc1ccc(C[N@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)s1 ZINC001205796586 1053825716 /nfs/dbraw/zinc/82/57/16/1053825716.db2.gz SGUOBTJAXWTBTL-AWEZNQCLSA-N 2 1 330.488 4.287 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2nccc3c2CCCC3)c1 ZINC000921609290 1053920685 /nfs/dbraw/zinc/92/06/85/1053920685.db2.gz YXOLHUCYXCROHC-UHFFFAOYSA-N 2 1 337.511 4.090 20 0 EIADMP CC(C)[N@@H+](C)Cc1cc(O[C@H]2CC[NH+](C[C@H](C)C(C)(C)C)C2)ccn1 ZINC000856558422 1054085284 /nfs/dbraw/zinc/08/52/84/1054085284.db2.gz IGNGOVBHKKLAIH-PXNSSMCTSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@H]2CC[N@H+](C[C@H](C)C(C)(C)C)C2)ccn1 ZINC000856558422 1054085298 /nfs/dbraw/zinc/08/52/98/1054085298.db2.gz IGNGOVBHKKLAIH-PXNSSMCTSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@H]2CC[N@@H+](C[C@H](C)C(C)(C)C)C2)ccn1 ZINC000856558422 1054085315 /nfs/dbraw/zinc/08/53/15/1054085315.db2.gz IGNGOVBHKKLAIH-PXNSSMCTSA-N 2 1 347.547 4.057 20 0 EIADMP CC[C@@H](CCC(F)(F)F)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000872016708 1054332634 /nfs/dbraw/zinc/33/26/34/1054332634.db2.gz NNTJOSSMNDYVPM-INIZCTEOSA-N 2 1 328.422 4.362 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000872022898 1054337900 /nfs/dbraw/zinc/33/79/00/1054337900.db2.gz MUKXMIWSGNLERX-HXUWFJFHSA-N 2 1 330.516 4.108 20 0 EIADMP CC(C)[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC001199127296 1054348601 /nfs/dbraw/zinc/34/86/01/1054348601.db2.gz WYNNRUSBORCOQN-RBBKRZOGSA-N 2 1 328.544 4.498 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)CC1 ZINC000872036618 1054353251 /nfs/dbraw/zinc/35/32/51/1054353251.db2.gz XRZVVOKYNUKNCY-DUXKGJEZSA-N 2 1 344.543 4.395 20 0 EIADMP C[C@@H](C[NH2+]C[C@H]1CC[N@H+](C2CC2)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001199197846 1054362151 /nfs/dbraw/zinc/36/21/51/1054362151.db2.gz KIQHFATWCUYHLE-IEBWSBKVSA-N 2 1 328.544 4.237 20 0 EIADMP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)C1 ZINC001199265868 1054376714 /nfs/dbraw/zinc/37/67/14/1054376714.db2.gz FANKTOINVGYHLA-STZQEDGTSA-N 2 1 344.543 4.498 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc3ccc(F)c(F)c3n2)C1 ZINC001199344870 1054388805 /nfs/dbraw/zinc/38/88/05/1054388805.db2.gz LSFOQKLXGCJHPL-OAHLLOKOSA-N 2 1 347.453 4.115 20 0 EIADMP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2ccsc2C(F)(F)F)C1 ZINC001199329168 1054393004 /nfs/dbraw/zinc/39/30/04/1054393004.db2.gz OIRUBPTVYDLVEA-STQMWFEESA-N 2 1 334.451 4.225 20 0 EIADMP c1ccc(CCCCCC[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000858460516 1054495033 /nfs/dbraw/zinc/49/50/33/1054495033.db2.gz BBEFUYRMXPJCJU-JOCHJYFZSA-N 2 1 344.543 4.023 20 0 EIADMP Nc1c(Cl)cccc1C[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC001199926861 1054498231 /nfs/dbraw/zinc/49/82/31/1054498231.db2.gz YTPYLPFHZKAJFA-UHFFFAOYSA-N 2 1 335.923 4.057 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(SC(F)F)cc1 ZINC000858490896 1054498596 /nfs/dbraw/zinc/49/85/96/1054498596.db2.gz RUNKDZPYWUVZSI-KGLIPLIRSA-N 2 1 328.472 4.384 20 0 EIADMP CSc1ccc(CN[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC001200880372 1054566051 /nfs/dbraw/zinc/56/60/51/1054566051.db2.gz SIMJNHSDFTZRMG-WBVHZDCISA-N 2 1 330.497 4.144 20 0 EIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000062427059 1054783261 /nfs/dbraw/zinc/78/32/61/1054783261.db2.gz BCJMZLZSGYQDES-HNNXBMFYSA-N 2 1 332.875 4.420 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000062427059 1054783275 /nfs/dbraw/zinc/78/32/75/1054783275.db2.gz BCJMZLZSGYQDES-HNNXBMFYSA-N 2 1 332.875 4.420 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000776166998 1054800701 /nfs/dbraw/zinc/80/07/01/1054800701.db2.gz ILFIWIHCYNKINZ-QGZVFWFLSA-N 2 1 338.467 4.230 20 0 EIADMP CCC(CC)C[NH+]1CCC2(CCC[N@H+]2Cc2c(C)noc2C)CC1 ZINC001201526298 1054843356 /nfs/dbraw/zinc/84/33/56/1054843356.db2.gz WIKSSBWESAFBAM-UHFFFAOYSA-N 2 1 333.520 4.158 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCC2(CCC[N@H+]2Cc2cnn(C)c2)CC1 ZINC001201559546 1054849329 /nfs/dbraw/zinc/84/93/29/1054849329.db2.gz LFXAUYRXHMMPPZ-IBGZPJMESA-N 2 1 346.563 4.067 20 0 EIADMP Clc1csc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)n1 ZINC000876903558 1054980587 /nfs/dbraw/zinc/98/05/87/1054980587.db2.gz XEVZMMLPCYTNAK-UHFFFAOYSA-N 2 1 335.904 4.072 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cccc(Br)c1 ZINC000173441688 1055003136 /nfs/dbraw/zinc/00/31/36/1055003136.db2.gz YOHPXMNOBYVRNM-ZDUSSCGKSA-N 2 1 336.277 4.085 20 0 EIADMP CCCC[N@@H+](C)CC1CCN(Cc2ncc(-c3cccs3)o2)CC1 ZINC000067485656 1055038419 /nfs/dbraw/zinc/03/84/19/1055038419.db2.gz DVIFJBMIVBCOSQ-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2ncc(-c3cccs3)o2)CC1 ZINC000067485656 1055038434 /nfs/dbraw/zinc/03/84/34/1055038434.db2.gz DVIFJBMIVBCOSQ-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ncc(-c3cccs3)o2)CC1 ZINC000067485656 1055038448 /nfs/dbraw/zinc/03/84/48/1055038448.db2.gz DVIFJBMIVBCOSQ-UHFFFAOYSA-N 2 1 347.528 4.347 20 0 EIADMP CC[NH+](CC)[C@H](C)C[NH2+]CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC001202258979 1055102190 /nfs/dbraw/zinc/10/21/90/1055102190.db2.gz LSMOGEWOVMVYOT-MRXNPFEDSA-N 2 1 346.465 4.417 20 0 EIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](CCC(F)(F)F)C[C@H]21 ZINC001202328550 1055142172 /nfs/dbraw/zinc/14/21/72/1055142172.db2.gz HNJRBGOQNWHGLN-NUEKZKHPSA-N 2 1 346.462 4.233 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@H+](CCC(F)(F)F)C[C@H]21 ZINC001202328550 1055142177 /nfs/dbraw/zinc/14/21/77/1055142177.db2.gz HNJRBGOQNWHGLN-NUEKZKHPSA-N 2 1 346.462 4.233 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@@H+](CCC(F)(F)F)C[C@H]21 ZINC001202328550 1055142182 /nfs/dbraw/zinc/14/21/82/1055142182.db2.gz HNJRBGOQNWHGLN-NUEKZKHPSA-N 2 1 346.462 4.233 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CC[C@H]3COCC[C@H]3C2)CC1 ZINC000921750453 1056415360 /nfs/dbraw/zinc/41/53/60/1056415360.db2.gz WPXSOKDLMYLNAG-IWLVTHKOSA-N 2 1 342.527 4.007 20 0 EIADMP COc1ccccc1CCC[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000542886070 1056695721 /nfs/dbraw/zinc/69/57/21/1056695721.db2.gz ONXNAARPNFGPKH-QGZVFWFLSA-N 2 1 349.478 4.473 20 0 EIADMP C[NH+](C)CC[C@H]([NH2+][C@@H]1Cc2cccc(Cl)c2C1)c1ccccc1 ZINC001168684235 1056720671 /nfs/dbraw/zinc/72/06/71/1056720671.db2.gz HPCXNSUFWIYTPN-XLIONFOSSA-N 2 1 328.887 4.090 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000746048244 1059986238 /nfs/dbraw/zinc/98/62/38/1059986238.db2.gz ZIRNYBVCPACIEA-UWJYYQICSA-N 2 1 344.543 4.278 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379638610 1060133266 /nfs/dbraw/zinc/13/32/66/1060133266.db2.gz UQWCRVDEWZETOB-NQIIRXRSSA-N 2 1 338.495 4.146 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379638610 1060133282 /nfs/dbraw/zinc/13/32/82/1060133282.db2.gz UQWCRVDEWZETOB-NQIIRXRSSA-N 2 1 338.495 4.146 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000386483112 1060270639 /nfs/dbraw/zinc/27/06/39/1060270639.db2.gz WLRQDPIDGSNHHW-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(F)F)cc2)[C@H](C)C1 ZINC000746469516 1060373320 /nfs/dbraw/zinc/37/33/20/1060373320.db2.gz COFBAFZSOXPIOW-CZUORRHYSA-N 2 1 328.472 4.163 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(SC(F)F)cc2)[C@H](C)C1 ZINC000746469516 1060373347 /nfs/dbraw/zinc/37/33/47/1060373347.db2.gz COFBAFZSOXPIOW-CZUORRHYSA-N 2 1 328.472 4.163 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(SC(F)F)cc2)[C@H](C)C1 ZINC000746469516 1060373366 /nfs/dbraw/zinc/37/33/66/1060373366.db2.gz COFBAFZSOXPIOW-CZUORRHYSA-N 2 1 328.472 4.163 20 0 EIADMP COc1cc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)ccc1Cl ZINC001168839922 1060449239 /nfs/dbraw/zinc/44/92/39/1060449239.db2.gz ZDINCGDGGGNHDJ-UHFFFAOYSA-N 2 1 332.875 4.042 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCc1cccc(Oc3ccccc3)c1)C2 ZINC001169095665 1060631538 /nfs/dbraw/zinc/63/15/38/1060631538.db2.gz QRTOBSZNGOHMRE-ACDBMABISA-N 2 1 336.479 4.236 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CCCc3c(Br)cccc31)C2 ZINC001169118259 1060647845 /nfs/dbraw/zinc/64/78/45/1060647845.db2.gz GEZJYGDACRZKHT-AHXJXLJNSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](n1cc(C3CC[NH2+]CC3)c3cc(F)ccc31)C2 ZINC001169153608 1060671017 /nfs/dbraw/zinc/67/10/17/1060671017.db2.gz KHGWPUQTKRBMRS-PIIMJCKOSA-N 2 1 341.474 4.045 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+](Cc1ccccc1)C1CCSCC1)C2 ZINC001169153049 1060671114 /nfs/dbraw/zinc/67/11/14/1060671114.db2.gz GHHHZLQGKYZGOJ-ACDBMABISA-N 2 1 330.541 4.009 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+](Cc1ccccc1)C1CCSCC1)C2 ZINC001169153049 1060671117 /nfs/dbraw/zinc/67/11/17/1060671117.db2.gz GHHHZLQGKYZGOJ-ACDBMABISA-N 2 1 330.541 4.009 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+](Cc1ccccc1)C1CCSCC1)C2 ZINC001169153049 1060671122 /nfs/dbraw/zinc/67/11/22/1060671122.db2.gz GHHHZLQGKYZGOJ-ACDBMABISA-N 2 1 330.541 4.009 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+](Cc1ccccc1)C1CCSCC1)C2 ZINC001169153049 1060671128 /nfs/dbraw/zinc/67/11/28/1060671128.db2.gz GHHHZLQGKYZGOJ-ACDBMABISA-N 2 1 330.541 4.009 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2sccc2Oc2ccccc2)CCC[C@@H]1C[NH3+] ZINC001206003736 1060687389 /nfs/dbraw/zinc/68/73/89/1060687389.db2.gz LYSYUHUFUGITRA-HZPDHXFCSA-N 2 1 330.497 4.347 20 0 EIADMP CC[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccc(OC(F)(F)F)cc2)CC1 ZINC001169264704 1060710388 /nfs/dbraw/zinc/71/03/88/1060710388.db2.gz RLVYMNFUIFUQND-KRWDZBQOSA-N 2 1 342.405 4.206 20 0 EIADMP CC[NH+]1CCC([N@H+]2CCC[C@H]2c2ccc(OC(F)(F)F)cc2)CC1 ZINC001169264704 1060710406 /nfs/dbraw/zinc/71/04/06/1060710406.db2.gz RLVYMNFUIFUQND-KRWDZBQOSA-N 2 1 342.405 4.206 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(Br)s1 ZINC000038001941 213186090 /nfs/dbraw/zinc/18/60/90/213186090.db2.gz UWYGIRYRHLRJKZ-GFCCVEGCSA-N 2 1 331.323 4.037 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cn2ccccc2n1 ZINC000571229919 370704168 /nfs/dbraw/zinc/70/41/68/370704168.db2.gz KVUBFMWSBLCLPL-KRWDZBQOSA-N 2 1 336.483 4.027 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2Oc2cccc(F)c2)CC[N@@H+]1C ZINC000532226296 1032106538 /nfs/dbraw/zinc/10/65/38/1032106538.db2.gz WFIQHIDZCUJWOM-MAUKXSAKSA-N 2 1 328.431 4.190 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2Oc2cccc(F)c2)CC[N@H+]1C ZINC000532226296 1032106548 /nfs/dbraw/zinc/10/65/48/1032106548.db2.gz WFIQHIDZCUJWOM-MAUKXSAKSA-N 2 1 328.431 4.190 20 0 EIADMP Cc1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)c(OC(C)(C)C)c1 ZINC000532234660 1032113795 /nfs/dbraw/zinc/11/37/95/1032113795.db2.gz IULLZKGMHBMUFW-UHFFFAOYSA-N 2 1 330.516 4.136 20 0 EIADMP C[C@@H](C[NH3+])[NH2+][C@@H](C)c1ccc(-c2ccccc2Br)s1 ZINC000423359639 1038169160 /nfs/dbraw/zinc/16/91/60/1038169160.db2.gz DQSSFZFKZMEXAJ-QWRGUYRKSA-N 2 1 339.302 4.175 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1ccccc1OC(F)F)C1CCCCC1 ZINC000322086888 1032174102 /nfs/dbraw/zinc/17/41/02/1032174102.db2.gz IVKGOCMWALHAJX-UHFFFAOYSA-N 2 1 326.431 4.032 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1ccccc1OC(F)F)C1CCCCC1 ZINC000322086888 1032174114 /nfs/dbraw/zinc/17/41/14/1032174114.db2.gz IVKGOCMWALHAJX-UHFFFAOYSA-N 2 1 326.431 4.032 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000532802084 1032320692 /nfs/dbraw/zinc/32/06/92/1032320692.db2.gz JFBNDSCQYMFGND-PKOBYXMFSA-N 2 1 328.500 4.145 20 0 EIADMP C[C@H](c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427247 1032486783 /nfs/dbraw/zinc/48/67/83/1032486783.db2.gz FFOPRUKBJWKTEV-WBVHZDCISA-N 2 1 340.433 4.270 20 0 EIADMP C[C@H](c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427247 1032486785 /nfs/dbraw/zinc/48/67/85/1032486785.db2.gz FFOPRUKBJWKTEV-WBVHZDCISA-N 2 1 340.433 4.270 20 0 EIADMP Cc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)s1 ZINC000178625558 1032543062 /nfs/dbraw/zinc/54/30/62/1032543062.db2.gz UVXBAEBYMMZVJX-LLVKDONJSA-N 2 1 344.459 4.244 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512391649 1032633886 /nfs/dbraw/zinc/63/38/86/1032633886.db2.gz OQRMBXGTHIMDQY-APWZRJJASA-N 2 1 342.527 4.143 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512391649 1032633903 /nfs/dbraw/zinc/63/39/03/1032633903.db2.gz OQRMBXGTHIMDQY-APWZRJJASA-N 2 1 342.527 4.143 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000683108326 1018836358 /nfs/dbraw/zinc/83/63/58/1018836358.db2.gz BPQXJIZNJGCTKU-ZCNNSNEGSA-N 2 1 332.557 4.018 20 0 EIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccc(F)cc4)s3)C2)C1 ZINC000430144599 1018844576 /nfs/dbraw/zinc/84/45/76/1018844576.db2.gz CCLDXDNBNLTLPO-IBGZPJMESA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(-c4ccc(F)cc4)s3)C2)C1 ZINC000430144599 1018844579 /nfs/dbraw/zinc/84/45/79/1018844579.db2.gz CCLDXDNBNLTLPO-IBGZPJMESA-N 2 1 330.472 4.082 20 0 EIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(-c4ccc(F)cc4)s3)C2)C1 ZINC000430144599 1018844580 /nfs/dbraw/zinc/84/45/80/1018844580.db2.gz CCLDXDNBNLTLPO-IBGZPJMESA-N 2 1 330.472 4.082 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)c(C)c2c1 ZINC000643545896 1018892838 /nfs/dbraw/zinc/89/28/38/1018892838.db2.gz FDTBVDSAEFNJQP-CABCVRRESA-N 2 1 328.456 4.075 20 0 EIADMP CC(C)C[C@@H]1C[C@H]([NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000274765453 1019410800 /nfs/dbraw/zinc/41/08/00/1019410800.db2.gz LECKHYPHVZWILZ-ZHHKINOHSA-N 2 1 344.543 4.080 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cnc3ccc(C)cc3c2)CC1 ZINC001167078785 1019587326 /nfs/dbraw/zinc/58/73/26/1019587326.db2.gz VSHFMTWHMSKBFW-UHFFFAOYSA-N 2 1 339.527 4.487 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+]2CCC([NH2+]C(C)C)CC2)cc1 ZINC000179835263 1019903575 /nfs/dbraw/zinc/90/35/75/1019903575.db2.gz BSIALUFNIGRRQX-UHFFFAOYSA-N 2 1 338.495 4.325 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000432816805 1032872740 /nfs/dbraw/zinc/87/27/40/1032872740.db2.gz RKDGZEOXJLFNMS-KRWDZBQOSA-N 2 1 332.488 4.470 20 0 EIADMP COc1ccc([C@@H]([NH2+]C[C@@H](C)Cn2cc[nH+]c2C)c2ccccc2)cc1 ZINC000180442137 1020115067 /nfs/dbraw/zinc/11/50/67/1020115067.db2.gz PCHXJTOOBZSSSB-VGSWGCGISA-N 2 1 349.478 4.215 20 0 EIADMP CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547830240 1020775178 /nfs/dbraw/zinc/77/51/78/1020775178.db2.gz KLSCIUISJUWKSL-USXIJHARSA-N 2 1 328.422 4.218 20 0 EIADMP Cc1cnc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c(C)c1 ZINC000655806796 1020977023 /nfs/dbraw/zinc/97/70/23/1020977023.db2.gz FBUWTRCFOGBUBR-DKUWSORSSA-N 2 1 349.522 4.026 20 0 EIADMP CC(=O)Nc1cccc([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000121596662 1021000658 /nfs/dbraw/zinc/00/06/58/1021000658.db2.gz YHKSYBATFPTSFY-INIZCTEOSA-N 2 1 343.515 4.093 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccncc1F ZINC000340475461 1021095383 /nfs/dbraw/zinc/09/53/83/1021095383.db2.gz RQXNUJXCUNCVMM-DLBZAZTESA-N 2 1 341.474 4.446 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1ccncc1F ZINC000340475461 1021095391 /nfs/dbraw/zinc/09/53/91/1021095391.db2.gz RQXNUJXCUNCVMM-DLBZAZTESA-N 2 1 341.474 4.446 20 0 EIADMP Cc1ccncc1[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000683691506 1021099761 /nfs/dbraw/zinc/09/97/61/1021099761.db2.gz YNVFDSFOHIZERQ-AYWYSENESA-N 2 1 335.495 4.236 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc3cnccc3c2)C1 ZINC000683765174 1021379207 /nfs/dbraw/zinc/37/92/07/1021379207.db2.gz FOPYSRJGTKNCJB-HDICACEKSA-N 2 1 325.500 4.083 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2ccc3cnccc3c2)cc1F ZINC000683766867 1021396838 /nfs/dbraw/zinc/39/68/38/1021396838.db2.gz QSZULEJELTZYLH-UHFFFAOYSA-N 2 1 346.409 4.158 20 0 EIADMP CCCO[C@H]1CCC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC001167363523 1021732746 /nfs/dbraw/zinc/73/27/46/1021732746.db2.gz AUTMZCUEXLQQPK-QFIPXVFZSA-N 2 1 344.543 4.454 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000398053766 1022052216 /nfs/dbraw/zinc/05/22/16/1022052216.db2.gz YTONRPZHVFJZJR-FOIQADDNSA-N 2 1 346.877 4.479 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]CC[C@@H]3CCC[N@@H+](C)C3)oc21 ZINC000414199447 1022103346 /nfs/dbraw/zinc/10/33/46/1022103346.db2.gz XBBOVPBWQIZPGU-HOTGVXAUSA-N 2 1 330.472 4.214 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000580579097 1022227863 /nfs/dbraw/zinc/22/78/63/1022227863.db2.gz WXOBWQBZFPIJNY-NEWSRXKRSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000580579097 1022227890 /nfs/dbraw/zinc/22/78/90/1022227890.db2.gz WXOBWQBZFPIJNY-NEWSRXKRSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)C[C@H]2CCC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000580579097 1022227914 /nfs/dbraw/zinc/22/79/14/1022227914.db2.gz WXOBWQBZFPIJNY-NEWSRXKRSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)C[C@H]2CCC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000580579097 1022227943 /nfs/dbraw/zinc/22/79/43/1022227943.db2.gz WXOBWQBZFPIJNY-NEWSRXKRSA-N 2 1 336.470 4.407 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1 ZINC001167424318 1022316906 /nfs/dbraw/zinc/31/69/06/1022316906.db2.gz HDRVFCXYGZVGRE-PKOBYXMFSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424513 1022318971 /nfs/dbraw/zinc/31/89/71/1022318971.db2.gz KUTWADINFHPBPO-GUDVDZBRSA-N 2 1 336.564 4.167 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424513 1022318991 /nfs/dbraw/zinc/31/89/91/1022318991.db2.gz KUTWADINFHPBPO-GUDVDZBRSA-N 2 1 336.564 4.167 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424513 1022319012 /nfs/dbraw/zinc/31/90/12/1022319012.db2.gz KUTWADINFHPBPO-GUDVDZBRSA-N 2 1 336.564 4.167 20 0 EIADMP C[N@@H+](Cc1cc2ccccc2[nH]1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000684023170 1022371663 /nfs/dbraw/zinc/37/16/63/1022371663.db2.gz ULCYRCDVCDMFLT-IBGZPJMESA-N 2 1 333.479 4.122 20 0 EIADMP C[N@H+](Cc1cc2ccccc2[nH]1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000684023170 1022371679 /nfs/dbraw/zinc/37/16/79/1022371679.db2.gz ULCYRCDVCDMFLT-IBGZPJMESA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1cc2ccccc2[nH]1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000684023170 1022371696 /nfs/dbraw/zinc/37/16/96/1022371696.db2.gz ULCYRCDVCDMFLT-IBGZPJMESA-N 2 1 333.479 4.122 20 0 EIADMP C[NH+](Cc1cc2ccccc2[nH]1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000684023170 1022371712 /nfs/dbraw/zinc/37/17/12/1022371712.db2.gz ULCYRCDVCDMFLT-IBGZPJMESA-N 2 1 333.479 4.122 20 0 EIADMP C[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)CC(F)(F)F ZINC000414279001 1022388453 /nfs/dbraw/zinc/38/84/53/1022388453.db2.gz IPGHZFJQVORJMU-NRSFXHEJSA-N 2 1 340.433 4.360 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)[C@H]2CCN(C)C[C@@H]2C)cc1OCC ZINC000580801444 1022509783 /nfs/dbraw/zinc/50/97/83/1022509783.db2.gz JFPYGVJEIBKKAX-HKUYNNGSSA-N 2 1 348.531 4.036 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@@H]2C)cc1OCC ZINC000580801444 1022509800 /nfs/dbraw/zinc/50/98/00/1022509800.db2.gz JFPYGVJEIBKKAX-HKUYNNGSSA-N 2 1 348.531 4.036 20 0 EIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@@H]2C)cc1OCC ZINC000580801444 1022509840 /nfs/dbraw/zinc/50/98/40/1022509840.db2.gz JFPYGVJEIBKKAX-HKUYNNGSSA-N 2 1 348.531 4.036 20 0 EIADMP CC(C)(C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccnc1 ZINC000414324205 1022544194 /nfs/dbraw/zinc/54/41/94/1022544194.db2.gz BCNMWZZGNNLELM-DKUWSORSSA-N 2 1 349.522 4.144 20 0 EIADMP CC[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1nc(C(F)(F)F)cs1 ZINC000925525157 1022552926 /nfs/dbraw/zinc/55/29/26/1022552926.db2.gz ALLDPPBHAMKNTR-MXWKQRLJSA-N 2 1 335.439 4.109 20 0 EIADMP C[C@@H](CCc1ccco1)[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000310846188 1022647029 /nfs/dbraw/zinc/64/70/29/1022647029.db2.gz IKTMIQOSVWWJRU-FPOVZHCZSA-N 2 1 340.511 4.493 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(C(F)(F)F)c(C)c1 ZINC000414358877 1022728577 /nfs/dbraw/zinc/72/85/77/1022728577.db2.gz MUSLLJXQXXAXQC-UHFFFAOYSA-N 2 1 325.378 4.089 20 0 EIADMP c1nc(-c2ccccc2)sc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647542781 1022778145 /nfs/dbraw/zinc/77/81/45/1022778145.db2.gz BSWGVIFTIVTDTG-MSOLQXFVSA-N 2 1 341.524 4.022 20 0 EIADMP c1cc(-c2nc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cs2)cs1 ZINC000647542793 1022779349 /nfs/dbraw/zinc/77/93/49/1022779349.db2.gz BXMMMHGZBCDVMS-CABCVRRESA-N 2 1 347.553 4.083 20 0 EIADMP Clc1cccc2c1SCC[C@@H]2[NH2+]CCC[NH2+]Cc1cccnc1 ZINC000423194257 1022811023 /nfs/dbraw/zinc/81/10/23/1022811023.db2.gz YSEHAZBGTHJFDX-KRWDZBQOSA-N 2 1 347.915 4.041 20 0 EIADMP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000472603063 1022814854 /nfs/dbraw/zinc/81/48/54/1022814854.db2.gz RQKNQBLJVCMXOB-UHFFFAOYSA-N 2 1 344.833 4.002 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000472603063 1022814858 /nfs/dbraw/zinc/81/48/58/1022814858.db2.gz RQKNQBLJVCMXOB-UHFFFAOYSA-N 2 1 344.833 4.002 20 0 EIADMP Fc1ccc2c(c1)[C@H]([N@@H+]1CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C1)CCC2 ZINC000510377657 1022962944 /nfs/dbraw/zinc/96/29/44/1022962944.db2.gz WLKQPGGEKZZSIG-MAODMQOUSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([N@H+]1CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C1)CCC2 ZINC000510377657 1022962962 /nfs/dbraw/zinc/96/29/62/1022962962.db2.gz WLKQPGGEKZZSIG-MAODMQOUSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH+]1CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C1)CCC2 ZINC000510377657 1022962977 /nfs/dbraw/zinc/96/29/77/1022962977.db2.gz WLKQPGGEKZZSIG-MAODMQOUSA-N 2 1 328.475 4.152 20 0 EIADMP Fc1ccc2c(c1)[C@H]([NH+]1CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C1)CCC2 ZINC000510377657 1022962987 /nfs/dbraw/zinc/96/29/87/1022962987.db2.gz WLKQPGGEKZZSIG-MAODMQOUSA-N 2 1 328.475 4.152 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CCC[C@@H]([C@H](C)[NH3+])C3)s2)cc1 ZINC000430556796 1023004990 /nfs/dbraw/zinc/00/49/90/1023004990.db2.gz VKDCODRWJDXUEO-MAUKXSAKSA-N 2 1 343.540 4.493 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000178158706 1023061848 /nfs/dbraw/zinc/06/18/48/1023061848.db2.gz NPHJKQROAITBMN-VLCRHTCISA-N 2 1 334.507 4.423 20 0 EIADMP C[C@@H]([NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310067396 1023098535 /nfs/dbraw/zinc/09/85/35/1023098535.db2.gz BYZLFJGPBUEYET-UTKZUKDTSA-N 2 1 326.459 4.389 20 0 EIADMP C[C@@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000310067396 1023098545 /nfs/dbraw/zinc/09/85/45/1023098545.db2.gz BYZLFJGPBUEYET-UTKZUKDTSA-N 2 1 326.459 4.389 20 0 EIADMP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc3c(n2)CCC3)CC1 ZINC000656525535 1023144246 /nfs/dbraw/zinc/14/42/46/1023144246.db2.gz QJLOUOKYQCPIQX-UHFFFAOYSA-N 2 1 349.522 4.092 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H]2COCc4ccccc42)C3)cc1 ZINC000417364537 1023291490 /nfs/dbraw/zinc/29/14/90/1023291490.db2.gz MXFOBAADCNYXOC-KGSLCBSSSA-N 2 1 348.490 4.043 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H]2COCc4ccccc42)C3)cc1 ZINC000417364537 1023291499 /nfs/dbraw/zinc/29/14/99/1023291499.db2.gz MXFOBAADCNYXOC-KGSLCBSSSA-N 2 1 348.490 4.043 20 0 EIADMP C[C@@H]1CC(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C[C@@H](C)O1 ZINC000581501310 1023309494 /nfs/dbraw/zinc/30/94/94/1023309494.db2.gz QXPKIEPNPLZKIS-JZJXAQOMSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]1CC(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C[C@@H](C)O1 ZINC000581501310 1023309499 /nfs/dbraw/zinc/30/94/99/1023309499.db2.gz QXPKIEPNPLZKIS-JZJXAQOMSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)CC[NH+]1CCC([NH2+][C@H](C)c2ccc(C(F)(F)F)nc2)CC1 ZINC000926836302 1023327283 /nfs/dbraw/zinc/32/72/83/1023327283.db2.gz LVKOMBZECWRXSU-CQSZACIVSA-N 2 1 343.437 4.262 20 0 EIADMP C[C@@H]([NH2+]CCc1nsc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000660255321 1023389149 /nfs/dbraw/zinc/38/91/49/1023389149.db2.gz BAHHSGGXZQOSBJ-CVEARBPZSA-N 2 1 343.540 4.081 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415083348 1023431327 /nfs/dbraw/zinc/43/13/27/1023431327.db2.gz NCWXBOMBWCRSTK-UIAACRFSSA-N 2 1 326.871 4.410 20 0 EIADMP C[C@@H](C[N@@H+](C)C[C@H]1CCC[NH+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078110 1023491181 /nfs/dbraw/zinc/49/11/81/1023491181.db2.gz ZUTLUDNOUHBORZ-GJZGRUSLSA-N 2 1 328.422 4.083 20 0 EIADMP C[C@@H](C[NH+](C)C[C@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078110 1023491191 /nfs/dbraw/zinc/49/11/91/1023491191.db2.gz ZUTLUDNOUHBORZ-GJZGRUSLSA-N 2 1 328.422 4.083 20 0 EIADMP C[C@@H](C[NH+](C)C[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078110 1023491197 /nfs/dbraw/zinc/49/11/97/1023491197.db2.gz ZUTLUDNOUHBORZ-GJZGRUSLSA-N 2 1 328.422 4.083 20 0 EIADMP CCCC[N@@H+](CCCN1CC[NH+](C(C)C)CC1)[C@H](C)c1ccccc1 ZINC000500126505 1023520592 /nfs/dbraw/zinc/52/05/92/1023520592.db2.gz ARRAKNZKPFDWMK-OAQYLSRUSA-N 2 1 345.575 4.266 20 0 EIADMP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)C1 ZINC000684370479 1023544943 /nfs/dbraw/zinc/54/49/43/1023544943.db2.gz VLQINWURUKZIDY-IOMROCGXSA-N 2 1 330.516 4.108 20 0 EIADMP C[C@@H]1OCC[C@H]1[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000549261832 1023583807 /nfs/dbraw/zinc/58/38/07/1023583807.db2.gz PKNWWFYWKOILJI-JFYUTPNLSA-N 2 1 348.918 4.021 20 0 EIADMP Cc1c(NC(=O)C(C)(C)C)cc[nH+]c1NCCC[N@H+]1CCCC[C@H]1C ZINC001167751770 1023626566 /nfs/dbraw/zinc/62/65/66/1023626566.db2.gz OFGKIBIUZUQZLG-OAHLLOKOSA-N 2 1 346.519 4.051 20 0 EIADMP Cc1c(NC(=O)C(C)(C)C)cc[nH+]c1NCCC[N@@H+]1CCCC[C@H]1C ZINC001167751770 1023626569 /nfs/dbraw/zinc/62/65/69/1023626569.db2.gz OFGKIBIUZUQZLG-OAHLLOKOSA-N 2 1 346.519 4.051 20 0 EIADMP CC[NH+](CC)Cc1cc(OC)ccc1NCCC[N@H+]1CCCC[C@@H]1C ZINC001167753920 1023636276 /nfs/dbraw/zinc/63/62/76/1023636276.db2.gz MNUVOSBNUYFTQS-SFHVURJKSA-N 2 1 347.547 4.213 20 0 EIADMP Cc1ccncc1CCC[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000377654961 1023659921 /nfs/dbraw/zinc/65/99/21/1023659921.db2.gz PHRSIGWMYFGXCP-LJQANCHMSA-N 2 1 337.511 4.138 20 0 EIADMP Clc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)C2 ZINC000310086309 1023691091 /nfs/dbraw/zinc/69/10/91/1023691091.db2.gz NRAVHDXYEPVVMP-OAQYLSRUSA-N 2 1 340.898 4.061 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[N@H+](C)C[C@@H]1CCc2[nH+]ccn2C1 ZINC000377699907 1023694609 /nfs/dbraw/zinc/69/46/09/1023694609.db2.gz QVWBJDVLRYCWDP-KGLIPLIRSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[N@@H+](C)C[C@@H]1CCc2[nH+]ccn2C1 ZINC000377699907 1023694615 /nfs/dbraw/zinc/69/46/15/1023694615.db2.gz QVWBJDVLRYCWDP-KGLIPLIRSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[N@H+](C)C[C@H]1CCc2[nH+]ccn2C1 ZINC000377699911 1023695539 /nfs/dbraw/zinc/69/55/39/1023695539.db2.gz QVWBJDVLRYCWDP-ZIAGYGMSSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[N@@H+](C)C[C@H]1CCc2[nH+]ccn2C1 ZINC000377699911 1023695548 /nfs/dbraw/zinc/69/55/48/1023695548.db2.gz QVWBJDVLRYCWDP-ZIAGYGMSSA-N 2 1 337.389 4.157 20 0 EIADMP COCc1cc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)ccc1OC ZINC000157937548 1023712602 /nfs/dbraw/zinc/71/26/02/1023712602.db2.gz HTLGHNLSZZZISO-MSOLQXFVSA-N 2 1 348.531 4.004 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000390625715 1023735845 /nfs/dbraw/zinc/73/58/45/1023735845.db2.gz HXFSLUXDESUTEZ-BDTNDASRSA-N 2 1 349.522 4.022 20 0 EIADMP COc1ccc(F)c(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1 ZINC000549760773 1033158207 /nfs/dbraw/zinc/15/82/07/1033158207.db2.gz BROPSHVLSSPLIX-KUHUBIRLSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(F)c(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000549760773 1033158214 /nfs/dbraw/zinc/15/82/14/1033158214.db2.gz BROPSHVLSSPLIX-KUHUBIRLSA-N 2 1 348.487 4.069 20 0 EIADMP Cc1ncsc1C[NH+]1CC[C@H]2C[N@@H+](CCCC(C)C)C[C@H]2CC1 ZINC001279520796 1023817210 /nfs/dbraw/zinc/81/72/10/1023817210.db2.gz FOCNRQZWBVMYRA-HDICACEKSA-N 2 1 335.561 4.032 20 0 EIADMP Cc1ncsc1C[N@@H+]1CC[C@H]2C[NH+](CCCC(C)C)C[C@H]2CC1 ZINC001279520796 1023817212 /nfs/dbraw/zinc/81/72/12/1023817212.db2.gz FOCNRQZWBVMYRA-HDICACEKSA-N 2 1 335.561 4.032 20 0 EIADMP Cc1ncsc1C[N@H+]1CC[C@H]2C[NH+](CCCC(C)C)C[C@H]2CC1 ZINC001279520796 1023817213 /nfs/dbraw/zinc/81/72/13/1023817213.db2.gz FOCNRQZWBVMYRA-HDICACEKSA-N 2 1 335.561 4.032 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000500426889 1023822445 /nfs/dbraw/zinc/82/24/45/1023822445.db2.gz HEAJOVMDEXPFDW-SBHAEUEKSA-N 2 1 329.532 4.065 20 0 EIADMP CC/C=C\CC[N@@H+]1CCC[C@@]2(CC[NH+](Cc3scnc3C)C2)C1 ZINC001279522491 1023842878 /nfs/dbraw/zinc/84/28/78/1023842878.db2.gz YUVMSDKPBALANN-PHWHVTFISA-N 2 1 333.545 4.096 20 0 EIADMP CC/C=C\CC[N@H+]1CCC[C@@]2(CC[NH+](Cc3scnc3C)C2)C1 ZINC001279522491 1023842882 /nfs/dbraw/zinc/84/28/82/1023842882.db2.gz YUVMSDKPBALANN-PHWHVTFISA-N 2 1 333.545 4.096 20 0 EIADMP CC/C=C\CC[NH+]1CCC[C@@]2(CC[N@H+](Cc3scnc3C)C2)C1 ZINC001279522491 1023842885 /nfs/dbraw/zinc/84/28/85/1023842885.db2.gz YUVMSDKPBALANN-PHWHVTFISA-N 2 1 333.545 4.096 20 0 EIADMP CC/C=C\CC[NH+]1CCC[C@@]2(CC[N@@H+](Cc3scnc3C)C2)C1 ZINC001279522491 1023842889 /nfs/dbraw/zinc/84/28/89/1023842889.db2.gz YUVMSDKPBALANN-PHWHVTFISA-N 2 1 333.545 4.096 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000090419487 1023862875 /nfs/dbraw/zinc/86/28/75/1023862875.db2.gz CCMFRKIOLJHHHY-JYJNAYRXSA-N 2 1 343.540 4.259 20 0 EIADMP CC[C@@H](CC(F)F)C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC000660496225 1023868880 /nfs/dbraw/zinc/86/88/80/1023868880.db2.gz FSTHSQXEIAAZCJ-HOTGVXAUSA-N 2 1 344.515 4.492 20 0 EIADMP CC[C@@H](CC(F)F)C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(C)s2)C1 ZINC000660496225 1023868887 /nfs/dbraw/zinc/86/88/87/1023868887.db2.gz FSTHSQXEIAAZCJ-HOTGVXAUSA-N 2 1 344.515 4.492 20 0 EIADMP CC[C@@H](CC(F)F)C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(C)s2)C1 ZINC000660496225 1023868894 /nfs/dbraw/zinc/86/88/94/1023868894.db2.gz FSTHSQXEIAAZCJ-HOTGVXAUSA-N 2 1 344.515 4.492 20 0 EIADMP CC(C)CCOc1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)cc1 ZINC000510541111 1024010072 /nfs/dbraw/zinc/01/00/72/1024010072.db2.gz ZEXDRIDAKWXHSM-SFHVURJKSA-N 2 1 327.472 4.214 20 0 EIADMP c1ccc(CSCC[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000430768290 1024021549 /nfs/dbraw/zinc/02/15/49/1024021549.db2.gz YODNPWGZJBPNBL-OAQYLSRUSA-N 2 1 340.536 4.032 20 0 EIADMP c1ccc2sc([C@@H]3CCC[N@@H+](CCC[NH+]4CCCCC4)C3)nc2c1 ZINC000548394684 1024187695 /nfs/dbraw/zinc/18/76/95/1024187695.db2.gz DBQZRZCUYRYZQH-QGZVFWFLSA-N 2 1 343.540 4.352 20 0 EIADMP c1ccc2sc([C@@H]3CCC[N@H+](CCC[NH+]4CCCCC4)C3)nc2c1 ZINC000548394684 1024187707 /nfs/dbraw/zinc/18/77/07/1024187707.db2.gz DBQZRZCUYRYZQH-QGZVFWFLSA-N 2 1 343.540 4.352 20 0 EIADMP CC[NH+](CC)CC1CC[NH+](Cc2csc(-c3ccc(C)o3)n2)CC1 ZINC000047978785 1024377566 /nfs/dbraw/zinc/37/75/66/1024377566.db2.gz GFUPGNYMJHDYKQ-UHFFFAOYSA-N 2 1 347.528 4.265 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)CC1 ZINC000510740263 1024382353 /nfs/dbraw/zinc/38/23/53/1024382353.db2.gz YZKMWUZAZYODFB-CQSZACIVSA-N 2 1 328.422 4.100 20 0 EIADMP COc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1OC ZINC000090586755 1024445666 /nfs/dbraw/zinc/44/56/66/1024445666.db2.gz JFAXXFWUQAMPBR-MSOLQXFVSA-N 2 1 348.531 4.031 20 0 EIADMP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000090764496 1024469935 /nfs/dbraw/zinc/46/99/35/1024469935.db2.gz MTGXYVBRGLUJAF-JXXFODFXSA-N 2 1 341.499 4.038 20 0 EIADMP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000090764496 1024469949 /nfs/dbraw/zinc/46/99/49/1024469949.db2.gz MTGXYVBRGLUJAF-JXXFODFXSA-N 2 1 341.499 4.038 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000164662524 1024778532 /nfs/dbraw/zinc/77/85/32/1024778532.db2.gz PUXAXZWFBUXOMJ-GOSISDBHSA-N 2 1 325.456 4.008 20 0 EIADMP COC1CCC(CC[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000548485645 1024838508 /nfs/dbraw/zinc/83/85/08/1024838508.db2.gz ASZZJZHNAJOVFY-KCUKBOBISA-N 2 1 344.543 4.082 20 0 EIADMP Cc1cc(F)ccc1C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000548488850 1024852017 /nfs/dbraw/zinc/85/20/17/1024852017.db2.gz FFYJFESXJUOHQT-UHFFFAOYSA-N 2 1 341.474 4.268 20 0 EIADMP C[C@@H](CC1CCOCC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510954626 1024865091 /nfs/dbraw/zinc/86/50/91/1024865091.db2.gz YIBMAARKOBCDLS-GHTZIAJQSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H](CC1CCOCC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510954626 1024865095 /nfs/dbraw/zinc/86/50/95/1024865095.db2.gz YIBMAARKOBCDLS-GHTZIAJQSA-N 2 1 344.543 4.082 20 0 EIADMP COc1ccc2ccccc2c1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000535811343 1024958337 /nfs/dbraw/zinc/95/83/37/1024958337.db2.gz HXVIBDJWNPPVMM-UHFFFAOYSA-N 2 1 340.511 4.401 20 0 EIADMP c1ccc2sc([C@H]3CCC[N@@H+]3Cc3cccc4c3CC[NH2+]C4)nc2c1 ZINC000662257471 1025005647 /nfs/dbraw/zinc/00/56/47/1025005647.db2.gz CYCAZAZITDKTLI-LJQANCHMSA-N 2 1 349.503 4.279 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(C)o3)CC2)cs1 ZINC000161795021 1025070360 /nfs/dbraw/zinc/07/03/60/1025070360.db2.gz YTISOGPIAKZBFT-OAHLLOKOSA-N 2 1 347.528 4.170 20 0 EIADMP c1c(C2CC[NH2+]CC2)n[nH]c1C1CC[NH+](CC2CCCCCC2)CC1 ZINC000662326920 1025079743 /nfs/dbraw/zinc/07/97/43/1025079743.db2.gz HEQAPHCFDZUPSV-UHFFFAOYSA-N 2 1 344.547 4.027 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc2ccncc2s1 ZINC000663463801 1025391133 /nfs/dbraw/zinc/39/11/33/1025391133.db2.gz BRZVAFHGHKPBGD-GDBMZVCRSA-N 2 1 329.513 4.069 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC000663466309 1025392370 /nfs/dbraw/zinc/39/23/70/1025392370.db2.gz QWSPOIUYEAHDQO-PWRODBHTSA-N 2 1 341.543 4.128 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(C)(C)CC(F)(F)F ZINC000663477438 1025435396 /nfs/dbraw/zinc/43/53/96/1025435396.db2.gz FDWWVHJJBAQBPN-DOTOQJQBSA-N 2 1 342.449 4.465 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(C)(C)CC(F)(F)F ZINC000663477438 1025435404 /nfs/dbraw/zinc/43/54/04/1025435404.db2.gz FDWWVHJJBAQBPN-DOTOQJQBSA-N 2 1 342.449 4.465 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H](Oc2cccc(OC)c2)C1 ZINC001167824726 1025585420 /nfs/dbraw/zinc/58/54/20/1025585420.db2.gz FZDOOYYTJGQFCV-GHTZIAJQSA-N 2 1 348.531 4.049 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](Cc1ccccc1)C1CCOCC1 ZINC001167826581 1025624699 /nfs/dbraw/zinc/62/46/99/1025624699.db2.gz QRYDAXUKWXVBOP-IBGZPJMESA-N 2 1 332.532 4.178 20 0 EIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@H]2C[NH2+]CCC2(F)F)cc1 ZINC000925784396 1025658284 /nfs/dbraw/zinc/65/82/84/1025658284.db2.gz RBRQMJJUQXUZRZ-UKRRQHHQSA-N 2 1 328.472 4.083 20 0 EIADMP Clc1ccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)cc1 ZINC001167966296 1025735304 /nfs/dbraw/zinc/73/53/04/1025735304.db2.gz SUWCTVCSXYZKDU-IHWFROFDSA-N 2 1 344.930 4.367 20 0 EIADMP Fc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c(F)c1F ZINC000657296219 1025744462 /nfs/dbraw/zinc/74/44/62/1025744462.db2.gz FGIIOBCVFFRQJE-UHFFFAOYSA-N 2 1 348.412 4.380 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1c1cccc(C(=O)OC)c1 ZINC001167834084 1025810700 /nfs/dbraw/zinc/81/07/00/1025810700.db2.gz HLINSFRWUMWWCZ-XLIONFOSSA-N 2 1 346.515 4.121 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2cccc(SC(F)(F)F)c2)CC1 ZINC000759965918 1025844620 /nfs/dbraw/zinc/84/46/20/1025844620.db2.gz KAYRWUZBFULUHW-CQSZACIVSA-N 2 1 332.435 4.215 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2cccc(SC(F)(F)F)c2)CC1 ZINC000759965918 1025844624 /nfs/dbraw/zinc/84/46/24/1025844624.db2.gz KAYRWUZBFULUHW-CQSZACIVSA-N 2 1 332.435 4.215 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCO[C@@](C)(c2ccc(C)cc2)C1 ZINC001167837435 1025848037 /nfs/dbraw/zinc/84/80/37/1025848037.db2.gz KBKWXNQPJWVJCD-PZJWPPBQSA-N 2 1 332.532 4.053 20 0 EIADMP COC1(C[C@@H](C)[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)CCC1 ZINC000365344659 1025863630 /nfs/dbraw/zinc/86/36/30/1025863630.db2.gz LKGDFSDPHOTWKT-MSOLQXFVSA-N 2 1 330.516 4.149 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+][C@@H](c2ccccc2)C2CCCC2)CCCO1 ZINC000432404668 1025871257 /nfs/dbraw/zinc/87/12/57/1025871257.db2.gz FFCPEKVNRQKPJN-RXVVDRJESA-N 2 1 330.516 4.008 20 0 EIADMP Cc1ccc2cc(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)[nH]c2c1 ZINC000657309650 1025877177 /nfs/dbraw/zinc/87/71/77/1025877177.db2.gz PTOAILJBDFECRX-UHFFFAOYSA-N 2 1 347.506 4.273 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCc3ccccc3OC2)cc1 ZINC000511052781 1025885167 /nfs/dbraw/zinc/88/51/67/1025885167.db2.gz ZHMBATLGOFEXQA-UZLBHIALSA-N 2 1 347.462 4.225 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1cncc(F)c1 ZINC000157645352 1025895482 /nfs/dbraw/zinc/89/54/82/1025895482.db2.gz KVWHHRTWTGHHJN-IRXDYDNUSA-N 2 1 341.474 4.303 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1cc2ccccc2s1 ZINC000432425676 1025918313 /nfs/dbraw/zinc/91/83/13/1025918313.db2.gz WLPDSZJATQFXPX-CVEARBPZSA-N 2 1 332.513 4.053 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1cc2ccccc2s1 ZINC000432425676 1025918322 /nfs/dbraw/zinc/91/83/22/1025918322.db2.gz WLPDSZJATQFXPX-CVEARBPZSA-N 2 1 332.513 4.053 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cccc(OC(F)F)c1 ZINC000319783454 1025923746 /nfs/dbraw/zinc/92/37/46/1025923746.db2.gz GVGYZWIQMXHPNC-GJZGRUSLSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cccc(OC(F)F)c1 ZINC000319783458 1025925927 /nfs/dbraw/zinc/92/59/27/1025925927.db2.gz GVGYZWIQMXHPNC-LSDHHAIUSA-N 2 1 326.431 4.203 20 0 EIADMP CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C1(C)C ZINC000344066011 1025953613 /nfs/dbraw/zinc/95/36/13/1025953613.db2.gz DPOAMVDZCSKLEK-MDASCCDHSA-N 2 1 327.472 4.035 20 0 EIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000582030421 1025989136 /nfs/dbraw/zinc/98/91/36/1025989136.db2.gz QTQNWZSVAQICBS-AWEZNQCLSA-N 2 1 334.410 4.045 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000582030421 1025989160 /nfs/dbraw/zinc/98/91/60/1025989160.db2.gz QTQNWZSVAQICBS-AWEZNQCLSA-N 2 1 334.410 4.045 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000657319092 1026040942 /nfs/dbraw/zinc/04/09/42/1026040942.db2.gz RQKZGFBSTJQISS-UHFFFAOYSA-N 2 1 341.524 4.083 20 0 EIADMP Fc1ccccc1[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CC1 ZINC001167970942 1026048901 /nfs/dbraw/zinc/04/89/01/1026048901.db2.gz QIICUISWZGSMTC-GKTUAVMOSA-N 2 1 328.475 4.272 20 0 EIADMP Fc1ccccc1[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C1CC1 ZINC001167970942 1026048921 /nfs/dbraw/zinc/04/89/21/1026048921.db2.gz QIICUISWZGSMTC-GKTUAVMOSA-N 2 1 328.475 4.272 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H]2CCCC[C@H]2Cc2ccccc2)s1 ZINC000512135408 1026107845 /nfs/dbraw/zinc/10/78/45/1026107845.db2.gz JVHSKQHOKCTOAY-PKOBYXMFSA-N 2 1 343.540 4.096 20 0 EIADMP Clc1cnccc1[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CC1 ZINC001167974826 1026200168 /nfs/dbraw/zinc/20/01/68/1026200168.db2.gz AXCHOWXZSONJDO-KRXYWNSISA-N 2 1 345.918 4.181 20 0 EIADMP Clc1cnccc1[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C1CC1 ZINC001167974826 1026200176 /nfs/dbraw/zinc/20/01/76/1026200176.db2.gz AXCHOWXZSONJDO-KRXYWNSISA-N 2 1 345.918 4.181 20 0 EIADMP Fc1cccc2c1CCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167975192 1026218254 /nfs/dbraw/zinc/21/82/54/1026218254.db2.gz LGPDVTPZXAAVKM-KVSYXXJQSA-N 2 1 328.475 4.198 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)cc1 ZINC000163536576 1026380212 /nfs/dbraw/zinc/38/02/12/1026380212.db2.gz BNBDCLTVRJTKNW-KRWDZBQOSA-N 2 1 339.483 4.108 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](CCCSc2ccccc2Cl)C1 ZINC001167558783 1026385098 /nfs/dbraw/zinc/38/50/98/1026385098.db2.gz SPVODWVLHROCBW-MRXNPFEDSA-N 2 1 340.964 4.486 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](CCCSc2ccccc2Cl)C1 ZINC001167558783 1026385111 /nfs/dbraw/zinc/38/51/11/1026385111.db2.gz SPVODWVLHROCBW-MRXNPFEDSA-N 2 1 340.964 4.486 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](CCCSc2ccccc2Cl)C1 ZINC001167558783 1026385130 /nfs/dbraw/zinc/38/51/30/1026385130.db2.gz SPVODWVLHROCBW-MRXNPFEDSA-N 2 1 340.964 4.486 20 0 EIADMP c1cc(C[N@H+]2CC[C@H](c3ccncc3)C2)cc(C[NH+]2CCCCC2)c1 ZINC000563363149 1026673424 /nfs/dbraw/zinc/67/34/24/1026673424.db2.gz HNTQOUVNFTVUPY-QFIPXVFZSA-N 2 1 335.495 4.057 20 0 EIADMP CCC[NH+]1CCN(c2ccccc2C[N@@H+](C)[C@H](C)c2ccco2)CC1 ZINC000507212863 1026704877 /nfs/dbraw/zinc/70/48/77/1026704877.db2.gz PCIVDWDOLLKTDB-GOSISDBHSA-N 2 1 341.499 4.005 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148326 1026750549 /nfs/dbraw/zinc/75/05/49/1026750549.db2.gz XOKFCLNKPINFAN-WMZOPIPTSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148326 1026750560 /nfs/dbraw/zinc/75/05/60/1026750560.db2.gz XOKFCLNKPINFAN-WMZOPIPTSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148326 1026750565 /nfs/dbraw/zinc/75/05/65/1026750565.db2.gz XOKFCLNKPINFAN-WMZOPIPTSA-N 2 1 340.433 4.369 20 0 EIADMP [NH3+][C@@H]1C[C@@H](NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000261629372 1026756619 /nfs/dbraw/zinc/75/66/19/1026756619.db2.gz VTYNMQHREBQRHS-UEVCKROQSA-N 2 1 349.522 4.023 20 0 EIADMP CCCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000582560159 1026805442 /nfs/dbraw/zinc/80/54/42/1026805442.db2.gz CWFFKGAYMQIECV-UNMCSNQZSA-N 2 1 338.495 4.401 20 0 EIADMP CCCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000582560158 1026806183 /nfs/dbraw/zinc/80/61/83/1026806183.db2.gz CWFFKGAYMQIECV-RBBKRZOGSA-N 2 1 338.495 4.401 20 0 EIADMP CCc1cccnc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000507520672 1026826844 /nfs/dbraw/zinc/82/68/44/1026826844.db2.gz SFKXZDIRAAPHOB-QGZVFWFLSA-N 2 1 325.500 4.335 20 0 EIADMP CCc1cccnc1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000507522273 1026826900 /nfs/dbraw/zinc/82/69/00/1026826900.db2.gz FUQNXSHRTNKHLU-GOSISDBHSA-N 2 1 337.511 4.481 20 0 EIADMP CCC(CC)(C[NH2+][C@H](C)[C@@H]1CCCOC1)[NH2+][C@@H](C)c1ccccc1 ZINC000507523764 1026828108 /nfs/dbraw/zinc/82/81/08/1026828108.db2.gz DIHGUZFQXRVDBV-WSTZPKSXSA-N 2 1 332.532 4.301 20 0 EIADMP Cc1cccc([C@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)c1C ZINC000152822167 1026852737 /nfs/dbraw/zinc/85/27/37/1026852737.db2.gz YLXATNQPWUJPFK-IBGZPJMESA-N 2 1 337.511 4.056 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)cc1C ZINC000152840654 1026854730 /nfs/dbraw/zinc/85/47/30/1026854730.db2.gz QKFXRRUCCAZQKP-IBGZPJMESA-N 2 1 337.511 4.056 20 0 EIADMP Cc1cc([NH+]2CCCCC2)ccc1-n1cc(CC[NH3+])c2cc(O)ccc21 ZINC001167986932 1026873752 /nfs/dbraw/zinc/87/37/52/1026873752.db2.gz ISGXKLWPVCDMNM-UHFFFAOYSA-N 2 1 349.478 4.136 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2cccc3C)cn1 ZINC000153077840 1026981905 /nfs/dbraw/zinc/98/19/05/1026981905.db2.gz QNLDTEKJPMDGJQ-HNAYVOBHSA-N 2 1 332.451 4.222 20 0 EIADMP COc1ccc([C@@H](C)[C@H](C)[NH2+]CC(C)(C)[NH+]2CCCCC2)cc1OC ZINC000474482839 1027116746 /nfs/dbraw/zinc/11/67/46/1027116746.db2.gz PKNQAJBWAPLRNZ-IRXDYDNUSA-N 2 1 348.531 4.050 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCCN(c3cc[nH+]c4ccsc43)C2)CC1 ZINC000302004583 1027182619 /nfs/dbraw/zinc/18/26/19/1027182619.db2.gz ZIEXMKOEWHLEOJ-INIZCTEOSA-N 2 1 329.513 4.245 20 0 EIADMP c1ccc2c(c1)cccc2CSCC[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000166278065 1027248139 /nfs/dbraw/zinc/24/81/39/1027248139.db2.gz PSHBKXVINBBEIP-WOJBJXKFSA-N 2 1 340.536 4.289 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2(c3ccc(N)cc3)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168038992 1027314477 /nfs/dbraw/zinc/31/44/77/1027314477.db2.gz ASHSFRIRTNOHRH-OPMZPASUSA-N 2 1 349.522 4.289 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccccc1OC(F)(F)F ZINC000520206070 1027315144 /nfs/dbraw/zinc/31/51/44/1027315144.db2.gz VFAQCTYPZOWCSD-HNNXBMFYSA-N 2 1 344.421 4.329 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000342858341 1027328261 /nfs/dbraw/zinc/32/82/61/1027328261.db2.gz DCNLWTCVLLTBQH-QFIPXVFZSA-N 2 1 331.463 4.229 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000342858341 1027328280 /nfs/dbraw/zinc/32/82/80/1027328280.db2.gz DCNLWTCVLLTBQH-QFIPXVFZSA-N 2 1 331.463 4.229 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000342858755 1027330730 /nfs/dbraw/zinc/33/07/30/1027330730.db2.gz BZZDIMNPRDVBIK-HNNXBMFYSA-N 2 1 335.854 4.081 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000342858755 1027330753 /nfs/dbraw/zinc/33/07/53/1027330753.db2.gz BZZDIMNPRDVBIK-HNNXBMFYSA-N 2 1 335.854 4.081 20 0 EIADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c(F)c1 ZINC000520238418 1027341815 /nfs/dbraw/zinc/34/18/15/1027341815.db2.gz IONOEQAHQIQFGQ-DNVCBOLYSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c(F)c1 ZINC000520238418 1027341826 /nfs/dbraw/zinc/34/18/26/1027341826.db2.gz IONOEQAHQIQFGQ-DNVCBOLYSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c(F)c1 ZINC000520238417 1027344484 /nfs/dbraw/zinc/34/44/84/1027344484.db2.gz IONOEQAHQIQFGQ-BEFAXECRSA-N 2 1 348.487 4.069 20 0 EIADMP COc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c(F)c1 ZINC000520238417 1027344495 /nfs/dbraw/zinc/34/44/95/1027344495.db2.gz IONOEQAHQIQFGQ-BEFAXECRSA-N 2 1 348.487 4.069 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccccc2N(C)C)cc1 ZINC000119798425 1027389430 /nfs/dbraw/zinc/38/94/30/1027389430.db2.gz KDLBAUZEZKVZTH-INIZCTEOSA-N 2 1 334.467 4.098 20 0 EIADMP C[C@@H](c1ccccn1)[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000342874066 1027394452 /nfs/dbraw/zinc/39/44/52/1027394452.db2.gz KOAZBINNCWOIMV-IBGZPJMESA-N 2 1 335.495 4.131 20 0 EIADMP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]C1CC[NH+](CCc2ccncc2)CC1 ZINC000153468975 1027478596 /nfs/dbraw/zinc/47/85/96/1027478596.db2.gz PQMQJKDGTHNLGA-PGRDOPGGSA-N 2 1 349.522 4.235 20 0 EIADMP c1cncc([C@@H]2CCC[C@@H]([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)C2)c1 ZINC000657678220 1027525735 /nfs/dbraw/zinc/52/57/35/1027525735.db2.gz NXGDMGVWSFNLIM-MISYRCLQSA-N 2 1 327.516 4.104 20 0 EIADMP c1cncc([C@@H]2CCC[C@@H]([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)C2)c1 ZINC000657678220 1027525755 /nfs/dbraw/zinc/52/57/55/1027525755.db2.gz NXGDMGVWSFNLIM-MISYRCLQSA-N 2 1 327.516 4.104 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1cccc(Cl)c1 ZINC000112517450 1027580236 /nfs/dbraw/zinc/58/02/36/1027580236.db2.gz IJMGHVVWWAHMFC-MRXNPFEDSA-N 2 1 344.886 4.023 20 0 EIADMP COc1ccccc1[C@H](C)[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167994657 1027754692 /nfs/dbraw/zinc/75/46/92/1027754692.db2.gz JFIYWTJBUNKOHB-UBLGTCEWSA-N 2 1 328.500 4.093 20 0 EIADMP COc1ccccc1[C@H](C)[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167994657 1027754714 /nfs/dbraw/zinc/75/47/14/1027754714.db2.gz JFIYWTJBUNKOHB-UBLGTCEWSA-N 2 1 328.500 4.093 20 0 EIADMP COc1ccccc1[C@H](C)[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167994657 1027754737 /nfs/dbraw/zinc/75/47/37/1027754737.db2.gz JFIYWTJBUNKOHB-UBLGTCEWSA-N 2 1 328.500 4.093 20 0 EIADMP COc1ccccc1[C@H](C)[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167994657 1027754754 /nfs/dbraw/zinc/75/47/54/1027754754.db2.gz JFIYWTJBUNKOHB-UBLGTCEWSA-N 2 1 328.500 4.093 20 0 EIADMP Fc1ccc(C2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)cc1 ZINC001167995489 1027772467 /nfs/dbraw/zinc/77/24/67/1027772467.db2.gz HJBCJZQYCCMBHM-CBQGHPETSA-N 2 1 342.502 4.411 20 0 EIADMP Fc1ccccc1C1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001167995641 1027791841 /nfs/dbraw/zinc/79/18/41/1027791841.db2.gz MDXDNCOOAWSMCF-YOFSQIOKSA-N 2 1 342.502 4.411 20 0 EIADMP COc1ccc([C@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995749 1027808266 /nfs/dbraw/zinc/80/82/66/1027808266.db2.gz PORMFVUPRTVAIQ-XQXKNUKBSA-N 2 1 340.511 4.238 20 0 EIADMP COc1ccc([C@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167995749 1027808272 /nfs/dbraw/zinc/80/82/72/1027808272.db2.gz PORMFVUPRTVAIQ-XQXKNUKBSA-N 2 1 340.511 4.238 20 0 EIADMP COc1ccc([C@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167995749 1027808277 /nfs/dbraw/zinc/80/82/77/1027808277.db2.gz PORMFVUPRTVAIQ-XQXKNUKBSA-N 2 1 340.511 4.238 20 0 EIADMP C[NH+](C)CCC1CC[NH+](Cc2nc(C3CCCCC3)cs2)CC1 ZINC000444592343 1027878942 /nfs/dbraw/zinc/87/89/42/1027878942.db2.gz INYFZGJNDASNLL-UHFFFAOYSA-N 2 1 335.561 4.355 20 0 EIADMP CC[N@@H+](C)C[C@H]1CCN(c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000125653942 1027881100 /nfs/dbraw/zinc/88/11/00/1027881100.db2.gz MADRLPMPTDQWFC-CYBMUJFWSA-N 2 1 337.389 4.032 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCOc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000583099511 1028001683 /nfs/dbraw/zinc/00/16/83/1028001683.db2.gz MMBSJDPBDQVICB-ICSRJNTNSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCOc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000583099511 1028001689 /nfs/dbraw/zinc/00/16/89/1028001689.db2.gz MMBSJDPBDQVICB-ICSRJNTNSA-N 2 1 344.886 4.144 20 0 EIADMP CC(C)[C@H]([NH2+]C1CC[NH+](CCc2ccncc2)CC1)c1ccccc1 ZINC000154137088 1028119122 /nfs/dbraw/zinc/11/91/22/1028119122.db2.gz BAMMGJBSQFZALF-QFIPXVFZSA-N 2 1 337.511 4.075 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](CCO)C2CCCCC2)cc1 ZINC000343093749 1028188471 /nfs/dbraw/zinc/18/84/71/1028188471.db2.gz BUCJIVBXPVYPJY-HRAATJIYSA-N 2 1 341.499 4.163 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000280809200 1028195525 /nfs/dbraw/zinc/19/55/25/1028195525.db2.gz LUJDGBMYZOMMTP-SDNTUTLCSA-N 2 1 326.406 4.024 20 0 EIADMP C[C@H]1C[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000280809200 1028195531 /nfs/dbraw/zinc/19/55/31/1028195531.db2.gz LUJDGBMYZOMMTP-SDNTUTLCSA-N 2 1 326.406 4.024 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000443971987 1028216584 /nfs/dbraw/zinc/21/65/84/1028216584.db2.gz LPYFMWKWSQELHG-KRWDZBQOSA-N 2 1 328.431 4.049 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCSC(F)(F)F)CC1 ZINC001167658850 1028225494 /nfs/dbraw/zinc/22/54/94/1028225494.db2.gz LKTRRRWTRJOXHM-AWEZNQCLSA-N 2 1 338.483 4.216 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCCCC[C@H]1c1ccncc1 ZINC000346188943 1028294258 /nfs/dbraw/zinc/29/42/58/1028294258.db2.gz YNRUWINBPZBRQB-NRFANRHFSA-N 2 1 347.466 4.088 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000280995063 1028314544 /nfs/dbraw/zinc/31/45/44/1028314544.db2.gz XETVQZPTLZQUOZ-NFBKMPQASA-N 2 1 349.522 4.077 20 0 EIADMP Cc1nn(-c2ccncc2)cc1CN1CC[C@@H]1c1ccc(Cl)cc1 ZINC000346194046 1028319247 /nfs/dbraw/zinc/31/92/47/1028319247.db2.gz XOKNLNMVBZUERY-LJQANCHMSA-N 2 1 338.842 4.176 20 0 EIADMP Cc1[nH+]ccn1CC[NH+]1CCC(c2ccccc2C(F)(F)F)CC1 ZINC000346320776 1028373330 /nfs/dbraw/zinc/37/33/30/1028373330.db2.gz ZJOKARNDPSMHHE-UHFFFAOYSA-N 2 1 337.389 4.090 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(Br)s2)CC1 ZINC000524156022 1028723942 /nfs/dbraw/zinc/72/39/42/1028723942.db2.gz AGTBKNCAXKGKNS-UHFFFAOYSA-N 2 1 345.350 4.063 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(Br)s2)CC1 ZINC000524156022 1028723964 /nfs/dbraw/zinc/72/39/64/1028723964.db2.gz AGTBKNCAXKGKNS-UHFFFAOYSA-N 2 1 345.350 4.063 20 0 EIADMP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1C/C=C/c1ccc(OCc2ccccc2)cc1 ZINC000583572432 1028882035 /nfs/dbraw/zinc/88/20/35/1028882035.db2.gz IQSCKUZAJHQEPA-CZBMUTHLSA-N 2 1 336.479 4.090 20 0 EIADMP C[C@@H]1C[C@H]([NH3+])CC[N@H+]1C/C=C/c1ccc(OCc2ccccc2)cc1 ZINC000583572432 1028882041 /nfs/dbraw/zinc/88/20/41/1028882041.db2.gz IQSCKUZAJHQEPA-CZBMUTHLSA-N 2 1 336.479 4.090 20 0 EIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC000384105389 1028914094 /nfs/dbraw/zinc/91/40/94/1028914094.db2.gz XDIZUUDMUHNYBD-HXUWFJFHSA-N 2 1 326.459 4.136 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000324421129 1029009148 /nfs/dbraw/zinc/00/91/48/1029009148.db2.gz YMPDRXYVVBKHQT-QGZVFWFLSA-N 2 1 326.484 4.060 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444200770 1029070675 /nfs/dbraw/zinc/07/06/75/1029070675.db2.gz UESXPABGYIFMDL-HZPDHXFCSA-N 2 1 338.442 4.157 20 0 EIADMP C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444200770 1029070689 /nfs/dbraw/zinc/07/06/89/1029070689.db2.gz UESXPABGYIFMDL-HZPDHXFCSA-N 2 1 338.442 4.157 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(Cl)ccc1Cl ZINC000650751895 1029145805 /nfs/dbraw/zinc/14/58/05/1029145805.db2.gz DOCLMPILKGHDKG-SNVBAGLBSA-N 2 1 327.230 4.442 20 0 EIADMP COCCC1CC[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168053294 1029157865 /nfs/dbraw/zinc/15/78/65/1029157865.db2.gz NCYBYCFUKZHZEF-HATOLVCRSA-N 2 1 344.543 4.177 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@H](c3cccnc3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053366 1029159504 /nfs/dbraw/zinc/15/95/04/1029159504.db2.gz OEOPTENAXNXTEN-KNKQGSTJSA-N 2 1 349.522 4.313 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC[N@@H+]1C ZINC000157766004 1029220901 /nfs/dbraw/zinc/22/09/01/1029220901.db2.gz GLUXMVAHZSAEBA-LALPHHSUSA-N 2 1 343.298 4.279 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC[N@H+]1C ZINC000157766004 1029220910 /nfs/dbraw/zinc/22/09/10/1029220910.db2.gz GLUXMVAHZSAEBA-LALPHHSUSA-N 2 1 343.298 4.279 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)CCS2 ZINC000343470729 1029315639 /nfs/dbraw/zinc/31/56/39/1029315639.db2.gz XRXOUYKVQUUTCJ-CRAIPNDOSA-N 2 1 334.529 4.086 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000583957367 1029417643 /nfs/dbraw/zinc/41/76/43/1029417643.db2.gz VVSFGDNBXSTBSZ-DESUXHOBSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000583957367 1029417651 /nfs/dbraw/zinc/41/76/51/1029417651.db2.gz VVSFGDNBXSTBSZ-DESUXHOBSA-N 2 1 338.417 4.325 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000132512711 1029474452 /nfs/dbraw/zinc/47/44/52/1029474452.db2.gz OIONFXABPGHRHZ-XNJGSVPQSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000132512711 1029474465 /nfs/dbraw/zinc/47/44/65/1029474465.db2.gz OIONFXABPGHRHZ-XNJGSVPQSA-N 2 1 347.503 4.391 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2nc(C3CC3)cs2)CC1 ZINC000343548104 1029480366 /nfs/dbraw/zinc/48/03/66/1029480366.db2.gz IEHWXYHCYVRJII-INIZCTEOSA-N 2 1 347.572 4.497 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2nc(C3CC3)cs2)CC1 ZINC000343548104 1029480376 /nfs/dbraw/zinc/48/03/76/1029480376.db2.gz IEHWXYHCYVRJII-INIZCTEOSA-N 2 1 347.572 4.497 20 0 EIADMP C[C@@H](CCc1ccccc1F)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475279233 1029486587 /nfs/dbraw/zinc/48/65/87/1029486587.db2.gz XQWNNSPMYHPYEI-ICSRJNTNSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475272453 1029488809 /nfs/dbraw/zinc/48/88/09/1029488809.db2.gz BSHNFTOZHSPGPY-NQIIRXRSSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000475281263 1029495780 /nfs/dbraw/zinc/49/57/80/1029495780.db2.gz PWKAYWQMCYOSJW-FUHWJXTLSA-N 2 1 336.470 4.312 20 0 EIADMP COC[C@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C1CCCC1 ZINC000446830785 1029596568 /nfs/dbraw/zinc/59/65/68/1029596568.db2.gz WVZNOPDKOOQLOH-UTKZUKDTSA-N 2 1 330.516 4.007 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(C(F)F)nc1 ZINC000657829968 1029641844 /nfs/dbraw/zinc/64/18/44/1029641844.db2.gz KCKQMJSIOXDGTG-CQSZACIVSA-N 2 1 325.447 4.324 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(C(F)F)nc1 ZINC000657829968 1029641849 /nfs/dbraw/zinc/64/18/49/1029641849.db2.gz KCKQMJSIOXDGTG-CQSZACIVSA-N 2 1 325.447 4.324 20 0 EIADMP CC[N@H+](Cc1ccccn1)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168065457 1029649230 /nfs/dbraw/zinc/64/92/30/1029649230.db2.gz WLTSIEWQFYPUNP-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP CC[N@@H+](Cc1ccccn1)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168065457 1029649238 /nfs/dbraw/zinc/64/92/38/1029649238.db2.gz WLTSIEWQFYPUNP-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP CC[NH+](Cc1ccccn1)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168065457 1029649242 /nfs/dbraw/zinc/64/92/42/1029649242.db2.gz WLTSIEWQFYPUNP-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP CC[NH+](Cc1ccccn1)[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168065457 1029649250 /nfs/dbraw/zinc/64/92/50/1029649250.db2.gz WLTSIEWQFYPUNP-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+][C@@H](C)CC3CCCCC3)sc2C1 ZINC000447092117 1029684842 /nfs/dbraw/zinc/68/48/42/1029684842.db2.gz XZAKKPKCYJLZKO-HNNXBMFYSA-N 2 1 335.561 4.358 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+][C@@H](C)CC3CCCCC3)sc2C1 ZINC000447092117 1029684847 /nfs/dbraw/zinc/68/48/47/1029684847.db2.gz XZAKKPKCYJLZKO-HNNXBMFYSA-N 2 1 335.561 4.358 20 0 EIADMP CC(C)OCC[NH+]1CCC(Nc2cc[nH+]c3cc(Cl)ccc23)CC1 ZINC000301477324 1029740494 /nfs/dbraw/zinc/74/04/94/1029740494.db2.gz PDRUQDMZXQVZSE-UHFFFAOYSA-N 2 1 347.890 4.190 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000657840124 1029755528 /nfs/dbraw/zinc/75/55/28/1029755528.db2.gz MGTNJZLLVVUNOZ-KZNAEPCWSA-N 2 1 340.433 4.243 20 0 EIADMP Cc1nc(C)c(C)c(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)n1 ZINC000301697309 1029790762 /nfs/dbraw/zinc/79/07/62/1029790762.db2.gz QMVNBUGGXYRWDK-IHWFROFDSA-N 2 1 336.483 4.009 20 0 EIADMP Cc1nc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(C)c(C)[nH+]1 ZINC000301697309 1029790769 /nfs/dbraw/zinc/79/07/69/1029790769.db2.gz QMVNBUGGXYRWDK-IHWFROFDSA-N 2 1 336.483 4.009 20 0 EIADMP Cc1nc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c(C)c(C)[nH+]1 ZINC000301697309 1029790777 /nfs/dbraw/zinc/79/07/77/1029790777.db2.gz QMVNBUGGXYRWDK-IHWFROFDSA-N 2 1 336.483 4.009 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)c2c1 ZINC000301763400 1029805122 /nfs/dbraw/zinc/80/51/22/1029805122.db2.gz GOJMHBLYQYLONF-IFXJQAMLSA-N 2 1 341.886 4.341 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000301763400 1029805123 /nfs/dbraw/zinc/80/51/23/1029805123.db2.gz GOJMHBLYQYLONF-IFXJQAMLSA-N 2 1 341.886 4.341 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cccc3cnccc32)C1 ZINC000248390307 1029807199 /nfs/dbraw/zinc/80/71/99/1029807199.db2.gz TWOMJUITTMQFJZ-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cccc3cnccc32)C1 ZINC000248390307 1029807203 /nfs/dbraw/zinc/80/72/03/1029807203.db2.gz TWOMJUITTMQFJZ-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cccc3cnccc32)C1 ZINC000248390307 1029807207 /nfs/dbraw/zinc/80/72/07/1029807207.db2.gz TWOMJUITTMQFJZ-OALUTQOASA-N 2 1 337.511 4.321 20 0 EIADMP c1cc2[nH+]ccc(N3CCC(CCC[NH+]4CCCC4)CC3)c2s1 ZINC000301802788 1029811330 /nfs/dbraw/zinc/81/13/30/1029811330.db2.gz UEAXXJHSMJESNQ-UHFFFAOYSA-N 2 1 329.513 4.389 20 0 EIADMP COCc1ccc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000086279079 1029838784 /nfs/dbraw/zinc/83/87/84/1029838784.db2.gz SIYNOSDVGNRFOH-INIZCTEOSA-N 2 1 335.451 4.178 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccc(F)cn1 ZINC000092739288 1029841964 /nfs/dbraw/zinc/84/19/64/1029841964.db2.gz OAQSRBLYJZDOQE-QGZVFWFLSA-N 2 1 341.474 4.303 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](CC2CCCC2)CC1)c1cc2cnccc2o1 ZINC000657859691 1029845025 /nfs/dbraw/zinc/84/50/25/1029845025.db2.gz XCTAEMGEWBGWSX-HNNXBMFYSA-N 2 1 327.472 4.133 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657859387 1029845715 /nfs/dbraw/zinc/84/57/15/1029845715.db2.gz TVMMZSVJNQWDIS-MJGOQNOKSA-N 2 1 349.478 4.391 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657859387 1029845718 /nfs/dbraw/zinc/84/57/18/1029845718.db2.gz TVMMZSVJNQWDIS-MJGOQNOKSA-N 2 1 349.478 4.391 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(C)cc32)cc1 ZINC000090452399 1029860491 /nfs/dbraw/zinc/86/04/91/1029860491.db2.gz CFPQSIQHAQRLES-FOIQADDNSA-N 2 1 333.435 4.273 20 0 EIADMP CC(C)[C@@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1ccccc1 ZINC000091265951 1029882297 /nfs/dbraw/zinc/88/22/97/1029882297.db2.gz PSCQSJPHIZTQGB-JOCHJYFZSA-N 2 1 338.495 4.006 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccc(F)cn1 ZINC000092739316 1029931139 /nfs/dbraw/zinc/93/11/39/1029931139.db2.gz ODVJIFVMFLTMGS-IRXDYDNUSA-N 2 1 341.474 4.303 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccc(F)cn1 ZINC000092739316 1029931163 /nfs/dbraw/zinc/93/11/63/1029931163.db2.gz ODVJIFVMFLTMGS-IRXDYDNUSA-N 2 1 341.474 4.303 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccc(F)cn1 ZINC000092739317 1029932740 /nfs/dbraw/zinc/93/27/40/1029932740.db2.gz WDCJHOQGXMQXRM-SJORKVTESA-N 2 1 341.474 4.446 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1ccc(F)cn1 ZINC000092739317 1029932752 /nfs/dbraw/zinc/93/27/52/1029932752.db2.gz WDCJHOQGXMQXRM-SJORKVTESA-N 2 1 341.474 4.446 20 0 EIADMP CC[N@@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@@H](C)Cc1ccsc1 ZINC000428476862 1029941969 /nfs/dbraw/zinc/94/19/69/1029941969.db2.gz YSVGCEXMWMLHSZ-HNNXBMFYSA-N 2 1 340.496 4.090 20 0 EIADMP Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C3CCC3)C1)CCC2 ZINC000183187756 1029993522 /nfs/dbraw/zinc/99/35/22/1029993522.db2.gz DHDHOQQKKDMISZ-LXZKKBNFSA-N 2 1 333.545 4.072 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1nccs1 ZINC000093397945 1030003099 /nfs/dbraw/zinc/00/30/99/1030003099.db2.gz WXESLDYTSITHHC-CVEARBPZSA-N 2 1 329.513 4.368 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1nccs1 ZINC000093397945 1030003122 /nfs/dbraw/zinc/00/31/22/1030003122.db2.gz WXESLDYTSITHHC-CVEARBPZSA-N 2 1 329.513 4.368 20 0 EIADMP C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(-n2ccnc2)cc1 ZINC000392266006 1030079092 /nfs/dbraw/zinc/07/90/92/1030079092.db2.gz OGZVTOQPYLRTEK-SFHVURJKSA-N 2 1 340.515 4.178 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C(F)F ZINC000657879100 1030163182 /nfs/dbraw/zinc/16/31/82/1030163182.db2.gz JOCHOVNGLQUEEO-CCNLRDMRSA-N 2 1 336.470 4.451 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC[N@H+]1C ZINC000447563831 1030171672 /nfs/dbraw/zinc/17/16/72/1030171672.db2.gz FWOBGAWISJEGNH-KBPBESRZSA-N 2 1 341.326 4.487 20 0 EIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000392263986 1030331587 /nfs/dbraw/zinc/33/15/87/1030331587.db2.gz LDILFFDDEFKRBG-SFHVURJKSA-N 2 1 336.479 4.178 20 0 EIADMP Brc1cccc2c1CC[C@@H]2[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000530371256 1030346110 /nfs/dbraw/zinc/34/61/10/1030346110.db2.gz NVXFUPJHSWHBOF-JRSKDTKFSA-N 2 1 349.316 4.043 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH+](C)[C@@H]1CC[N@@H+](C)C[C@H]1C ZINC000685470050 1030356650 /nfs/dbraw/zinc/35/66/50/1030356650.db2.gz LMSWROTUWHNWPP-QAEGFZEYSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH+](C)[C@@H]1CC[N@H+](C)C[C@H]1C ZINC000685470050 1030356671 /nfs/dbraw/zinc/35/66/71/1030356671.db2.gz LMSWROTUWHNWPP-QAEGFZEYSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[N@@H+](C)[C@@H]1CC[NH+](C)C[C@H]1C ZINC000685470050 1030356691 /nfs/dbraw/zinc/35/66/91/1030356691.db2.gz LMSWROTUWHNWPP-QAEGFZEYSA-N 2 1 340.433 4.381 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[N@H+](C)[C@@H]1CC[NH+](C)C[C@H]1C ZINC000685470050 1030356711 /nfs/dbraw/zinc/35/67/11/1030356711.db2.gz LMSWROTUWHNWPP-QAEGFZEYSA-N 2 1 340.433 4.381 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000708566640 1030385518 /nfs/dbraw/zinc/38/55/18/1030385518.db2.gz RHWMYNHBYYZAGA-UEXGIBASSA-N 2 1 340.486 4.114 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000657893068 1030391394 /nfs/dbraw/zinc/39/13/94/1030391394.db2.gz ZSXOBQNORMPBTL-MBNYWOFBSA-N 2 1 348.840 4.362 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000657893068 1030391411 /nfs/dbraw/zinc/39/14/11/1030391411.db2.gz ZSXOBQNORMPBTL-MBNYWOFBSA-N 2 1 348.840 4.362 20 0 EIADMP CSCC1CCC([NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000708573363 1030399046 /nfs/dbraw/zinc/39/90/46/1030399046.db2.gz IWENDDZNZUOBEN-MAKTXDPSSA-N 2 1 346.584 4.266 20 0 EIADMP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1ccccc1OC(F)F ZINC000321694075 1030517093 /nfs/dbraw/zinc/51/70/93/1030517093.db2.gz YUZDMJCHFQLNFL-LSDHHAIUSA-N 2 1 326.431 4.061 20 0 EIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000470013469 1030549625 /nfs/dbraw/zinc/54/96/25/1030549625.db2.gz OCTKQXGMSMZBHJ-QGZVFWFLSA-N 2 1 326.484 4.058 20 0 EIADMP COc1ccc([C@H]([NH2+]C[C@@H](C)C[NH+]2CCCC2)c2ccccc2)cc1 ZINC000392937746 1030583884 /nfs/dbraw/zinc/58/38/84/1030583884.db2.gz JGRDGRRDEPJOMU-XMSQKQJNSA-N 2 1 338.495 4.106 20 0 EIADMP CCC[NH+]1CCC([N@H+](C)CCOc2cccc3ccccc32)CC1 ZINC000530905273 1030783083 /nfs/dbraw/zinc/78/30/83/1030783083.db2.gz DNWJCSUWGIJQBU-UHFFFAOYSA-N 2 1 326.484 4.025 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)CCOc2cccc3ccccc32)CC1 ZINC000530905273 1030783096 /nfs/dbraw/zinc/78/30/96/1030783096.db2.gz DNWJCSUWGIJQBU-UHFFFAOYSA-N 2 1 326.484 4.025 20 0 EIADMP FC(F)(F)CCC(CCC(F)(F)F)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000658252552 1030924336 /nfs/dbraw/zinc/92/43/36/1030924336.db2.gz DSDANRWIBJEONB-UHFFFAOYSA-N 2 1 346.359 4.256 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319279 1030980058 /nfs/dbraw/zinc/98/00/58/1030980058.db2.gz YWDQQYRVJZEESP-VXKWHMMOSA-N 2 1 349.522 4.425 20 0 EIADMP C[C@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cncs1 ZINC000658319533 1030982040 /nfs/dbraw/zinc/98/20/40/1030982040.db2.gz FYEQZJAXPOQXRL-WMZOPIPTSA-N 2 1 341.524 4.096 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCC[C@@H]3CC)CC2)cs1 ZINC000532505323 1031225769 /nfs/dbraw/zinc/22/57/69/1031225769.db2.gz CUAFRHDOQQLNHE-WMZOPIPTSA-N 2 1 335.561 4.086 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1NCc1ccc(Oc2ccccc2F)c(F)c1 ZINC000532525054 1031241315 /nfs/dbraw/zinc/24/13/15/1031241315.db2.gz QKXOIJYFANKAIF-KBXCAEBGSA-N 2 1 346.421 4.187 20 0 EIADMP C[C@H]1CN(C)CC[C@H]1[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000532525054 1031241332 /nfs/dbraw/zinc/24/13/32/1031241332.db2.gz QKXOIJYFANKAIF-KBXCAEBGSA-N 2 1 346.421 4.187 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000532525054 1031241364 /nfs/dbraw/zinc/24/13/64/1031241364.db2.gz QKXOIJYFANKAIF-KBXCAEBGSA-N 2 1 346.421 4.187 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000532525054 1031241391 /nfs/dbraw/zinc/24/13/91/1031241391.db2.gz QKXOIJYFANKAIF-KBXCAEBGSA-N 2 1 346.421 4.187 20 0 EIADMP COc1cccc2c(C[N@H+]3CCC[C@H]3Cn3ccnc3C)cccc12 ZINC000449037699 1031374739 /nfs/dbraw/zinc/37/47/39/1031374739.db2.gz OFSQHTHBNDTQTR-SFHVURJKSA-N 2 1 335.451 4.018 20 0 EIADMP COc1cccc2c(C[N@@H+]3CCC[C@H]3Cn3cc[nH+]c3C)cccc12 ZINC000449037699 1031374759 /nfs/dbraw/zinc/37/47/59/1031374759.db2.gz OFSQHTHBNDTQTR-SFHVURJKSA-N 2 1 335.451 4.018 20 0 EIADMP COc1cccc2c(C[N@H+]3CCC[C@H]3Cn3cc[nH+]c3C)cccc12 ZINC000449037699 1031374771 /nfs/dbraw/zinc/37/47/71/1031374771.db2.gz OFSQHTHBNDTQTR-SFHVURJKSA-N 2 1 335.451 4.018 20 0 EIADMP CN(C)[C@H](C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1ccco1 ZINC000449059447 1031389464 /nfs/dbraw/zinc/38/94/64/1031389464.db2.gz ATGVVBXCBUHTHZ-GOSISDBHSA-N 2 1 349.563 4.151 20 0 EIADMP C[NH+](C)[C@H](CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1ccco1 ZINC000449059447 1031389481 /nfs/dbraw/zinc/38/94/81/1031389481.db2.gz ATGVVBXCBUHTHZ-GOSISDBHSA-N 2 1 349.563 4.151 20 0 EIADMP C[N@@H+](Cc1cc2ccccc2o1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000532623371 1031427224 /nfs/dbraw/zinc/42/72/24/1031427224.db2.gz WUYICVITDPWGKT-IBGZPJMESA-N 2 1 334.463 4.387 20 0 EIADMP C[N@H+](Cc1cc2ccccc2o1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000532623371 1031427234 /nfs/dbraw/zinc/42/72/34/1031427234.db2.gz WUYICVITDPWGKT-IBGZPJMESA-N 2 1 334.463 4.387 20 0 EIADMP C[NH+](Cc1cc2ccccc2o1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000532623371 1031427242 /nfs/dbraw/zinc/42/72/42/1031427242.db2.gz WUYICVITDPWGKT-IBGZPJMESA-N 2 1 334.463 4.387 20 0 EIADMP C[NH+](Cc1cc2ccccc2o1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000532623371 1031427252 /nfs/dbraw/zinc/42/72/52/1031427252.db2.gz WUYICVITDPWGKT-IBGZPJMESA-N 2 1 334.463 4.387 20 0 EIADMP c1c(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)sc2c1CCCC2 ZINC000525709041 1031450038 /nfs/dbraw/zinc/45/00/38/1031450038.db2.gz GYQHSGBIAZRQKI-UHFFFAOYSA-N 2 1 340.536 4.381 20 0 EIADMP Clc1ccc(C[C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000449090468 1031450384 /nfs/dbraw/zinc/45/03/84/1031450384.db2.gz NDBVQOMVJODAMD-NBYUQASBSA-N 2 1 332.919 4.268 20 0 EIADMP Cc1cccc(CC[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1 ZINC000449159989 1031500590 /nfs/dbraw/zinc/50/05/90/1031500590.db2.gz KEGCUCZBTCJQNU-AZUAARDMSA-N 2 1 328.525 4.272 20 0 EIADMP Cc1cccc(CC[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1 ZINC000449159989 1031500606 /nfs/dbraw/zinc/50/06/06/1031500606.db2.gz KEGCUCZBTCJQNU-AZUAARDMSA-N 2 1 328.525 4.272 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)c1ccc(F)cc1Cl ZINC000531718366 1031518431 /nfs/dbraw/zinc/51/84/31/1031518431.db2.gz WNYOXBZCPLLBQG-PBFPGSCMSA-N 2 1 326.887 4.075 20 0 EIADMP COCC1CCC([NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000449182192 1031518945 /nfs/dbraw/zinc/51/89/45/1031518945.db2.gz BAUUULOVANMAGT-LSJNQWAISA-N 2 1 327.472 4.037 20 0 EIADMP COc1cccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@@H]3C)cc2)c1 ZINC000531725045 1031527398 /nfs/dbraw/zinc/52/73/98/1031527398.db2.gz GKOGDKVOLNRRMT-PNLZDCPESA-N 2 1 338.495 4.181 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)CCCc1cccnc1 ZINC000453064823 1031529592 /nfs/dbraw/zinc/52/95/92/1031529592.db2.gz ULNHPGWHKRLYKE-IBGZPJMESA-N 2 1 339.527 4.423 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000453070100 1031535918 /nfs/dbraw/zinc/53/59/18/1031535918.db2.gz ZVUABRYSDLFWLO-HSALFYBXSA-N 2 1 331.548 4.141 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]C2CCC(OC3CCCC3)CC2)C1 ZINC000449211845 1031538307 /nfs/dbraw/zinc/53/83/07/1031538307.db2.gz SDJPSPAUVODCQJ-JSOIOWGOSA-N 2 1 336.564 4.214 20 0 EIADMP C[NH+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)sc2Cl)c1 ZINC000449220096 1031552545 /nfs/dbraw/zinc/55/25/45/1031552545.db2.gz PDIQOBOEEJORSP-UHFFFAOYSA-N 2 1 329.296 4.406 20 0 EIADMP CCC[C@@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)C1CCCC1 ZINC000449228578 1031558982 /nfs/dbraw/zinc/55/89/82/1031558982.db2.gz ZGHAQTVQJDYEHY-LJQANCHMSA-N 2 1 330.520 4.011 20 0 EIADMP C[C@@H]([NH2+]C1CCC(OC2CCCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000449231327 1031560953 /nfs/dbraw/zinc/56/09/53/1031560953.db2.gz DGUQYEXVNBSWJX-MVLYANGWSA-N 2 1 348.575 4.499 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1ccncn1 ZINC000453075526 1031562671 /nfs/dbraw/zinc/56/26/71/1031562671.db2.gz WGZHCFGAEMXGAA-KRWDZBQOSA-N 2 1 338.499 4.092 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)c1ccncn1 ZINC000453075526 1031562680 /nfs/dbraw/zinc/56/26/80/1031562680.db2.gz WGZHCFGAEMXGAA-KRWDZBQOSA-N 2 1 338.499 4.092 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccncc1 ZINC000453079039 1031566773 /nfs/dbraw/zinc/56/67/73/1031566773.db2.gz CIZXMCBSNUAAKK-LPHOPBHVSA-N 2 1 329.513 4.096 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccncc1 ZINC000453079039 1031566783 /nfs/dbraw/zinc/56/67/83/1031566783.db2.gz CIZXMCBSNUAAKK-LPHOPBHVSA-N 2 1 329.513 4.096 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21)C(F)(F)F ZINC000453207613 1031719792 /nfs/dbraw/zinc/71/97/92/1031719792.db2.gz WMJQURBRAGWVNG-BZZMCLGOSA-N 2 1 340.433 4.218 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2c(F)cccc2F)cc1 ZINC000531954634 1031869081 /nfs/dbraw/zinc/86/90/81/1031869081.db2.gz AEYNKRNSJFPSIL-AWEZNQCLSA-N 2 1 341.405 4.352 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc3ccccc3n2)CC1 ZINC000531956068 1031873668 /nfs/dbraw/zinc/87/36/68/1031873668.db2.gz TZNLVWIMHWCYHP-VGOFRKELSA-N 2 1 337.511 4.368 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CCOCC1 ZINC000531967642 1031889354 /nfs/dbraw/zinc/88/93/54/1031889354.db2.gz RCTVHNLTXPTACP-LAUBAEHRSA-N 2 1 330.516 4.007 20 0 EIADMP CCCCOc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1OC ZINC000453370689 1031914794 /nfs/dbraw/zinc/91/47/94/1031914794.db2.gz VTVKOZWXAGBSGS-UXDRXVOSSA-N 2 1 346.515 4.150 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453373229 1031920078 /nfs/dbraw/zinc/92/00/78/1031920078.db2.gz WZFLZFSHYSQAGU-KVMCETHSSA-N 2 1 328.500 4.239 20 0 EIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(OC(F)(F)F)cc1 ZINC000453375538 1031921689 /nfs/dbraw/zinc/92/16/89/1031921689.db2.gz XWAYQRWTFORZLG-BTFYYFJDSA-N 2 1 342.405 4.251 20 0 EIADMP COc1ccc(C[N@H+](CCCCn2cc[nH+]c2C)[C@@H](C)C2CC2)cc1 ZINC000119417838 1031929229 /nfs/dbraw/zinc/92/92/29/1031929229.db2.gz SFXMTKQZPVBTNG-KRWDZBQOSA-N 2 1 341.499 4.281 20 0 EIADMP COc1ccc(C[N@@H+](CCCCn2cc[nH+]c2C)[C@@H](C)C2CC2)cc1 ZINC000119417838 1031929249 /nfs/dbraw/zinc/92/92/49/1031929249.db2.gz SFXMTKQZPVBTNG-KRWDZBQOSA-N 2 1 341.499 4.281 20 0 EIADMP C[N@@H+](CCCC[NH2+][C@H](c1ccccc1)c1ccc(F)cc1)C1CC1 ZINC000453395881 1031965773 /nfs/dbraw/zinc/96/57/73/1031965773.db2.gz ICQZHQWDPUSDOO-OAQYLSRUSA-N 2 1 326.459 4.379 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)c1ccc(Cl)nc1)[N@H+](C)Cc1ccccc1 ZINC000179135375 1032019149 /nfs/dbraw/zinc/01/91/49/1032019149.db2.gz ZMHJBOORUBZAJO-HZPDHXFCSA-N 2 1 331.891 4.296 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)c1ccc(Cl)nc1)[N@@H+](C)Cc1ccccc1 ZINC000179135375 1032019167 /nfs/dbraw/zinc/01/91/67/1032019167.db2.gz ZMHJBOORUBZAJO-HZPDHXFCSA-N 2 1 331.891 4.296 20 0 EIADMP C[N@H+]1CCC[C@]2(CC[NH+](CCCOc3ccc4ccccc4c3)C2)C1 ZINC000549840768 1033294802 /nfs/dbraw/zinc/29/48/02/1033294802.db2.gz OBDIBUULPMCUHS-QFIPXVFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[NH+]1CCC[C@]2(CC[N@H+](CCCOc3ccc4ccccc4c3)C2)C1 ZINC000549840768 1033294820 /nfs/dbraw/zinc/29/48/20/1033294820.db2.gz OBDIBUULPMCUHS-QFIPXVFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[NH+]1CCC[C@]2(CC[N@@H+](CCCOc3ccc4ccccc4c3)C2)C1 ZINC000549840768 1033294838 /nfs/dbraw/zinc/29/48/38/1033294838.db2.gz OBDIBUULPMCUHS-QFIPXVFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[C@H](c1ccncc1)[NH+](C)CCCCC[N@H+](C)[C@H](C)c1ccncc1 ZINC000246086453 1033344902 /nfs/dbraw/zinc/34/49/02/1033344902.db2.gz IGWFOTRNYNMTDV-RTBURBONSA-N 2 1 340.515 4.333 20 0 EIADMP CO[C@]1(C)CCC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000411662142 1034026601 /nfs/dbraw/zinc/02/66/01/1034026601.db2.gz FDJSJOFDESFNAT-OAQYLSRUSA-N 2 1 330.516 4.064 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2cc[nH+]c3ccccc23)cc1 ZINC000433407212 1034329687 /nfs/dbraw/zinc/32/96/87/1034329687.db2.gz AITXKIOKVWICSA-HNNXBMFYSA-N 2 1 328.419 4.324 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc(OC)cc3)s2)[C@@H](C)C1 ZINC000469080850 1034808473 /nfs/dbraw/zinc/80/84/73/1034808473.db2.gz XWTLAPFCYMXLAL-HNAYVOBHSA-N 2 1 344.524 4.244 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc(F)c(F)c1 ZINC000469100082 1034899108 /nfs/dbraw/zinc/89/91/08/1034899108.db2.gz ZCIOFOBBMOZGDQ-IERDGZPVSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc(F)c(F)c1 ZINC000469100082 1034899109 /nfs/dbraw/zinc/89/91/09/1034899109.db2.gz ZCIOFOBBMOZGDQ-IERDGZPVSA-N 2 1 344.449 4.008 20 0 EIADMP CCc1ncc(C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)s1 ZINC000513500614 1034998851 /nfs/dbraw/zinc/99/88/51/1034998851.db2.gz NMKKXRFBVBDCFV-WMZOPIPTSA-N 2 1 343.540 4.096 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)c1 ZINC000513667990 1035088441 /nfs/dbraw/zinc/08/84/41/1035088441.db2.gz UXDGOHLJMJDWTC-QRVBRYPASA-N 2 1 337.511 4.197 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H](c3cccnc3)C3CCC3)CC2)cc1 ZINC000280187779 1035193770 /nfs/dbraw/zinc/19/37/70/1035193770.db2.gz CVZAJJIRJCTYNE-HSZRJFAPSA-N 2 1 349.522 4.220 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H](c3cccnc3)C3CCC3)CC2)cc1 ZINC000280285662 1035220746 /nfs/dbraw/zinc/22/07/46/1035220746.db2.gz MCYLPFQNONIXSW-JOCHJYFZSA-N 2 1 335.495 4.177 20 0 EIADMP C[NH+](C)[C@H](C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1)C1CCCCC1 ZINC000501427559 1035444093 /nfs/dbraw/zinc/44/40/93/1035444093.db2.gz WOTRMPPSCZGNBT-CEWLAPEOSA-N 2 1 329.532 4.208 20 0 EIADMP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3nc(-c4ccccc4Cl)cs3)C[C@H]21 ZINC000420302384 1035501767 /nfs/dbraw/zinc/50/17/67/1035501767.db2.gz FUOFVAXWRFCLFU-XNRPHZJLSA-N 2 1 347.915 4.023 20 0 EIADMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4ccccc4Cl)cs3)C[C@H]21 ZINC000420302384 1035501774 /nfs/dbraw/zinc/50/17/74/1035501774.db2.gz FUOFVAXWRFCLFU-XNRPHZJLSA-N 2 1 347.915 4.023 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CC[C@H]([C@@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420302791 1035504657 /nfs/dbraw/zinc/50/46/57/1035504657.db2.gz GOBOQPVHVMSESW-ZLDLUXBVSA-N 2 1 333.863 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@H]([C@@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420302791 1035504675 /nfs/dbraw/zinc/50/46/75/1035504675.db2.gz GOBOQPVHVMSESW-ZLDLUXBVSA-N 2 1 333.863 4.034 20 0 EIADMP c1ccc(C[N@H+](Cc2cccc3ccccc32)[C@H]2CCC[NH2+]CC2)nc1 ZINC000420307502 1035504827 /nfs/dbraw/zinc/50/48/27/1035504827.db2.gz ISGKJUYZYGATNQ-QFIPXVFZSA-N 2 1 345.490 4.379 20 0 EIADMP c1ccc(C[N@@H+](Cc2cccc3ccccc32)[C@H]2CCC[NH2+]CC2)nc1 ZINC000420307502 1035504841 /nfs/dbraw/zinc/50/48/41/1035504841.db2.gz ISGKJUYZYGATNQ-QFIPXVFZSA-N 2 1 345.490 4.379 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315681 1035509773 /nfs/dbraw/zinc/50/97/73/1035509773.db2.gz XEPDGSZYZDPIMX-GUDXXQAFSA-N 2 1 345.874 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315681 1035509781 /nfs/dbraw/zinc/50/97/81/1035509781.db2.gz XEPDGSZYZDPIMX-GUDXXQAFSA-N 2 1 345.874 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CCC[C@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420319115 1035515400 /nfs/dbraw/zinc/51/54/00/1035515400.db2.gz XDBOUXCEDPHRDM-LSDHHAIUSA-N 2 1 347.890 4.425 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420327448 1035532466 /nfs/dbraw/zinc/53/24/66/1035532466.db2.gz LDPLGFBKDPYTHZ-FVQBIDKESA-N 2 1 326.406 4.088 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1cnn(C2CCC2)c1 ZINC000924856476 1035661002 /nfs/dbraw/zinc/66/10/02/1035661002.db2.gz OFYFYSUCTITLDV-QGZVFWFLSA-N 2 1 344.547 4.303 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000568930873 1035851482 /nfs/dbraw/zinc/85/14/82/1035851482.db2.gz PRSYYIDLNZSYOX-JXFKEZNVSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2F)CC[N@H+]1Cc1ccccc1 ZINC000568930873 1035851483 /nfs/dbraw/zinc/85/14/83/1035851483.db2.gz PRSYYIDLNZSYOX-JXFKEZNVSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccc(F)cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000568930875 1035852163 /nfs/dbraw/zinc/85/21/63/1035852163.db2.gz PRSYYIDLNZSYOX-OXQOHEQNSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CCc2ccc(F)cc2F)CC[N@H+]1Cc1ccccc1 ZINC000568930875 1035852167 /nfs/dbraw/zinc/85/21/67/1035852167.db2.gz PRSYYIDLNZSYOX-OXQOHEQNSA-N 2 1 344.449 4.150 20 0 EIADMP CC(C)[NH2+]CCCC[C@H]([NH3+])c1nc(-c2ccc3ccccc3c2)no1 ZINC001212144992 1035889143 /nfs/dbraw/zinc/88/91/43/1035889143.db2.gz IRPAOBFVNJWZQE-SFHVURJKSA-N 2 1 338.455 4.058 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)oc1C ZINC000502476728 1036255843 /nfs/dbraw/zinc/25/58/43/1036255843.db2.gz YRGTYGGBRPCHRW-ABSDTBQOSA-N 2 1 326.484 4.458 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000502476728 1036255856 /nfs/dbraw/zinc/25/58/56/1036255856.db2.gz YRGTYGGBRPCHRW-ABSDTBQOSA-N 2 1 326.484 4.458 20 0 EIADMP c1ncc(-c2ccc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)cc2)o1 ZINC000906520646 1036314923 /nfs/dbraw/zinc/31/49/23/1036314923.db2.gz SMOLFAFLCUCEAX-UHFFFAOYSA-N 2 1 339.483 4.228 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC12CCSCC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000421385522 1036344951 /nfs/dbraw/zinc/34/49/51/1036344951.db2.gz QAJVINTXXXXKEL-SXLOBPIMSA-N 2 1 344.568 4.020 20 0 EIADMP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2cnc(-c3ccccc3)s2)C1 ZINC000589641446 1036856966 /nfs/dbraw/zinc/85/69/66/1036856966.db2.gz KTSGHUKOUBKDIA-IRXDYDNUSA-N 2 1 343.540 4.268 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc4[nH]cnc4c3)cc2)C1 ZINC000589641137 1036857469 /nfs/dbraw/zinc/85/74/69/1036857469.db2.gz UFVIBJFZODGOME-QGZVFWFLSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc4nc[nH]c4c3)cc2)C1 ZINC000589641137 1036857471 /nfs/dbraw/zinc/85/74/71/1036857471.db2.gz UFVIBJFZODGOME-QGZVFWFLSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc4nc[nH]c4c3)cc2)C1 ZINC000589641137 1036857472 /nfs/dbraw/zinc/85/74/72/1036857472.db2.gz UFVIBJFZODGOME-QGZVFWFLSA-N 2 1 348.494 4.085 20 0 EIADMP CN(c1ccccc1)c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000589837986 1036880674 /nfs/dbraw/zinc/88/06/74/1036880674.db2.gz OEAWLNDITAQATE-VXKWHMMOSA-N 2 1 335.495 4.171 20 0 EIADMP CN(c1ccccc1)c1ccc(C[NH2+][C@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC000589837986 1036880679 /nfs/dbraw/zinc/88/06/79/1036880679.db2.gz OEAWLNDITAQATE-VXKWHMMOSA-N 2 1 335.495 4.171 20 0 EIADMP C[N@H+](Cc1cc(Cl)cc(Cl)c1)C1CC[NH+](CC2CC2)CC1 ZINC001168395379 1036884953 /nfs/dbraw/zinc/88/49/53/1036884953.db2.gz XWCFHQDLOHIPPG-UHFFFAOYSA-N 2 1 327.299 4.300 20 0 EIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)C1CC[NH+](CC2CC2)CC1 ZINC001168395379 1036884957 /nfs/dbraw/zinc/88/49/57/1036884957.db2.gz XWCFHQDLOHIPPG-UHFFFAOYSA-N 2 1 327.299 4.300 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C/C=C\c1ccncc1 ZINC000486944396 1036898600 /nfs/dbraw/zinc/89/86/00/1036898600.db2.gz PMNQBJUKCOWGFW-MONCILHSSA-N 2 1 335.495 4.259 20 0 EIADMP Fc1ccc(C2CC[NH+](C3CC[NH+](CC4CC4)CC3)CC2)c(F)c1 ZINC001168397467 1036962065 /nfs/dbraw/zinc/96/20/65/1036962065.db2.gz OBRFCKMKKHJWDS-UHFFFAOYSA-N 2 1 334.454 4.019 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1nccn1C ZINC000271742681 1037003130 /nfs/dbraw/zinc/00/31/30/1037003130.db2.gz VSIHOSLEWFWZNZ-PXNSSMCTSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1nccn1C ZINC000271742681 1037003151 /nfs/dbraw/zinc/00/31/51/1037003151.db2.gz VSIHOSLEWFWZNZ-PXNSSMCTSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@@H]2CCC23CCOCC3)cc1 ZINC000669698639 1037016750 /nfs/dbraw/zinc/01/67/50/1037016750.db2.gz VPQYIEAEZUJZCL-WIYYLYMNSA-N 2 1 342.527 4.110 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]CCCn3cc[nH+]c3C)oc21 ZINC000271874104 1037041884 /nfs/dbraw/zinc/04/18/84/1037041884.db2.gz NLSYOOHQYZAYSX-AWEZNQCLSA-N 2 1 327.428 4.077 20 0 EIADMP CCOc1c(Cl)cccc1C[NH2+]Cc1cccc(C[N@@H+](C)CC)c1 ZINC000487311892 1037120744 /nfs/dbraw/zinc/12/07/44/1037120744.db2.gz QRXUZRLYCQAKPV-UHFFFAOYSA-N 2 1 346.902 4.480 20 0 EIADMP C[C@H](N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccnc1Cl ZINC000272355890 1037171414 /nfs/dbraw/zinc/17/14/14/1037171414.db2.gz RJMMXOBPDPJWQW-XYJFISCASA-N 2 1 343.902 4.296 20 0 EIADMP c1sc(C2CCCCC2)nc1C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000573005528 1037221873 /nfs/dbraw/zinc/22/18/73/1037221873.db2.gz SCTGIZAXFDRYIX-QGZVFWFLSA-N 2 1 333.545 4.012 20 0 EIADMP CCOCCC1(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000272711312 1037276621 /nfs/dbraw/zinc/27/66/21/1037276621.db2.gz COBHMDYZFCHCLH-PZJWPPBQSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=[NH2+])Nc2ccccc2)cc1 ZINC000057887896 1037288289 /nfs/dbraw/zinc/28/82/89/1037288289.db2.gz BROGNUAVQBKVEE-QGZVFWFLSA-N 2 1 336.483 4.197 20 0 EIADMP FC(F)(F)c1cccc(C[NH2+]C2CC[NH+]([C@H]3C[C@H]4C[C@H]4C3)CC2)c1 ZINC001167948419 1037477632 /nfs/dbraw/zinc/47/76/32/1037477632.db2.gz MLIDJUIGUHJGGH-HWWDLCQESA-N 2 1 338.417 4.058 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(N(C)c2ccccc2)cc1 ZINC000591700473 1037551710 /nfs/dbraw/zinc/55/17/10/1037551710.db2.gz DANCKSPHXIFOMO-GOSISDBHSA-N 2 1 348.494 4.385 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488423515 1037575687 /nfs/dbraw/zinc/57/56/87/1037575687.db2.gz AZEDIPMECBQYMP-RSPOEFSDSA-N 2 1 346.584 4.407 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488423515 1037575696 /nfs/dbraw/zinc/57/56/96/1037575696.db2.gz AZEDIPMECBQYMP-RSPOEFSDSA-N 2 1 346.584 4.407 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CS1 ZINC000488434920 1037592427 /nfs/dbraw/zinc/59/24/27/1037592427.db2.gz UIGLUWJRYKDCER-GTAWCEEGSA-N 2 1 332.557 4.017 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CS1 ZINC000488434920 1037592431 /nfs/dbraw/zinc/59/24/31/1037592431.db2.gz UIGLUWJRYKDCER-GTAWCEEGSA-N 2 1 332.557 4.017 20 0 EIADMP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000414653268 1037678159 /nfs/dbraw/zinc/67/81/59/1037678159.db2.gz DZPOVSDMMAIABT-UONOGXRCSA-N 2 1 341.480 4.116 20 0 EIADMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000414653268 1037678178 /nfs/dbraw/zinc/67/81/78/1037678178.db2.gz DZPOVSDMMAIABT-UONOGXRCSA-N 2 1 341.480 4.116 20 0 EIADMP C[NH2+]C[C@H]1CCC[N@H+](Cc2cc(-c3ccccc3C)ccc2OC)C1 ZINC000414656146 1037692511 /nfs/dbraw/zinc/69/25/11/1037692511.db2.gz MNCQLCOINRZZCL-GOSISDBHSA-N 2 1 338.495 4.102 20 0 EIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2cc(-c3ccccc3C)ccc2OC)C1 ZINC000414656146 1037692523 /nfs/dbraw/zinc/69/25/23/1037692523.db2.gz MNCQLCOINRZZCL-GOSISDBHSA-N 2 1 338.495 4.102 20 0 EIADMP c1nc([C@@H]2CCC[N@H+](CCSC3CCCCC3)C2)n2c1CCCC2 ZINC000503371263 1037714077 /nfs/dbraw/zinc/71/40/77/1037714077.db2.gz HTTVEYFEGLBFRG-QGZVFWFLSA-N 2 1 347.572 4.465 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000513787593 1037714829 /nfs/dbraw/zinc/71/48/29/1037714829.db2.gz BLMGIIJUIBCZBP-BJLQDIEVSA-N 2 1 340.511 4.430 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000513787593 1037714852 /nfs/dbraw/zinc/71/48/52/1037714852.db2.gz BLMGIIJUIBCZBP-BJLQDIEVSA-N 2 1 340.511 4.430 20 0 EIADMP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000513787593 1037714872 /nfs/dbraw/zinc/71/48/72/1037714872.db2.gz BLMGIIJUIBCZBP-BJLQDIEVSA-N 2 1 340.511 4.430 20 0 EIADMP CSCCCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000592366603 1037776887 /nfs/dbraw/zinc/77/68/87/1037776887.db2.gz CCTQLDOBWLTQHF-IBGZPJMESA-N 2 1 332.557 4.307 20 0 EIADMP CSCCCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000592366603 1037776913 /nfs/dbraw/zinc/77/69/13/1037776913.db2.gz CCTQLDOBWLTQHF-IBGZPJMESA-N 2 1 332.557 4.307 20 0 EIADMP C[C@H](CCCC[NH3+])[NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000422727198 1037818695 /nfs/dbraw/zinc/81/86/95/1037818695.db2.gz BOUTVQFYNKJAIE-GOSISDBHSA-N 3 1 331.548 4.058 20 0 EIADMP C[C@@H]([NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1)c1c[nH+]ccc1N ZINC000422776327 1037831034 /nfs/dbraw/zinc/83/10/34/1037831034.db2.gz ACNUJCULIMISKZ-CYBMUJFWSA-N 2 1 349.400 4.285 20 0 EIADMP Fc1ccccc1Oc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1F ZINC000422782251 1037832355 /nfs/dbraw/zinc/83/23/55/1037832355.db2.gz JQWLSEMCQFUFLM-XYPWUTKMSA-N 2 1 344.405 4.130 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)ccc1OC(C)C ZINC000422814208 1037840584 /nfs/dbraw/zinc/84/05/84/1037840584.db2.gz UAWJSBIDCOMBTA-JVPBZIDWSA-N 2 1 340.467 4.278 20 0 EIADMP Clc1ccc2sc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)nc2c1 ZINC000422899189 1037860582 /nfs/dbraw/zinc/86/05/82/1037860582.db2.gz GYDIHCLLWJCUBQ-SOUVJXGZSA-N 2 1 349.931 4.350 20 0 EIADMP C[C@H]([NH2+]CC1(Sc2ccccc2)CCCC1)c1c[nH+]ccc1N ZINC000422903664 1037864221 /nfs/dbraw/zinc/86/42/21/1037864221.db2.gz FZYMFIWDLBWKFS-HNNXBMFYSA-N 2 1 327.497 4.250 20 0 EIADMP Cc1sc(C[NH2+][C@H]2CC[NH2+]CC[C@H]2C)nc1-c1ccc(Cl)cc1 ZINC000422936815 1037876053 /nfs/dbraw/zinc/87/60/53/1037876053.db2.gz BYWIITNKEJFSLI-WBMJQRKESA-N 2 1 349.931 4.250 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCc3c2cccc3Br)c2ccccc21 ZINC000422952739 1037886735 /nfs/dbraw/zinc/88/67/35/1037886735.db2.gz DDCQBHJTTIWDQH-KURKYZTESA-N 2 1 343.268 4.171 20 0 EIADMP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000423048942 1037913018 /nfs/dbraw/zinc/91/30/18/1037913018.db2.gz AMHFKNHDWNZVTR-OPQQBVKSSA-N 2 1 342.327 4.414 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000503864812 1037950605 /nfs/dbraw/zinc/95/06/05/1037950605.db2.gz WHCQLJBKTOXWRK-QFBILLFUSA-N 2 1 336.470 4.312 20 0 EIADMP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]C1CC(c2ccc(F)c(Cl)c2)C1 ZINC000423094863 1037952759 /nfs/dbraw/zinc/95/27/59/1037952759.db2.gz CXCWWUBUCLDGQJ-QANLSNOQSA-N 2 1 346.877 4.273 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Br)c(F)c1 ZINC000489489137 1038081263 /nfs/dbraw/zinc/08/12/63/1038081263.db2.gz YSWKSRZVKYCRKM-IACUBPJLSA-N 2 1 343.284 4.112 20 0 EIADMP [NH3+]C[C@@H]([NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1)C1CC1 ZINC000423276219 1038100763 /nfs/dbraw/zinc/10/07/63/1038100763.db2.gz MTEBAUYJQCVNCC-UAIPMZCESA-N 2 1 326.406 4.059 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCOc3c(Cl)cc(C)cc32)C1 ZINC000489585739 1038130575 /nfs/dbraw/zinc/13/05/75/1038130575.db2.gz AXIXHKAHGGQJLD-QAPCUYQASA-N 2 1 336.907 4.184 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC[NH2+]1 ZINC000423371374 1038188583 /nfs/dbraw/zinc/18/85/83/1038188583.db2.gz FLMDNIIDAFPYIN-DKSSEZFCSA-N 2 1 346.421 4.108 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC[NH2+]1 ZINC000423371376 1038190901 /nfs/dbraw/zinc/19/09/01/1038190901.db2.gz FLMDNIIDAFPYIN-LJHODMEESA-N 2 1 346.421 4.108 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(F)cc1Br ZINC000423375801 1038206594 /nfs/dbraw/zinc/20/65/94/1038206594.db2.gz IWKJHMKIYTVBPC-NSHDSACASA-N 2 1 349.247 4.042 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423444687 1038226091 /nfs/dbraw/zinc/22/60/91/1038226091.db2.gz LXLOFJCCFZWHPP-AVRDEDQJSA-N 2 1 349.522 4.045 20 0 EIADMP CC(C)[C@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939045 1038232458 /nfs/dbraw/zinc/23/24/58/1038232458.db2.gz FDXHNMPIJDWPHW-UWJYYQICSA-N 2 1 343.490 4.418 20 0 EIADMP CC(C)[C@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939045 1038232483 /nfs/dbraw/zinc/23/24/83/1038232483.db2.gz FDXHNMPIJDWPHW-UWJYYQICSA-N 2 1 343.490 4.418 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)oc1C ZINC000423477976 1038251951 /nfs/dbraw/zinc/25/19/51/1038251951.db2.gz SRWCFJMWMJADHZ-DKSSEZFCSA-N 2 1 330.447 4.079 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cc(F)ccc1F ZINC000423481440 1038252540 /nfs/dbraw/zinc/25/25/40/1038252540.db2.gz WPCOEVVNAFRGTK-QIIPPGSGSA-N 2 1 348.412 4.148 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cc(F)ccc1F ZINC000423481439 1038252867 /nfs/dbraw/zinc/25/28/67/1038252867.db2.gz WPCOEVVNAFRGTK-DHSIGJKJSA-N 2 1 348.412 4.148 20 0 EIADMP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423454648 1038255112 /nfs/dbraw/zinc/25/51/12/1038255112.db2.gz ZHRIHOYPAZFEAQ-MJVIPROJSA-N 2 1 335.904 4.166 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000594974498 1038485336 /nfs/dbraw/zinc/48/53/36/1038485336.db2.gz KNWYVBGSOSIJBZ-LJQANCHMSA-N 2 1 344.568 4.307 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000594974498 1038485362 /nfs/dbraw/zinc/48/53/62/1038485362.db2.gz KNWYVBGSOSIJBZ-LJQANCHMSA-N 2 1 344.568 4.307 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000608067800 1038489543 /nfs/dbraw/zinc/48/95/43/1038489543.db2.gz TVURLRNJGCECBL-NHYWBVRUSA-N 2 1 334.813 4.179 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000608067800 1038489550 /nfs/dbraw/zinc/48/95/50/1038489550.db2.gz TVURLRNJGCECBL-NHYWBVRUSA-N 2 1 334.813 4.179 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2ccncc2)c2cccs2)C1 ZINC000424311947 1038799304 /nfs/dbraw/zinc/79/93/04/1038799304.db2.gz LNZKKMFZBSLTNU-OALUTQOASA-N 2 1 343.540 4.137 20 0 EIADMP CC(C)[C@@H](CCc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000480770560 1038808139 /nfs/dbraw/zinc/80/81/39/1038808139.db2.gz OOVQGMGCPSIRMN-YLJYHZDGSA-N 2 1 334.935 4.371 20 0 EIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000480770559 1038808753 /nfs/dbraw/zinc/80/87/53/1038808753.db2.gz OOVQGMGCPSIRMN-XLIONFOSSA-N 2 1 334.935 4.371 20 0 EIADMP CC(C)CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000480775854 1038811832 /nfs/dbraw/zinc/81/18/32/1038811832.db2.gz QPKPYDLFMQXTRH-QZTJIDSGSA-N 2 1 330.516 4.246 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000539083146 1038814934 /nfs/dbraw/zinc/81/49/34/1038814934.db2.gz WVHSAIUKVCPXFN-KBPBESRZSA-N 2 1 339.405 4.067 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cc(F)ccc2F)CC1)CC1CC1 ZINC001168424899 1038844737 /nfs/dbraw/zinc/84/47/37/1038844737.db2.gz YIKSBNYCYRCDGB-UHFFFAOYSA-N 2 1 336.470 4.299 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccnn1C1CCC1 ZINC000924686348 1038873609 /nfs/dbraw/zinc/87/36/09/1038873609.db2.gz RIRRRKPVNDTVEF-FGTMMUONSA-N 2 1 332.536 4.017 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc3cc(OC)ccc3c2)C1 ZINC000481023380 1038958140 /nfs/dbraw/zinc/95/81/40/1038958140.db2.gz NDLRMRVNLVIEHW-IRXDYDNUSA-N 2 1 326.484 4.231 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000481037767 1038988523 /nfs/dbraw/zinc/98/85/23/1038988523.db2.gz MXZOEKCCSCVWBB-MLGOLLRUSA-N 2 1 327.299 4.302 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555232557 1039000080 /nfs/dbraw/zinc/00/00/80/1039000080.db2.gz HVPRVHXZAGIKNW-ZXHYAQOVSA-N 2 1 348.534 4.333 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCc2ccccc21 ZINC000481185240 1039089022 /nfs/dbraw/zinc/08/90/22/1039089022.db2.gz WNSHJXDLVADSTJ-JMUQELJHSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(F)c(F)c2F)C[C@@H]1c1ccccc1 ZINC000550780553 1039131728 /nfs/dbraw/zinc/13/17/28/1039131728.db2.gz HSAPQDJNKZKVKB-SJLPKXTDSA-N 2 1 348.412 4.072 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc(F)c(F)c2F)C[C@@H]1c1ccccc1 ZINC000550780553 1039131738 /nfs/dbraw/zinc/13/17/38/1039131738.db2.gz HSAPQDJNKZKVKB-SJLPKXTDSA-N 2 1 348.412 4.072 20 0 EIADMP Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000555422768 1039180846 /nfs/dbraw/zinc/18/08/46/1039180846.db2.gz FOGQAIWSMYBRLQ-QFBILLFUSA-N 2 1 329.532 4.256 20 0 EIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c(C)c1OC ZINC000552225101 1039277577 /nfs/dbraw/zinc/27/75/77/1039277577.db2.gz AICKNZZEGWEGDU-WMZOPIPTSA-N 2 1 348.531 4.175 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](C[C@H]3CCCC(F)(F)C3)C2)CC1 ZINC000513882639 1039343840 /nfs/dbraw/zinc/34/38/40/1039343840.db2.gz MYLNQFIQCCADMP-ROUUACIJSA-N 2 1 328.491 4.256 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1OCCC ZINC000157224857 1039386929 /nfs/dbraw/zinc/38/69/29/1039386929.db2.gz PIDLMNWVBWRNJE-ZIFCJYIRSA-N 2 1 348.531 4.398 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1OCCC ZINC000157224857 1039386937 /nfs/dbraw/zinc/38/69/37/1039386937.db2.gz PIDLMNWVBWRNJE-ZIFCJYIRSA-N 2 1 348.531 4.398 20 0 EIADMP C[C@@H](CC[NH2+][C@@H](c1cccnc1)C1CCC1)[N@@H+](C)Cc1ccccc1 ZINC000481666505 1039717700 /nfs/dbraw/zinc/71/77/00/1039717700.db2.gz IXANJMWBOPJLSZ-PGRDOPGGSA-N 2 1 337.511 4.423 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCc2c1cc(Cl)cc2Br ZINC000534792792 1039788463 /nfs/dbraw/zinc/78/84/63/1039788463.db2.gz DDAOQFSTCYADDG-BMIGLBTASA-N 2 1 345.712 4.020 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC[N@@H+]1C ZINC000481740608 1039804163 /nfs/dbraw/zinc/80/41/63/1039804163.db2.gz MUTHHPPYNRGWLB-IPHXSNPTSA-N 2 1 344.449 4.321 20 0 EIADMP c1ccc(Oc2ccc(C[NH2+]C3CC[NH+](CC4CC4)CC3)cc2)cc1 ZINC001168352833 1039822595 /nfs/dbraw/zinc/82/25/95/1039822595.db2.gz GJTIFMUYKBBRQB-UHFFFAOYSA-N 2 1 336.479 4.443 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](c2cccnc2)C2CCC2)CC1 ZINC000481920547 1039895799 /nfs/dbraw/zinc/89/57/99/1039895799.db2.gz JNSCMQOISBTVCY-QHCPKHFHSA-N 2 1 349.522 4.485 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000551176432 1040023267 /nfs/dbraw/zinc/02/32/67/1040023267.db2.gz XPOZPJVJBOEJSW-BURNTYAHSA-N 2 1 330.516 4.005 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000551176432 1040023287 /nfs/dbraw/zinc/02/32/87/1040023287.db2.gz XPOZPJVJBOEJSW-BURNTYAHSA-N 2 1 330.516 4.005 20 0 EIADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551186154 1040034829 /nfs/dbraw/zinc/03/48/29/1040034829.db2.gz FFGAVOSBIPYIAO-CQSZACIVSA-N 2 1 349.931 4.285 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000551186154 1040034845 /nfs/dbraw/zinc/03/48/45/1040034845.db2.gz FFGAVOSBIPYIAO-CQSZACIVSA-N 2 1 349.931 4.285 20 0 EIADMP Fc1ccc(/C=C/C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000435058316 1040038293 /nfs/dbraw/zinc/03/82/93/1040038293.db2.gz MGNXWZQTEJATMT-ONEGZZNKSA-N 2 1 339.458 4.251 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000666969021 1040054472 /nfs/dbraw/zinc/05/44/72/1040054472.db2.gz XZLNFBAPAXKCSU-AEFFLSMTSA-N 2 1 333.545 4.155 20 0 EIADMP c1nc(C2CCCCC2)sc1C[N@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000666969021 1040054487 /nfs/dbraw/zinc/05/44/87/1040054487.db2.gz XZLNFBAPAXKCSU-AEFFLSMTSA-N 2 1 333.545 4.155 20 0 EIADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000514625818 1040065562 /nfs/dbraw/zinc/06/55/62/1040065562.db2.gz KWUSSBHAPYUPOU-CQSZACIVSA-N 2 1 334.410 4.045 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000514625818 1040065575 /nfs/dbraw/zinc/06/55/75/1040065575.db2.gz KWUSSBHAPYUPOU-CQSZACIVSA-N 2 1 334.410 4.045 20 0 EIADMP CC(C)=CCC[C@@H](C)CC[NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000482233451 1040086817 /nfs/dbraw/zinc/08/68/17/1040086817.db2.gz XWRJUMZRPCGWPF-QGZVFWFLSA-N 2 1 344.547 4.424 20 0 EIADMP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000551267686 1040129190 /nfs/dbraw/zinc/12/91/90/1040129190.db2.gz SLEAXSPUKYIQAD-DLBZAZTESA-N 2 1 339.527 4.298 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccs1 ZINC000482443007 1040250203 /nfs/dbraw/zinc/25/02/03/1040250203.db2.gz FCYNTBQBECHXDS-MOPGFXCFSA-N 2 1 328.525 4.353 20 0 EIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C)CC1)c1cccc(Br)c1 ZINC000479327080 1040273587 /nfs/dbraw/zinc/27/35/87/1040273587.db2.gz QMLKJNPMWGJURZ-KRWDZBQOSA-N 2 1 339.321 4.220 20 0 EIADMP Cc1ccc(O[C@H](C)C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000565670182 1040296493 /nfs/dbraw/zinc/29/64/93/1040296493.db2.gz JFEHZXADLMEUNC-CBQOVEMMSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1ccc(O[C@H](C)C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000565670182 1040296508 /nfs/dbraw/zinc/29/65/08/1040296508.db2.gz JFEHZXADLMEUNC-CBQOVEMMSA-N 2 1 338.495 4.187 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000668063912 1040311215 /nfs/dbraw/zinc/31/12/15/1040311215.db2.gz ZLESVLDOVAOPIJ-GOSISDBHSA-N 2 1 329.513 4.035 20 0 EIADMP CC[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(OC(F)F)cc1 ZINC000479515072 1040434682 /nfs/dbraw/zinc/43/46/82/1040434682.db2.gz XSEJOVFDDQXTDV-HTWSVDAQSA-N 2 1 338.442 4.346 20 0 EIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(OC3CCCC3)cc2)CC1 ZINC000551811535 1040621274 /nfs/dbraw/zinc/62/12/74/1040621274.db2.gz FDUMESPGPTYBDH-UHFFFAOYSA-N 2 1 330.516 4.361 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cc3ccncc3s2)C1 ZINC000667560867 1040680901 /nfs/dbraw/zinc/68/09/01/1040680901.db2.gz DTBMXQMJEWIRCQ-IAGOWNOFSA-N 2 1 343.540 4.383 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cc3ccncc3s2)C1 ZINC000667560867 1040680923 /nfs/dbraw/zinc/68/09/23/1040680923.db2.gz DTBMXQMJEWIRCQ-IAGOWNOFSA-N 2 1 343.540 4.383 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cc3ccncc3s2)C1 ZINC000667560867 1040680940 /nfs/dbraw/zinc/68/09/40/1040680940.db2.gz DTBMXQMJEWIRCQ-IAGOWNOFSA-N 2 1 343.540 4.383 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cc3ccncc3s2)C1 ZINC000667560867 1040680950 /nfs/dbraw/zinc/68/09/50/1040680950.db2.gz DTBMXQMJEWIRCQ-IAGOWNOFSA-N 2 1 343.540 4.383 20 0 EIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCc2ccc(F)cc21 ZINC000483088701 1040697720 /nfs/dbraw/zinc/69/77/20/1040697720.db2.gz LILZWBICRUBQOU-GCJKJVERSA-N 2 1 338.470 4.267 20 0 EIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CCc2ccc(F)cc21 ZINC000483088701 1040697731 /nfs/dbraw/zinc/69/77/31/1040697731.db2.gz LILZWBICRUBQOU-GCJKJVERSA-N 2 1 338.470 4.267 20 0 EIADMP CCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)C[C@H]2C)cc1OCC ZINC000539817499 1040808949 /nfs/dbraw/zinc/80/89/49/1040808949.db2.gz OJNBFMMYFKFRMO-IEBWSBKVSA-N 2 1 348.531 4.036 20 0 EIADMP CCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)cc1OCC ZINC000539817502 1040811962 /nfs/dbraw/zinc/81/19/62/1040811962.db2.gz OJNBFMMYFKFRMO-PKOBYXMFSA-N 2 1 348.531 4.036 20 0 EIADMP CCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)cc1OCC ZINC000539817502 1040811967 /nfs/dbraw/zinc/81/19/67/1040811967.db2.gz OJNBFMMYFKFRMO-PKOBYXMFSA-N 2 1 348.531 4.036 20 0 EIADMP CCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)C[C@@H]2C)cc1OCC ZINC000539817502 1040811970 /nfs/dbraw/zinc/81/19/70/1040811970.db2.gz OJNBFMMYFKFRMO-PKOBYXMFSA-N 2 1 348.531 4.036 20 0 EIADMP CCC[N@H+](C[C@H]1CC=CCC1)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000539829588 1040824992 /nfs/dbraw/zinc/82/49/92/1040824992.db2.gz OLKQOUKTIUWNSK-IBGZPJMESA-N 2 1 342.531 4.131 20 0 EIADMP CCC[N@@H+](C[C@H]1CC=CCC1)C1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000539829588 1040824998 /nfs/dbraw/zinc/82/49/98/1040824998.db2.gz OLKQOUKTIUWNSK-IBGZPJMESA-N 2 1 342.531 4.131 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCCc4c(O)cccc43)CC2)C1 ZINC000483430726 1040852556 /nfs/dbraw/zinc/85/25/56/1040852556.db2.gz XGORLEZUZHZQCL-HGHGUNKESA-N 2 1 342.527 4.402 20 0 EIADMP c1c2ccncc2sc1C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000667592771 1040865890 /nfs/dbraw/zinc/86/58/90/1040865890.db2.gz DSBKZYCJCDUTLP-KRWDZBQOSA-N 2 1 343.540 4.384 20 0 EIADMP c1c2ccncc2sc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000667592771 1040865894 /nfs/dbraw/zinc/86/58/94/1040865894.db2.gz DSBKZYCJCDUTLP-KRWDZBQOSA-N 2 1 343.540 4.384 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483483451 1040872070 /nfs/dbraw/zinc/87/20/70/1040872070.db2.gz NNFKUGPRECHSNE-KMFMINBZSA-N 2 1 326.406 4.183 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000483483451 1040872081 /nfs/dbraw/zinc/87/20/81/1040872081.db2.gz NNFKUGPRECHSNE-KMFMINBZSA-N 2 1 326.406 4.183 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000483483451 1040872085 /nfs/dbraw/zinc/87/20/85/1040872085.db2.gz NNFKUGPRECHSNE-KMFMINBZSA-N 2 1 326.406 4.183 20 0 EIADMP COC1CC[NH+](C2(C[NH2+][C@H]3C[C@H](C)CC(C)(C)C3)CCCC2)CC1 ZINC000462744754 1040892469 /nfs/dbraw/zinc/89/24/69/1040892469.db2.gz MOFXANNMQGYQSW-ROUUACIJSA-N 2 1 336.564 4.214 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1cscn1 ZINC000537944564 1040911660 /nfs/dbraw/zinc/91/16/60/1040911660.db2.gz GHSOJDIGEDRANI-BQFCYCMXSA-N 2 1 329.513 4.094 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCC2)CC[N@H+]1C ZINC000537964482 1040936828 /nfs/dbraw/zinc/93/68/28/1040936828.db2.gz RYNOQPCATQMHGK-UKRRQHHQSA-N 2 1 341.326 4.487 20 0 EIADMP FC(F)(F)CCC(CCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000924648679 1040938589 /nfs/dbraw/zinc/93/85/89/1040938589.db2.gz NKTSGVNRJFXZIB-LLVKDONJSA-N 2 1 346.359 4.114 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(COc2ccccc2)cc1 ZINC000537988281 1040966244 /nfs/dbraw/zinc/96/62/44/1040966244.db2.gz WHISYYCMHTXXKA-HMFYCAOWSA-N 2 1 338.495 4.084 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]C[C@H](C)Cn3cc[nH+]c3C)c(C)c2c1 ZINC000537967509 1040969012 /nfs/dbraw/zinc/96/90/12/1040969012.db2.gz MAUSEWCWGVPPIP-ZFWWWQNUSA-N 2 1 341.455 4.242 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000379740222 1040992338 /nfs/dbraw/zinc/99/23/38/1040992338.db2.gz HWPIKSPXGYGELJ-RXVVDRJESA-N 2 1 326.459 4.389 20 0 EIADMP CC(C)[C@@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1cccnc1 ZINC000538115705 1041065694 /nfs/dbraw/zinc/06/56/94/1041065694.db2.gz AWLKXZWBWGWDFY-WIYYLYMNSA-N 2 1 325.500 4.279 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)c1cscn1 ZINC000903454379 1041066517 /nfs/dbraw/zinc/06/65/17/1041066517.db2.gz BPRHLOCYAWICET-OQIJWPOYSA-N 2 1 341.524 4.094 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CC[C@@H](Cc2ccc(C(C)C)cc2)C1 ZINC000460972395 1041077462 /nfs/dbraw/zinc/07/74/62/1041077462.db2.gz XQSMCTBNUBTSAF-FQEVSTJZSA-N 2 1 325.500 4.270 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC[C@@H](Cc2ccc(C(C)C)cc2)C1 ZINC000460972395 1041077470 /nfs/dbraw/zinc/07/74/70/1041077470.db2.gz XQSMCTBNUBTSAF-FQEVSTJZSA-N 2 1 325.500 4.270 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2cccc(F)c2F)cc1 ZINC000540178137 1041224310 /nfs/dbraw/zinc/22/43/10/1041224310.db2.gz SHZNMAYIPJNHOC-CQSZACIVSA-N 2 1 341.405 4.352 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1cccs1 ZINC000540162342 1041224341 /nfs/dbraw/zinc/22/43/41/1041224341.db2.gz BRNKLSPMHOHKAD-XLIONFOSSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1cccs1 ZINC000540162342 1041224355 /nfs/dbraw/zinc/22/43/55/1041224355.db2.gz BRNKLSPMHOHKAD-XLIONFOSSA-N 2 1 328.525 4.181 20 0 EIADMP Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)c1 ZINC000484485144 1041255979 /nfs/dbraw/zinc/25/59/79/1041255979.db2.gz JBPWCEQQCPPJEN-RRFJBIMHSA-N 2 1 326.431 4.120 20 0 EIADMP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc[nH+]c2ccsc21 ZINC000463063410 1041295912 /nfs/dbraw/zinc/29/59/12/1041295912.db2.gz UHHKOQJBODMATK-QGZVFWFLSA-N 2 1 337.492 4.255 20 0 EIADMP CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc[nH+]c2ccsc21 ZINC000463063410 1041295926 /nfs/dbraw/zinc/29/59/26/1041295926.db2.gz UHHKOQJBODMATK-QGZVFWFLSA-N 2 1 337.492 4.255 20 0 EIADMP C[C@H]1CCN(c2cc[nH+]c3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000463062555 1041296113 /nfs/dbraw/zinc/29/61/13/1041296113.db2.gz ADRYIGWLBKLRMO-SFHVURJKSA-N 2 1 331.463 4.336 20 0 EIADMP Cc1cccc(OCC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000463072630 1041318138 /nfs/dbraw/zinc/31/81/38/1041318138.db2.gz RAKDZKVTZMFKDX-TZIWHRDSSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1cccc(OCC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000463072630 1041318151 /nfs/dbraw/zinc/31/81/51/1041318151.db2.gz RAKDZKVTZMFKDX-TZIWHRDSSA-N 2 1 338.495 4.017 20 0 EIADMP CCCCCOc1ccc([C@@H]([NH2+]C2CC[NH+](C)CC2)C2CC2)cc1 ZINC000540261575 1041327772 /nfs/dbraw/zinc/32/77/72/1041327772.db2.gz IWHSDPRFAAMXAB-NRFANRHFSA-N 2 1 330.516 4.391 20 0 EIADMP CCS[C@H]1CCCC[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463187574 1041416500 /nfs/dbraw/zinc/41/65/00/1041416500.db2.gz BPNXQKLDODRYRW-RTWAWAEBSA-N 2 1 346.584 4.347 20 0 EIADMP CC(C)[NH+](CCCN[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000463208589 1041419396 /nfs/dbraw/zinc/41/93/96/1041419396.db2.gz XOVOXKNCPMLHOB-UNMCSNQZSA-N 2 1 345.575 4.138 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC3(CCCC3)O2)cc1 ZINC000554816155 1041423941 /nfs/dbraw/zinc/42/39/41/1041423941.db2.gz KUZWMSAGCUNOTO-UZLBHIALSA-N 2 1 339.483 4.323 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(SCC(F)F)cc1 ZINC000480615340 1041425395 /nfs/dbraw/zinc/42/53/95/1041425395.db2.gz RWGWYGULZVYRMM-XKQJLSEDSA-N 2 1 340.483 4.321 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(SCC(F)F)cc1 ZINC000480615340 1041425398 /nfs/dbraw/zinc/42/53/98/1041425398.db2.gz RWGWYGULZVYRMM-XKQJLSEDSA-N 2 1 340.483 4.321 20 0 EIADMP C[C@H](CCCC(F)(F)F)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463252283 1041463532 /nfs/dbraw/zinc/46/35/32/1041463532.db2.gz KHKSJSOOMDPWEF-MRXNPFEDSA-N 2 1 342.449 4.404 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cccc(C(C)C)c2)[C@@H](C)C1 ZINC000480674046 1041465588 /nfs/dbraw/zinc/46/55/88/1041465588.db2.gz WPLMDACGDOAROX-RXVVDRJESA-N 2 1 332.532 4.037 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCOC1 ZINC000480703453 1041480651 /nfs/dbraw/zinc/48/06/51/1041480651.db2.gz YPRHDNPTZCZWAM-UDKICSLYSA-N 2 1 344.543 4.069 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000195132211 1041484481 /nfs/dbraw/zinc/48/44/81/1041484481.db2.gz WJKCORPLOJQRGP-SJLPKXTDSA-N 2 1 342.458 4.007 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[N@@H+]1C ZINC000538717699 1041486891 /nfs/dbraw/zinc/48/68/91/1041486891.db2.gz SDEGMBKCMYNOGV-GDBMZVCRSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[N@H+]1C ZINC000538717699 1041486902 /nfs/dbraw/zinc/48/69/02/1041486902.db2.gz SDEGMBKCMYNOGV-GDBMZVCRSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[NH+]1C ZINC000538717699 1041486910 /nfs/dbraw/zinc/48/69/10/1041486910.db2.gz SDEGMBKCMYNOGV-GDBMZVCRSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[NH+]1C ZINC000538717699 1041486916 /nfs/dbraw/zinc/48/69/16/1041486916.db2.gz SDEGMBKCMYNOGV-GDBMZVCRSA-N 2 1 332.488 4.469 20 0 EIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538722005 1041493151 /nfs/dbraw/zinc/49/31/51/1041493151.db2.gz RXCGCOQDNHKQCQ-INIZCTEOSA-N 2 1 340.458 4.069 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538722005 1041493157 /nfs/dbraw/zinc/49/31/57/1041493157.db2.gz RXCGCOQDNHKQCQ-INIZCTEOSA-N 2 1 340.458 4.069 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538722005 1041493163 /nfs/dbraw/zinc/49/31/63/1041493163.db2.gz RXCGCOQDNHKQCQ-INIZCTEOSA-N 2 1 340.458 4.069 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc(C)c(OC(F)F)c(C)c2)C1 ZINC000538722005 1041493167 /nfs/dbraw/zinc/49/31/67/1041493167.db2.gz RXCGCOQDNHKQCQ-INIZCTEOSA-N 2 1 340.458 4.069 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@@H]([C@H](C)[NH3+])C3)s2)cc1 ZINC000484903382 1041503664 /nfs/dbraw/zinc/50/36/64/1041503664.db2.gz FXFRZKDZJFSEKY-WMLDXEAASA-N 2 1 329.513 4.103 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccccc4F)o3)CC[C@@H]21 ZINC000538799167 1041539521 /nfs/dbraw/zinc/53/95/21/1041539521.db2.gz RRENVKHCEKAYTI-KXBFYZLASA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(-c4ccccc4F)o3)CC[C@@H]21 ZINC000538799167 1041539526 /nfs/dbraw/zinc/53/95/26/1041539526.db2.gz RRENVKHCEKAYTI-KXBFYZLASA-N 2 1 328.431 4.002 20 0 EIADMP c1csc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000538798679 1041540187 /nfs/dbraw/zinc/54/01/87/1041540187.db2.gz STYLXVGJAHAIQX-QUCCMNQESA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000538798679 1041540194 /nfs/dbraw/zinc/54/01/94/1041540194.db2.gz STYLXVGJAHAIQX-QUCCMNQESA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)c1 ZINC000538798679 1041540202 /nfs/dbraw/zinc/54/02/02/1041540202.db2.gz STYLXVGJAHAIQX-QUCCMNQESA-N 2 1 326.509 4.235 20 0 EIADMP c1csc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000538798679 1041540212 /nfs/dbraw/zinc/54/02/12/1041540212.db2.gz STYLXVGJAHAIQX-QUCCMNQESA-N 2 1 326.509 4.235 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@H]21 ZINC000538799217 1041540891 /nfs/dbraw/zinc/54/08/91/1041540891.db2.gz URBUTZRBHMMBOC-QFBILLFUSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@H]21 ZINC000538799217 1041540893 /nfs/dbraw/zinc/54/08/93/1041540893.db2.gz URBUTZRBHMMBOC-QFBILLFUSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@H]21 ZINC000538799217 1041540897 /nfs/dbraw/zinc/54/08/97/1041540897.db2.gz URBUTZRBHMMBOC-QFBILLFUSA-N 2 1 328.431 4.002 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@@H]21 ZINC000538799216 1041541536 /nfs/dbraw/zinc/54/15/36/1041541536.db2.gz URBUTZRBHMMBOC-LPHOPBHVSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@@H]21 ZINC000538799216 1041541542 /nfs/dbraw/zinc/54/15/42/1041541542.db2.gz URBUTZRBHMMBOC-LPHOPBHVSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@@H]21 ZINC000538799216 1041541545 /nfs/dbraw/zinc/54/15/45/1041541545.db2.gz URBUTZRBHMMBOC-LPHOPBHVSA-N 2 1 328.431 4.002 20 0 EIADMP CC[N@H+]1CC[C@H](Nc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)[C@@H](C)C1 ZINC000540699435 1041613799 /nfs/dbraw/zinc/61/37/99/1041613799.db2.gz FDEHMQRWLSYIBQ-WFXMLNOXSA-N 2 1 329.532 4.203 20 0 EIADMP CC[NH+]1CC[C@H](Nc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)[C@@H](C)C1 ZINC000540699435 1041613802 /nfs/dbraw/zinc/61/38/02/1041613802.db2.gz FDEHMQRWLSYIBQ-WFXMLNOXSA-N 2 1 329.532 4.203 20 0 EIADMP CC[NH+]1CC[C@H](Nc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)[C@@H](C)C1 ZINC000540699435 1041613805 /nfs/dbraw/zinc/61/38/05/1041613805.db2.gz FDEHMQRWLSYIBQ-WFXMLNOXSA-N 2 1 329.532 4.203 20 0 EIADMP CCCc1nc(C[NH+]2CCC(CCC[NH+](CC)CC)CC2)cs1 ZINC000541090537 1041807518 /nfs/dbraw/zinc/80/75/18/1041807518.db2.gz UNNDCFDWJCBFFP-UHFFFAOYSA-N 2 1 337.577 4.430 20 0 EIADMP Cc1ccc2cc([C@@H](C)[NH2+]CCCC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)oc2c1 ZINC000425927138 1041950874 /nfs/dbraw/zinc/95/08/74/1041950874.db2.gz YNPULDBLPDUHKE-FGTMMUONSA-N 2 1 344.499 4.281 20 0 EIADMP Cc1ccc2cc([C@H](C)[NH2+]CCCC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)oc2c1 ZINC000425927139 1041951846 /nfs/dbraw/zinc/95/18/46/1041951846.db2.gz YNPULDBLPDUHKE-KSZLIROESA-N 2 1 344.499 4.281 20 0 EIADMP CC[C@@H]1CCC[C@H](C[N@@H+](C)C2CCN(CCc3ccccn3)CC2)C1 ZINC000541536593 1041998819 /nfs/dbraw/zinc/99/88/19/1041998819.db2.gz CWDFCQMVGIDHCD-UXHICEINSA-N 2 1 343.559 4.237 20 0 EIADMP FC1(F)CC(C[NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000425940700 1042018128 /nfs/dbraw/zinc/01/81/28/1042018128.db2.gz XNIPNMOUVJKIMA-XUVXKRRUSA-N 2 1 348.481 4.312 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCc2ccccc2C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603539 1042038483 /nfs/dbraw/zinc/03/84/83/1042038483.db2.gz WICIHGNPRGVDDH-UEXGIBASSA-N 2 1 326.528 4.034 20 0 EIADMP Cn1cc[nH+]c1CC1CC[NH+]([C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000438119250 1042047146 /nfs/dbraw/zinc/04/71/46/1042047146.db2.gz JDUVOQSSYDOWLZ-IRLDBZIGSA-N 2 1 337.511 4.185 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](CCOc2cc(Cl)cc(Cl)c2)C1 ZINC000464778410 1042160547 /nfs/dbraw/zinc/16/05/47/1042160547.db2.gz OEGOXHKLDOJXSD-CQSZACIVSA-N 2 1 345.314 4.036 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCOc2cc(Cl)cc(Cl)c2)C1 ZINC000464778410 1042160549 /nfs/dbraw/zinc/16/05/49/1042160549.db2.gz OEGOXHKLDOJXSD-CQSZACIVSA-N 2 1 345.314 4.036 20 0 EIADMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000541908757 1042165691 /nfs/dbraw/zinc/16/56/91/1042165691.db2.gz MCRNNYSBYDUBEI-AWEZNQCLSA-N 2 1 334.916 4.452 20 0 EIADMP C[N@@H+](CCC[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)Cc1ccccc1 ZINC000303093372 1042295983 /nfs/dbraw/zinc/29/59/83/1042295983.db2.gz BUXAZRPSNGJMET-DLBZAZTESA-N 2 1 328.422 4.219 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000542164963 1042311847 /nfs/dbraw/zinc/31/18/47/1042311847.db2.gz HIEWKDVYUVNJLF-MMOPVJDHSA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000542164963 1042311853 /nfs/dbraw/zinc/31/18/53/1042311853.db2.gz HIEWKDVYUVNJLF-MMOPVJDHSA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000542164963 1042311863 /nfs/dbraw/zinc/31/18/63/1042311863.db2.gz HIEWKDVYUVNJLF-MMOPVJDHSA-N 2 1 330.491 4.096 20 0 EIADMP C[C@H](CCc1cccc(F)c1)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000542164963 1042311867 /nfs/dbraw/zinc/31/18/67/1042311867.db2.gz HIEWKDVYUVNJLF-MMOPVJDHSA-N 2 1 330.491 4.096 20 0 EIADMP Cc1cc(C)c(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1C ZINC000303149414 1042323157 /nfs/dbraw/zinc/32/31/57/1042323157.db2.gz FCWXXNPJMNTAEJ-QFIPXVFZSA-N 2 1 336.523 4.266 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@]2(C)CCCS2)CC1 ZINC000438826649 1042371069 /nfs/dbraw/zinc/37/10/69/1042371069.db2.gz OJRHHDCOGJGRKQ-SOAGJPPSSA-N 2 1 332.557 4.305 20 0 EIADMP COc1ccc2ccccc2c1C[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000506384565 1042373007 /nfs/dbraw/zinc/37/30/07/1042373007.db2.gz WQTNHJGQASAQHR-UHFFFAOYSA-N 2 1 326.484 4.153 20 0 EIADMP COc1ccc2ccccc2c1C[N@@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000506384565 1042373011 /nfs/dbraw/zinc/37/30/11/1042373011.db2.gz WQTNHJGQASAQHR-UHFFFAOYSA-N 2 1 326.484 4.153 20 0 EIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258747 1042436425 /nfs/dbraw/zinc/43/64/25/1042436425.db2.gz TYDROYGRANIVFW-PGRDOPGGSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258747 1042436435 /nfs/dbraw/zinc/43/64/35/1042436435.db2.gz TYDROYGRANIVFW-PGRDOPGGSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258747 1042436445 /nfs/dbraw/zinc/43/64/45/1042436445.db2.gz TYDROYGRANIVFW-PGRDOPGGSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1 ZINC000518258747 1042436453 /nfs/dbraw/zinc/43/64/53/1042436453.db2.gz TYDROYGRANIVFW-PGRDOPGGSA-N 2 1 338.495 4.038 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCOc2ccccc2)C1 ZINC000303657672 1042492770 /nfs/dbraw/zinc/49/27/70/1042492770.db2.gz VEFNWMSIQKHOGN-PMACEKPBSA-N 2 1 330.516 4.042 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCOc2ccccc2)C1 ZINC000303657672 1042492772 /nfs/dbraw/zinc/49/27/72/1042492772.db2.gz VEFNWMSIQKHOGN-PMACEKPBSA-N 2 1 330.516 4.042 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCOc2ccccc2)C1 ZINC000303657672 1042492776 /nfs/dbraw/zinc/49/27/76/1042492776.db2.gz VEFNWMSIQKHOGN-PMACEKPBSA-N 2 1 330.516 4.042 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)ccc2C1 ZINC001168442476 1042505674 /nfs/dbraw/zinc/50/56/74/1042505674.db2.gz VMGFSJAHRAAOKM-PWRODBHTSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@@H]1CCc2cc(F)ccc2C1 ZINC001168442476 1042505680 /nfs/dbraw/zinc/50/56/80/1042505680.db2.gz VMGFSJAHRAAOKM-PWRODBHTSA-N 2 1 330.491 4.022 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@@H]1CCc2cc(F)ccc2C1 ZINC001168442476 1042505686 /nfs/dbraw/zinc/50/56/86/1042505686.db2.gz VMGFSJAHRAAOKM-PWRODBHTSA-N 2 1 330.491 4.022 20 0 EIADMP CC(C)CSCCC[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492426624 1042649805 /nfs/dbraw/zinc/64/98/05/1042649805.db2.gz WLTOBZDNXVIREY-QUCCMNQESA-N 2 1 334.573 4.266 20 0 EIADMP c1cc(C[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc(OCC2CCCCC2)c1 ZINC000518767821 1042676779 /nfs/dbraw/zinc/67/67/79/1042676779.db2.gz TUSZRKVKSBEVFJ-FQEVSTJZSA-N 2 1 342.527 4.220 20 0 EIADMP C[C@H](C[N@H+](C)CC(C)(C)C[NH+](C)Cc1ccccc1)c1nccs1 ZINC000542464181 1042743348 /nfs/dbraw/zinc/74/33/48/1042743348.db2.gz ZGAZCHQWHBBSFH-QGZVFWFLSA-N 2 1 345.556 4.337 20 0 EIADMP C[C@H](C[N@@H+](C)CC(C)(C)C[NH+](C)Cc1ccccc1)c1nccs1 ZINC000542464181 1042743356 /nfs/dbraw/zinc/74/33/56/1042743356.db2.gz ZGAZCHQWHBBSFH-QGZVFWFLSA-N 2 1 345.556 4.337 20 0 EIADMP C[C@H](C[NH+](C)CC(C)(C)C[N@H+](C)Cc1ccccc1)c1nccs1 ZINC000542464181 1042743360 /nfs/dbraw/zinc/74/33/60/1042743360.db2.gz ZGAZCHQWHBBSFH-QGZVFWFLSA-N 2 1 345.556 4.337 20 0 EIADMP C[C@H](C[NH+](C)CC(C)(C)C[N@@H+](C)Cc1ccccc1)c1nccs1 ZINC000542464181 1042743365 /nfs/dbraw/zinc/74/33/65/1042743365.db2.gz ZGAZCHQWHBBSFH-QGZVFWFLSA-N 2 1 345.556 4.337 20 0 EIADMP C[C@@H](c1ccccn1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000493106253 1042819539 /nfs/dbraw/zinc/81/95/39/1042819539.db2.gz OCODLTKKIXXSNL-UGKGYDQZSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccccn1)[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000493106253 1042819542 /nfs/dbraw/zinc/81/95/42/1042819542.db2.gz OCODLTKKIXXSNL-UGKGYDQZSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccccn1)[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000493106253 1042819545 /nfs/dbraw/zinc/81/95/45/1042819545.db2.gz OCODLTKKIXXSNL-UGKGYDQZSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccccn1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000493106253 1042819549 /nfs/dbraw/zinc/81/95/49/1042819549.db2.gz OCODLTKKIXXSNL-UGKGYDQZSA-N 2 1 335.495 4.131 20 0 EIADMP COc1ccccc1C[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000310860665 1042846815 /nfs/dbraw/zinc/84/68/15/1042846815.db2.gz KLVXTJRSUKINNP-FQEVSTJZSA-N 2 1 338.495 4.087 20 0 EIADMP COc1ccccc1C[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000310860665 1042846816 /nfs/dbraw/zinc/84/68/16/1042846816.db2.gz KLVXTJRSUKINNP-FQEVSTJZSA-N 2 1 338.495 4.087 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000311016327 1042850666 /nfs/dbraw/zinc/85/06/66/1042850666.db2.gz NADWJIPWPYTHFU-FGSXEWAUSA-N 2 1 338.495 4.084 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000311107647 1042853179 /nfs/dbraw/zinc/85/31/79/1042853179.db2.gz DNOGWAUZWYLNOY-UYAOXDASSA-N 2 1 338.495 4.345 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000311107647 1042853180 /nfs/dbraw/zinc/85/31/80/1042853180.db2.gz DNOGWAUZWYLNOY-UYAOXDASSA-N 2 1 338.495 4.345 20 0 EIADMP COc1ccc([C@H]([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c2ccccc2)cc1 ZINC000493277234 1042890792 /nfs/dbraw/zinc/89/07/92/1042890792.db2.gz PQZVAEDXJRBGLU-RZUBCFFCSA-N 2 1 338.495 4.247 20 0 EIADMP CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000493890809 1042972078 /nfs/dbraw/zinc/97/20/78/1042972078.db2.gz HMTGJMDJNPFGOK-AVRDEDQJSA-N 2 1 340.511 4.393 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc2cc(OC)ccc2c1 ZINC000152418281 1043005702 /nfs/dbraw/zinc/00/57/02/1043005702.db2.gz ANTQRRABYMDJEE-OPAMFIHVSA-N 2 1 338.495 4.373 20 0 EIADMP Cc1cc(F)ccc1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310070953 1043099478 /nfs/dbraw/zinc/09/94/78/1043099478.db2.gz ACFSARWIWJXXAN-IBGZPJMESA-N 2 1 326.459 4.136 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cc(O)cc(F)c1 ZINC000185468202 1043186823 /nfs/dbraw/zinc/18/68/23/1043186823.db2.gz IIJFCXZSCUSGIP-INIZCTEOSA-N 2 1 342.458 4.196 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1cc(O)cc(F)c1 ZINC000185468202 1043186830 /nfs/dbraw/zinc/18/68/30/1043186830.db2.gz IIJFCXZSCUSGIP-INIZCTEOSA-N 2 1 342.458 4.196 20 0 EIADMP C[N@H+](CCCCC1CCOCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000499540058 1043216494 /nfs/dbraw/zinc/21/64/94/1043216494.db2.gz VIBAIQOCJLHCEF-UHFFFAOYSA-N 2 1 344.543 4.180 20 0 EIADMP C[N@@H+](CCCCC1CCOCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000499540058 1043216503 /nfs/dbraw/zinc/21/65/03/1043216503.db2.gz VIBAIQOCJLHCEF-UHFFFAOYSA-N 2 1 344.543 4.180 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C3(Cc4ccccc4)CC3)CC2)cc1 ZINC000186579200 1043293005 /nfs/dbraw/zinc/29/30/05/1043293005.db2.gz WZWNCSRORXMXSB-UHFFFAOYSA-N 2 1 334.507 4.058 20 0 EIADMP COc1ccc(-c2csc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000166764663 1043311788 /nfs/dbraw/zinc/31/17/88/1043311788.db2.gz FLTLUMNUFXXGPQ-ZWKOTPCHSA-N 2 1 342.508 4.140 20 0 EIADMP C[C@@H]1C[C@@H](Nc2cccc(F)c2C[NH3+])C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168011590 1043334277 /nfs/dbraw/zinc/33/42/77/1043334277.db2.gz PTVVMFCREJZXFP-ALXJQNPVSA-N 2 1 341.474 4.138 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc2ccccc2c1 ZINC000674049513 1043351493 /nfs/dbraw/zinc/35/14/93/1043351493.db2.gz PMUFPWXOQHSRON-VGSWGCGISA-N 2 1 338.495 4.134 20 0 EIADMP COc1cccc2cc(C[NH2+]CCC[N@H+](C)C3CCCCC3)oc21 ZINC000324253132 1043380005 /nfs/dbraw/zinc/38/00/05/1043380005.db2.gz BQPORBYHRKGDIC-UHFFFAOYSA-N 2 1 330.472 4.186 20 0 EIADMP COc1cccc2cc(C[NH2+]CCC[N@@H+](C)C3CCCCC3)oc21 ZINC000324253132 1043380013 /nfs/dbraw/zinc/38/00/13/1043380013.db2.gz BQPORBYHRKGDIC-UHFFFAOYSA-N 2 1 330.472 4.186 20 0 EIADMP CCCc1csc(C[NH2+]Cc2ccccc2C[NH+](CC)CC)n1 ZINC000494372723 1043453299 /nfs/dbraw/zinc/45/32/99/1043453299.db2.gz BYZXTNKGMFCFRR-UHFFFAOYSA-N 2 1 331.529 4.227 20 0 EIADMP Cc1cscc1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000494448261 1043490413 /nfs/dbraw/zinc/49/04/13/1043490413.db2.gz FJLVDSWIAOSEGE-ACDBMABISA-N 2 1 326.509 4.342 20 0 EIADMP C[N@@H+](CCCc1ccsc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000543032333 1043595130 /nfs/dbraw/zinc/59/51/30/1043595130.db2.gz LOJLKKYJYBNCPO-FQEVSTJZSA-N 2 1 328.525 4.135 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442643141 1043789688 /nfs/dbraw/zinc/78/96/88/1043789688.db2.gz GKRLKHAVODXWFK-YJBOKZPZSA-N 2 1 340.433 4.415 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cnn(C(C)C)c2C)c1 ZINC000191267114 1043803790 /nfs/dbraw/zinc/80/37/90/1043803790.db2.gz CTGASTRYSRYJTN-MRXNPFEDSA-N 2 1 328.504 4.075 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)CCS2 ZINC000191528779 1043823812 /nfs/dbraw/zinc/82/38/12/1043823812.db2.gz MODTVSOIZMSWNT-QGZVFWFLSA-N 2 1 334.529 4.085 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)CCS2 ZINC000191535780 1043824809 /nfs/dbraw/zinc/82/48/09/1043824809.db2.gz ZGNYFVITIOGBBW-QFBILLFUSA-N 2 1 348.556 4.190 20 0 EIADMP C[N@@H+](Cc1ccccc1C[NH2+]Cc1cncc(F)c1)C1CCCCC1 ZINC000494597224 1043838085 /nfs/dbraw/zinc/83/80/85/1043838085.db2.gz ONXPSLOEJABBJW-UHFFFAOYSA-N 2 1 341.474 4.275 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000442872455 1043873733 /nfs/dbraw/zinc/87/37/33/1043873733.db2.gz JNRWJFQWJJIIHR-HBFSDRIKSA-N 2 1 338.495 4.344 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000358343724 1044277187 /nfs/dbraw/zinc/27/71/87/1044277187.db2.gz UBLGSBIDTSWKHU-CRAIPNDOSA-N 2 1 336.520 4.320 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000358343724 1044277200 /nfs/dbraw/zinc/27/72/00/1044277200.db2.gz UBLGSBIDTSWKHU-CRAIPNDOSA-N 2 1 336.520 4.320 20 0 EIADMP COc1ccccc1CC[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000347969803 1044343131 /nfs/dbraw/zinc/34/31/31/1044343131.db2.gz WFRKEJQEQBATDQ-INIZCTEOSA-N 2 1 335.451 4.083 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1 ZINC000494880544 1044466158 /nfs/dbraw/zinc/46/61/58/1044466158.db2.gz SNLZLVMODBMLOP-LQWHRVPQSA-N 2 1 348.506 4.148 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001168473094 1044476460 /nfs/dbraw/zinc/47/64/60/1044476460.db2.gz JAICDESYSHZOHQ-SFHVURJKSA-N 2 1 340.486 4.401 20 0 EIADMP CCC(CC)(C[NH2+][C@H](C)C1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000675894938 1044544956 /nfs/dbraw/zinc/54/49/56/1044544956.db2.gz WFGUGAQOFCUOOK-MOPGFXCFSA-N 3 1 345.575 4.216 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(Cl)cc1 ZINC000675882629 1044551656 /nfs/dbraw/zinc/55/16/56/1044551656.db2.gz SZLQYLMENUDYBA-OALUTQOASA-N 2 1 336.907 4.024 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(Cl)s1 ZINC000675880105 1044552571 /nfs/dbraw/zinc/55/25/71/1044552571.db2.gz BFKIJGVEYVYTMH-CABCVRRESA-N 2 1 342.936 4.086 20 0 EIADMP CC(C)[C@H](O)[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000657744028 1044565243 /nfs/dbraw/zinc/56/52/43/1044565243.db2.gz CSRMBIHSQYFTGT-YADHBBJMSA-N 2 1 344.543 4.131 20 0 EIADMP Clc1cccc2c1SCC[C@H]2[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000360501540 1044732063 /nfs/dbraw/zinc/73/20/63/1044732063.db2.gz UGMXFFUBOYQYJS-QGZVFWFLSA-N 2 1 336.932 4.483 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2(Cc3cccnc3)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168031899 1044841429 /nfs/dbraw/zinc/84/14/29/1044841429.db2.gz DATRXQWHVYHMOA-HATOLVCRSA-N 2 1 349.522 4.188 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]C[C@@H]3CCC4(CCC4)O3)CC[N@@H+]2C2CC2)cc1 ZINC000895677915 1044845317 /nfs/dbraw/zinc/84/53/17/1044845317.db2.gz TXMRSVJHRKMXOT-GIVPXCGWSA-N 2 1 340.511 4.046 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]C[C@@H]3CCC4(CCC4)O3)CC[N@H+]2C2CC2)cc1 ZINC000895677915 1044845318 /nfs/dbraw/zinc/84/53/18/1044845318.db2.gz TXMRSVJHRKMXOT-GIVPXCGWSA-N 2 1 340.511 4.046 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000673600222 1044861011 /nfs/dbraw/zinc/86/10/11/1044861011.db2.gz WPAXHEQWJOTUKX-VOKWIDLSSA-N 2 1 338.417 4.325 20 0 EIADMP CCc1cccc(Cl)c1C[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000474358848 1044884019 /nfs/dbraw/zinc/88/40/19/1044884019.db2.gz UBALAWYZDJMWTP-UHFFFAOYSA-N 2 1 346.902 4.133 20 0 EIADMP CCC[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1cccnc1 ZINC000544570184 1044943513 /nfs/dbraw/zinc/94/35/13/1044943513.db2.gz WPZYJFSKSXZZKF-GHTZIAJQSA-N 2 1 325.500 4.423 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](CCCc2ccc(C)nc2)CC1)CC1CC1 ZINC000474465028 1045015847 /nfs/dbraw/zinc/01/58/47/1045015847.db2.gz BCENZIFWCMVGEQ-UHFFFAOYSA-N 2 1 343.559 4.157 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001168492900 1045323770 /nfs/dbraw/zinc/32/37/70/1045323770.db2.gz ZTXBKIFHWPXWEI-GOSISDBHSA-N 2 1 340.486 4.353 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001168492900 1045323776 /nfs/dbraw/zinc/32/37/76/1045323776.db2.gz ZTXBKIFHWPXWEI-GOSISDBHSA-N 2 1 340.486 4.353 20 0 EIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000236931450 1045370363 /nfs/dbraw/zinc/37/03/63/1045370363.db2.gz IVOQPSFCTJMHCQ-HNNXBMFYSA-N 2 1 332.875 4.422 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000236931450 1045370370 /nfs/dbraw/zinc/37/03/70/1045370370.db2.gz IVOQPSFCTJMHCQ-HNNXBMFYSA-N 2 1 332.875 4.422 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1F ZINC000237532413 1045388208 /nfs/dbraw/zinc/38/82/08/1045388208.db2.gz VPZOSECVWQZCCH-KRWDZBQOSA-N 2 1 326.459 4.449 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)s1 ZINC000237548726 1045388607 /nfs/dbraw/zinc/38/86/07/1045388607.db2.gz QHELRUFSBCFNFK-KRWDZBQOSA-N 2 1 342.552 4.284 20 0 EIADMP CCCc1cc(N2CCC[C@@H](c3[nH+]ccn3C)C2)c2ccccc2[nH+]1 ZINC000443963330 1045449326 /nfs/dbraw/zinc/44/93/26/1045449326.db2.gz UHNBCVPYZJRCCM-MRXNPFEDSA-N 2 1 334.467 4.305 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)C(c1ccccc1)c1ccccc1 ZINC000322881305 1045500861 /nfs/dbraw/zinc/50/08/61/1045500861.db2.gz BLOAPIBHLBFSTF-IRFPFTSISA-N 2 1 334.507 4.422 20 0 EIADMP CC[N@H+](CC1=CSC(=C2SC=CS2)S1)C1CC[NH2+]CC1 ZINC001235758353 1045502177 /nfs/dbraw/zinc/50/21/77/1045502177.db2.gz DPYJGCWOIMKDNI-UHFFFAOYSA-N 2 1 344.596 4.460 20 0 EIADMP CC[N@@H+](CC1=CSC(=C2SC=CS2)S1)C1CC[NH2+]CC1 ZINC001235758353 1045502184 /nfs/dbraw/zinc/50/21/84/1045502184.db2.gz DPYJGCWOIMKDNI-UHFFFAOYSA-N 2 1 344.596 4.460 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000429531729 1045677143 /nfs/dbraw/zinc/67/71/43/1045677143.db2.gz SFKZTMZPRWGJSX-ZFWWWQNUSA-N 2 1 330.394 4.062 20 0 EIADMP C[C@H]1C[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CCC[C@@H]1C[NH3+] ZINC001206026684 1045711613 /nfs/dbraw/zinc/71/16/13/1045711613.db2.gz TZBDZPMOSDNFDY-CMPLNLGQSA-N 2 1 335.706 4.454 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc(Br)c2)cc1 ZINC000768252821 1045765247 /nfs/dbraw/zinc/76/52/47/1045765247.db2.gz RJIISZDRIUTQSN-UHFFFAOYSA-N 2 1 347.300 4.143 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCSc1ccccc1 ZINC000397977363 1045818968 /nfs/dbraw/zinc/81/89/68/1045818968.db2.gz KZLAHAZGPLXGSG-WIYYLYMNSA-N 2 1 340.536 4.279 20 0 EIADMP c1nc(C2CCCC2)sc1CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246818803 1045832076 /nfs/dbraw/zinc/83/20/76/1045832076.db2.gz RHCXCGHKTMYJSZ-QFBILLFUSA-N 2 1 345.556 4.249 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccsc1 ZINC000247039042 1045838476 /nfs/dbraw/zinc/83/84/76/1045838476.db2.gz MPQDCVGCZALEEQ-IXDOHACOSA-N 2 1 344.524 4.208 20 0 EIADMP CC(=O)Nc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000248457111 1045874608 /nfs/dbraw/zinc/87/46/08/1045874608.db2.gz SUEHQWIOTYYKLJ-FGTMMUONSA-N 2 1 345.531 4.054 20 0 EIADMP C[C@H](Cc1ccccc1Cl)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001170250348 1045971603 /nfs/dbraw/zinc/97/16/03/1045971603.db2.gz KPKKZEFUQFTTAJ-IEBWSBKVSA-N 2 1 342.914 4.383 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000161521244 1046003243 /nfs/dbraw/zinc/00/32/43/1046003243.db2.gz SHLQQJRIXYIUDD-MRXNPFEDSA-N 2 1 342.458 4.150 20 0 EIADMP Cc1cc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c2[nH+]ccn2c1 ZINC001170332347 1046003354 /nfs/dbraw/zinc/00/33/54/1046003354.db2.gz DNVARIZVWHWWLQ-OWZKRDHZSA-N 2 1 346.478 4.250 20 0 EIADMP Cc1cc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c2[nH+]ccn2c1 ZINC001170332347 1046003367 /nfs/dbraw/zinc/00/33/67/1046003367.db2.gz DNVARIZVWHWWLQ-OWZKRDHZSA-N 2 1 346.478 4.250 20 0 EIADMP c1[nH]c2ccc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)cc2[nH+]1 ZINC001170337854 1046018784 /nfs/dbraw/zinc/01/87/84/1046018784.db2.gz ZZBVKWNWZKLKRQ-LDLYASANSA-N 2 1 332.451 4.170 20 0 EIADMP c1[nH]c2ccc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)cc2[nH+]1 ZINC001170337854 1046018799 /nfs/dbraw/zinc/01/87/99/1046018799.db2.gz ZZBVKWNWZKLKRQ-LDLYASANSA-N 2 1 332.451 4.170 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCC[C@H](CC(C)C)C2)cn1 ZINC000792922668 1046108629 /nfs/dbraw/zinc/10/86/29/1046108629.db2.gz QFESFQGRSSYWFI-IEBWSBKVSA-N 2 1 326.488 4.270 20 0 EIADMP COc1ccccc1-c1ccc([C@@H](C)[N@@H+](C)C[C@@H]2CCC[NH2+]C2)cc1 ZINC000261745938 1046144452 /nfs/dbraw/zinc/14/44/52/1046144452.db2.gz BWMYVDZTRPWFBR-QZTJIDSGSA-N 2 1 338.495 4.355 20 0 EIADMP CCOc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+](C)CC)c1 ZINC000123984163 1046208779 /nfs/dbraw/zinc/20/87/79/1046208779.db2.gz XSEUFDSINBKSKY-KRWDZBQOSA-N 2 1 326.484 4.388 20 0 EIADMP C[C@H]([NH2+]CCc1cccc(F)c1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508710051 1046365442 /nfs/dbraw/zinc/36/54/42/1046365442.db2.gz KVEZBTYQWLFUND-LPHOPBHVSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@H]([NH2+]CCc1cc(F)cc(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508712198 1046370730 /nfs/dbraw/zinc/37/07/30/1046370730.db2.gz CHGFJHWTZUOCLR-LPHOPBHVSA-N 2 1 344.449 4.008 20 0 EIADMP C[C@@H]([NH2+]CCc1ccc(Cl)s1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508718465 1046376353 /nfs/dbraw/zinc/37/63/53/1046376353.db2.gz IZAOAWBQCPDPEG-NVXWUHKLSA-N 2 1 348.943 4.444 20 0 EIADMP C[C@H]([NH2+]CCc1c[nH]c2ccccc12)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508715708 1046381137 /nfs/dbraw/zinc/38/11/37/1046381137.db2.gz XHNHYORWEGNHNP-RXVVDRJESA-N 2 1 347.506 4.211 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000508722031 1046420580 /nfs/dbraw/zinc/42/05/80/1046420580.db2.gz QUTGCHMSSXOLLZ-GHTZIAJQSA-N 2 1 338.495 4.004 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2OCC2CC2)CC1 ZINC000536652558 1046595699 /nfs/dbraw/zinc/59/56/99/1046595699.db2.gz XGNPXHPYCRGVDU-UHFFFAOYSA-N 2 1 330.516 4.028 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@@H]1C ZINC000536659109 1046613363 /nfs/dbraw/zinc/61/33/63/1046613363.db2.gz FHRSUOVCMROXQR-KBXCAEBGSA-N 2 1 346.906 4.035 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@@H]1C ZINC000536659109 1046613374 /nfs/dbraw/zinc/61/33/74/1046613374.db2.gz FHRSUOVCMROXQR-KBXCAEBGSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@@H]1C ZINC000536659109 1046613388 /nfs/dbraw/zinc/61/33/88/1046613388.db2.gz FHRSUOVCMROXQR-KBXCAEBGSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@@H]1C ZINC000536659109 1046613403 /nfs/dbraw/zinc/61/34/03/1046613403.db2.gz FHRSUOVCMROXQR-KBXCAEBGSA-N 2 1 346.906 4.035 20 0 EIADMP COc1ccc(-c2ccccc2)cc1CN(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000536661961 1046631207 /nfs/dbraw/zinc/63/12/07/1046631207.db2.gz JKENQNLPXJFYDB-UTKZUKDTSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@H+](C)[C@H]1CCN(C)[C@H](C)C1 ZINC000536661961 1046631212 /nfs/dbraw/zinc/63/12/12/1046631212.db2.gz JKENQNLPXJFYDB-UTKZUKDTSA-N 2 1 338.495 4.277 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)[C@H]1CCN(C)[C@H](C)C1 ZINC000536661961 1046631222 /nfs/dbraw/zinc/63/12/22/1046631222.db2.gz JKENQNLPXJFYDB-UTKZUKDTSA-N 2 1 338.495 4.277 20 0 EIADMP c1csc([C@H]([NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)C2CCCC2)c1 ZINC000772457386 1046643425 /nfs/dbraw/zinc/64/34/25/1046643425.db2.gz VMPOEVITXLCNDV-AZUAARDMSA-N 2 1 348.556 4.212 20 0 EIADMP C[N@H+](Cc1cccc2cc[nH]c21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536677260 1046663983 /nfs/dbraw/zinc/66/39/83/1046663983.db2.gz GSABXYYCRSFLLN-LJQANCHMSA-N 2 1 333.479 4.122 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)[C@H](C)C1 ZINC000536682262 1046685263 /nfs/dbraw/zinc/68/52/63/1046685263.db2.gz BJCDJJXDORATLU-IIBYNOLFSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc3cc(OC)ccc3c2)[C@H](C)C1 ZINC000536682262 1046685266 /nfs/dbraw/zinc/68/52/66/1046685266.db2.gz BJCDJJXDORATLU-IIBYNOLFSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc3cc(OC)ccc3c2)[C@H](C)C1 ZINC000536682262 1046685269 /nfs/dbraw/zinc/68/52/69/1046685269.db2.gz BJCDJJXDORATLU-IIBYNOLFSA-N 2 1 326.484 4.011 20 0 EIADMP Cc1ccc(CC[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000536714376 1046706320 /nfs/dbraw/zinc/70/63/20/1046706320.db2.gz XXEFSYPTJKPYOM-UHFFFAOYSA-N 2 1 337.511 4.171 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCOc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379624693 1046715532 /nfs/dbraw/zinc/71/55/32/1046715532.db2.gz JRDUVMUTZSYSOT-FPOVZHCZSA-N 2 1 338.495 4.098 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCCOc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379624693 1046715549 /nfs/dbraw/zinc/71/55/49/1046715549.db2.gz JRDUVMUTZSYSOT-FPOVZHCZSA-N 2 1 338.495 4.098 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379657624 1046760313 /nfs/dbraw/zinc/76/03/13/1046760313.db2.gz UAPVFNOKVQHUJN-LVCYWYKZSA-N 2 1 338.495 4.399 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379657624 1046760325 /nfs/dbraw/zinc/76/03/25/1046760325.db2.gz UAPVFNOKVQHUJN-LVCYWYKZSA-N 2 1 338.495 4.399 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000536834390 1046810925 /nfs/dbraw/zinc/81/09/25/1046810925.db2.gz USIHMEZJQBFJAG-XKQJLSEDSA-N 2 1 328.422 4.475 20 0 EIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000536834390 1046810926 /nfs/dbraw/zinc/81/09/26/1046810926.db2.gz USIHMEZJQBFJAG-XKQJLSEDSA-N 2 1 328.422 4.475 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccc(OCC2CC2)c(F)c1 ZINC000537123101 1046953918 /nfs/dbraw/zinc/95/39/18/1046953918.db2.gz CMRWDMLZFHNVEX-MAUKXSAKSA-N 2 1 334.479 4.140 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(OCC2CC2)c(F)c1 ZINC000537123101 1046953928 /nfs/dbraw/zinc/95/39/28/1046953928.db2.gz CMRWDMLZFHNVEX-MAUKXSAKSA-N 2 1 334.479 4.140 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000129139536 1047312377 /nfs/dbraw/zinc/31/23/77/1047312377.db2.gz QYIKSRQEKXXLAG-UHFFFAOYSA-N 2 1 335.451 4.290 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000129139536 1047312390 /nfs/dbraw/zinc/31/23/90/1047312390.db2.gz QYIKSRQEKXXLAG-UHFFFAOYSA-N 2 1 335.451 4.290 20 0 EIADMP c1[nH+]c(C2CC[NH+](C[C@@H]3CCc4ccccc43)CC2)n2c1CCCC2 ZINC000789351994 1047401610 /nfs/dbraw/zinc/40/16/10/1047401610.db2.gz BRJGFZOTQJDLQE-IBGZPJMESA-N 2 1 335.495 4.129 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000556052693 1047417356 /nfs/dbraw/zinc/41/73/56/1047417356.db2.gz KWODHMSWKAOPGL-PMACEKPBSA-N 2 1 328.887 4.308 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000556052693 1047417360 /nfs/dbraw/zinc/41/73/60/1047417360.db2.gz KWODHMSWKAOPGL-PMACEKPBSA-N 2 1 328.887 4.308 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c(C)o1 ZINC000556064112 1047430295 /nfs/dbraw/zinc/43/02/95/1047430295.db2.gz UCCNHDDYVMBLGJ-FXAWDEMLSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)c(C)o1 ZINC000556064112 1047430306 /nfs/dbraw/zinc/43/03/06/1047430306.db2.gz UCCNHDDYVMBLGJ-FXAWDEMLSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](Cc1ccccc1Cl)C1CC1 ZINC000556077241 1047433454 /nfs/dbraw/zinc/43/34/54/1047433454.db2.gz VDCNXXPBFVAICB-KUHUBIRLSA-N 2 1 331.891 4.092 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556076012 1047434737 /nfs/dbraw/zinc/43/47/37/1047434737.db2.gz HUNBFIGTEPIXGK-NHCUHLMSSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556076012 1047434742 /nfs/dbraw/zinc/43/47/42/1047434742.db2.gz HUNBFIGTEPIXGK-NHCUHLMSSA-N 2 1 338.495 4.189 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000556103324 1047454097 /nfs/dbraw/zinc/45/40/97/1047454097.db2.gz MMPJNUJPYYWOOR-RTWAWAEBSA-N 2 1 344.543 4.399 20 0 EIADMP CCOCCC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000556103324 1047454106 /nfs/dbraw/zinc/45/41/06/1047454106.db2.gz MMPJNUJPYYWOOR-RTWAWAEBSA-N 2 1 344.543 4.399 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCCNc2ccccc2F)C[C@H]1c1ccccc1 ZINC000556172915 1047536515 /nfs/dbraw/zinc/53/65/15/1047536515.db2.gz CQLNYDPZCBFJIV-RXVVDRJESA-N 2 1 341.474 4.053 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCCNc2ccccc2F)C[C@H]1c1ccccc1 ZINC000556172915 1047536523 /nfs/dbraw/zinc/53/65/23/1047536523.db2.gz CQLNYDPZCBFJIV-RXVVDRJESA-N 2 1 341.474 4.053 20 0 EIADMP CCCNc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556178522 1047539906 /nfs/dbraw/zinc/53/99/06/1047539906.db2.gz JGCOKBKUFLCMCK-YADHBBJMSA-N 2 1 337.511 4.434 20 0 EIADMP CCCNc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556178522 1047539914 /nfs/dbraw/zinc/53/99/14/1047539914.db2.gz JGCOKBKUFLCMCK-YADHBBJMSA-N 2 1 337.511 4.434 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C1(C)C ZINC000556179636 1047541778 /nfs/dbraw/zinc/54/17/78/1047541778.db2.gz URIJMELPMOVCGE-ZGXWSNOMSA-N 2 1 330.516 4.004 20 0 EIADMP CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C1(C)C ZINC000556179636 1047541788 /nfs/dbraw/zinc/54/17/88/1047541788.db2.gz URIJMELPMOVCGE-ZGXWSNOMSA-N 2 1 330.516 4.004 20 0 EIADMP CCCC[C@@H](COC)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000556233067 1047595794 /nfs/dbraw/zinc/59/57/94/1047595794.db2.gz FOCPHBYJUNQWIO-KBWCOIMZSA-N 2 1 332.532 4.224 20 0 EIADMP CCC[C@@H](CC)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231266 1047596061 /nfs/dbraw/zinc/59/60/61/1047596061.db2.gz UNPJRFAEUQDCEA-LEWJYISDSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242189 1047622874 /nfs/dbraw/zinc/62/28/74/1047622874.db2.gz RJIGLFQNEXNFOK-FDTGPBLFSA-N 2 1 334.507 4.290 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242189 1047622880 /nfs/dbraw/zinc/62/28/80/1047622880.db2.gz RJIGLFQNEXNFOK-FDTGPBLFSA-N 2 1 334.507 4.290 20 0 EIADMP C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550643955 1047801507 /nfs/dbraw/zinc/80/15/07/1047801507.db2.gz HYXWBVCNOOBVMN-NQSCKRDGSA-N 2 1 338.495 4.138 20 0 EIADMP C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550643955 1047801509 /nfs/dbraw/zinc/80/15/09/1047801509.db2.gz HYXWBVCNOOBVMN-NQSCKRDGSA-N 2 1 338.495 4.138 20 0 EIADMP Cc1cc(F)ccc1CC[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550680212 1047814405 /nfs/dbraw/zinc/81/44/05/1047814405.db2.gz JFRGNXJXGSXPGI-NHCUHLMSSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1cc(F)ccc1CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550680212 1047814408 /nfs/dbraw/zinc/81/44/08/1047814408.db2.gz JFRGNXJXGSXPGI-NHCUHLMSSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1cc(F)ccc1CC[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550680211 1047814604 /nfs/dbraw/zinc/81/46/04/1047814604.db2.gz JFRGNXJXGSXPGI-LEWJYISDSA-N 2 1 326.459 4.102 20 0 EIADMP Cc1cc(F)ccc1CC[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550680211 1047814605 /nfs/dbraw/zinc/81/46/05/1047814605.db2.gz JFRGNXJXGSXPGI-LEWJYISDSA-N 2 1 326.459 4.102 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000498771053 1047843028 /nfs/dbraw/zinc/84/30/28/1047843028.db2.gz WGWCYOJAUHEAQS-FQEVSTJZSA-N 2 1 341.886 4.228 20 0 EIADMP Clc1c[nH+]ccc1N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000498771053 1047843037 /nfs/dbraw/zinc/84/30/37/1047843037.db2.gz WGWCYOJAUHEAQS-FQEVSTJZSA-N 2 1 341.886 4.228 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000131295016 1047859845 /nfs/dbraw/zinc/85/98/45/1047859845.db2.gz YUTBIOTUFKSOFJ-QZTJIDSGSA-N 3 1 342.531 4.342 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000131294867 1047860537 /nfs/dbraw/zinc/86/05/37/1047860537.db2.gz YUTBIOTUFKSOFJ-ROUUACIJSA-N 3 1 342.531 4.342 20 0 EIADMP c1ccc(CC[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000814172734 1047865271 /nfs/dbraw/zinc/86/52/71/1047865271.db2.gz AYQWAVFRWBPYJH-NOTZXAQLSA-N 2 1 334.507 4.404 20 0 EIADMP C[N@@H+](C1CCC([NH3+])CC1)[C@@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171063036 1047905098 /nfs/dbraw/zinc/90/50/98/1047905098.db2.gz LAKUISFDEYPUSC-YMAMQOFZSA-N 2 1 327.299 4.052 20 0 EIADMP C[C@@]1(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1(Cl)Cl ZINC000824969683 1048013074 /nfs/dbraw/zinc/01/30/74/1048013074.db2.gz HXRBEXBMGWWKNA-QGZVFWFLSA-N 2 1 341.326 4.215 20 0 EIADMP FC1(F)CC([NH2+][C@@H]2CCCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000556887849 1048099895 /nfs/dbraw/zinc/09/98/95/1048099895.db2.gz MGQXTUWWPAZQGA-NZSAHSFTSA-N 2 1 334.454 4.065 20 0 EIADMP CCC[N@H+](CCC[NH+](C)C)Cc1cc(F)c(OCC)c(Cl)c1 ZINC001143746394 1048182280 /nfs/dbraw/zinc/18/22/80/1048182280.db2.gz RCOUAHDASDTWCC-UHFFFAOYSA-N 2 1 330.875 4.042 20 0 EIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1cc(F)c(OCC)c(Cl)c1 ZINC001143746394 1048182283 /nfs/dbraw/zinc/18/22/83/1048182283.db2.gz RCOUAHDASDTWCC-UHFFFAOYSA-N 2 1 330.875 4.042 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CCc3cccs3)C2)s1 ZINC000844325997 1048296124 /nfs/dbraw/zinc/29/61/24/1048296124.db2.gz FQWNLGRSSQBMTP-MRXNPFEDSA-N 2 1 334.554 4.114 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CCc3cccs3)C2)s1 ZINC000844325997 1048296138 /nfs/dbraw/zinc/29/61/38/1048296138.db2.gz FQWNLGRSSQBMTP-MRXNPFEDSA-N 2 1 334.554 4.114 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CCc3cccs3)C2)s1 ZINC000844325997 1048296150 /nfs/dbraw/zinc/29/61/50/1048296150.db2.gz FQWNLGRSSQBMTP-MRXNPFEDSA-N 2 1 334.554 4.114 20 0 EIADMP c1ccc(CCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000499163146 1048370830 /nfs/dbraw/zinc/37/08/30/1048370830.db2.gz UEGQAMLYHRTDNE-WBDAEOGXSA-N 2 1 334.507 4.404 20 0 EIADMP CC(C)CSCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499194656 1048394103 /nfs/dbraw/zinc/39/41/03/1048394103.db2.gz SCPHGIWHVNKROO-OWZKRDHZSA-N 2 1 332.557 4.161 20 0 EIADMP CC[NH+]1CCC([N@H+](C)[C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171162227 1048597064 /nfs/dbraw/zinc/59/70/64/1048597064.db2.gz IXFZSFIYNGZAEW-MRXNPFEDSA-N 2 1 341.326 4.267 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171162227 1048597075 /nfs/dbraw/zinc/59/70/75/1048597075.db2.gz IXFZSFIYNGZAEW-MRXNPFEDSA-N 2 1 341.326 4.267 20 0 EIADMP c1nc2cc(C[N@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ccc2s1 ZINC001144737124 1048839362 /nfs/dbraw/zinc/83/93/62/1048839362.db2.gz NTQNFMCILWKSIN-KRWDZBQOSA-N 2 1 329.513 4.137 20 0 EIADMP c1nc2cc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ccc2s1 ZINC001144737124 1048839366 /nfs/dbraw/zinc/83/93/66/1048839366.db2.gz NTQNFMCILWKSIN-KRWDZBQOSA-N 2 1 329.513 4.137 20 0 EIADMP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc2scnc2c1 ZINC001144743263 1048848698 /nfs/dbraw/zinc/84/86/98/1048848698.db2.gz HIVHAURPADHAJR-IRXDYDNUSA-N 2 1 329.513 4.135 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc2scnc2c1 ZINC001144743263 1048848702 /nfs/dbraw/zinc/84/87/02/1048848702.db2.gz HIVHAURPADHAJR-IRXDYDNUSA-N 2 1 329.513 4.135 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccc2scnc2c1 ZINC001144743263 1048848706 /nfs/dbraw/zinc/84/87/06/1048848706.db2.gz HIVHAURPADHAJR-IRXDYDNUSA-N 2 1 329.513 4.135 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccc2scnc2c1 ZINC001144743263 1048848708 /nfs/dbraw/zinc/84/87/08/1048848708.db2.gz HIVHAURPADHAJR-IRXDYDNUSA-N 2 1 329.513 4.135 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CC2([NH3+])CCCCC2)ccc1SC(F)F ZINC000817938433 1049060605 /nfs/dbraw/zinc/06/06/05/1049060605.db2.gz KKWSNYODPHBTQQ-GFCCVEGCSA-N 2 1 344.471 4.322 20 0 EIADMP Cc1[nH+]ccc(N([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)c1F ZINC001170648463 1049316915 /nfs/dbraw/zinc/31/69/15/1049316915.db2.gz YGSRBUBUWQLHCO-QQGUTBHFSA-N 2 1 339.458 4.162 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCCNc2ccccc21)[N@@H+](C)Cc1ccccc1 ZINC000348097587 1049416006 /nfs/dbraw/zinc/41/60/06/1049416006.db2.gz WQQBUJDVEKAHFB-XMSQKQJNSA-N 2 1 337.511 4.434 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000136688116 1049500062 /nfs/dbraw/zinc/50/00/62/1049500062.db2.gz OIDHOQDDCPKWOA-FQEVSTJZSA-N 2 1 344.543 4.226 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CCCO1 ZINC000820829450 1049563174 /nfs/dbraw/zinc/56/31/74/1049563174.db2.gz JLOLZGTZHBMGKF-DSBNJHONSA-N 2 1 342.527 4.119 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccc2c(c1)CCO2 ZINC000773079761 1049569263 /nfs/dbraw/zinc/56/92/63/1049569263.db2.gz YVNXBFMWAAPUND-YLJYHZDGSA-N 2 1 330.516 4.030 20 0 EIADMP Fc1cccc2c1CC[C@@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001171434020 1049674820 /nfs/dbraw/zinc/67/48/20/1049674820.db2.gz PMPLLEMGYBUIAV-RBUKOAKNSA-N 2 1 330.491 4.023 20 0 EIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCc2c(F)cccc2C1 ZINC001171445372 1049697190 /nfs/dbraw/zinc/69/71/90/1049697190.db2.gz JRUOPZCEFFNEAJ-FQEVSTJZSA-N 2 1 344.518 4.412 20 0 EIADMP Fc1cc2c(cc1F)C[C@@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001171486350 1049717303 /nfs/dbraw/zinc/71/73/03/1049717303.db2.gz BPLIABWPBCWRNO-MOPGFXCFSA-N 2 1 348.481 4.163 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495141 1049720493 /nfs/dbraw/zinc/72/04/93/1049720493.db2.gz XTNDEBFJWRHBDH-IPMKNSEASA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495141 1049720508 /nfs/dbraw/zinc/72/05/08/1049720508.db2.gz XTNDEBFJWRHBDH-IPMKNSEASA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495141 1049720513 /nfs/dbraw/zinc/72/05/13/1049720513.db2.gz XTNDEBFJWRHBDH-IPMKNSEASA-N 2 1 348.481 4.161 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001171549487 1049752369 /nfs/dbraw/zinc/75/23/69/1049752369.db2.gz BIQMJWUUJMPWAQ-VJBMBRPKSA-N 2 1 348.534 4.495 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001171549487 1049752375 /nfs/dbraw/zinc/75/23/75/1049752375.db2.gz BIQMJWUUJMPWAQ-VJBMBRPKSA-N 2 1 348.534 4.495 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171558895 1049755237 /nfs/dbraw/zinc/75/52/37/1049755237.db2.gz PYKAJMZQSLHPFR-BVSLBCMMSA-N 2 1 349.522 4.019 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CC[N@@H+]1C ZINC000245511791 1049758248 /nfs/dbraw/zinc/75/82/48/1049758248.db2.gz ZDRAUEKUEALHPC-AHEZYBDSSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CC[N@H+]1C ZINC000245511791 1049758254 /nfs/dbraw/zinc/75/82/54/1049758254.db2.gz ZDRAUEKUEALHPC-AHEZYBDSSA-N 2 1 340.433 4.414 20 0 EIADMP C[NH+]1C(C)(C)CC([N@@H+]2C[C@H]3[C@@H](C2)CCC[C@@H]3OCC2CC2)CC1(C)C ZINC001171638618 1049778553 /nfs/dbraw/zinc/77/85/53/1049778553.db2.gz XJYXEHSKWPRFPE-HOJAQTOUSA-N 2 1 348.575 4.165 20 0 EIADMP C[NH+]1C(C)(C)CC([N@@H+]2C[C@H]3[C@@H](C2)CCC[C@H]3OCC2CC2)CC1(C)C ZINC001171638619 1049779486 /nfs/dbraw/zinc/77/94/86/1049779486.db2.gz XJYXEHSKWPRFPE-YZGWKJHDSA-N 2 1 348.575 4.165 20 0 EIADMP COc1ccccc1C[C@@H](C)[N@@H+](C)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642754 1049781096 /nfs/dbraw/zinc/78/10/96/1049781096.db2.gz MEYTYBSFHZVVGH-MRXNPFEDSA-N 2 1 332.532 4.209 20 0 EIADMP Cc1cccc2c(CC[NH3+])cn([C@@H]3C[C@H](C)[N@H+](Cc4ccccc4)C3)c21 ZINC001171726354 1049785482 /nfs/dbraw/zinc/78/54/82/1049785482.db2.gz VERMBNJPXMICEV-GHTZIAJQSA-N 2 1 347.506 4.286 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC[C@@H]2CC2(Cl)Cl)cc1 ZINC000822822753 1049801377 /nfs/dbraw/zinc/80/13/77/1049801377.db2.gz UFOWTNLYMCHATC-SWLSCSKDSA-N 2 1 338.282 4.415 20 0 EIADMP C[C@@H]1C[C@H](NC(=[NH2+])c2ccc(F)c(Cl)c2)C[N@@H+]1Cc1ccccc1 ZINC001171740571 1049802051 /nfs/dbraw/zinc/80/20/51/1049802051.db2.gz SKBOCVISIOQFFA-CJNGLKHVSA-N 2 1 345.849 4.057 20 0 EIADMP C[C@@H]1C[C@H](NC(=[NH2+])c2ccc(F)c(Cl)c2)C[N@H+]1Cc1ccccc1 ZINC001171740571 1049802054 /nfs/dbraw/zinc/80/20/54/1049802054.db2.gz SKBOCVISIOQFFA-CJNGLKHVSA-N 2 1 345.849 4.057 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CCCC[C@@H]1[NH+](C)C ZINC001171959604 1049823282 /nfs/dbraw/zinc/82/32/82/1049823282.db2.gz CNBSIJZAZFVCGU-COXVUDFISA-N 2 1 328.422 4.099 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001171960694 1049824158 /nfs/dbraw/zinc/82/41/58/1049824158.db2.gz GIPFZLBHSJRLMR-RUGDWHBFSA-N 2 1 340.433 4.241 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001171960694 1049824159 /nfs/dbraw/zinc/82/41/59/1049824159.db2.gz GIPFZLBHSJRLMR-RUGDWHBFSA-N 2 1 340.433 4.241 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171966443 1049826606 /nfs/dbraw/zinc/82/66/06/1049826606.db2.gz UTDVSGLBUZNBNQ-HXUWFJFHSA-N 2 1 326.459 4.359 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2cccc(F)c2)CC[N@H+]1Cc1ccccc1 ZINC001171966443 1049826607 /nfs/dbraw/zinc/82/66/07/1049826607.db2.gz UTDVSGLBUZNBNQ-HXUWFJFHSA-N 2 1 326.459 4.359 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cccc(O)c1 ZINC001171967890 1049827840 /nfs/dbraw/zinc/82/78/40/1049827840.db2.gz NXPATKNCGAOEEB-XLIONFOSSA-N 2 1 338.495 4.486 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccc(O)c1 ZINC001171967890 1049827842 /nfs/dbraw/zinc/82/78/42/1049827842.db2.gz NXPATKNCGAOEEB-XLIONFOSSA-N 2 1 338.495 4.486 20 0 EIADMP CC1(C)C[C@@H](n2c3ccccc3nc2C[NH3+])CC[N@H+]1Cc1ccccc1 ZINC001171966574 1049828303 /nfs/dbraw/zinc/82/83/03/1049828303.db2.gz VNDORPAFLQXIRT-SFHVURJKSA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@H]([NH+]2CCC(C(F)F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171988968 1049831754 /nfs/dbraw/zinc/83/17/54/1049831754.db2.gz YEQIOKUWPLEYLD-GOSISDBHSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C(C)(C)O1 ZINC000245720021 1049838813 /nfs/dbraw/zinc/83/88/13/1049838813.db2.gz OOQTYJZGAFMGEI-HAGHYFMRSA-N 2 1 342.527 4.118 20 0 EIADMP Cc1ncsc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980619 1049839454 /nfs/dbraw/zinc/83/94/54/1049839454.db2.gz WAOHHXGTOQJFNN-SFHVURJKSA-N 2 1 343.540 4.027 20 0 EIADMP CC1(C)C[C@H]([NH2+]CC2Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001171979042 1049839461 /nfs/dbraw/zinc/83/94/61/1049839461.db2.gz KMTYVMWTXUZCDI-HSZRJFAPSA-N 2 1 348.534 4.434 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CC[C@H](c3ccccn3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171983818 1049840017 /nfs/dbraw/zinc/84/00/17/1049840017.db2.gz GWHZCPGRAPDMNJ-SFTDATJTSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CC[C@H](c3ccccn3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983818 1049840020 /nfs/dbraw/zinc/84/00/20/1049840020.db2.gz GWHZCPGRAPDMNJ-SFTDATJTSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CC[C@H](c3ccccn3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983818 1049840025 /nfs/dbraw/zinc/84/00/25/1049840025.db2.gz GWHZCPGRAPDMNJ-SFTDATJTSA-N 2 1 349.522 4.314 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccc(N)cc1 ZINC001171984846 1049840303 /nfs/dbraw/zinc/84/03/03/1049840303.db2.gz YCKPOFSKWIREJF-LAUBAEHRSA-N 2 1 337.511 4.363 20 0 EIADMP CO[C@@H]1CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172076428 1049844589 /nfs/dbraw/zinc/84/45/89/1049844589.db2.gz YMXXYPSAOGUMMB-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP CO[C@@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172076428 1049844591 /nfs/dbraw/zinc/84/45/91/1049844591.db2.gz YMXXYPSAOGUMMB-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP CO[C@@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172076428 1049844596 /nfs/dbraw/zinc/84/45/96/1049844596.db2.gz YMXXYPSAOGUMMB-CLAROIROSA-N 2 1 342.527 4.073 20 0 EIADMP C[C@@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062337 1049850111 /nfs/dbraw/zinc/85/01/11/1049850111.db2.gz NELUWNOIFSTXJW-AYWYSENESA-N 2 1 335.495 4.318 20 0 EIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062337 1049850116 /nfs/dbraw/zinc/85/01/16/1049850116.db2.gz NELUWNOIFSTXJW-AYWYSENESA-N 2 1 335.495 4.318 20 0 EIADMP c1cc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cs1 ZINC001172064441 1049850759 /nfs/dbraw/zinc/85/07/59/1049850759.db2.gz GBGFHMCZRLFEED-OWZKRDHZSA-N 2 1 326.509 4.423 20 0 EIADMP F[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067366 1049850786 /nfs/dbraw/zinc/85/07/86/1049850786.db2.gz MZOOMGKLVHYUFU-FDKIHUSFSA-N 2 1 330.491 4.442 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccncc1 ZINC001172064786 1049851585 /nfs/dbraw/zinc/85/15/85/1049851585.db2.gz JPPHKUJKYSZQNR-AGOPTVSRSA-N 2 1 335.495 4.318 20 0 EIADMP CCCC(O)(CCC)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245777053 1049853647 /nfs/dbraw/zinc/85/36/47/1049853647.db2.gz YGWYMWBIMYDRSF-WKCHPHFGSA-N 2 1 344.543 4.103 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cnc(-c3cccs3)s2)[C@@H](C)C1 ZINC000245799476 1049856524 /nfs/dbraw/zinc/85/65/24/1049856524.db2.gz XOICAUXEWHXHJJ-DZGCQCFKSA-N 2 1 335.542 4.034 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCCc1ccc(C(F)(F)F)cc1)C2 ZINC001172107435 1049856622 /nfs/dbraw/zinc/85/66/22/1049856622.db2.gz XPIYDLPJSZNELM-BCDXTJNWSA-N 2 1 340.433 4.243 20 0 EIADMP Cc1c(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cccc1C(F)(F)F ZINC001172106226 1049857275 /nfs/dbraw/zinc/85/72/75/1049857275.db2.gz NREYQCFCLXXIJD-PHZGNYQRSA-N 2 1 326.406 4.119 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1c(Cl)cccc1C(F)(F)F)C2 ZINC001172104151 1049857383 /nfs/dbraw/zinc/85/73/83/1049857383.db2.gz AHZGMZGDMVKYTC-CLLJXQQHSA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1c(Cl)cccc1C(F)(F)F)C2 ZINC001172104151 1049857387 /nfs/dbraw/zinc/85/73/87/1049857387.db2.gz AHZGMZGDMVKYTC-CLLJXQQHSA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC3(CCCc4ccccc43)CC1)C2 ZINC001172120679 1049858703 /nfs/dbraw/zinc/85/87/03/1049858703.db2.gz LMJOYVGRJXWKGW-WKCHPHFGSA-N 2 1 338.539 4.372 20 0 EIADMP CC(C)C[C@@H]([NH3+])c1nc2ccccc2n1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172118816 1049859095 /nfs/dbraw/zinc/85/90/95/1049859095.db2.gz TVWVLNATGRGVMY-VSZNYVQBSA-N 2 1 340.515 4.270 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Oc3cccc(Cl)c3)CC1)C2 ZINC001172122330 1049859353 /nfs/dbraw/zinc/85/93/53/1049859353.db2.gz PCTHIFRYDXJIIJ-PIIMJCKOSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(Oc3cccc(Cl)c3)CC1)C2 ZINC001172122330 1049859354 /nfs/dbraw/zinc/85/93/54/1049859354.db2.gz PCTHIFRYDXJIIJ-PIIMJCKOSA-N 2 1 348.918 4.199 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCc3c(cccc3C(F)(F)F)C1)C2 ZINC001172123531 1049860297 /nfs/dbraw/zinc/86/02/97/1049860297.db2.gz DUVMIJWIKREUOR-MUJYYYPQSA-N 2 1 338.417 4.079 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCc3c(cccc3C(F)(F)F)C1)C2 ZINC001172123531 1049860300 /nfs/dbraw/zinc/86/03/00/1049860300.db2.gz DUVMIJWIKREUOR-MUJYYYPQSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCc3c(cccc3C(F)(F)F)C1)C2 ZINC001172123531 1049860304 /nfs/dbraw/zinc/86/03/04/1049860304.db2.gz DUVMIJWIKREUOR-MUJYYYPQSA-N 2 1 338.417 4.079 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCc3c(cccc3C(F)(F)F)C1)C2 ZINC001172123531 1049860308 /nfs/dbraw/zinc/86/03/08/1049860308.db2.gz DUVMIJWIKREUOR-MUJYYYPQSA-N 2 1 338.417 4.079 20 0 EIADMP CC(C)(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CSc2ccccc2C1 ZINC001172199246 1049869245 /nfs/dbraw/zinc/86/92/45/1049869245.db2.gz UEWMTECKUXQVBA-KZNAEPCWSA-N 2 1 332.557 4.321 20 0 EIADMP COCCC[NH+]1CCC([NH+](C2CCCCC2)C2CCCCC2)CC1 ZINC001172249320 1049872411 /nfs/dbraw/zinc/87/24/11/1049872411.db2.gz JHNIKIQDPHCPIK-UHFFFAOYSA-N 2 1 336.564 4.455 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001172319422 1049877529 /nfs/dbraw/zinc/87/75/29/1049877529.db2.gz QUNPRFHXWOVOBT-OOOLTRJPSA-N 2 1 344.543 4.080 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172326881 1049880069 /nfs/dbraw/zinc/88/00/69/1049880069.db2.gz BSOGAMSJXQTCEL-ZJOUEHCJSA-N 2 1 346.559 4.470 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172326881 1049880072 /nfs/dbraw/zinc/88/00/72/1049880072.db2.gz BSOGAMSJXQTCEL-ZJOUEHCJSA-N 2 1 346.559 4.470 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(OC)cc2)C1 ZINC000245954242 1049882835 /nfs/dbraw/zinc/88/28/35/1049882835.db2.gz LNQZOYFYNILALM-PGRDOPGGSA-N 2 1 338.495 4.106 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(OC)cc2)C1 ZINC000245954242 1049882836 /nfs/dbraw/zinc/88/28/36/1049882836.db2.gz LNQZOYFYNILALM-PGRDOPGGSA-N 2 1 338.495 4.106 20 0 EIADMP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C[C@H]1C ZINC001172379932 1049886204 /nfs/dbraw/zinc/88/62/04/1049886204.db2.gz UJZIVSXLMXZTKI-GGPKGHCWSA-N 2 1 330.516 4.392 20 0 EIADMP C[C@@H]1CC[C@H]([NH2+][C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2[NH3+])C[C@@H]1C ZINC001172369560 1049897366 /nfs/dbraw/zinc/89/73/66/1049897366.db2.gz RTASDKLVWUTVDQ-SKVJOWPXSA-N 2 1 346.518 4.388 20 0 EIADMP CC(C)COCC[C@@H](C)[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172475936 1049908648 /nfs/dbraw/zinc/90/86/48/1049908648.db2.gz NQPXAQNTCOGMRU-IRLDBZIGSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)COCC[C@@H](C)[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001172475936 1049908651 /nfs/dbraw/zinc/90/86/51/1049908651.db2.gz NQPXAQNTCOGMRU-IRLDBZIGSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)COCC[C@@H](C)[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001172475936 1049908654 /nfs/dbraw/zinc/90/86/54/1049908654.db2.gz NQPXAQNTCOGMRU-IRLDBZIGSA-N 2 1 344.543 4.036 20 0 EIADMP CC(C)OCC[C@H](C)[N@@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001172439226 1049912765 /nfs/dbraw/zinc/91/27/65/1049912765.db2.gz AFGPMKKDASSXIK-KYXZJRGPSA-N 2 1 344.543 4.318 20 0 EIADMP CC[N@H+](Cc1ccccc1)C1CC[NH+]([C@@H](C)CCOC(C)C)CC1 ZINC001172447083 1049915055 /nfs/dbraw/zinc/91/50/55/1049915055.db2.gz AMKFOBVDLXRFCK-IBGZPJMESA-N 2 1 332.532 4.177 20 0 EIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H](C)CCOC(C)C)CC1 ZINC001172447083 1049915061 /nfs/dbraw/zinc/91/50/61/1049915061.db2.gz AMKFOBVDLXRFCK-IBGZPJMESA-N 2 1 332.532 4.177 20 0 EIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172560749 1049933726 /nfs/dbraw/zinc/93/37/26/1049933726.db2.gz SGIFAWVWPPFVDP-WOJBJXKFSA-N 2 1 335.495 4.265 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc2ccccc2n1 ZINC000246879412 1050003758 /nfs/dbraw/zinc/00/37/58/1050003758.db2.gz DXRAEQFAPDHHRN-ZWKOTPCHSA-N 2 1 325.500 4.398 20 0 EIADMP Cc1ccsc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000247083239 1050012867 /nfs/dbraw/zinc/01/28/67/1050012867.db2.gz OYDOXZQTFKRTPR-IRXDYDNUSA-N 2 1 344.524 4.128 20 0 EIADMP Cc1ccsc1[C@H](C)[NH2+]Cc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000247083239 1050012876 /nfs/dbraw/zinc/01/28/76/1050012876.db2.gz OYDOXZQTFKRTPR-IRXDYDNUSA-N 2 1 344.524 4.128 20 0 EIADMP CCOCCC[N@H+]1CC[C@H](N[C@H](C)c2ccc(Cl)s2)[C@@H](C)C1 ZINC000247088478 1050013245 /nfs/dbraw/zinc/01/32/45/1050013245.db2.gz PGVWWSNWJWBKNV-ZNMIVQPWSA-N 2 1 344.952 4.189 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(Cl)s2)[C@@H](C)C1 ZINC000247088478 1050013251 /nfs/dbraw/zinc/01/32/51/1050013251.db2.gz PGVWWSNWJWBKNV-ZNMIVQPWSA-N 2 1 344.952 4.189 20 0 EIADMP Cc1ccc(-c2ncc(C[NH+]3CC[C@@H]4[C@@H](CCC[N@H+]4C)C3)s2)cc1 ZINC000247239366 1050018182 /nfs/dbraw/zinc/01/81/82/1050018182.db2.gz WSEJEIZJQDCDNC-PKOBYXMFSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[NH+]3CC[C@@H]4[C@@H](CCC[N@@H+]4C)C3)s2)cc1 ZINC000247239366 1050018186 /nfs/dbraw/zinc/01/81/86/1050018186.db2.gz WSEJEIZJQDCDNC-PKOBYXMFSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C)C3)s2)cc1 ZINC000247239366 1050018192 /nfs/dbraw/zinc/01/81/92/1050018192.db2.gz WSEJEIZJQDCDNC-PKOBYXMFSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C)C3)s2)cc1 ZINC000247239366 1050018197 /nfs/dbraw/zinc/01/81/97/1050018197.db2.gz WSEJEIZJQDCDNC-PKOBYXMFSA-N 2 1 341.524 4.035 20 0 EIADMP Cc1cccc2[nH]cc(CC[NH2+][C@H]3CC[N@@H+](C)[C@@H](c4ccccc4)C3)c21 ZINC000519719055 1050021169 /nfs/dbraw/zinc/02/11/69/1050021169.db2.gz XFBPGBSBBOODBB-RBBKRZOGSA-N 2 1 347.506 4.444 20 0 EIADMP Cc1cccc2[nH]cc(CC[NH2+][C@H]3CC[N@H+](C)[C@@H](c4ccccc4)C3)c21 ZINC000519719055 1050021176 /nfs/dbraw/zinc/02/11/76/1050021176.db2.gz XFBPGBSBBOODBB-RBBKRZOGSA-N 2 1 347.506 4.444 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+][C@H](C)[C@H]1CCC[N@H+](C3CCC3)C1)CCC2 ZINC000248408981 1050055807 /nfs/dbraw/zinc/05/58/07/1050055807.db2.gz WBEJTDBHONPFKX-HLLBOEOZSA-N 2 1 347.572 4.326 20 0 EIADMP C[C@H](N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1nc2ccccc2o1 ZINC000248545341 1050063580 /nfs/dbraw/zinc/06/35/80/1050063580.db2.gz DHQXAHPTZDNPBA-JYJNAYRXSA-N 2 1 327.472 4.131 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)C1 ZINC000249091998 1050091352 /nfs/dbraw/zinc/09/13/52/1050091352.db2.gz DLMPSPYFIORTEK-MSOLQXFVSA-N 2 1 340.433 4.146 20 0 EIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)C1 ZINC000249091998 1050091355 /nfs/dbraw/zinc/09/13/55/1050091355.db2.gz DLMPSPYFIORTEK-MSOLQXFVSA-N 2 1 340.433 4.146 20 0 EIADMP Cc1ccc2c(c1)C[C@H]([NH+]1CCC([N@@H+](C)Cc3ccccc3)CC1)CC2 ZINC001172830118 1050168139 /nfs/dbraw/zinc/16/81/39/1050168139.db2.gz FXDFQFUCNCRAFF-XMMPIXPASA-N 2 1 348.534 4.449 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccc(C[NH2+][C@H]3CCC[C@@H](C)CC3)cc2)C[C@H](C)O1 ZINC001177245565 1050172791 /nfs/dbraw/zinc/17/27/91/1050172791.db2.gz XOEYBIJLQXZKNC-IWQHBPENSA-N 2 1 344.543 4.354 20 0 EIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH+]1CCC([NH3+])(c2ccccc2)CC1 ZINC001172866583 1050175856 /nfs/dbraw/zinc/17/58/56/1050175856.db2.gz VDNLPBDRPMGCLU-HNNXBMFYSA-N 2 1 346.877 4.360 20 0 EIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cn(C)nc2C2CCCCC2)C1 ZINC001177299277 1050180650 /nfs/dbraw/zinc/18/06/50/1050180650.db2.gz NJEBONZTLZTNCI-SFHVURJKSA-N 2 1 346.563 4.070 20 0 EIADMP COc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1OC ZINC000090586761 1050187556 /nfs/dbraw/zinc/18/75/56/1050187556.db2.gz JFAXXFWUQAMPBR-QZTJIDSGSA-N 2 1 348.531 4.031 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(c3ccc(F)cc3)CCCCC2)CC1(C)C ZINC001177487788 1050225015 /nfs/dbraw/zinc/22/50/15/1050225015.db2.gz PNCUNPNPNPMMTB-LJQANCHMSA-N 2 1 332.507 4.490 20 0 EIADMP COc1ccc(CC[C@@H](C)[NH2+]CC(C)(C)[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC001177483484 1050226378 /nfs/dbraw/zinc/22/63/78/1050226378.db2.gz UIWLSEXDLPHBAY-QZTJIDSGSA-N 2 1 332.532 4.116 20 0 EIADMP COc1ccc(CC[C@@H](C)[NH2+]CC(C)(C)[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001177483484 1050226389 /nfs/dbraw/zinc/22/63/89/1050226389.db2.gz UIWLSEXDLPHBAY-QZTJIDSGSA-N 2 1 332.532 4.116 20 0 EIADMP CCCC[NH+]1CCC([NH2+]Cc2cnc(-c3cccs3)s2)CC1 ZINC001177505981 1050231985 /nfs/dbraw/zinc/23/19/85/1050231985.db2.gz ANFFAMIZVISNAI-UHFFFAOYSA-N 2 1 335.542 4.226 20 0 EIADMP C[N@@H+](Cc1ccccc1C[NH2+]C[C@H]1CCC=CO1)C1CCCCC1 ZINC000774975078 1050243880 /nfs/dbraw/zinc/24/38/80/1050243880.db2.gz AHBRVAGVNYROEU-OAQYLSRUSA-N 2 1 328.500 4.233 20 0 EIADMP CCCc1ccc(C[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)s1 ZINC001177668980 1050273697 /nfs/dbraw/zinc/27/36/97/1050273697.db2.gz LXOWZNGBARDTCF-LJQANCHMSA-N 2 1 342.552 4.355 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3F)o2)C1 ZINC001177744689 1050291084 /nfs/dbraw/zinc/29/10/84/1050291084.db2.gz ZXVPMIBFYNJWKA-MRXNPFEDSA-N 2 1 330.447 4.296 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3F)o2)C1 ZINC001177744689 1050291092 /nfs/dbraw/zinc/29/10/92/1050291092.db2.gz ZXVPMIBFYNJWKA-MRXNPFEDSA-N 2 1 330.447 4.296 20 0 EIADMP c1cncc(-c2cccc(C[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)c2)c1 ZINC000092066480 1050314826 /nfs/dbraw/zinc/31/48/26/1050314826.db2.gz VJURAIARAHDNKP-FYYLOGMGSA-N 2 1 347.506 4.197 20 0 EIADMP c1cncc(-c2cccc(C[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)c2)c1 ZINC000092066480 1050314834 /nfs/dbraw/zinc/31/48/34/1050314834.db2.gz VJURAIARAHDNKP-FYYLOGMGSA-N 2 1 347.506 4.197 20 0 EIADMP c1cncc(-c2cccc(C[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2)c1 ZINC000092066480 1050314855 /nfs/dbraw/zinc/31/48/55/1050314855.db2.gz VJURAIARAHDNKP-FYYLOGMGSA-N 2 1 347.506 4.197 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(F)cc2F)[C@@H]1c1cccs1 ZINC001177920846 1050329729 /nfs/dbraw/zinc/32/97/29/1050329729.db2.gz XGGLHODVPQTFAY-KBXCAEBGSA-N 2 1 336.451 4.199 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(F)cc2F)[C@@H]1c1cccs1 ZINC001177920846 1050329741 /nfs/dbraw/zinc/32/97/41/1050329741.db2.gz XGGLHODVPQTFAY-KBXCAEBGSA-N 2 1 336.451 4.199 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173198162 1050343267 /nfs/dbraw/zinc/34/32/67/1050343267.db2.gz PCWCUJDIATVAOR-LWEYNCJUSA-N 2 1 330.516 4.231 20 0 EIADMP CC(C)[N@H+]1CC[C@@H]([NH2+]C2CCC(Oc3ccccc3)CC2)[C@H](C)C1 ZINC001173202544 1050344563 /nfs/dbraw/zinc/34/45/63/1050344563.db2.gz UJNSJROBNXYYKF-AXIYNFMDSA-N 2 1 330.516 4.085 20 0 EIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001173207340 1050368402 /nfs/dbraw/zinc/36/84/02/1050368402.db2.gz QVKQXBUGCXEIDV-PTUXOGIPSA-N 2 1 348.534 4.481 20 0 EIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH+]1C[C@H]2CC[N@H+](C)C[C@H]2C1 ZINC001173207340 1050368412 /nfs/dbraw/zinc/36/84/12/1050368412.db2.gz QVKQXBUGCXEIDV-PTUXOGIPSA-N 2 1 348.534 4.481 20 0 EIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH+]1C[C@H]2CC[N@@H+](C)C[C@H]2C1 ZINC001173207340 1050368424 /nfs/dbraw/zinc/36/84/24/1050368424.db2.gz QVKQXBUGCXEIDV-PTUXOGIPSA-N 2 1 348.534 4.481 20 0 EIADMP CC[C@@H]1CC[C@@H]([NH2+][C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2[NH3+])C1 ZINC001173270943 1050392092 /nfs/dbraw/zinc/39/20/92/1050392092.db2.gz DKFCHGOVZLZWIE-FIEVGXRPSA-N 2 1 332.491 4.142 20 0 EIADMP CCc1ccc(C[C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001173237242 1050395115 /nfs/dbraw/zinc/39/51/15/1050395115.db2.gz GPIMETLQGHZWRZ-AUSIDOKSSA-N 2 1 336.523 4.292 20 0 EIADMP CCSC[C@H](C)[N@@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001173297780 1050398332 /nfs/dbraw/zinc/39/83/32/1050398332.db2.gz WMNSJVVJMPLDEL-DQAVMHLFSA-N 2 1 332.557 4.256 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2(C)Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001178188073 1050400258 /nfs/dbraw/zinc/40/02/58/1050400258.db2.gz JRCDUFRZGGKXRE-CVDCTZTESA-N 2 1 348.534 4.434 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CC2(C)Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001178188073 1050400272 /nfs/dbraw/zinc/40/02/72/1050400272.db2.gz JRCDUFRZGGKXRE-CVDCTZTESA-N 2 1 348.534 4.434 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+][C@H]2CC[C@@H](C)SC2)C[N@H+]1Cc1ccccc1 ZINC001178207158 1050404355 /nfs/dbraw/zinc/40/43/55/1050404355.db2.gz APOXJDJCPXDXKK-CUDHKJQZSA-N 2 1 332.557 4.161 20 0 EIADMP CCC(CC)[N@@H+](C1Cc2cc(F)c(F)cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173475896 1050459140 /nfs/dbraw/zinc/45/91/40/1050459140.db2.gz KWOKVKRUURGKTK-JCNLHEQBSA-N 2 1 336.470 4.193 20 0 EIADMP COc1ccc(C[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1OCC(C)C ZINC001178462391 1050475070 /nfs/dbraw/zinc/47/50/70/1050475070.db2.gz DNDWCRJKBPNZPJ-SFHVURJKSA-N 2 1 348.531 4.084 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC001173544987 1050477985 /nfs/dbraw/zinc/47/79/85/1050477985.db2.gz VDHGRYNDANWJNF-ZFWWWQNUSA-N 2 1 329.315 4.246 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000450740965 1050526627 /nfs/dbraw/zinc/52/66/27/1050526627.db2.gz XGNZIOTZYBGJIC-JFRXWTBNSA-N 2 1 336.470 4.168 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1CCC3(CCc4ccccc43)CC1)C2 ZINC001173688568 1050541651 /nfs/dbraw/zinc/54/16/51/1050541651.db2.gz IEGGVIGJQPHPBJ-NVSXCIMMSA-N 2 1 338.539 4.418 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1CCC3(CCc4ccccc43)CC1)C2 ZINC001173688568 1050541666 /nfs/dbraw/zinc/54/16/66/1050541666.db2.gz IEGGVIGJQPHPBJ-NVSXCIMMSA-N 2 1 338.539 4.418 20 0 EIADMP c1cncc(-c2cccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)c2)c1 ZINC000093683554 1050658221 /nfs/dbraw/zinc/65/82/21/1050658221.db2.gz AETPFLNUINTAGR-FQEVSTJZSA-N 2 1 335.495 4.056 20 0 EIADMP c1cc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc(-c2ccncc2)c1 ZINC000093683661 1050658453 /nfs/dbraw/zinc/65/84/53/1050658453.db2.gz KLKKOXVKRUQHQL-HXUWFJFHSA-N 2 1 335.495 4.056 20 0 EIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001179259165 1050661819 /nfs/dbraw/zinc/66/18/19/1050661819.db2.gz SHPMGYWNNOZPQS-MRXNPFEDSA-N 2 1 340.433 4.225 20 0 EIADMP CC[C@@H](Cc1ccccc1)[N@@H+](CC)Cc1ccnn1-c1cc[nH+]cc1 ZINC001180057672 1050869634 /nfs/dbraw/zinc/86/96/34/1050869634.db2.gz HMSFQHMRQSFYAL-IBGZPJMESA-N 2 1 334.467 4.111 20 0 EIADMP Cc1cc(C)c(/C=C/C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1C ZINC001180082799 1050878556 /nfs/dbraw/zinc/87/85/56/1050878556.db2.gz SWBPQGADZJTFBC-YAQIIAKESA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C/C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1C ZINC001180082799 1050878563 /nfs/dbraw/zinc/87/85/63/1050878563.db2.gz SWBPQGADZJTFBC-YAQIIAKESA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C/C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1C ZINC001180082799 1050878568 /nfs/dbraw/zinc/87/85/68/1050878568.db2.gz SWBPQGADZJTFBC-YAQIIAKESA-N 2 1 326.528 4.289 20 0 EIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1C ZINC001180082799 1050878575 /nfs/dbraw/zinc/87/85/75/1050878575.db2.gz SWBPQGADZJTFBC-YAQIIAKESA-N 2 1 326.528 4.289 20 0 EIADMP OC[C@H]1CCC[N@H+]1Cc1ccccc1C[NH2+]CCC1CCCCCC1 ZINC001180310489 1050946427 /nfs/dbraw/zinc/94/64/27/1050946427.db2.gz JAZLAGYAPWUDQQ-JOCHJYFZSA-N 2 1 344.543 4.093 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1)c1cccs1 ZINC000153475544 1051050467 /nfs/dbraw/zinc/05/04/67/1051050467.db2.gz WCXUCJDFWSVSNH-APWZRJJASA-N 2 1 344.524 4.210 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[N@H+]2CCO[C@H](C)C2)c1)c1cccs1 ZINC000153475544 1051050481 /nfs/dbraw/zinc/05/04/81/1051050481.db2.gz WCXUCJDFWSVSNH-APWZRJJASA-N 2 1 344.524 4.210 20 0 EIADMP Cc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000153489156 1051058614 /nfs/dbraw/zinc/05/86/14/1051058614.db2.gz DMNJQWANWBTTDJ-MOPGFXCFSA-N 2 1 338.495 4.067 20 0 EIADMP Cc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000153489156 1051058625 /nfs/dbraw/zinc/05/86/25/1051058625.db2.gz DMNJQWANWBTTDJ-MOPGFXCFSA-N 2 1 338.495 4.067 20 0 EIADMP C[N@@H+]1CCC[C@H]2C[NH+](CCCc3c(Cl)cccc3Cl)CC[C@@H]21 ZINC001204278337 1051065690 /nfs/dbraw/zinc/06/56/90/1051065690.db2.gz BAKKUOSSGRYTBE-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCc3c(Cl)cccc3Cl)CC[C@@H]21 ZINC001204278337 1051065702 /nfs/dbraw/zinc/06/57/02/1051065702.db2.gz BAKKUOSSGRYTBE-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCc3c(Cl)cccc3Cl)CC[C@@H]21 ZINC001204278337 1051065713 /nfs/dbraw/zinc/06/57/13/1051065713.db2.gz BAKKUOSSGRYTBE-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCc3c(Cl)cccc3Cl)CC[C@@H]21 ZINC001204278337 1051065725 /nfs/dbraw/zinc/06/57/25/1051065725.db2.gz BAKKUOSSGRYTBE-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CCC2(CCC[N@H+]2CCCc2c(Cl)cccc2Cl)CC1 ZINC001180883291 1051101824 /nfs/dbraw/zinc/10/18/24/1051101824.db2.gz GTDOOMCNNFXOOQ-UHFFFAOYSA-N 2 1 341.326 4.486 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1cccc(OCC2CCCCC2)c1 ZINC000620513542 1051148690 /nfs/dbraw/zinc/14/86/90/1051148690.db2.gz UYLJVITYKKZHJE-UHFFFAOYSA-N 2 1 341.499 4.331 20 0 EIADMP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2csc(C)n2)ccc1OC ZINC000775376797 1051157955 /nfs/dbraw/zinc/15/79/55/1051157955.db2.gz SBKDMHZKNSIEGX-CQSZACIVSA-N 2 1 347.528 4.153 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC[N@@H+]1C ZINC000775393146 1051201249 /nfs/dbraw/zinc/20/12/49/1051201249.db2.gz LNHQCZMULJIFDY-IFIJOSMWSA-N 2 1 340.483 4.451 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC[N@H+]1C ZINC000775393146 1051201258 /nfs/dbraw/zinc/20/12/58/1051201258.db2.gz LNHQCZMULJIFDY-IFIJOSMWSA-N 2 1 340.483 4.451 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCn2ccc3cc(Cl)ccc32)CC1 ZINC001190819092 1051283529 /nfs/dbraw/zinc/28/35/29/1051283529.db2.gz SOCCVZUHELOXOJ-UHFFFAOYSA-N 2 1 347.934 4.347 20 0 EIADMP C[C@@]1(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)CC1(Cl)Cl ZINC001190825828 1051286240 /nfs/dbraw/zinc/28/62/40/1051286240.db2.gz CXYYDJWWJLCWBG-CVEARBPZSA-N 2 1 333.347 4.158 20 0 EIADMP C[C@@]1(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)CC1(Cl)Cl ZINC001190825828 1051286252 /nfs/dbraw/zinc/28/62/52/1051286252.db2.gz CXYYDJWWJLCWBG-CVEARBPZSA-N 2 1 333.347 4.158 20 0 EIADMP C([C@H]1CCC2(CCCCCC2)O1)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001191069971 1051339444 /nfs/dbraw/zinc/33/94/44/1051339444.db2.gz JDXLWRBGTDZLKN-WOJBJXKFSA-N 2 1 334.548 4.066 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2cccc3ncccc23)C1 ZINC001191048956 1051348887 /nfs/dbraw/zinc/34/88/87/1051348887.db2.gz VLVCRMHDWSLVHU-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2cccc3ncccc23)C1 ZINC001191048956 1051348893 /nfs/dbraw/zinc/34/88/93/1051348893.db2.gz VLVCRMHDWSLVHU-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2cccc3ncccc23)C1 ZINC001191048956 1051348897 /nfs/dbraw/zinc/34/88/97/1051348897.db2.gz VLVCRMHDWSLVHU-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP CC(C)COc1cccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC001191099870 1051350946 /nfs/dbraw/zinc/35/09/46/1051350946.db2.gz QAFCEGPERJJHKH-HXUWFJFHSA-N 2 1 330.516 4.172 20 0 EIADMP CC(C)COc1cccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC001191099870 1051350954 /nfs/dbraw/zinc/35/09/54/1051350954.db2.gz QAFCEGPERJJHKH-HXUWFJFHSA-N 2 1 330.516 4.172 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)C1 ZINC001181982682 1051363629 /nfs/dbraw/zinc/36/36/29/1051363629.db2.gz JTSZWKLVWYKHCD-MRXNPFEDSA-N 2 1 342.508 4.302 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1(C)C ZINC001175240241 1051467168 /nfs/dbraw/zinc/46/71/68/1051467168.db2.gz YRBDIVSNTSARGW-IBGZPJMESA-N 2 1 329.463 4.379 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](c2ccc(F)cc2)C1(C)C ZINC001175240241 1051467175 /nfs/dbraw/zinc/46/71/75/1051467175.db2.gz YRBDIVSNTSARGW-IBGZPJMESA-N 2 1 329.463 4.379 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCOC3(CCCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000271503938 1051541807 /nfs/dbraw/zinc/54/18/07/1051541807.db2.gz MJUSKISVOGQVPT-HLAWJBBLSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCOC3(CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC000271503938 1051541819 /nfs/dbraw/zinc/54/18/19/1051541819.db2.gz MJUSKISVOGQVPT-HLAWJBBLSA-N 2 1 342.527 4.121 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000774449660 1051595043 /nfs/dbraw/zinc/59/50/43/1051595043.db2.gz XFWZGDXYHSDDPG-NSHDSACASA-N 2 1 344.330 4.489 20 0 EIADMP COc1ccc(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)cc1Cl ZINC001175601017 1051664954 /nfs/dbraw/zinc/66/49/54/1051664954.db2.gz FHKRIMGERQJSMZ-UHFFFAOYSA-N 2 1 338.923 4.148 20 0 EIADMP CC(C)C[N@@H+](CC[C@@H]1CCc2ccccc21)CC1CC[NH+](C)CC1 ZINC001175601018 1051665220 /nfs/dbraw/zinc/66/52/20/1051665220.db2.gz FIHXBNXUPWHRFX-NRFANRHFSA-N 2 1 328.544 4.406 20 0 EIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@H](C)Cc1ccccc1C(F)(F)F ZINC001182714017 1051680709 /nfs/dbraw/zinc/68/07/09/1051680709.db2.gz KAQYUEWASHVXBD-OAHLLOKOSA-N 2 1 330.438 4.204 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cnc2ccsc2c1 ZINC000157942163 1051687487 /nfs/dbraw/zinc/68/74/87/1051687487.db2.gz VBHCNGHWZKVUEC-CVEARBPZSA-N 2 1 331.529 4.459 20 0 EIADMP C[C@@H]1SCC[C@H]1[NH2+]C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001182726493 1051687692 /nfs/dbraw/zinc/68/76/92/1051687692.db2.gz UBWVZDNFWOZPGK-DSKINZAPSA-N 2 1 346.584 4.408 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000158582355 1051760302 /nfs/dbraw/zinc/76/03/02/1051760302.db2.gz RJRZWPSACDTMKH-BGYRXZFFSA-N 2 1 343.559 4.003 20 0 EIADMP COCC1([NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CCCCC1 ZINC001183059813 1051781245 /nfs/dbraw/zinc/78/12/45/1051781245.db2.gz PEYNQZWOBYNXRV-CTNGQTDRSA-N 2 1 342.527 4.293 20 0 EIADMP COCC1([NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CCCCC1 ZINC001183059813 1051781254 /nfs/dbraw/zinc/78/12/54/1051781254.db2.gz PEYNQZWOBYNXRV-CTNGQTDRSA-N 2 1 342.527 4.293 20 0 EIADMP COCC1([NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CCCCC1 ZINC001183059815 1051782214 /nfs/dbraw/zinc/78/22/14/1051782214.db2.gz PEYNQZWOBYNXRV-FPOVZHCZSA-N 2 1 342.527 4.293 20 0 EIADMP COCC1([NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CCCCC1 ZINC001183059815 1051782223 /nfs/dbraw/zinc/78/22/23/1051782223.db2.gz PEYNQZWOBYNXRV-FPOVZHCZSA-N 2 1 342.527 4.293 20 0 EIADMP C[C@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001183095483 1051785911 /nfs/dbraw/zinc/78/59/11/1051785911.db2.gz QFQVCZGBMOYIHX-MJGOQNOKSA-N 2 1 339.527 4.201 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCOc2cccc3ccccc32)cc1 ZINC001192909313 1051829721 /nfs/dbraw/zinc/82/97/21/1051829721.db2.gz HJHFJMCYOQZJFU-UHFFFAOYSA-N 2 1 348.490 4.412 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@@H]1CCCC(C)(C)O1 ZINC001193092252 1051874236 /nfs/dbraw/zinc/87/42/36/1051874236.db2.gz CHHHBLITYURQBB-IZZBFERCSA-N 2 1 344.543 4.080 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)ccc1OC1CCCC1 ZINC000159265478 1051966138 /nfs/dbraw/zinc/96/61/38/1051966138.db2.gz MEDWPNXLJCHCMB-BQFCYCMXSA-N 2 1 346.515 4.150 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1OC1CCCC1 ZINC000159265478 1051966154 /nfs/dbraw/zinc/96/61/54/1051966154.db2.gz MEDWPNXLJCHCMB-BQFCYCMXSA-N 2 1 346.515 4.150 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cncs1 ZINC000290210182 1052001353 /nfs/dbraw/zinc/00/13/53/1052001353.db2.gz PWFMAINYFBPMJR-WMZOPIPTSA-N 2 1 329.513 4.096 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cncs1 ZINC000290210182 1052001362 /nfs/dbraw/zinc/00/13/62/1052001362.db2.gz PWFMAINYFBPMJR-WMZOPIPTSA-N 2 1 329.513 4.096 20 0 EIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21 ZINC001184386266 1052002272 /nfs/dbraw/zinc/00/22/72/1052002272.db2.gz AMWFWTLGJPVKGC-FJTGNWTPSA-N 2 1 334.507 4.214 20 0 EIADMP COc1ccc2cc([C@H](C)[NH2+]CCCCn3cc[nH+]c3C)ccc2c1 ZINC000164701645 1052038439 /nfs/dbraw/zinc/03/84/39/1052038439.db2.gz CFTSDEZQNFPNPE-INIZCTEOSA-N 2 1 337.467 4.484 20 0 EIADMP C[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1cccs1 ZINC000167466900 1052118785 /nfs/dbraw/zinc/11/87/85/1052118785.db2.gz FVKQPWVWNZJRPP-GOSISDBHSA-N 2 1 342.552 4.223 20 0 EIADMP C[C@@H]1CCC[C@@H](C[NH2+]c2ccc(N3CCC([NH+](C)C)CC3)cc2)C1 ZINC000774824215 1052172366 /nfs/dbraw/zinc/17/23/66/1052172366.db2.gz MAWSXPGDOUGQQL-QZTJIDSGSA-N 2 1 329.532 4.455 20 0 EIADMP CCc1nc(NCc2ccccc2C[NH+]2CCCCCC2)cc(C)[nH+]1 ZINC001185339411 1052224766 /nfs/dbraw/zinc/22/47/66/1052224766.db2.gz ONKDAPZSWYVPRZ-UHFFFAOYSA-N 2 1 338.499 4.336 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC001177127721 1052226619 /nfs/dbraw/zinc/22/66/19/1052226619.db2.gz KPULZKFORQUJBZ-UHFFFAOYSA-N 2 1 348.494 4.208 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(-c2ccc(F)cc2C)o1 ZINC000174453480 1052568182 /nfs/dbraw/zinc/56/81/82/1052568182.db2.gz QZNPWDQTSUOZAH-UHFFFAOYSA-N 2 1 341.430 4.469 20 0 EIADMP C[N@H+]1CC[C@H](N[C@@H](c2cccs2)c2ccc(F)cc2)CC1(C)C ZINC000623342026 1052625839 /nfs/dbraw/zinc/62/58/39/1052625839.db2.gz BHEAZOVKVWBUBN-FUHWJXTLSA-N 2 1 332.488 4.439 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@H]3CC[N@@H+](C)C(C)(C)C3)cc2)cs1 ZINC000623379222 1052639709 /nfs/dbraw/zinc/63/97/09/1052639709.db2.gz DPULMEAXKYTTPC-KRWDZBQOSA-N 2 1 329.513 4.081 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)cc2)cs1 ZINC000623379222 1052639712 /nfs/dbraw/zinc/63/97/12/1052639712.db2.gz DPULMEAXKYTTPC-KRWDZBQOSA-N 2 1 329.513 4.081 20 0 EIADMP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000623656915 1052698480 /nfs/dbraw/zinc/69/84/80/1052698480.db2.gz FMWKFQBMRXWOLV-SFKKXYGYSA-N 2 1 338.442 4.013 20 0 EIADMP C[C@@H]1C[C@H](NC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@H+]1C ZINC000178606538 1052709954 /nfs/dbraw/zinc/70/99/54/1052709954.db2.gz BVCFPAQWUIFOCA-AUUYWEPGSA-N 2 1 330.422 4.127 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000178707838 1052710866 /nfs/dbraw/zinc/71/08/66/1052710866.db2.gz AIQQUUNKCQLZGG-CHWSQXEVSA-N 2 1 341.377 4.077 20 0 EIADMP Cc1cnc(Cl)c(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000921508798 1052793048 /nfs/dbraw/zinc/79/30/48/1052793048.db2.gz ZHTRWMFVTHDLOC-UHFFFAOYSA-N 2 1 343.902 4.319 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000180550188 1052808023 /nfs/dbraw/zinc/80/80/23/1052808023.db2.gz UMPKNYHHUMCYPD-INIZCTEOSA-N 2 1 343.368 4.394 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(F)cc1C(F)(F)F ZINC000623998521 1052850068 /nfs/dbraw/zinc/85/00/68/1052850068.db2.gz VGRQYMPDUIEVFD-GFCCVEGCSA-N 2 1 332.385 4.370 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000624120225 1052867203 /nfs/dbraw/zinc/86/72/03/1052867203.db2.gz UPLSCUDDTUKNME-YOEHRIQHSA-N 2 1 326.431 4.061 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)c2ccccc21 ZINC000624169317 1052872749 /nfs/dbraw/zinc/87/27/49/1052872749.db2.gz DEDDZYXLPOGKMX-COPCDDAFSA-N 2 1 342.527 4.104 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1nccn1C ZINC000182534541 1052938964 /nfs/dbraw/zinc/93/89/64/1052938964.db2.gz BNAOCXRYBXIXJE-KRWDZBQOSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)c1nccn1C ZINC000182534541 1052938968 /nfs/dbraw/zinc/93/89/68/1052938968.db2.gz BNAOCXRYBXIXJE-KRWDZBQOSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@@H]([NH2+]CCSc1ccc(F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185706639 1053021287 /nfs/dbraw/zinc/02/12/87/1053021287.db2.gz DKESLWHYHAKWCM-CVEARBPZSA-N 2 1 336.520 4.160 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCO1 ZINC000381195272 1053057178 /nfs/dbraw/zinc/05/71/78/1053057178.db2.gz ZVBSNEPYWJPDKP-BDTNDASRSA-N 2 1 344.543 4.082 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000119683811 1053089336 /nfs/dbraw/zinc/08/93/36/1053089336.db2.gz DXAZOJNMBLSJMM-CMKODMSKSA-N 2 1 344.543 4.259 20 0 EIADMP CSC1(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000381904869 1053110592 /nfs/dbraw/zinc/11/05/92/1053110592.db2.gz IKVUGFDBUZUMNF-IBGZPJMESA-N 2 1 332.557 4.164 20 0 EIADMP C[C@H]([NH2+]Cc1cnc2ccccc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382169304 1053156722 /nfs/dbraw/zinc/15/67/22/1053156722.db2.gz PKKQCTFSXKLHFD-PGRDOPGGSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc2ccccc2[nH]1 ZINC000775628272 1053221055 /nfs/dbraw/zinc/22/10/55/1053221055.db2.gz QSTOMFVCZAVHFI-AZUAARDMSA-N 2 1 347.506 4.383 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2C[C@@H](O)c3ccccc32)cc1 ZINC000850527324 1053290167 /nfs/dbraw/zinc/29/01/67/1053290167.db2.gz FUUYWZGMFVQOHX-SZFUDVHCSA-N 2 1 333.435 4.010 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CCC[C@H]3Cc3ccccn3)CC2)cc1 ZINC000850543143 1053305356 /nfs/dbraw/zinc/30/53/56/1053305356.db2.gz ZAOGKQZBUZJSRL-NZQKXSOJSA-N 2 1 349.522 4.047 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)C1 ZINC000339070114 1053321070 /nfs/dbraw/zinc/32/10/70/1053321070.db2.gz WPWCKUPRTRSTIP-XAPVIXHLSA-N 2 1 344.543 4.112 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)[C@H](C)C2CCCCC2)cn1 ZINC000765248638 1053475386 /nfs/dbraw/zinc/47/53/86/1053475386.db2.gz AAGHCYDNCMHEII-JKSUJKDBSA-N 2 1 326.488 4.270 20 0 EIADMP C[C@@H]([NH2+]Cc1cnc2c(F)cccc2c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000865523482 1053534171 /nfs/dbraw/zinc/53/41/71/1053534171.db2.gz CFQLRQRFCUOGFV-CRAIPNDOSA-N 2 1 341.474 4.117 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@H]2CCCO2)[C@@H]1c1cccs1 ZINC000866271589 1053671152 /nfs/dbraw/zinc/67/11/52/1053671152.db2.gz ANQJYFWZSCWSIL-HNBVOPMISA-N 2 1 348.556 4.068 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@H]2CCCO2)[C@@H]1c1cccs1 ZINC000866271589 1053671165 /nfs/dbraw/zinc/67/11/65/1053671165.db2.gz ANQJYFWZSCWSIL-HNBVOPMISA-N 2 1 348.556 4.068 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866372468 1053709552 /nfs/dbraw/zinc/70/95/52/1053709552.db2.gz GXFDBBBDCSNYRZ-IRLDBZIGSA-N 2 1 337.511 4.077 20 0 EIADMP CC[N@@H+](CCCc1cccc(OC)c1)Cc1ccc(C[NH+](C)C)cc1 ZINC001196623678 1053716034 /nfs/dbraw/zinc/71/60/34/1053716034.db2.gz SKWNWBXZORXHRQ-UHFFFAOYSA-N 2 1 340.511 4.212 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C2CCC2)[C@H]2CCOC2)cc1 ZINC000866512138 1053760671 /nfs/dbraw/zinc/76/06/71/1053760671.db2.gz ZXSBEFWVDQTWPR-PAXLWEDBSA-N 2 1 339.483 4.037 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386797880 1053829396 /nfs/dbraw/zinc/82/93/96/1053829396.db2.gz MFGQFWZLYGCAFY-OPYAIIAOSA-N 2 1 340.486 4.257 20 0 EIADMP CC(C)[N@@H+](C)Cc1cc(O[C@@H]2CC[NH+](CCCC(C)(C)C)C2)ccn1 ZINC000856604484 1054092301 /nfs/dbraw/zinc/09/23/01/1054092301.db2.gz NZYAQMLBJOIJSM-HXUWFJFHSA-N 2 1 347.547 4.201 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@@H]2CC[N@H+](CCCC(C)(C)C)C2)ccn1 ZINC000856604484 1054092315 /nfs/dbraw/zinc/09/23/15/1054092315.db2.gz NZYAQMLBJOIJSM-HXUWFJFHSA-N 2 1 347.547 4.201 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@@H]2CC[N@@H+](CCCC(C)(C)C)C2)ccn1 ZINC000856604484 1054092322 /nfs/dbraw/zinc/09/23/22/1054092322.db2.gz NZYAQMLBJOIJSM-HXUWFJFHSA-N 2 1 347.547 4.201 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl ZINC000542667114 1054180421 /nfs/dbraw/zinc/18/04/21/1054180421.db2.gz WYFZVZWIYUGQNX-LSBZLQRGSA-N 2 1 331.891 4.407 20 0 EIADMP CC(C)[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC001199127294 1054347737 /nfs/dbraw/zinc/34/77/37/1054347737.db2.gz WYNNRUSBORCOQN-IFMALSPDSA-N 2 1 328.544 4.498 20 0 EIADMP C[C@H](C[NH2+]C[C@H]1CC[N@H+](C2CC2)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001199197851 1054362598 /nfs/dbraw/zinc/36/25/98/1054362598.db2.gz KIQHFATWCUYHLE-PKOBYXMFSA-N 2 1 328.544 4.237 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cc(F)cc3cccnc32)C1 ZINC001199320661 1054390416 /nfs/dbraw/zinc/39/04/16/1054390416.db2.gz PIWKUODGFRSNJI-CALCHBBNSA-N 2 1 343.490 4.222 20 0 EIADMP 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 1054392283 /nfs/dbraw/zinc/39/22/83/1054392283.db2.gz UYJZZTKBYDONBH-AISZHWQLSA-N 2 1 344.543 4.210 20 0 EIADMP CC[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)CCO1 ZINC001199630292 1054434729 /nfs/dbraw/zinc/43/47/29/1054434729.db2.gz VKTKJEHVTOKXOB-UNMCSNQZSA-N 2 1 344.543 4.498 20 0 EIADMP [NH3+][C@H](C[C@@H]1CCC[N@@H+](Cc2scnc2C2CC2)C1)C1CCCC1 ZINC000873232496 1054509600 /nfs/dbraw/zinc/50/96/00/1054509600.db2.gz RPIAAMVDYVWVOG-WMLDXEAASA-N 2 1 333.545 4.140 20 0 EIADMP Brc1cc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)cs1 ZINC001200923066 1054578038 /nfs/dbraw/zinc/57/80/38/1054578038.db2.gz PLNQVEXPJMCKCM-UHFFFAOYSA-N 2 1 343.334 4.007 20 0 EIADMP Cc1cccc2c1[nH+]c(N)n2C1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001201470401 1054805202 /nfs/dbraw/zinc/80/52/02/1054805202.db2.gz RTVRIOLNUIHLPP-MSOLQXFVSA-N 2 1 344.462 4.205 20 0 EIADMP COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CC[NH+](C[C@H](C)CCC=C(C)C)C2 ZINC001201486254 1054814704 /nfs/dbraw/zinc/81/47/04/1054814704.db2.gz HWJDCUUUPYLZGV-FCEUIQTBSA-N 2 1 348.575 4.049 20 0 EIADMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@H+](C[C@H](C)CCC=C(C)C)C2 ZINC001201486254 1054814711 /nfs/dbraw/zinc/81/47/11/1054814711.db2.gz HWJDCUUUPYLZGV-FCEUIQTBSA-N 2 1 348.575 4.049 20 0 EIADMP COC[C@H]1C[NH+](CC2CC2)C[C@@]12CC[N@@H+](C[C@H](C)CCC=C(C)C)C2 ZINC001201486254 1054814717 /nfs/dbraw/zinc/81/47/17/1054814717.db2.gz HWJDCUUUPYLZGV-FCEUIQTBSA-N 2 1 348.575 4.049 20 0 EIADMP c1cc(C[N@@H+]2CCC3(C2)CC[NH+](CCCc2ccccc2)CC3)co1 ZINC001201662820 1054879100 /nfs/dbraw/zinc/87/91/00/1054879100.db2.gz KWJSGSVRXBPOSZ-UHFFFAOYSA-N 2 1 338.495 4.200 20 0 EIADMP Cc1c(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)ccnc1F ZINC000862251171 1055034283 /nfs/dbraw/zinc/03/42/83/1055034283.db2.gz WUAJQRXHWSJKNB-INIZCTEOSA-N 2 1 333.495 4.006 20 0 EIADMP C[C@H](N[C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccns1 ZINC000877659439 1055102162 /nfs/dbraw/zinc/10/21/62/1055102162.db2.gz SCQYPBLABBJNKZ-LESCRADOSA-N 2 1 327.497 4.162 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCN(C2CC2)[C@H](c2ccccc2)C1)c1ccns1 ZINC000877659439 1055102171 /nfs/dbraw/zinc/10/21/71/1055102171.db2.gz SCQYPBLABBJNKZ-LESCRADOSA-N 2 1 327.497 4.162 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+]2C)ccc1OCCC(C)C ZINC001168604127 1055151234 /nfs/dbraw/zinc/15/12/34/1055151234.db2.gz KYBQANZSVTWHHW-IEBWSBKVSA-N 2 1 348.531 4.255 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000863542682 1055222806 /nfs/dbraw/zinc/22/28/06/1055222806.db2.gz SPQGIQVTUNFHJR-HEHGZKQESA-N 2 1 326.406 4.072 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000863542830 1055225304 /nfs/dbraw/zinc/22/53/04/1055225304.db2.gz SPQGIQVTUNFHJR-XEZPLFJOSA-N 2 1 326.406 4.072 20 0 EIADMP c1nc(C2CC2)c(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)s1 ZINC000785440453 1055240521 /nfs/dbraw/zinc/24/05/21/1055240521.db2.gz BVCMVCOJIKCYRS-UHFFFAOYSA-N 2 1 333.545 4.155 20 0 EIADMP FC1(F)CCC[C@H]1CC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000878527657 1055334652 /nfs/dbraw/zinc/33/46/52/1055334652.db2.gz FAZFBSDTWJBOOI-INIZCTEOSA-N 2 1 337.458 4.224 20 0 EIADMP C[C@H](Cc1ccsc1)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000542776147 1055972456 /nfs/dbraw/zinc/97/24/56/1055972456.db2.gz VDNLQTFQORFZME-UWVAXJGDSA-N 2 1 328.525 4.179 20 0 EIADMP C[C@H]([NH2+]CCCc1cccs1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000542818641 1056115553 /nfs/dbraw/zinc/11/55/53/1056115553.db2.gz XZRXJUXHEZVART-HKUYNNGSSA-N 2 1 328.525 4.181 20 0 EIADMP c1ccc(SCC[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000303672510 1056229671 /nfs/dbraw/zinc/22/96/71/1056229671.db2.gz GTIODPRCFZEWFJ-LJQANCHMSA-N 2 1 332.557 4.367 20 0 EIADMP c1ccc(SCC[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000303672510 1056229692 /nfs/dbraw/zinc/22/96/92/1056229692.db2.gz GTIODPRCFZEWFJ-LJQANCHMSA-N 2 1 332.557 4.367 20 0 EIADMP CC[N@H+](C[C@@H]1CC1(Cl)Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000743873779 1059197223 /nfs/dbraw/zinc/19/72/23/1059197223.db2.gz VCRGOBKRBQMJMO-SJORKVTESA-N 2 1 341.326 4.024 20 0 EIADMP CC[N@@H+](C[C@@H]1CC1(Cl)Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000743873779 1059197255 /nfs/dbraw/zinc/19/72/55/1059197255.db2.gz VCRGOBKRBQMJMO-SJORKVTESA-N 2 1 341.326 4.024 20 0 EIADMP CC[NH+](C[C@@H]1CC1(Cl)Cl)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000743873779 1059197292 /nfs/dbraw/zinc/19/72/92/1059197292.db2.gz VCRGOBKRBQMJMO-SJORKVTESA-N 2 1 341.326 4.024 20 0 EIADMP CC[NH+](C[C@@H]1CC1(Cl)Cl)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000743873779 1059197326 /nfs/dbraw/zinc/19/73/26/1059197326.db2.gz VCRGOBKRBQMJMO-SJORKVTESA-N 2 1 341.326 4.024 20 0 EIADMP CCCC[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccccc1 ZINC000746047697 1059978228 /nfs/dbraw/zinc/97/82/28/1059978228.db2.gz PUIXKIYAYAQADY-LEWJYISDSA-N 2 1 330.516 4.151 20 0 EIADMP C[N@H+](Cc1cccc2cnccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000183294984 1059980708 /nfs/dbraw/zinc/98/07/08/1059980708.db2.gz CYYNSBRIAXXUFC-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cccc2cnccc21)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000183294984 1059980727 /nfs/dbraw/zinc/98/07/27/1059980727.db2.gz CYYNSBRIAXXUFC-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cccc2cnccc21)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000183294984 1059980757 /nfs/dbraw/zinc/98/07/57/1059980757.db2.gz CYYNSBRIAXXUFC-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc(OC(C)C)c1 ZINC000191498187 1060188722 /nfs/dbraw/zinc/18/87/22/1060188722.db2.gz KLXHWBZPPCXIRK-UHFFFAOYSA-N 2 1 329.488 4.145 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc(OC(C)C)c1 ZINC000191498187 1060188737 /nfs/dbraw/zinc/18/87/37/1060188737.db2.gz KLXHWBZPPCXIRK-UHFFFAOYSA-N 2 1 329.488 4.145 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1nc(C)sc1C ZINC000390341327 1060292568 /nfs/dbraw/zinc/29/25/68/1060292568.db2.gz MPBYXKSCJQYHJL-AWEZNQCLSA-N 2 1 331.529 4.453 20 0 EIADMP C[C@@H]1CCCC[C@H]1C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001168825267 1060428406 /nfs/dbraw/zinc/42/84/06/1060428406.db2.gz HRUOHJMONODKKW-QUCCMNQESA-N 2 1 329.532 4.446 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCc2nsc3ccccc32)cc1 ZINC001168839027 1060451889 /nfs/dbraw/zinc/45/18/89/1060451889.db2.gz QJPVUTBBLSSSEK-UHFFFAOYSA-N 2 1 339.508 4.032 20 0 EIADMP C[C@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)CCC[C@@H]1C[NH3+] ZINC001205995739 1060510424 /nfs/dbraw/zinc/51/04/24/1060510424.db2.gz PTMFGELENJHKPF-NWDGAFQWSA-N 2 1 334.813 4.166 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)c1cc(Cl)cc(Cl)c1)C2 ZINC001169101336 1060635823 /nfs/dbraw/zinc/63/58/23/1060635823.db2.gz RESCQYXJMXCGIH-MUJYYYPQSA-N 2 1 327.299 4.443 20 0 EIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169154970 1060670584 /nfs/dbraw/zinc/67/05/84/1060670584.db2.gz VGTCDVTZZDTYDA-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP CC[NH+](Cc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169154970 1060670595 /nfs/dbraw/zinc/67/05/95/1060670595.db2.gz VGTCDVTZZDTYDA-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP CC[NH+](Cc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169154970 1060670602 /nfs/dbraw/zinc/67/06/02/1060670602.db2.gz VGTCDVTZZDTYDA-FVQHAEBGSA-N 2 1 326.406 4.153 20 0 EIADMP CC[NH+]1CCC([NH2+]C(C)(C)Cc2ccccc2C(F)(F)F)CC1 ZINC001169241535 1060715656 /nfs/dbraw/zinc/71/56/56/1060715656.db2.gz OWSYWPQZCNHRPC-UHFFFAOYSA-N 2 1 328.422 4.100 20 0 EIADMP CC[NH+]1CCC([NH+]2CCC(c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC001169255883 1060726512 /nfs/dbraw/zinc/72/65/12/1060726512.db2.gz VKNHFWUZNZQQBL-UHFFFAOYSA-N 2 1 340.433 4.369 20 0 EIADMP CC[NH+]1CCC([N@@H+]2CC[C@@H](c3ccc(OC(C)(C)C)cc3)C2)CC1 ZINC001169269042 1060751416 /nfs/dbraw/zinc/75/14/16/1060751416.db2.gz UMDIRRWEBKNNKX-GOSISDBHSA-N 2 1 330.516 4.138 20 0 EIADMP CC[NH+]1CCC([N@H+]2CC[C@@H](c3ccc(OC(C)(C)C)cc3)C2)CC1 ZINC001169269042 1060751429 /nfs/dbraw/zinc/75/14/29/1060751429.db2.gz UMDIRRWEBKNNKX-GOSISDBHSA-N 2 1 330.516 4.138 20 0 EIADMP Cc1ccsc1C[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001204024435 1060797157 /nfs/dbraw/zinc/79/71/57/1060797157.db2.gz XSJVLGXUUFDVPY-UHFFFAOYSA-N 2 1 328.525 4.401 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@@H]3C)s2)cc1 ZINC000532249384 1032110284 /nfs/dbraw/zinc/11/02/84/1032110284.db2.gz WYXNNSZKMKCTEY-YZVOILCLSA-N 2 1 344.524 4.242 20 0 EIADMP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000194226533 1032224820 /nfs/dbraw/zinc/22/48/20/1032224820.db2.gz NROGCAJACSBZJG-UHFFFAOYSA-N 2 1 348.494 4.208 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Sc3ccccc3)cc2)CC[N@H+]1C ZINC000532804326 1032322590 /nfs/dbraw/zinc/32/25/90/1032322590.db2.gz BEVNNXQPISFUKI-WMZOPIPTSA-N 2 1 326.509 4.410 20 0 EIADMP CC[N@@H+](Cc1sc(C)nc1C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174486095 1032401946 /nfs/dbraw/zinc/40/19/46/1032401946.db2.gz JWINSDGBCLRPIW-IBGZPJMESA-N 2 1 343.540 4.104 20 0 EIADMP CC[N@H+](Cc1sc(C)nc1C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000174486095 1032401950 /nfs/dbraw/zinc/40/19/50/1032401950.db2.gz JWINSDGBCLRPIW-IBGZPJMESA-N 2 1 343.540 4.104 20 0 EIADMP CC[NH+](Cc1sc(C)nc1C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000174486095 1032401958 /nfs/dbraw/zinc/40/19/58/1032401958.db2.gz JWINSDGBCLRPIW-IBGZPJMESA-N 2 1 343.540 4.104 20 0 EIADMP CC[NH+](Cc1sc(C)nc1C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174486095 1032401961 /nfs/dbraw/zinc/40/19/61/1032401961.db2.gz JWINSDGBCLRPIW-IBGZPJMESA-N 2 1 343.540 4.104 20 0 EIADMP CC[N@@H+](CC=C(C)C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533074421 1032474410 /nfs/dbraw/zinc/47/44/10/1032474410.db2.gz DSOZDWXLZDAURN-UHFFFAOYSA-N 2 1 330.520 4.165 20 0 EIADMP Clc1ccc(OCCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533077438 1032476560 /nfs/dbraw/zinc/47/65/60/1032476560.db2.gz BMXLLAHCDCNYPG-UZLBHIALSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000533077438 1032476577 /nfs/dbraw/zinc/47/65/77/1032476577.db2.gz BMXLLAHCDCNYPG-UZLBHIALSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000533077438 1032476591 /nfs/dbraw/zinc/47/65/91/1032476591.db2.gz BMXLLAHCDCNYPG-UZLBHIALSA-N 2 1 348.918 4.058 20 0 EIADMP Clc1ccc(OCCC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000533077438 1032476606 /nfs/dbraw/zinc/47/66/06/1032476606.db2.gz BMXLLAHCDCNYPG-UZLBHIALSA-N 2 1 348.918 4.058 20 0 EIADMP FC1(F)CC(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000450499641 1032541071 /nfs/dbraw/zinc/54/10/71/1032541071.db2.gz JJFKJTIQZGGCHZ-OALUTQOASA-N 2 1 334.454 4.018 20 0 EIADMP FC1(F)CC(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000450499642 1032541252 /nfs/dbraw/zinc/54/12/52/1032541252.db2.gz JJFKJTIQZGGCHZ-RBUKOAKNSA-N 2 1 334.454 4.018 20 0 EIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccccc1F ZINC000180622113 1032613551 /nfs/dbraw/zinc/61/35/51/1032613551.db2.gz WVVDRAFRJVRFCT-IBGZPJMESA-N 2 1 327.447 4.239 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC000093089039 1032656510 /nfs/dbraw/zinc/65/65/10/1032656510.db2.gz BTDJTKAZFJLKMS-UHFFFAOYSA-N 2 1 338.495 4.136 20 0 EIADMP CCC[N@@H+](CC)Cc1ccc(-c2nc([C@H]([NH3+])CC(C)C)no2)cc1 ZINC000339392476 1018838779 /nfs/dbraw/zinc/83/87/79/1018838779.db2.gz FFIAJDWGVKSPBU-QGZVFWFLSA-N 2 1 330.476 4.014 20 0 EIADMP COc1ccc(-c2ccccc2)cc1CNC[C@H]1CC[N@H+](C(C)C)C1 ZINC000579765406 1018873528 /nfs/dbraw/zinc/87/35/28/1018873528.db2.gz XUVIFFJWQLZYET-GOSISDBHSA-N 2 1 338.495 4.182 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000579765406 1018873534 /nfs/dbraw/zinc/87/35/34/1018873534.db2.gz XUVIFFJWQLZYET-GOSISDBHSA-N 2 1 338.495 4.182 20 0 EIADMP COc1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1CC[N@H+](C(C)C)C1 ZINC000579765406 1018873538 /nfs/dbraw/zinc/87/35/38/1018873538.db2.gz XUVIFFJWQLZYET-GOSISDBHSA-N 2 1 338.495 4.182 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)c(C)c2c1 ZINC000643545897 1018893753 /nfs/dbraw/zinc/89/37/53/1018893753.db2.gz FDTBVDSAEFNJQP-GJZGRUSLSA-N 2 1 328.456 4.075 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000530460224 1019001844 /nfs/dbraw/zinc/00/18/44/1019001844.db2.gz WUSCCFFUABZEHW-RHSMWYFYSA-N 2 1 338.282 4.195 20 0 EIADMP C[NH+](C)[C@H]1CCC[N@@H+](CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC000683227150 1019544599 /nfs/dbraw/zinc/54/45/99/1019544599.db2.gz CCPLVWMVXCFVGI-KRWDZBQOSA-N 2 1 328.422 4.054 20 0 EIADMP C[N@@H+](Cc1ccccc1NC(=O)CCCCCC[NH3+])C1CCCCC1 ZINC000237166636 1032850475 /nfs/dbraw/zinc/85/04/75/1032850475.db2.gz IWSWXGIRNUIYKG-UHFFFAOYSA-N 2 1 345.531 4.299 20 0 EIADMP CS[C@@H]1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000180141846 1020066219 /nfs/dbraw/zinc/06/62/19/1020066219.db2.gz RFUHKMZCLCDMOQ-JPGZLTHCSA-N 2 1 344.568 4.446 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000398190507 1020528949 /nfs/dbraw/zinc/52/89/49/1020528949.db2.gz ZETGDMONIDYTNF-KBXCAEBGSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc(Cl)cs1 ZINC000398190507 1020528974 /nfs/dbraw/zinc/52/89/74/1020528974.db2.gz ZETGDMONIDYTNF-KBXCAEBGSA-N 2 1 334.916 4.402 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+]([C@H]3CCc4ccc(F)cc43)C2)CC1 ZINC001167256151 1020683514 /nfs/dbraw/zinc/68/35/14/1020683514.db2.gz UFIOHYIHHBURPV-UTKZUKDTSA-N 2 1 330.491 4.257 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@H+]([C@H]3CCc4ccc(F)cc43)C2)CC1 ZINC001167256151 1020683524 /nfs/dbraw/zinc/68/35/24/1020683524.db2.gz UFIOHYIHHBURPV-UTKZUKDTSA-N 2 1 330.491 4.257 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2cc(F)cc3F)c1 ZINC000121279942 1020794895 /nfs/dbraw/zinc/79/48/95/1020794895.db2.gz NNUAFLAQVZWUOA-FQEVSTJZSA-N 2 1 330.422 4.194 20 0 EIADMP Cc1ccncc1[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000683691513 1021099271 /nfs/dbraw/zinc/09/92/71/1021099271.db2.gz YNVFDSFOHIZERQ-ZIBCJSCZSA-N 2 1 335.495 4.236 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c(C)o1 ZINC000310074142 1021587439 /nfs/dbraw/zinc/58/74/39/1021587439.db2.gz FLRCARBSYLIXGZ-PXNSSMCTSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c(C)o1 ZINC000310074142 1021587455 /nfs/dbraw/zinc/58/74/55/1021587455.db2.gz FLRCARBSYLIXGZ-PXNSSMCTSA-N 2 1 326.484 4.459 20 0 EIADMP CC[C@H]1C[N@H+](Cc2c(OC(F)F)ccc3ccccc32)CC[C@@H]1[NH3+] ZINC000647498169 1021623701 /nfs/dbraw/zinc/62/37/01/1021623701.db2.gz BXDSOQLSCBITEI-GUYCJALGSA-N 2 1 334.410 4.000 20 0 EIADMP CC[C@H]1C[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)CC[C@@H]1[NH3+] ZINC000647498169 1021623710 /nfs/dbraw/zinc/62/37/10/1021623710.db2.gz BXDSOQLSCBITEI-GUYCJALGSA-N 2 1 334.410 4.000 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)s1 ZINC000376165589 1021639799 /nfs/dbraw/zinc/63/97/99/1021639799.db2.gz ZQUICPWTRUDVGG-KKXDTOCCSA-N 2 1 329.513 4.104 20 0 EIADMP Fc1ccc(CC[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000685845601 1021711133 /nfs/dbraw/zinc/71/11/33/1021711133.db2.gz CFXDXEQRMMONLO-QGZVFWFLSA-N 2 1 346.877 4.133 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2cc3ccccc3[nH]2)cc1F ZINC000683926208 1021982434 /nfs/dbraw/zinc/98/24/34/1021982434.db2.gz BRXMTGVEDTWIKS-UHFFFAOYSA-N 2 1 334.398 4.091 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1csc(-c2ccccc2)n1 ZINC000414169527 1022019657 /nfs/dbraw/zinc/01/96/57/1022019657.db2.gz BGFOFIAVLFHPPW-HOTGVXAUSA-N 2 1 329.513 4.193 20 0 EIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000414170382 1022022309 /nfs/dbraw/zinc/02/23/09/1022022309.db2.gz BYYWSLMPMFOGJZ-VGOFRKELSA-N 2 1 349.478 4.239 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3nccc4ccccc43)CC2)[nH+]c1 ZINC000377822524 1022034270 /nfs/dbraw/zinc/03/42/70/1022034270.db2.gz YHEIQVRVOZINGA-KRWDZBQOSA-N 2 1 346.478 4.258 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3nccc4ccccc43)CC2)[nH+]c1 ZINC000377822525 1022035432 /nfs/dbraw/zinc/03/54/32/1022035432.db2.gz YHEIQVRVOZINGA-QGZVFWFLSA-N 2 1 346.478 4.258 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1csc(-c2ccccc2F)n1 ZINC000414193958 1022089494 /nfs/dbraw/zinc/08/94/94/1022089494.db2.gz UCIIGDPNIDCMKY-GJZGRUSLSA-N 2 1 347.503 4.332 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](CCSc2ccccc2F)CC1 ZINC000613491538 1022163830 /nfs/dbraw/zinc/16/38/30/1022163830.db2.gz WSJQQRUSTCNLOS-UHFFFAOYSA-N 2 1 338.536 4.362 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000236808712 1022170699 /nfs/dbraw/zinc/17/06/99/1022170699.db2.gz IQOGODFYSFVAJN-INIZCTEOSA-N 2 1 330.447 4.216 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000236808712 1022170719 /nfs/dbraw/zinc/17/07/19/1022170719.db2.gz IQOGODFYSFVAJN-INIZCTEOSA-N 2 1 330.447 4.216 20 0 EIADMP COc1ccsc1[C@H](C)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000471593614 1022200361 /nfs/dbraw/zinc/20/03/61/1022200361.db2.gz MJBLPSVVUAWZAB-BQFCYCMXSA-N 2 1 344.524 4.318 20 0 EIADMP COc1ccsc1[C@H](C)N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000471593614 1022200378 /nfs/dbraw/zinc/20/03/78/1022200378.db2.gz MJBLPSVVUAWZAB-BQFCYCMXSA-N 2 1 344.524 4.318 20 0 EIADMP c1ccc(CC2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCCCC2)cc1 ZINC000471592360 1022201834 /nfs/dbraw/zinc/20/18/34/1022201834.db2.gz DJPQTPURGMURLR-NHCUHLMSSA-N 2 1 326.528 4.396 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](C[C@H](OC)c2ccccc2)CC1)CC1CC1 ZINC000549387777 1022204611 /nfs/dbraw/zinc/20/46/11/1022204611.db2.gz PIPYXMHVFSMEPF-QFIPXVFZSA-N 2 1 344.543 4.208 20 0 EIADMP Cc1ncc([C@@H](C)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000245572044 1033036854 /nfs/dbraw/zinc/03/68/54/1033036854.db2.gz CCMFRKIOLJHHHY-ASKKUZCQSA-N 2 1 343.540 4.259 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+][C@H]2[C@H](C)CN(Cc3ccccc3)C[C@@H]2C)s1 ZINC000245572044 1033036871 /nfs/dbraw/zinc/03/68/71/1033036871.db2.gz CCMFRKIOLJHHHY-ASKKUZCQSA-N 2 1 343.540 4.259 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000245572044 1033036888 /nfs/dbraw/zinc/03/68/88/1033036888.db2.gz CCMFRKIOLJHHHY-ASKKUZCQSA-N 2 1 343.540 4.259 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000245572044 1033036910 /nfs/dbraw/zinc/03/69/10/1033036910.db2.gz CCMFRKIOLJHHHY-ASKKUZCQSA-N 2 1 343.540 4.259 20 0 EIADMP CO[C@](C)([C@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000414249797 1022309162 /nfs/dbraw/zinc/30/91/62/1022309162.db2.gz XINUBNHKNBESPJ-SQIAZXFVSA-N 2 1 344.543 4.223 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@@H]2CCCC23CCOCC3)C1 ZINC001167424091 1022317194 /nfs/dbraw/zinc/31/71/94/1022317194.db2.gz AXNRWPIMZJTFCO-HKBOAZHASA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@@H]2CCCC23CCOCC3)C1 ZINC001167424091 1022317213 /nfs/dbraw/zinc/31/72/13/1022317213.db2.gz AXNRWPIMZJTFCO-HKBOAZHASA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@@H]2CCCC23CCOCC3)C1 ZINC001167424091 1022317227 /nfs/dbraw/zinc/31/72/27/1022317227.db2.gz AXNRWPIMZJTFCO-HKBOAZHASA-N 2 1 348.575 4.170 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2csc(C(F)(F)F)n2)C1 ZINC000892590178 1022358583 /nfs/dbraw/zinc/35/85/83/1022358583.db2.gz RSXCFPLELMEWBU-BETUJISGSA-N 2 1 349.466 4.010 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2csc(C(F)(F)F)n2)C1 ZINC000892590178 1022358562 /nfs/dbraw/zinc/35/85/62/1022358562.db2.gz RSXCFPLELMEWBU-BETUJISGSA-N 2 1 349.466 4.010 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398165577 1022409169 /nfs/dbraw/zinc/40/91/69/1022409169.db2.gz GSYBSAHFRJSWIH-NJNPRVFISA-N 2 1 340.486 4.257 20 0 EIADMP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398165577 1022409179 /nfs/dbraw/zinc/40/91/79/1022409179.db2.gz GSYBSAHFRJSWIH-NJNPRVFISA-N 2 1 340.486 4.257 20 0 EIADMP CC[C@H]([NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1nc(C(F)(F)F)cs1 ZINC000925525158 1022555085 /nfs/dbraw/zinc/55/50/85/1022555085.db2.gz ALLDPPBHAMKNTR-VWYCJHECSA-N 2 1 335.439 4.109 20 0 EIADMP c1cc(-c2nc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cs2)cs1 ZINC000647542795 1022777598 /nfs/dbraw/zinc/77/75/98/1022777598.db2.gz BXMMMHGZBCDVMS-HUUCEWRRSA-N 2 1 347.553 4.083 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000374542762 1022786216 /nfs/dbraw/zinc/78/62/16/1022786216.db2.gz HSYDIUXRGOTNOZ-HKBOAZHASA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCO1 ZINC000374542762 1022786232 /nfs/dbraw/zinc/78/62/32/1022786232.db2.gz HSYDIUXRGOTNOZ-HKBOAZHASA-N 2 1 344.543 4.080 20 0 EIADMP Clc1cc2cccnc2c(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1 ZINC000647543894 1022797427 /nfs/dbraw/zinc/79/74/27/1022797427.db2.gz UDWOJAYPLJFYHZ-IAGOWNOFSA-N 2 1 343.902 4.100 20 0 EIADMP C[C@H]([NH2+]CCc1c(F)cccc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000402101120 1022800440 /nfs/dbraw/zinc/80/04/40/1022800440.db2.gz VGCRZWLMUXDAJU-FUHWJXTLSA-N 2 1 344.449 4.008 20 0 EIADMP CCOc1cccc(C[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000311003475 1022812072 /nfs/dbraw/zinc/81/20/72/1022812072.db2.gz KGMUZTVRSYCCND-QFIPXVFZSA-N 2 1 338.495 4.087 20 0 EIADMP CC[NH2+]CC1CC[NH+](Cc2csc(Nc3ccc(C)cc3)n2)CC1 ZINC000430540746 1022890762 /nfs/dbraw/zinc/89/07/62/1022890762.db2.gz AMOYIZSSRDZQDY-UHFFFAOYSA-N 2 1 344.528 4.017 20 0 EIADMP Cc1cccc(N2CCC([NH2+]C3CC(c4cccc(F)c4)C3)CC2)[nH+]1 ZINC000378625339 1022896792 /nfs/dbraw/zinc/89/67/92/1022896792.db2.gz PBAAUFNVTCJBPC-UHFFFAOYSA-N 2 1 339.458 4.034 20 0 EIADMP C[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1c1ccccc1)C1CCC(C(F)(F)F)CC1 ZINC000423498000 1022931004 /nfs/dbraw/zinc/93/10/04/1022931004.db2.gz AVVDITJPSCFLFJ-KRLXULGHSA-N 2 1 340.433 4.089 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CCC[C@@H]([C@@H](C)[NH3+])C3)s2)cc1 ZINC000430556795 1023005550 /nfs/dbraw/zinc/00/55/50/1023005550.db2.gz VKDCODRWJDXUEO-CRAIPNDOSA-N 2 1 343.540 4.493 20 0 EIADMP CC[N@@H+](Cc1ccc(Cl)cc1C(F)(F)F)C1CCN(C)CC1 ZINC001143505964 1023028667 /nfs/dbraw/zinc/02/86/67/1023028667.db2.gz QMOBTSHOIKVSOR-UHFFFAOYSA-N 2 1 334.813 4.275 20 0 EIADMP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000165313484 1023029030 /nfs/dbraw/zinc/02/90/30/1023029030.db2.gz PINRHQNEEJFJCZ-PKOBYXMFSA-N 2 1 334.573 4.061 20 0 EIADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000236602663 1023105560 /nfs/dbraw/zinc/10/55/60/1023105560.db2.gz RQCRUQQNRQXPBK-UHFFFAOYSA-N 2 1 338.495 4.228 20 0 EIADMP CC[NH+](CC)CCC[NH2+]Cc1ccc(-c2ccccc2OC)cc1 ZINC000236853514 1023186232 /nfs/dbraw/zinc/18/62/32/1023186232.db2.gz XJMSKMNAGFQJOI-UHFFFAOYSA-N 2 1 326.484 4.184 20 0 EIADMP C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687839 1023188691 /nfs/dbraw/zinc/18/86/91/1023188691.db2.gz PXEIDOKANLTINQ-DNVCBOLYSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687839 1023188696 /nfs/dbraw/zinc/18/86/96/1023188696.db2.gz PXEIDOKANLTINQ-DNVCBOLYSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687839 1023188698 /nfs/dbraw/zinc/18/86/98/1023188698.db2.gz PXEIDOKANLTINQ-DNVCBOLYSA-N 2 1 328.431 4.002 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCN(c3ccccc3)C2)cc1 ZINC000153856781 1023343974 /nfs/dbraw/zinc/34/39/74/1023343974.db2.gz AURFVGHRHOUMBD-YLJYHZDGSA-N 2 1 346.478 4.110 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC(N[C@H](CCC[NH3+])c2ccccc2)CC1 ZINC000415052866 1023409812 /nfs/dbraw/zinc/40/98/12/1023409812.db2.gz LVQOOQNRRYKSRT-STZQEDGTSA-N 2 1 343.559 4.099 20 0 EIADMP Fc1ccc(CC[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c(Cl)c1 ZINC000415087945 1023438228 /nfs/dbraw/zinc/43/82/28/1023438228.db2.gz LITWYURKOBCUMJ-PKOBYXMFSA-N 2 1 332.850 4.105 20 0 EIADMP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C[C@H]([NH3+])CC(C)C)s2)cc1 ZINC000415096617 1023440376 /nfs/dbraw/zinc/44/03/76/1023440376.db2.gz BTOWOFXXGQXBIL-CZUORRHYSA-N 2 1 347.528 4.151 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@@H]1c1ccccc1 ZINC000581621801 1023440874 /nfs/dbraw/zinc/44/08/74/1023440874.db2.gz HGAOZWZIEBGCFV-TZIWHRDSSA-N 2 1 338.495 4.269 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@@H]1c1ccccc1 ZINC000581621801 1023440882 /nfs/dbraw/zinc/44/08/82/1023440882.db2.gz HGAOZWZIEBGCFV-TZIWHRDSSA-N 2 1 338.495 4.269 20 0 EIADMP CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000415100261 1023443656 /nfs/dbraw/zinc/44/36/56/1023443656.db2.gz HUMIFGBOZKTVKT-IKGGRYGDSA-N 2 1 328.504 4.018 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000415121014 1023451641 /nfs/dbraw/zinc/45/16/41/1023451641.db2.gz YSKPEYXAAKBRNR-CFLQYTFWSA-N 2 1 330.422 4.151 20 0 EIADMP C[N@@H+]1CC[C@H](C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)[C@@H]1c1cccs1 ZINC000377386050 1023504221 /nfs/dbraw/zinc/50/42/21/1023504221.db2.gz LWZHUUPMJVUIDJ-YALNPMBYSA-N 2 1 338.586 4.251 20 0 EIADMP C[N@H+]1CC[C@H](C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)[C@@H]1c1cccs1 ZINC000377386050 1023504229 /nfs/dbraw/zinc/50/42/29/1023504229.db2.gz LWZHUUPMJVUIDJ-YALNPMBYSA-N 2 1 338.586 4.251 20 0 EIADMP c1sc(C[N@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)nc1-c1ccccc1 ZINC000656784829 1023531837 /nfs/dbraw/zinc/53/18/37/1023531837.db2.gz HSQOAODBBXUUGG-GOSISDBHSA-N 2 1 341.524 4.022 20 0 EIADMP Cc1n[nH]cc1C1CC[NH+]([C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000377632569 1023649060 /nfs/dbraw/zinc/64/90/60/1023649060.db2.gz SYRAFZGIQXJMSZ-MRXNPFEDSA-N 2 1 349.482 4.153 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000236778881 1023678689 /nfs/dbraw/zinc/67/86/89/1023678689.db2.gz GLPJJCVTDVIAHW-UHFFFAOYSA-N 2 1 334.813 4.323 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000398097549 1023683126 /nfs/dbraw/zinc/68/31/26/1023683126.db2.gz KWUSLTALRXMGNE-OXJNMPFZSA-N 2 1 328.887 4.340 20 0 EIADMP Cc1ccc([C@@H](C2CC2)[N@H+](C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1 ZINC000377688615 1023687143 /nfs/dbraw/zinc/68/71/43/1023687143.db2.gz AFPXSLHYNQRNEL-VABKMULXSA-N 2 1 349.522 4.466 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(CN[C@H]2CC[N@H+]3CCC[C@H]3C2)o1 ZINC000377750836 1023741682 /nfs/dbraw/zinc/74/16/82/1023741682.db2.gz WTCJWEDELPJKBG-IRXDYDNUSA-N 2 1 328.431 4.111 20 0 EIADMP CCC[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1 ZINC000471780431 1023841186 /nfs/dbraw/zinc/84/11/86/1023841186.db2.gz NAPJVWNRVVDEHK-MRXNPFEDSA-N 2 1 326.271 4.400 20 0 EIADMP CCC[C@H]([NH2+]CCc1c[nH+]cn1C)c1cccc(C(F)(F)F)c1 ZINC000276727898 1023905213 /nfs/dbraw/zinc/90/52/13/1023905213.db2.gz XMXIRBPFLGCYJH-INIZCTEOSA-N 2 1 325.378 4.112 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@@H]2C)o1 ZINC000581948653 1023923857 /nfs/dbraw/zinc/92/38/57/1023923857.db2.gz VHXHHOFUDNIDJS-LIRRHRJNSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@@H]2C)o1 ZINC000581948653 1023923864 /nfs/dbraw/zinc/92/38/64/1023923864.db2.gz VHXHHOFUDNIDJS-LIRRHRJNSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)o1 ZINC000581948653 1023923872 /nfs/dbraw/zinc/92/38/72/1023923872.db2.gz VHXHHOFUDNIDJS-LIRRHRJNSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)o1 ZINC000581948653 1023923878 /nfs/dbraw/zinc/92/38/78/1023923878.db2.gz VHXHHOFUDNIDJS-LIRRHRJNSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CO2 ZINC000581962210 1023939273 /nfs/dbraw/zinc/93/92/73/1023939273.db2.gz PLZIPDQNBSZQFV-XWSHUIEDSA-N 2 1 348.490 4.214 20 0 EIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3Cc1ccccc1)CO2 ZINC000581962210 1023939290 /nfs/dbraw/zinc/93/92/90/1023939290.db2.gz PLZIPDQNBSZQFV-XWSHUIEDSA-N 2 1 348.490 4.214 20 0 EIADMP COc1cccc([C@H](C)[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000430710902 1023965646 /nfs/dbraw/zinc/96/56/46/1023965646.db2.gz UYBMRFRSVCJWNL-ICSRJNTNSA-N 2 1 338.495 4.210 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccccc1)[C@@H]1COC(C)(C)C1 ZINC000661199605 1023983683 /nfs/dbraw/zinc/98/36/83/1023983683.db2.gz QIHTWTYOGJRCRM-FQEVSTJZSA-N 2 1 341.499 4.041 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccccc1)[C@@H]1COC(C)(C)C1 ZINC000661199605 1023983708 /nfs/dbraw/zinc/98/37/08/1023983708.db2.gz QIHTWTYOGJRCRM-FQEVSTJZSA-N 2 1 341.499 4.041 20 0 EIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2cccc(C)c2)c2cccc(F)c2)C1 ZINC000510648511 1024169215 /nfs/dbraw/zinc/16/92/15/1024169215.db2.gz FRPFRSDQCJQREI-UWJYYQICSA-N 2 1 326.459 4.155 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2cccc(C)c2)c2cccc(F)c2)C1 ZINC000510648511 1024169236 /nfs/dbraw/zinc/16/92/36/1024169236.db2.gz FRPFRSDQCJQREI-UWJYYQICSA-N 2 1 326.459 4.155 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510671960 1024207723 /nfs/dbraw/zinc/20/77/23/1024207723.db2.gz ROOZVPMIOSWFJY-WBVHZDCISA-N 2 1 342.449 4.348 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000510683428 1024229259 /nfs/dbraw/zinc/22/92/59/1024229259.db2.gz FVYSFJYSYGNDND-OLMNPRSZSA-N 2 1 340.433 4.243 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000510683428 1024229276 /nfs/dbraw/zinc/22/92/76/1024229276.db2.gz FVYSFJYSYGNDND-OLMNPRSZSA-N 2 1 340.433 4.243 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000510683429 1024231029 /nfs/dbraw/zinc/23/10/29/1024231029.db2.gz FVYSFJYSYGNDND-ZTFGCOKTSA-N 2 1 340.433 4.243 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000510683429 1024231046 /nfs/dbraw/zinc/23/10/46/1024231046.db2.gz FVYSFJYSYGNDND-ZTFGCOKTSA-N 2 1 340.433 4.243 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000510683427 1024231176 /nfs/dbraw/zinc/23/11/76/1024231176.db2.gz FVYSFJYSYGNDND-JLSDUUJJSA-N 2 1 340.433 4.243 20 0 EIADMP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000510683427 1024231188 /nfs/dbraw/zinc/23/11/88/1024231188.db2.gz FVYSFJYSYGNDND-JLSDUUJJSA-N 2 1 340.433 4.243 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1cccc(C)c1)c1cccc(F)c1 ZINC000510687003 1024233992 /nfs/dbraw/zinc/23/39/92/1024233992.db2.gz NJQMMFUMUHMWQE-NRFANRHFSA-N 2 1 337.442 4.408 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510699550 1024252659 /nfs/dbraw/zinc/25/26/59/1024252659.db2.gz BZSMHBUQTFDQRG-DOTOQJQBSA-N 2 1 342.449 4.348 20 0 EIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1Cl ZINC000401781545 1024267543 /nfs/dbraw/zinc/26/75/43/1024267543.db2.gz QMBMTLCLNWJDFH-SECBINFHSA-N 2 1 332.662 4.274 20 0 EIADMP FCCC[C@H]1CCC[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000510723890 1024318825 /nfs/dbraw/zinc/31/88/25/1024318825.db2.gz UQRFZZRGLWNUCT-TZIWHRDSSA-N 2 1 332.507 4.202 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H]2CCOc3c(-c4ccccc4)cccc32)CC1 ZINC000341685013 1024321726 /nfs/dbraw/zinc/32/17/26/1024321726.db2.gz CJBVTBYWAPQQRO-OAQYLSRUSA-N 2 1 336.479 4.251 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341696899 1024339783 /nfs/dbraw/zinc/33/97/83/1024339783.db2.gz MFSOCVSTZVBHIR-CRAIPNDOSA-N 2 1 336.907 4.264 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341696899 1024339795 /nfs/dbraw/zinc/33/97/95/1024339795.db2.gz MFSOCVSTZVBHIR-CRAIPNDOSA-N 2 1 336.907 4.264 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)ccc1Cl ZINC000510738282 1024380201 /nfs/dbraw/zinc/38/02/01/1024380201.db2.gz VGMPBVKTDJRKKI-YESZJQIVSA-N 2 1 338.923 4.268 20 0 EIADMP Cc1cc(OCCC[C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1Cl ZINC000510738282 1024380217 /nfs/dbraw/zinc/38/02/17/1024380217.db2.gz VGMPBVKTDJRKKI-YESZJQIVSA-N 2 1 338.923 4.268 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)Cc1c(Cl)cccc1Cl ZINC000510927674 1024834069 /nfs/dbraw/zinc/83/40/69/1024834069.db2.gz GRUKPUQMIIYGBS-LBPRGKRZSA-N 2 1 326.271 4.109 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000510969976 1024871776 /nfs/dbraw/zinc/87/17/76/1024871776.db2.gz SRHPQNOYKMWVIL-ACRUOGEOSA-N 2 1 344.543 4.082 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000510969976 1024871778 /nfs/dbraw/zinc/87/17/78/1024871778.db2.gz SRHPQNOYKMWVIL-ACRUOGEOSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCc2ccccc2[C@H]1Cc1ccccc1 ZINC000535678526 1024878370 /nfs/dbraw/zinc/87/83/70/1024878370.db2.gz CCWUPUVOMDWWCL-HSZRJFAPSA-N 2 1 345.490 4.424 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCc2ccccc2[C@H]1Cc1ccccc1 ZINC000535678526 1024878372 /nfs/dbraw/zinc/87/83/72/1024878372.db2.gz CCWUPUVOMDWWCL-HSZRJFAPSA-N 2 1 345.490 4.424 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc2cc(Cl)ccc2o1 ZINC000278858978 1024946839 /nfs/dbraw/zinc/94/68/39/1024946839.db2.gz AWZQZOOOSQJIOM-OLZOCXBDSA-N 2 1 329.831 4.196 20 0 EIADMP C[C@@H](c1ccc(OC(F)F)cc1)[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295870 1025050339 /nfs/dbraw/zinc/05/03/39/1025050339.db2.gz IIEDUBYJKJMPJO-WMLDXEAASA-N 2 1 338.442 4.061 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cccs3)CC2)cs1 ZINC000161772654 1025073161 /nfs/dbraw/zinc/07/31/61/1025073161.db2.gz RYWFMTDBTZTQJR-AWEZNQCLSA-N 2 1 349.569 4.330 20 0 EIADMP c1nc(-c2ccccc2)sc1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663347125 1025143090 /nfs/dbraw/zinc/14/30/90/1025143090.db2.gz ZKSSDFXNXDCWIW-KRWDZBQOSA-N 2 1 341.524 4.022 20 0 EIADMP c1nc(-c2ccccc2)sc1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663347125 1025143097 /nfs/dbraw/zinc/14/30/97/1025143097.db2.gz ZKSSDFXNXDCWIW-KRWDZBQOSA-N 2 1 341.524 4.022 20 0 EIADMP CSc1ccccc1C[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467332 1025397473 /nfs/dbraw/zinc/39/74/73/1025397473.db2.gz DWCAFYHQDXYNPX-AEFFLSMTSA-N 2 1 332.557 4.051 20 0 EIADMP COCC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)(C)C ZINC000511002526 1025415775 /nfs/dbraw/zinc/41/57/75/1025415775.db2.gz UAKPAWVGMGZFIA-IHPCNDPISA-N 2 1 332.532 4.080 20 0 EIADMP COCC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)(C)C ZINC000511002526 1025415790 /nfs/dbraw/zinc/41/57/90/1025415790.db2.gz UAKPAWVGMGZFIA-IHPCNDPISA-N 2 1 332.532 4.080 20 0 EIADMP COCC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C ZINC000511002525 1025416197 /nfs/dbraw/zinc/41/61/97/1025416197.db2.gz UAKPAWVGMGZFIA-HOJAQTOUSA-N 2 1 332.532 4.080 20 0 EIADMP COCC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C ZINC000511002525 1025416202 /nfs/dbraw/zinc/41/62/02/1025416202.db2.gz UAKPAWVGMGZFIA-HOJAQTOUSA-N 2 1 332.532 4.080 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cnc2ccsc2c1 ZINC000663470616 1025421206 /nfs/dbraw/zinc/42/12/06/1025421206.db2.gz VMOQNMWCNJMMKX-HOCLYGCPSA-N 2 1 329.513 4.069 20 0 EIADMP CC[C@@H](CC(F)(F)F)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000546165261 1025598225 /nfs/dbraw/zinc/59/82/25/1025598225.db2.gz BEINYOYJCRZTMT-INIZCTEOSA-N 2 1 328.422 4.014 20 0 EIADMP Cc1ccc2cc(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)[nH]c2c1 ZINC000657285347 1025619476 /nfs/dbraw/zinc/61/94/76/1025619476.db2.gz DNTIGFDPOLOREH-UHFFFAOYSA-N 2 1 333.479 4.231 20 0 EIADMP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000643524155 1025679497 /nfs/dbraw/zinc/67/94/97/1025679497.db2.gz QLGZEWXEDHDCHO-URVUXULASA-N 2 1 349.453 4.323 20 0 EIADMP C[N@@H+](CCc1c(Cl)cccc1Cl)CC[C@H]1CCCC[NH+]1C ZINC001167508307 1025749165 /nfs/dbraw/zinc/74/91/65/1025749165.db2.gz GBZSJHUEMGAIIH-CQSZACIVSA-N 2 1 329.315 4.342 20 0 EIADMP C[N@H+](CCc1c(Cl)cccc1Cl)CC[C@H]1CCCC[NH+]1C ZINC001167508307 1025749195 /nfs/dbraw/zinc/74/91/95/1025749195.db2.gz GBZSJHUEMGAIIH-CQSZACIVSA-N 2 1 329.315 4.342 20 0 EIADMP C[NH+](CCc1c(Cl)cccc1Cl)CC[C@H]1CCCC[N@@H+]1C ZINC001167508307 1025749223 /nfs/dbraw/zinc/74/92/23/1025749223.db2.gz GBZSJHUEMGAIIH-CQSZACIVSA-N 2 1 329.315 4.342 20 0 EIADMP C[NH+](CCc1c(Cl)cccc1Cl)CC[C@H]1CCCC[N@H+]1C ZINC001167508307 1025749261 /nfs/dbraw/zinc/74/92/61/1025749261.db2.gz GBZSJHUEMGAIIH-CQSZACIVSA-N 2 1 329.315 4.342 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCSC[C@H]1c1ccc(F)cc1 ZINC001167833327 1025789735 /nfs/dbraw/zinc/78/97/35/1025789735.db2.gz AFRDRCNGTCXCIM-APWZRJJASA-N 2 1 338.536 4.426 20 0 EIADMP CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)[C@@H](C)CCC[NH+](CC)CC ZINC001167835290 1025836885 /nfs/dbraw/zinc/83/68/85/1025836885.db2.gz RBOJGSXQGMSUTF-AZUAARDMSA-N 2 1 332.532 4.480 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCCOc3c(C(C)C)cccc32)CC1 ZINC000431324743 1025838437 /nfs/dbraw/zinc/83/84/37/1025838437.db2.gz XXRLTDQNBPWVOK-HXUWFJFHSA-N 2 1 330.516 4.488 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCCOc3c(C)cc(Cl)cc32)CC1 ZINC000431323823 1025841783 /nfs/dbraw/zinc/84/17/83/1025841783.db2.gz QGILRKJDOYHBAC-GOSISDBHSA-N 2 1 336.907 4.326 20 0 EIADMP CCc1ccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cn1 ZINC000512047145 1025844010 /nfs/dbraw/zinc/84/40/10/1025844010.db2.gz XRMRDKQSQYBOHP-AZUAARDMSA-N 2 1 337.511 4.034 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(SC(F)F)cc1 ZINC000278943187 1025855729 /nfs/dbraw/zinc/85/57/29/1025855729.db2.gz KJZVIACXTKNKGS-STQMWFEESA-N 2 1 337.439 4.111 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@H](c2ccccc2)C2CCCC2)CCCO1 ZINC000432404669 1025871742 /nfs/dbraw/zinc/87/17/42/1025871742.db2.gz FFCPEKVNRQKPJN-WIYYLYMNSA-N 2 1 330.516 4.008 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](Cc1ccc(F)cc1)c1ccccc1 ZINC000511054108 1025897183 /nfs/dbraw/zinc/89/71/83/1025897183.db2.gz IQAYXJSUQOEPRZ-NRFANRHFSA-N 2 1 337.442 4.294 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](Cc1ccc(F)cc1)c1ccccc1 ZINC000511054109 1025898056 /nfs/dbraw/zinc/89/80/56/1025898056.db2.gz IQAYXJSUQOEPRZ-OAQYLSRUSA-N 2 1 337.442 4.294 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H](c2ccccc2F)C2CCCC2)CCCO1 ZINC000432420123 1025898141 /nfs/dbraw/zinc/89/81/41/1025898141.db2.gz IYVIVNZMTWAMQW-DYESRHJHSA-N 2 1 348.506 4.148 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH2+][C@H](CC2CCC2)c2ccccc2)CCCO1 ZINC000432421193 1025902633 /nfs/dbraw/zinc/90/26/33/1025902633.db2.gz OKJFVISBYQILHB-GHTZIAJQSA-N 2 1 330.516 4.008 20 0 EIADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000582030422 1025990404 /nfs/dbraw/zinc/99/04/04/1025990404.db2.gz QTQNWZSVAQICBS-CQSZACIVSA-N 2 1 334.410 4.045 20 0 EIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000582030422 1025990423 /nfs/dbraw/zinc/99/04/23/1025990423.db2.gz QTQNWZSVAQICBS-CQSZACIVSA-N 2 1 334.410 4.045 20 0 EIADMP C[C@H](CC(C)(C)c1ccccc1)[NH2+]Cc1ncc(C[NH+](C)C)s1 ZINC000512129084 1026073632 /nfs/dbraw/zinc/07/36/32/1026073632.db2.gz HDVHWLSXIDFSMZ-OAHLLOKOSA-N 2 1 331.529 4.051 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000344307603 1026230006 /nfs/dbraw/zinc/23/00/06/1026230006.db2.gz XEZLEJIGMYBFIN-OAHLLOKOSA-N 2 1 341.282 4.059 20 0 EIADMP Clc1nccc2cc(C[NH2+]C3CC([NH+]4CCCCC4)C3)sc21 ZINC000894624040 1026269064 /nfs/dbraw/zinc/26/90/64/1026269064.db2.gz UQCHUSIWZHBMKW-UHFFFAOYSA-N 2 1 335.904 4.056 20 0 EIADMP Cc1ccccc1CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001167975657 1026279789 /nfs/dbraw/zinc/27/97/89/1026279789.db2.gz TVPNOLOIWUVWKM-FRIKZZABSA-N 2 1 338.539 4.313 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1cc2cc(Br)ccc2o1 ZINC000049553335 1026297148 /nfs/dbraw/zinc/29/71/48/1026297148.db2.gz AKTJXCCZSDTAAT-NWDGAFQWSA-N 2 1 339.277 4.186 20 0 EIADMP COc1cccc(CCC[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC000303950948 1026297556 /nfs/dbraw/zinc/29/75/56/1026297556.db2.gz VRMRGZNYEFNSAA-TZIWHRDSSA-N 2 1 344.543 4.214 20 0 EIADMP COc1cccc(CCC[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC000303950948 1026297574 /nfs/dbraw/zinc/29/75/74/1026297574.db2.gz VRMRGZNYEFNSAA-TZIWHRDSSA-N 2 1 344.543 4.214 20 0 EIADMP COc1cccc(CCC[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)c1 ZINC000303950948 1026297588 /nfs/dbraw/zinc/29/75/88/1026297588.db2.gz VRMRGZNYEFNSAA-TZIWHRDSSA-N 2 1 344.543 4.214 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000049553334 1026299017 /nfs/dbraw/zinc/29/90/17/1026299017.db2.gz AKTJXCCZSDTAAT-NEPJUHHUSA-N 2 1 339.277 4.186 20 0 EIADMP COCCCC[N@H+]1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664836026 1026306870 /nfs/dbraw/zinc/30/68/70/1026306870.db2.gz IJXJNOVMCUGQTR-OAQYLSRUSA-N 2 1 344.543 4.036 20 0 EIADMP Fc1ccccc1CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001167979096 1026343132 /nfs/dbraw/zinc/34/31/32/1026343132.db2.gz VDCSLBORHDBWRV-IHWFROFDSA-N 2 1 342.502 4.143 20 0 EIADMP COc1ccccc1CC(C)(C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167979045 1026348549 /nfs/dbraw/zinc/34/85/49/1026348549.db2.gz TXFCKZJHFVCVKN-IHWFROFDSA-N 2 1 342.527 4.011 20 0 EIADMP CC[C@@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)CC1 ZINC000657371232 1026352861 /nfs/dbraw/zinc/35/28/61/1026352861.db2.gz ONRUTSITGSNGBA-QUCCMNQESA-N 2 1 347.547 4.452 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCCS2 ZINC000119703828 1026362904 /nfs/dbraw/zinc/36/29/04/1026362904.db2.gz UVXMRRWQZWQYBT-QGZVFWFLSA-N 2 1 336.932 4.483 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCCSc2ccccc2Cl)C1 ZINC001167558782 1026384354 /nfs/dbraw/zinc/38/43/54/1026384354.db2.gz SPVODWVLHROCBW-INIZCTEOSA-N 2 1 340.964 4.486 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](CCCSc2ccccc2Cl)C1 ZINC001167558782 1026384370 /nfs/dbraw/zinc/38/43/70/1026384370.db2.gz SPVODWVLHROCBW-INIZCTEOSA-N 2 1 340.964 4.486 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](CCCSc2ccccc2Cl)C1 ZINC001167558782 1026384385 /nfs/dbraw/zinc/38/43/85/1026384385.db2.gz SPVODWVLHROCBW-INIZCTEOSA-N 2 1 340.964 4.486 20 0 EIADMP COc1ccc(CC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC000342475434 1026409261 /nfs/dbraw/zinc/40/92/61/1026409261.db2.gz SJADNFBFWLXVRJ-INIZCTEOSA-N 2 1 335.451 4.083 20 0 EIADMP COCc1csc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000657389128 1026425147 /nfs/dbraw/zinc/42/51/47/1026425147.db2.gz SBEPBLFPONSVAN-APWZRJJASA-N 2 1 344.524 4.037 20 0 EIADMP COCc1csc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000657389128 1026425151 /nfs/dbraw/zinc/42/51/51/1026425151.db2.gz SBEPBLFPONSVAN-APWZRJJASA-N 2 1 344.524 4.037 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3cnc4ccccc4c3)CC2)n2c1CCCC2 ZINC000279508876 1026465057 /nfs/dbraw/zinc/46/50/57/1026465057.db2.gz WYDLKIOZFFYVJD-UHFFFAOYSA-N 2 1 346.478 4.147 20 0 EIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(F)c(F)c(F)c2)CC1 ZINC000506864738 1026470380 /nfs/dbraw/zinc/47/03/80/1026470380.db2.gz BLROPAXGPOSMAQ-UHFFFAOYSA-N 2 1 328.422 4.048 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(F)c(F)c(F)c2)CC1 ZINC000506864738 1026470387 /nfs/dbraw/zinc/47/03/87/1026470387.db2.gz BLROPAXGPOSMAQ-UHFFFAOYSA-N 2 1 328.422 4.048 20 0 EIADMP CCCc1csc(C[N@H+](CC)Cc2ccc(C[NH+](C)C)cc2)n1 ZINC000348970781 1026625317 /nfs/dbraw/zinc/62/53/17/1026625317.db2.gz WXMCNNTYKRAITA-UHFFFAOYSA-N 2 1 331.529 4.179 20 0 EIADMP CCCc1csc(C[N@@H+](CC)Cc2ccc(C[NH+](C)C)cc2)n1 ZINC000348970781 1026625320 /nfs/dbraw/zinc/62/53/20/1026625320.db2.gz WXMCNNTYKRAITA-UHFFFAOYSA-N 2 1 331.529 4.179 20 0 EIADMP C[C@H](N[C@H]1CCc2c1c(F)ccc2F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512312363 1026682039 /nfs/dbraw/zinc/68/20/39/1026682039.db2.gz DOONYDLLOFPKEA-NJSLBKSFSA-N 2 1 334.454 4.195 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2c1c(F)ccc2F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512312363 1026682042 /nfs/dbraw/zinc/68/20/42/1026682042.db2.gz DOONYDLLOFPKEA-NJSLBKSFSA-N 2 1 334.454 4.195 20 0 EIADMP C[C@H]([NH2+][C@H]1CCc2c1c(F)ccc2F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512312363 1026682047 /nfs/dbraw/zinc/68/20/47/1026682047.db2.gz DOONYDLLOFPKEA-NJSLBKSFSA-N 2 1 334.454 4.195 20 0 EIADMP Fc1ccccc1C[N@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000432664770 1026689335 /nfs/dbraw/zinc/68/93/35/1026689335.db2.gz OJFKBVJKTJCGAA-SFHVURJKSA-N 2 1 330.472 4.032 20 0 EIADMP Fc1ccccc1C[N@@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000432664770 1026689338 /nfs/dbraw/zinc/68/93/38/1026689338.db2.gz OJFKBVJKTJCGAA-SFHVURJKSA-N 2 1 330.472 4.032 20 0 EIADMP Cc1cc(OCC[N@H+](C)C2CC[NH+](C(C)C)CC2)ccc1C(C)C ZINC000507341323 1026751798 /nfs/dbraw/zinc/75/17/98/1026751798.db2.gz RAIBGEZSUFHAAJ-UHFFFAOYSA-N 2 1 332.532 4.302 20 0 EIADMP CC[NH+]1CCN(c2ccccc2C[N@@H+](C)[C@H](C)c2cccs2)CC1 ZINC000507440095 1026794828 /nfs/dbraw/zinc/79/48/28/1026794828.db2.gz HEBNQILQBPJIHC-QGZVFWFLSA-N 2 1 343.540 4.083 20 0 EIADMP CCc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)cn1 ZINC000512370165 1026812591 /nfs/dbraw/zinc/81/25/91/1026812591.db2.gz LZBANZGVJAYHDP-NRFANRHFSA-N 2 1 337.511 4.034 20 0 EIADMP CCc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)cn1 ZINC000512370165 1026812593 /nfs/dbraw/zinc/81/25/93/1026812593.db2.gz LZBANZGVJAYHDP-NRFANRHFSA-N 2 1 337.511 4.034 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(C(F)(F)F)s1 ZINC000582573282 1026824285 /nfs/dbraw/zinc/82/42/85/1026824285.db2.gz JULJDSHOSRKPQK-UHFFFAOYSA-N 2 1 345.434 4.438 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(C(F)(F)F)s1 ZINC000582573282 1026824289 /nfs/dbraw/zinc/82/42/89/1026824289.db2.gz JULJDSHOSRKPQK-UHFFFAOYSA-N 2 1 345.434 4.438 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccncc3)CC2)c(C)c1 ZINC000152870189 1026858503 /nfs/dbraw/zinc/85/85/03/1026858503.db2.gz OAKNZHMBNHFLHE-LJQANCHMSA-N 2 1 337.511 4.056 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@@H]1CCCc2cccnc21 ZINC000684958877 1026896476 /nfs/dbraw/zinc/89/64/76/1026896476.db2.gz YUASGSIJEIGGPV-OSZJIOELSA-N 2 1 349.522 4.205 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@@H]1CCCc2cccnc21 ZINC000684958877 1026896480 /nfs/dbraw/zinc/89/64/80/1026896480.db2.gz YUASGSIJEIGGPV-OSZJIOELSA-N 2 1 349.522 4.205 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCCc3cccnc32)C[N@H+]1Cc1ccccc1 ZINC000684960976 1026900243 /nfs/dbraw/zinc/90/02/43/1026900243.db2.gz VVQREQUABORPIE-SYYKKAFVSA-N 2 1 349.522 4.349 20 0 EIADMP CC[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1ccncc1 ZINC000582664255 1026916321 /nfs/dbraw/zinc/91/63/21/1026916321.db2.gz CKYKUFOZCXIROC-NHCUHLMSSA-N 2 1 335.495 4.320 20 0 EIADMP CC[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1ccncc1 ZINC000582664255 1026916327 /nfs/dbraw/zinc/91/63/27/1026916327.db2.gz CKYKUFOZCXIROC-NHCUHLMSSA-N 2 1 335.495 4.320 20 0 EIADMP Cc1ccccc1SC[C@H](C)C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC001167599047 1026943834 /nfs/dbraw/zinc/94/38/34/1026943834.db2.gz NWSPWVTUTKYFDW-YLJYHZDGSA-N 2 1 346.584 4.387 20 0 EIADMP Cc1ccccc1SC[C@H](C)C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC001167599047 1026943840 /nfs/dbraw/zinc/94/38/40/1026943840.db2.gz NWSPWVTUTKYFDW-YLJYHZDGSA-N 2 1 346.584 4.387 20 0 EIADMP Cc1ccccc1SC[C@H](C)C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC001167599047 1026943844 /nfs/dbraw/zinc/94/38/44/1026943844.db2.gz NWSPWVTUTKYFDW-YLJYHZDGSA-N 2 1 346.584 4.387 20 0 EIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1cc(Cl)ccc1OC ZINC000164605548 1027049541 /nfs/dbraw/zinc/04/95/41/1027049541.db2.gz GKJZMZJPVKSYCF-QGZVFWFLSA-N 2 1 335.879 4.375 20 0 EIADMP COc1ccc([C@H](C)[C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cc1OC ZINC000474476296 1027107467 /nfs/dbraw/zinc/10/74/67/1027107467.db2.gz WXGBPMYDZGKMPK-KSZLIROESA-N 2 1 348.531 4.050 20 0 EIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)cc1C ZINC000520220983 1027333293 /nfs/dbraw/zinc/33/32/93/1027333293.db2.gz BTPKRVIMRGQTLL-IBGZPJMESA-N 2 1 328.525 4.367 20 0 EIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cc1C ZINC000520220983 1027333315 /nfs/dbraw/zinc/33/33/15/1027333315.db2.gz BTPKRVIMRGQTLL-IBGZPJMESA-N 2 1 328.525 4.367 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000474628560 1027337679 /nfs/dbraw/zinc/33/76/79/1027337679.db2.gz LBXKIXAXRKKFOX-ZQDZILKHSA-N 2 1 326.937 4.215 20 0 EIADMP CO[C@@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(C)(C)C ZINC000520262621 1027371527 /nfs/dbraw/zinc/37/15/27/1027371527.db2.gz PCCGHGNNFCFVKQ-MHJFOBGBSA-N 2 1 332.532 4.080 20 0 EIADMP C[C@@H]1CC([N@H+]2CCC(F)(F)[C@H](C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168041208 1027433896 /nfs/dbraw/zinc/43/38/96/1027433896.db2.gz QZIAUKFOONSEBV-BRWVUGGUSA-N 2 1 336.470 4.405 20 0 EIADMP c1ccc2cc(CC[N@H+]3CC[C@@H]4[C@H](CCCN4C4CC4)C3)ccc2c1 ZINC000441398267 1027522147 /nfs/dbraw/zinc/52/21/47/1027522147.db2.gz HDSPGEKHWRJJKG-FYYLOGMGSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441398267 1027522162 /nfs/dbraw/zinc/52/21/62/1027522162.db2.gz HDSPGEKHWRJJKG-FYYLOGMGSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)ccc2c1 ZINC000441398267 1027522171 /nfs/dbraw/zinc/52/21/71/1027522171.db2.gz HDSPGEKHWRJJKG-FYYLOGMGSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)ccc2c1 ZINC000441398267 1027522191 /nfs/dbraw/zinc/52/21/91/1027522191.db2.gz HDSPGEKHWRJJKG-FYYLOGMGSA-N 2 1 334.507 4.331 20 0 EIADMP c1ccc2cc(CC[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)ccc2c1 ZINC000441398267 1027522200 /nfs/dbraw/zinc/52/22/00/1027522200.db2.gz HDSPGEKHWRJJKG-FYYLOGMGSA-N 2 1 334.507 4.331 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2cccc(Br)c21 ZINC000152452680 1027596248 /nfs/dbraw/zinc/59/62/48/1027596248.db2.gz KVIRHUJTDJHUEY-IGCXYCKISA-N 2 1 349.316 4.071 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1OC ZINC000152465961 1027660830 /nfs/dbraw/zinc/66/08/30/1027660830.db2.gz LGEWIZXJLJYNJQ-IAGOWNOFSA-N 2 1 346.515 4.009 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@H]3CCC[C@@H](CC(C)C)C3)CC2)nc(C)[nH+]1 ZINC000474881713 1027728542 /nfs/dbraw/zinc/72/85/42/1027728542.db2.gz WKXKXQNNSOLCBV-ICSRJNTNSA-N 2 1 344.547 4.257 20 0 EIADMP C[C@H](Cc1ccsc1)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000582956529 1027766308 /nfs/dbraw/zinc/76/63/08/1027766308.db2.gz CCQJDPGDNBFELS-MRXNPFEDSA-N 2 1 346.515 4.115 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000249124409 1027792247 /nfs/dbraw/zinc/79/22/47/1027792247.db2.gz UNCDKBBRJUTRME-XYPHTWIQSA-N 2 1 326.406 4.025 20 0 EIADMP C[N@@H+](CCc1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167996235 1027842426 /nfs/dbraw/zinc/84/24/26/1027842426.db2.gz ZXMWMBZLFGUTBM-YOFSQIOKSA-N 2 1 332.919 4.220 20 0 EIADMP C[NH+](CCc1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167996235 1027842430 /nfs/dbraw/zinc/84/24/30/1027842430.db2.gz ZXMWMBZLFGUTBM-YOFSQIOKSA-N 2 1 332.919 4.220 20 0 EIADMP C[NH+](CCc1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167996235 1027842435 /nfs/dbraw/zinc/84/24/35/1027842435.db2.gz ZXMWMBZLFGUTBM-YOFSQIOKSA-N 2 1 332.919 4.220 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCc3ccc(C)cc32)cc1F ZINC000153721158 1027890379 /nfs/dbraw/zinc/89/03/79/1027890379.db2.gz QCJDEDWJXRCLLG-HXUWFJFHSA-N 2 1 335.426 4.405 20 0 EIADMP c1csc(-c2ccc(C[N@@H+]3CC[C@H](C[NH+]4CCCC4)C3)cc2)c1 ZINC000444651470 1027918633 /nfs/dbraw/zinc/91/86/33/1027918633.db2.gz GQRUOJNZVHHCIR-GOSISDBHSA-N 2 1 326.509 4.333 20 0 EIADMP CCc1ccccc1CC[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000444685561 1027944594 /nfs/dbraw/zinc/94/45/94/1027944594.db2.gz ALPHANVXTGHZLZ-UHFFFAOYSA-N 2 1 337.511 4.035 20 0 EIADMP CC(C)COc1ccccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000441449612 1028004410 /nfs/dbraw/zinc/00/44/10/1028004410.db2.gz PNUDYZQXPZSECH-IBGZPJMESA-N 2 1 330.516 4.029 20 0 EIADMP CC(C)COc1ccccc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000441449612 1028004433 /nfs/dbraw/zinc/00/44/33/1028004433.db2.gz PNUDYZQXPZSECH-IBGZPJMESA-N 2 1 330.516 4.029 20 0 EIADMP c1ccc2c(c1)cccc2OCC[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000441453154 1028024515 /nfs/dbraw/zinc/02/45/15/1028024515.db2.gz XMLVHJLOAWDSNA-LJQANCHMSA-N 2 1 338.495 4.026 20 0 EIADMP c1ccc2cc(OCC[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000441455810 1028033033 /nfs/dbraw/zinc/03/30/33/1028033033.db2.gz ZTDNUHQHGAAUBR-IBGZPJMESA-N 2 1 338.495 4.026 20 0 EIADMP c1ccc2cc(OCC[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000441455810 1028033051 /nfs/dbraw/zinc/03/30/51/1028033051.db2.gz ZTDNUHQHGAAUBR-IBGZPJMESA-N 2 1 338.495 4.026 20 0 EIADMP Cc1cc(C)cc(OCCC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000523439827 1028119688 /nfs/dbraw/zinc/11/96/88/1028119688.db2.gz OSRRWJWFMKQMDJ-FQEVSTJZSA-N 2 1 330.516 4.023 20 0 EIADMP CC(C)CCOc1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000324208921 1028197547 /nfs/dbraw/zinc/19/75/47/1028197547.db2.gz OVQSXHSCFGJNQM-UHFFFAOYSA-N 2 1 332.532 4.464 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2c(F)cccc2F)CC1 ZINC001167658657 1028229638 /nfs/dbraw/zinc/22/96/38/1028229638.db2.gz JYKPAKNGOZNWJL-INIZCTEOSA-N 2 1 336.470 4.441 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2c(F)cccc2F)CC1 ZINC001167658657 1028229662 /nfs/dbraw/zinc/22/96/62/1028229662.db2.gz JYKPAKNGOZNWJL-INIZCTEOSA-N 2 1 336.470 4.441 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2c(F)cccc2F)CC1 ZINC001167658658 1028230753 /nfs/dbraw/zinc/23/07/53/1028230753.db2.gz JYKPAKNGOZNWJL-MRXNPFEDSA-N 2 1 336.470 4.441 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2c(F)cccc2F)CC1 ZINC001167658658 1028230781 /nfs/dbraw/zinc/23/07/81/1028230781.db2.gz JYKPAKNGOZNWJL-MRXNPFEDSA-N 2 1 336.470 4.441 20 0 EIADMP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1 ZINC000280963619 1028311195 /nfs/dbraw/zinc/31/11/95/1028311195.db2.gz ZGTUYTMNSFGFMK-DKIMLUQUSA-N 2 1 338.417 4.168 20 0 EIADMP CCCCCOc1cc(CN(C)C[C@H]2CCC[N@@H+](C)C2)ccc1OC ZINC000508526228 1028447892 /nfs/dbraw/zinc/44/78/92/1028447892.db2.gz BAIDDANHCWAHFZ-IBGZPJMESA-N 2 1 348.531 4.038 20 0 EIADMP CCCCCOc1cc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)ccc1OC ZINC000508526228 1028447902 /nfs/dbraw/zinc/44/79/02/1028447902.db2.gz BAIDDANHCWAHFZ-IBGZPJMESA-N 2 1 348.531 4.038 20 0 EIADMP CCCCCOc1cc(C[N@@H+](C)C[C@H]2CCC[NH+](C)C2)ccc1OC ZINC000508526228 1028447912 /nfs/dbraw/zinc/44/79/12/1028447912.db2.gz BAIDDANHCWAHFZ-IBGZPJMESA-N 2 1 348.531 4.038 20 0 EIADMP CCCCCOc1cc(C[NH+](C)C[C@H]2CCC[N@H+](C)C2)ccc1OC ZINC000508526228 1028447919 /nfs/dbraw/zinc/44/79/19/1028447919.db2.gz BAIDDANHCWAHFZ-IBGZPJMESA-N 2 1 348.531 4.038 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)C[C@@H]3CCC(F)(F)C3)C2)s1 ZINC000583325118 1028517650 /nfs/dbraw/zinc/51/76/50/1028517650.db2.gz APPVRYBLUIIIQQ-CVEARBPZSA-N 2 1 342.499 4.246 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C[C@@H]3CCC(F)(F)C3)C2)s1 ZINC000583325118 1028517665 /nfs/dbraw/zinc/51/76/65/1028517665.db2.gz APPVRYBLUIIIQQ-CVEARBPZSA-N 2 1 342.499 4.246 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)C[C@@H]3CCC(F)(F)C3)C2)s1 ZINC000583325118 1028517678 /nfs/dbraw/zinc/51/76/78/1028517678.db2.gz APPVRYBLUIIIQQ-CVEARBPZSA-N 2 1 342.499 4.246 20 0 EIADMP Cn1c[nH+]c2cc(N[C@H]3CC[N@H+](Cc4ccccc4)C4(CC4)C3)ccc21 ZINC000647298846 1028874931 /nfs/dbraw/zinc/87/49/31/1028874931.db2.gz VUOURSXHWOZOCP-IBGZPJMESA-N 2 1 346.478 4.182 20 0 EIADMP Cn1c[nH+]c2cc(N[C@H]3CC[N@@H+](Cc4ccccc4)C4(CC4)C3)ccc21 ZINC000647298846 1028874932 /nfs/dbraw/zinc/87/49/32/1028874932.db2.gz VUOURSXHWOZOCP-IBGZPJMESA-N 2 1 346.478 4.182 20 0 EIADMP FC(F)(F)c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000524756820 1029204811 /nfs/dbraw/zinc/20/48/11/1029204811.db2.gz AKUJFBDJDOCDFP-INIZCTEOSA-N 2 1 326.406 4.013 20 0 EIADMP FC(F)(F)c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000524756820 1029204824 /nfs/dbraw/zinc/20/48/24/1029204824.db2.gz AKUJFBDJDOCDFP-INIZCTEOSA-N 2 1 326.406 4.013 20 0 EIADMP CC[N@H+](Cc1cccnc1)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168055650 1029212187 /nfs/dbraw/zinc/21/21/87/1029212187.db2.gz XCSAUPZYCMKESZ-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP CC[N@@H+](Cc1cccnc1)[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168055650 1029212210 /nfs/dbraw/zinc/21/22/10/1029212210.db2.gz XCSAUPZYCMKESZ-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP CC[NH+](Cc1cccnc1)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168055650 1029212224 /nfs/dbraw/zinc/21/22/24/1029212224.db2.gz XCSAUPZYCMKESZ-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP CC[NH+](Cc1cccnc1)[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168055650 1029212239 /nfs/dbraw/zinc/21/22/39/1029212239.db2.gz XCSAUPZYCMKESZ-HATOLVCRSA-N 2 1 337.511 4.345 20 0 EIADMP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000511244940 1029253501 /nfs/dbraw/zinc/25/35/01/1029253501.db2.gz XDDLYRHBZQWAPK-WRWLIDTKSA-N 2 1 344.524 4.057 20 0 EIADMP C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000511244940 1029253518 /nfs/dbraw/zinc/25/35/18/1029253518.db2.gz XDDLYRHBZQWAPK-WRWLIDTKSA-N 2 1 344.524 4.057 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000583957370 1029417310 /nfs/dbraw/zinc/41/73/10/1029417310.db2.gz VVSFGDNBXSTBSZ-ZBEVKASSSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000583957370 1029417319 /nfs/dbraw/zinc/41/73/19/1029417319.db2.gz VVSFGDNBXSTBSZ-ZBEVKASSSA-N 2 1 338.417 4.325 20 0 EIADMP C[C@@H](CCc1cccc(F)c1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475272454 1029488948 /nfs/dbraw/zinc/48/89/48/1029488948.db2.gz BSHNFTOZHSPGPY-RXVVDRJESA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H](CCc1cccc(F)c1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475272452 1029489755 /nfs/dbraw/zinc/48/97/55/1029489755.db2.gz BSHNFTOZHSPGPY-GHTZIAJQSA-N 2 1 340.486 4.259 20 0 EIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CS1 ZINC000475291258 1029503296 /nfs/dbraw/zinc/50/32/96/1029503296.db2.gz NRATXTNUWIULCC-OTWHNJEPSA-N 2 1 332.557 4.018 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)OCc1ccccc1 ZINC000475313367 1029524881 /nfs/dbraw/zinc/52/48/81/1029524881.db2.gz PDYWFZLWAWGFBN-SBHAEUEKSA-N 2 1 344.543 4.224 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000523017341 1029551876 /nfs/dbraw/zinc/55/18/76/1029551876.db2.gz KUGMSOPHWMBAOX-HNNXBMFYSA-N 2 1 340.458 4.401 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000657824297 1029585233 /nfs/dbraw/zinc/58/52/33/1029585233.db2.gz GBALABRUNDMWJB-LBPRGKRZSA-N 2 1 348.840 4.364 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccc(Br)c(Cl)c2)CC1 ZINC000657826546 1029597997 /nfs/dbraw/zinc/59/79/97/1029597997.db2.gz VXLZXCFRWHPNLD-LLVKDONJSA-N 2 1 345.712 4.237 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)cc1 ZINC000584140661 1029640427 /nfs/dbraw/zinc/64/04/27/1029640427.db2.gz SBADXBSZNSHYNR-UTKZUKDTSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)cc1 ZINC000584140661 1029640432 /nfs/dbraw/zinc/64/04/32/1029640432.db2.gz SBADXBSZNSHYNR-UTKZUKDTSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000584140661 1029640434 /nfs/dbraw/zinc/64/04/34/1029640434.db2.gz SBADXBSZNSHYNR-UTKZUKDTSA-N 2 1 338.495 4.134 20 0 EIADMP COc1ccccc1-c1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000584140661 1029640438 /nfs/dbraw/zinc/64/04/38/1029640438.db2.gz SBADXBSZNSHYNR-UTKZUKDTSA-N 2 1 338.495 4.134 20 0 EIADMP c1ccc([C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)[C@@H]2CCCO2)cc1 ZINC000584188389 1029665032 /nfs/dbraw/zinc/66/50/32/1029665032.db2.gz FAMZOTAYDYSAJN-FCHUYYIVSA-N 2 1 342.527 4.293 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CCC(C[NH+]4CCCC4)CC3)c2c1 ZINC000301346941 1029713604 /nfs/dbraw/zinc/71/36/04/1029713604.db2.gz HOWCQIRTBKHZKM-UHFFFAOYSA-N 2 1 329.875 4.200 20 0 EIADMP C[C@@H]1c2ccccc2C[NH+]1CCOCC[N@H+]1Cc2ccccc2[C@H]1C ZINC000343738206 1029730842 /nfs/dbraw/zinc/73/08/42/1029730842.db2.gz JKKYDOKJLAARFX-QZTJIDSGSA-N 2 1 336.479 4.157 20 0 EIADMP C[C@@H]1c2ccccc2C[N@@H+]1CCOCC[NH+]1Cc2ccccc2[C@@H]1C ZINC000343738205 1029731211 /nfs/dbraw/zinc/73/12/11/1029731211.db2.gz JKKYDOKJLAARFX-HDICACEKSA-N 2 1 336.479 4.157 20 0 EIADMP C[C@@H]1c2ccccc2C[NH+]1CCOCC[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000343738205 1029731217 /nfs/dbraw/zinc/73/12/17/1029731217.db2.gz JKKYDOKJLAARFX-HDICACEKSA-N 2 1 336.479 4.157 20 0 EIADMP C[C@@H]1c2ccccc2C[NH+]1CCOCC[N@H+]1Cc2ccccc2[C@@H]1C ZINC000343738205 1029731224 /nfs/dbraw/zinc/73/12/24/1029731224.db2.gz JKKYDOKJLAARFX-HDICACEKSA-N 2 1 336.479 4.157 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1cccc(C2CC2)c1 ZINC000708502465 1029744151 /nfs/dbraw/zinc/74/41/51/1029744151.db2.gz HNSCXKKPRRKWIP-FDDCHVKYSA-N 2 1 334.507 4.422 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000301754467 1029804502 /nfs/dbraw/zinc/80/45/02/1029804502.db2.gz CMYYCTCIDYMQPF-IFXJQAMLSA-N 2 1 341.886 4.341 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000301754467 1029804503 /nfs/dbraw/zinc/80/45/03/1029804503.db2.gz CMYYCTCIDYMQPF-IFXJQAMLSA-N 2 1 341.886 4.341 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)s1 ZINC000584411429 1029833383 /nfs/dbraw/zinc/83/33/83/1029833383.db2.gz OMUMQMOLHHXSEH-GOSISDBHSA-N 2 1 341.524 4.047 20 0 EIADMP Cc1nc(C)c(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)s1 ZINC000584411429 1029833387 /nfs/dbraw/zinc/83/33/87/1029833387.db2.gz OMUMQMOLHHXSEH-GOSISDBHSA-N 2 1 341.524 4.047 20 0 EIADMP C[N@H+]1CC[C@H](C[NH2+]C/C=C/c2ccc(F)c(F)c2)[C@@H]1c1cccs1 ZINC000375751956 1029859570 /nfs/dbraw/zinc/85/95/70/1029859570.db2.gz YWUBBPJFJMGRDR-OSLWLWRUSA-N 2 1 348.462 4.322 20 0 EIADMP C[N@H+]1CC[C@H](C[NH2+]Cc2ccc3occc3c2)[C@H]1c1cccs1 ZINC000375751889 1029864683 /nfs/dbraw/zinc/86/46/83/1029864683.db2.gz YBYZZMBGUXNQDJ-APWZRJJASA-N 2 1 326.465 4.277 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccc(C(F)(F)F)cc1)C(C)C ZINC000091313909 1029883633 /nfs/dbraw/zinc/88/36/33/1029883633.db2.gz CIJGSURNKSOTBA-MRXNPFEDSA-N 2 1 325.378 4.197 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccc(F)cn1 ZINC000092739315 1029929954 /nfs/dbraw/zinc/92/99/54/1029929954.db2.gz ODVJIFVMFLTMGS-SJORKVTESA-N 2 1 341.474 4.303 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cn1 ZINC000092739315 1029929973 /nfs/dbraw/zinc/92/99/73/1029929973.db2.gz ODVJIFVMFLTMGS-SJORKVTESA-N 2 1 341.474 4.303 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3cc(F)ccc32)c1 ZINC000182062707 1029936902 /nfs/dbraw/zinc/93/69/02/1029936902.db2.gz DUCRFHJDLILIEK-FQEVSTJZSA-N 2 1 342.458 4.281 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCSc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183183479 1029987197 /nfs/dbraw/zinc/98/71/97/1029987197.db2.gz UDTWLPJFSYPALN-FRQCXROJSA-N 2 1 330.541 4.466 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000525860285 1030082200 /nfs/dbraw/zinc/08/22/00/1030082200.db2.gz REHZEMRASDYTNT-PDGJWGCVSA-N 2 1 344.543 4.049 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC[N@H+]1C ZINC000447563836 1030171080 /nfs/dbraw/zinc/17/10/80/1030171080.db2.gz FWOBGAWISJEGNH-ZIAGYGMSSA-N 2 1 341.326 4.487 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447579676 1030205582 /nfs/dbraw/zinc/20/55/82/1030205582.db2.gz LIYQORLFAAVAOQ-AGOPTVSRSA-N 2 1 349.522 4.490 20 0 EIADMP C[C@@H](c1ccc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1)C(F)(F)F ZINC000451066193 1030218323 /nfs/dbraw/zinc/21/83/23/1030218323.db2.gz BTWDZOIDUNLJKO-YJBOKZPZSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)cc1)C(F)(F)F ZINC000451066193 1030218354 /nfs/dbraw/zinc/21/83/54/1030218354.db2.gz BTWDZOIDUNLJKO-YJBOKZPZSA-N 2 1 340.433 4.270 20 0 EIADMP C[C@@H](c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1)C(F)(F)F ZINC000451066193 1030218372 /nfs/dbraw/zinc/21/83/72/1030218372.db2.gz BTWDZOIDUNLJKO-YJBOKZPZSA-N 2 1 340.433 4.270 20 0 EIADMP Clc1ccc(/C=C\C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000526056936 1030253792 /nfs/dbraw/zinc/25/37/92/1030253792.db2.gz RWZBQOISOJWSHK-FNCMOEPVSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C\C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000526056936 1030253813 /nfs/dbraw/zinc/25/38/13/1030253813.db2.gz RWZBQOISOJWSHK-FNCMOEPVSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C\C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000526056936 1030253838 /nfs/dbraw/zinc/25/38/38/1030253838.db2.gz RWZBQOISOJWSHK-FNCMOEPVSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C\C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000526056936 1030253856 /nfs/dbraw/zinc/25/38/56/1030253856.db2.gz RWZBQOISOJWSHK-FNCMOEPVSA-N 2 1 330.903 4.302 20 0 EIADMP FC(F)(F)CCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000278778732 1030288581 /nfs/dbraw/zinc/28/85/81/1030288581.db2.gz PQRJFVMVEGQDFJ-OSYLJGHBSA-N 2 1 326.406 4.114 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH2+]CC3=CC[N@@H+](C)CC3)ccc21 ZINC000392240283 1030306999 /nfs/dbraw/zinc/30/69/99/1030306999.db2.gz AVANXKRORXGHEM-UHFFFAOYSA-N 2 1 333.479 4.166 20 0 EIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CCOc2ccccc21 ZINC000685456693 1030334425 /nfs/dbraw/zinc/33/44/25/1030334425.db2.gz JAROUSWNDBVKGC-FQEVSTJZSA-N 2 1 338.495 4.136 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358420 1030337129 /nfs/dbraw/zinc/33/71/29/1030337129.db2.gz ZQKPMSQORVLIAF-HSALFYBXSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358420 1030337143 /nfs/dbraw/zinc/33/71/43/1030337143.db2.gz ZQKPMSQORVLIAF-HSALFYBXSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358420 1030337149 /nfs/dbraw/zinc/33/71/49/1030337149.db2.gz ZQKPMSQORVLIAF-HSALFYBXSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358420 1030337157 /nfs/dbraw/zinc/33/71/57/1030337157.db2.gz ZQKPMSQORVLIAF-HSALFYBXSA-N 2 1 334.548 4.065 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358420 1030337163 /nfs/dbraw/zinc/33/71/63/1030337163.db2.gz ZQKPMSQORVLIAF-HSALFYBXSA-N 2 1 334.548 4.065 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)C2CCSCC2)cc1 ZINC000187290843 1030356113 /nfs/dbraw/zinc/35/61/13/1030356113.db2.gz AFGRMYUCRKCMQS-HUUCEWRRSA-N 2 1 329.513 4.363 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000708566639 1030386364 /nfs/dbraw/zinc/38/63/64/1030386364.db2.gz RHWMYNHBYYZAGA-OPYAIIAOSA-N 2 1 340.486 4.114 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](CC[C@H](C)OCc2ccccc2)CC1 ZINC000530496357 1030472417 /nfs/dbraw/zinc/47/24/17/1030472417.db2.gz BHHZEMHVRFUNSA-IBGZPJMESA-N 2 1 332.532 4.034 20 0 EIADMP CCOc1ccccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398026959 1030686606 /nfs/dbraw/zinc/68/66/06/1030686606.db2.gz CPJUQOZVXCPTBP-NQIIRXRSSA-N 2 1 338.495 4.086 20 0 EIADMP CCOc1ccccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398026959 1030686609 /nfs/dbraw/zinc/68/66/09/1030686609.db2.gz CPJUQOZVXCPTBP-NQIIRXRSSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc2cnccc2o1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657968524 1030712838 /nfs/dbraw/zinc/71/28/38/1030712838.db2.gz AVYDFSDXBNKYKE-OWCLPIDISA-N 2 1 327.472 4.131 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc2cnccc2o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000657968524 1030712859 /nfs/dbraw/zinc/71/28/59/1030712859.db2.gz AVYDFSDXBNKYKE-OWCLPIDISA-N 2 1 327.472 4.131 20 0 EIADMP Cc1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc(C)c1O ZINC000398182644 1030734178 /nfs/dbraw/zinc/73/41/78/1030734178.db2.gz KKMMTTGOQHOVJI-WIYYLYMNSA-N 2 1 338.495 4.009 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccc3cc[nH]c3c2)CC1 ZINC000527659567 1030814137 /nfs/dbraw/zinc/81/41/37/1030814137.db2.gz BBJBHVOIVOUCRM-QGZVFWFLSA-N 2 1 333.479 4.483 20 0 EIADMP Brc1ccc(/C=C\CC[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000527741680 1030838641 /nfs/dbraw/zinc/83/86/41/1030838641.db2.gz AEKFDMYGDLWECB-AUVNQSNOSA-N 2 1 349.316 4.069 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](c2cccc(C)c2)C(C)C)cn1 ZINC000527849619 1030891486 /nfs/dbraw/zinc/89/14/86/1030891486.db2.gz MOJQYVNBJSIQHK-NRFANRHFSA-N 2 1 334.467 4.371 20 0 EIADMP Cc1cncc([C@H](C)[NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000658320183 1030982342 /nfs/dbraw/zinc/98/23/42/1030982342.db2.gz PLRQHZYWPSYAOD-UGKGYDQZSA-N 2 1 349.522 4.343 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCCc2ccco2)CC1 ZINC000658325289 1030989047 /nfs/dbraw/zinc/98/90/47/1030989047.db2.gz LLVDWTOTVIYAIC-UHFFFAOYSA-N 2 1 326.484 4.245 20 0 EIADMP COc1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1C ZINC000532469187 1031147112 /nfs/dbraw/zinc/14/71/12/1031147112.db2.gz MPCNBZGDBIKGNO-RXVVDRJESA-N 2 1 338.495 4.004 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCOc2ccc3ccccc3c2)CC[N@@H+]1C ZINC000531381779 1031176197 /nfs/dbraw/zinc/17/61/97/1031176197.db2.gz IKENAGHTTQFRTO-FXAWDEMLSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)CCCOc2ccc3ccccc3c2)CC[N@H+]1C ZINC000531381779 1031176209 /nfs/dbraw/zinc/17/62/09/1031176209.db2.gz IKENAGHTTQFRTO-FXAWDEMLSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)CCCOc2ccc3ccccc3c2)CC[NH+]1C ZINC000531381779 1031176244 /nfs/dbraw/zinc/17/62/44/1031176244.db2.gz IKENAGHTTQFRTO-FXAWDEMLSA-N 2 1 326.484 4.023 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)CCCOc2ccc3ccccc3c2)CC[NH+]1C ZINC000531381779 1031176256 /nfs/dbraw/zinc/17/62/56/1031176256.db2.gz IKENAGHTTQFRTO-FXAWDEMLSA-N 2 1 326.484 4.023 20 0 EIADMP C[N@H+]1CC[C@H](NCc2cnc3ccccc3c2)C[C@H]1c1ccccc1 ZINC000340209151 1031189858 /nfs/dbraw/zinc/18/98/58/1031189858.db2.gz IIIHEBRETUKJOW-UNMCSNQZSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cnc3ccccc3c2)C[C@H]1c1ccccc1 ZINC000340209151 1031189873 /nfs/dbraw/zinc/18/98/73/1031189873.db2.gz IIIHEBRETUKJOW-UNMCSNQZSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cnc3ccccc3c2)C[C@H]1c1ccccc1 ZINC000340209151 1031189891 /nfs/dbraw/zinc/18/98/91/1031189891.db2.gz IIIHEBRETUKJOW-UNMCSNQZSA-N 2 1 331.463 4.160 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000532506782 1031229188 /nfs/dbraw/zinc/22/91/88/1031229188.db2.gz FXUMAODPFZMWOV-AOIWGVFYSA-N 2 1 332.557 4.410 20 0 EIADMP Cc1ccc(CC[C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000532524468 1031242954 /nfs/dbraw/zinc/24/29/54/1031242954.db2.gz UKELLMZHAQHNQX-QGZVFWFLSA-N 2 1 326.484 4.163 20 0 EIADMP Cc1nc(C[N@@H+]2CCC[C@@H](n3ccnc3C(C)C)C2)nc2ccccc12 ZINC000375809217 1031271857 /nfs/dbraw/zinc/27/18/57/1031271857.db2.gz DULUWVJKOBDADU-QGZVFWFLSA-N 2 1 349.482 4.095 20 0 EIADMP CC1CCC([N@@H+]2C[C@@H]3CCC[C@@H]([NH+](C)Cc4ccccn4)[C@H]3C2)CC1 ZINC001168216969 1031323584 /nfs/dbraw/zinc/32/35/84/1031323584.db2.gz GOVBCIWFZVIOQW-LJZANRTKSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([N@H+]2C[C@@H]3CCC[C@@H]([NH+](C)Cc4ccccn4)[C@H]3C2)CC1 ZINC001168216969 1031323602 /nfs/dbraw/zinc/32/36/02/1031323602.db2.gz GOVBCIWFZVIOQW-LJZANRTKSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([NH+]2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)CC1 ZINC001168216969 1031323620 /nfs/dbraw/zinc/32/36/20/1031323620.db2.gz GOVBCIWFZVIOQW-LJZANRTKSA-N 2 1 341.543 4.193 20 0 EIADMP CC1CCC([NH+]2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)CC1 ZINC001168216969 1031323626 /nfs/dbraw/zinc/32/36/26/1031323626.db2.gz GOVBCIWFZVIOQW-LJZANRTKSA-N 2 1 341.543 4.193 20 0 EIADMP C[N@H+](CC1CC[NH+](C)CC1)Cn1c(-c2ccccc2)csc1=S ZINC000177143206 1031335675 /nfs/dbraw/zinc/33/56/75/1031335675.db2.gz UBAFFOFPOKPRNI-UHFFFAOYSA-N 2 1 347.553 4.177 20 0 EIADMP C[N@@H+](CC1CC[NH+](C)CC1)Cn1c(-c2ccccc2)csc1=S ZINC000177143206 1031335689 /nfs/dbraw/zinc/33/56/89/1031335689.db2.gz UBAFFOFPOKPRNI-UHFFFAOYSA-N 2 1 347.553 4.177 20 0 EIADMP C[C@@]1(CNCc2ccc(C(F)F)nc2)CCC[N@@H+]1Cc1ccccc1 ZINC000631114964 1031402912 /nfs/dbraw/zinc/40/29/12/1031402912.db2.gz FOJWSDHBWRAARS-FQEVSTJZSA-N 2 1 345.437 4.164 20 0 EIADMP C[C@@]1(CNCc2ccc(C(F)F)nc2)CCC[N@H+]1Cc1ccccc1 ZINC000631114964 1031402928 /nfs/dbraw/zinc/40/29/28/1031402928.db2.gz FOJWSDHBWRAARS-FQEVSTJZSA-N 2 1 345.437 4.164 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3cc4cccnc4o3)cc2)C1 ZINC000449073827 1031429515 /nfs/dbraw/zinc/42/95/15/1031429515.db2.gz AHOLKTSNWRNMGV-KRWDZBQOSA-N 2 1 349.478 4.350 20 0 EIADMP Cc1cnc(C[NH2+]Cc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)s1 ZINC000449083503 1031437972 /nfs/dbraw/zinc/43/79/72/1031437972.db2.gz UJUHEIBBUFJMHN-HZPDHXFCSA-N 2 1 343.540 4.219 20 0 EIADMP c1csc([C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C2CC2)c1 ZINC000531689535 1031460185 /nfs/dbraw/zinc/46/01/85/1031460185.db2.gz DPYMXCUODKPSNT-NRFANRHFSA-N 2 1 340.536 4.496 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H](C)[C@@H]3CCCC[C@@H]3C)CC2)oc1C ZINC000449123521 1031461049 /nfs/dbraw/zinc/46/10/49/1031461049.db2.gz NIJAEHUGBAJREP-XAUMDUMWSA-N 2 1 347.547 4.308 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccccc1OC ZINC000123986859 1031495031 /nfs/dbraw/zinc/49/50/31/1031495031.db2.gz KFXJFLMNMKGIPM-HXUWFJFHSA-N 2 1 326.484 4.388 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(C)cc1)c1ccccn1 ZINC000375917462 1031507944 /nfs/dbraw/zinc/50/79/44/1031507944.db2.gz BJEKOFWKDKZISS-NRFANRHFSA-N 2 1 334.467 4.054 20 0 EIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1nc(C(F)(F)F)cs1 ZINC000185969627 1031521881 /nfs/dbraw/zinc/52/18/81/1031521881.db2.gz FQKXHUHZFKZEQR-LBPRGKRZSA-N 2 1 346.422 4.188 20 0 EIADMP COc1ccc2c(c1)C[C@H]([N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168251735 1031524702 /nfs/dbraw/zinc/52/47/02/1031524702.db2.gz KYUAERVMTHGZJO-HMXCVIKNSA-N 2 1 342.527 4.067 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]C2CCC(OC3CCCC3)CC2)C1 ZINC000449211846 1031537858 /nfs/dbraw/zinc/53/78/58/1031537858.db2.gz SDJPSPAUVODCQJ-LWEYNCJUSA-N 2 1 336.564 4.214 20 0 EIADMP C[C@@H](CCCc1cccnc1)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000453053219 1031543683 /nfs/dbraw/zinc/54/36/83/1031543683.db2.gz FLVNAEBVDANNMJ-IBGZPJMESA-N 2 1 337.511 4.047 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)o1 ZINC000124649916 1031545261 /nfs/dbraw/zinc/54/52/61/1031545261.db2.gz KWLNYRNDEJJFQJ-KSZLIROESA-N 2 1 342.483 4.048 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cn2)C1 ZINC000453075803 1031563137 /nfs/dbraw/zinc/56/31/37/1031563137.db2.gz AYHIMWPANPYGRL-ROUUACIJSA-N 2 1 339.483 4.256 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cn2)C1 ZINC000453075803 1031563153 /nfs/dbraw/zinc/56/31/53/1031563153.db2.gz AYHIMWPANPYGRL-ROUUACIJSA-N 2 1 339.483 4.256 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCCOC2CCCC2)cc1 ZINC000125282698 1031584388 /nfs/dbraw/zinc/58/43/88/1031584388.db2.gz GRTBAGJQSJRIOC-MRXNPFEDSA-N 2 1 327.472 4.181 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CCCc2cccnc2)c1 ZINC000453098350 1031593420 /nfs/dbraw/zinc/59/34/20/1031593420.db2.gz XHIGYEBIOYJSFV-LJQANCHMSA-N 2 1 339.527 4.423 20 0 EIADMP CC[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453184465 1031687825 /nfs/dbraw/zinc/68/78/25/1031687825.db2.gz ZZHTURGNDMOUHT-UZKOGDIHSA-N 2 1 337.511 4.423 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21)C(F)(F)F ZINC000453207614 1031719650 /nfs/dbraw/zinc/71/96/50/1031719650.db2.gz WMJQURBRAGWVNG-DDBAPUKQSA-N 2 1 340.433 4.218 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccc(F)cc1F ZINC000128168384 1031727123 /nfs/dbraw/zinc/72/71/23/1031727123.db2.gz IRSZJUYDIZKJCI-LJQANCHMSA-N 2 1 345.437 4.378 20 0 EIADMP CC[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000453234219 1031756080 /nfs/dbraw/zinc/75/60/80/1031756080.db2.gz ZQBOSQKDUWOVQR-RTWAWAEBSA-N 2 1 337.511 4.423 20 0 EIADMP CC[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000453234219 1031756088 /nfs/dbraw/zinc/75/60/88/1031756088.db2.gz ZQBOSQKDUWOVQR-RTWAWAEBSA-N 2 1 337.511 4.423 20 0 EIADMP FC1(F)CC(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)C1 ZINC000453242255 1031796625 /nfs/dbraw/zinc/79/66/25/1031796625.db2.gz PYGGRXLLNVIYBE-GUDVDZBRSA-N 2 1 334.454 4.065 20 0 EIADMP C/C=C\COc1ccc(CC[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000449560320 1031847261 /nfs/dbraw/zinc/84/72/61/1031847261.db2.gz JJJMNEODENUPIH-KFEWKHROSA-N 2 1 342.527 4.177 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccccc2C(F)(F)F)C1 ZINC000531958970 1031878135 /nfs/dbraw/zinc/87/81/35/1031878135.db2.gz HCMKGAVIKAHKPO-GJZGRUSLSA-N 2 1 328.422 4.476 20 0 EIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCc2ccc(OC(F)(F)F)cc21)C1CC1 ZINC000453398541 1031933470 /nfs/dbraw/zinc/93/34/70/1031933470.db2.gz KPGFTBPYBCLKHB-QGZVFWFLSA-N 2 1 342.405 4.037 20 0 EIADMP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453406498 1031942157 /nfs/dbraw/zinc/94/21/57/1031942157.db2.gz RFDWTTUUSNCGDP-AWEZNQCLSA-N 2 1 344.528 4.039 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Oc2ccccc2)cn1 ZINC000453411609 1031947010 /nfs/dbraw/zinc/94/70/10/1031947010.db2.gz VQWQMUJQONIHLU-KRWDZBQOSA-N 2 1 339.483 4.399 20 0 EIADMP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000453419659 1031972701 /nfs/dbraw/zinc/97/27/01/1031972701.db2.gz VVKSITMDZXNWTP-QMCAAQAGSA-N 2 1 342.527 4.119 20 0 EIADMP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)CCCS2 ZINC000453420455 1031976434 /nfs/dbraw/zinc/97/64/34/1031976434.db2.gz ZOWYIZKDDDQTEQ-GOSISDBHSA-N 2 1 334.529 4.086 20 0 EIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(-c2cccc(F)c2F)o1)C1CC1 ZINC000453603303 1032038683 /nfs/dbraw/zinc/03/86/83/1032038683.db2.gz XGKFTJYDEMQTMZ-UHFFFAOYSA-N 2 1 334.410 4.189 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(SC(F)F)cc1 ZINC000178706746 1033696696 /nfs/dbraw/zinc/69/66/96/1033696696.db2.gz MZRNSDINBRDMDL-OLZOCXBDSA-N 2 1 339.455 4.493 20 0 EIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@H]3C[C@H]4C[C@H]4C3)[C@H](c3ccccc3)C2)cc1 ZINC001167917499 1033851470 /nfs/dbraw/zinc/85/14/70/1033851470.db2.gz MMHMYQVKLXQSAI-JTKSJCOOSA-N 2 1 346.518 4.433 20 0 EIADMP Cc1cnc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)s1 ZINC000411545858 1033977691 /nfs/dbraw/zinc/97/76/91/1033977691.db2.gz YLFKJSKYNQZTBW-MRXNPFEDSA-N 2 1 329.513 4.288 20 0 EIADMP 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 1034711117 /nfs/dbraw/zinc/71/11/17/1034711117.db2.gz GVMRSHOMCRAQES-WGEZERDCSA-N 2 1 330.541 4.079 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+]([C@@H]3C[C@H]4C[C@H]4C3)C[C@H]21 ZINC001167934137 1034711131 /nfs/dbraw/zinc/71/11/31/1034711131.db2.gz GVMRSHOMCRAQES-WGEZERDCSA-N 2 1 330.541 4.079 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+]([C@@H]3C[C@H]4C[C@H]4C3)C[C@H]21 ZINC001167934137 1034711147 /nfs/dbraw/zinc/71/11/47/1034711147.db2.gz GVMRSHOMCRAQES-WGEZERDCSA-N 2 1 330.541 4.079 20 0 EIADMP C[NH+](C)[C@H](CNc1cc[nH+]c2ccc(Cl)cc12)c1ccsc1 ZINC000513650292 1035077614 /nfs/dbraw/zinc/07/76/14/1035077614.db2.gz LUBVUBHJMAGHGX-QGZVFWFLSA-N 2 1 331.872 4.086 20 0 EIADMP CC[C@H](C)[NH+]1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000501033519 1035360743 /nfs/dbraw/zinc/36/07/43/1035360743.db2.gz UEMFHIQWMMBPNQ-AWEZNQCLSA-N 2 1 328.422 4.400 20 0 EIADMP CC[C@H](C)[NH+]1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000501033519 1035360748 /nfs/dbraw/zinc/36/07/48/1035360748.db2.gz UEMFHIQWMMBPNQ-AWEZNQCLSA-N 2 1 328.422 4.400 20 0 EIADMP C[N@H+](Cc1ccc(F)cc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501083472 1035374653 /nfs/dbraw/zinc/37/46/53/1035374653.db2.gz UJOWHNRIDYIIRS-UHFFFAOYSA-N 2 1 347.865 4.223 20 0 EIADMP C[N@@H+](CCC[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1)C1CCCCC1 ZINC000501379497 1035436568 /nfs/dbraw/zinc/43/65/68/1035436568.db2.gz BBZVFUPJFKATMS-UYAOXDASSA-N 2 1 329.532 4.352 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501384131 1035436616 /nfs/dbraw/zinc/43/66/16/1035436616.db2.gz WRWVEMQVKNAFDD-JTJHWIPRSA-N 2 1 329.532 4.065 20 0 EIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501417431 1035437534 /nfs/dbraw/zinc/43/75/34/1035437534.db2.gz AYCWEIYDUWCEIA-WSTZPKSXSA-N 2 1 329.532 4.208 20 0 EIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501417431 1035437535 /nfs/dbraw/zinc/43/75/35/1035437535.db2.gz AYCWEIYDUWCEIA-WSTZPKSXSA-N 2 1 329.532 4.208 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000501419518 1035441418 /nfs/dbraw/zinc/44/14/18/1035441418.db2.gz GZYHKHYRHXXEET-YVGNARHYSA-N 2 1 326.406 4.040 20 0 EIADMP C[NH+](C)[C@H](C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1)C1CCCCC1 ZINC000501427562 1035443787 /nfs/dbraw/zinc/44/37/87/1035443787.db2.gz WOTRMPPSCZGNBT-SESVDKBCSA-N 2 1 329.532 4.208 20 0 EIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000420299092 1035501821 /nfs/dbraw/zinc/50/18/21/1035501821.db2.gz GGBHINVZIOAIMJ-UONOGXRCSA-N 2 1 326.406 4.230 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2C[C@H](C[NH3+])C[C@H]2C)oc1-c1ccc(Cl)cc1 ZINC000420306833 1035506667 /nfs/dbraw/zinc/50/66/67/1035506667.db2.gz AWPZJLMPNYYPPQ-XBFCOCLRSA-N 2 1 333.863 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2C[C@H](C[NH3+])C[C@H]2C)oc1-c1ccc(Cl)cc1 ZINC000420306833 1035506681 /nfs/dbraw/zinc/50/66/81/1035506681.db2.gz AWPZJLMPNYYPPQ-XBFCOCLRSA-N 2 1 333.863 4.034 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420328277 1035532197 /nfs/dbraw/zinc/53/21/97/1035532197.db2.gz ZVTDIVMAVVLURT-CVEARBPZSA-N 2 1 329.513 4.111 20 0 EIADMP CSCC1(CC[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000595067425 1035549860 /nfs/dbraw/zinc/54/98/60/1035549860.db2.gz ILNPRTXKAGURLZ-MJGOQNOKSA-N 2 1 332.557 4.020 20 0 EIADMP CSCC1(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000595065893 1035551117 /nfs/dbraw/zinc/55/11/17/1035551117.db2.gz FWBZSBOXOLZYKV-OWZKRDHZSA-N 2 1 344.568 4.305 20 0 EIADMP Brc1ccc([C@H]2CCC[N@H+]2CC[C@@H]2CCC[NH2+]C2)s1 ZINC000420372163 1035557370 /nfs/dbraw/zinc/55/73/70/1035557370.db2.gz LGSBFONKUOMVFO-QWHCGFSZSA-N 2 1 343.334 4.037 20 0 EIADMP Cc1c(Cl)c(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)nc2ccccc12 ZINC000420413032 1035573065 /nfs/dbraw/zinc/57/30/65/1035573065.db2.gz ZKTGYKCENZBJNV-BEFAXECRSA-N 2 1 343.902 4.161 20 0 EIADMP Cc1c(Cl)c(C[N@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)nc2ccccc12 ZINC000420413032 1035573073 /nfs/dbraw/zinc/57/30/73/1035573073.db2.gz ZKTGYKCENZBJNV-BEFAXECRSA-N 2 1 343.902 4.161 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](CSc1ccccc1)C(C)C ZINC000491031771 1035777323 /nfs/dbraw/zinc/77/73/23/1035777323.db2.gz NWUFFEDQEJYUPS-APWZRJJASA-N 2 1 331.529 4.234 20 0 EIADMP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)CC3 ZINC000491043098 1035792123 /nfs/dbraw/zinc/79/21/23/1035792123.db2.gz YZIYFYSDOWEDAL-QZTJIDSGSA-N 2 1 339.527 4.044 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccc(F)cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000568930874 1035851593 /nfs/dbraw/zinc/85/15/93/1035851593.db2.gz PRSYYIDLNZSYOX-OXJNMPFZSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CCc2ccc(F)cc2F)CC[N@H+]1Cc1ccccc1 ZINC000568930874 1035851595 /nfs/dbraw/zinc/85/15/95/1035851595.db2.gz PRSYYIDLNZSYOX-OXJNMPFZSA-N 2 1 344.449 4.150 20 0 EIADMP FC(F)(F)c1cc(C[NH2+]C2CC[NH+](CC3CC3)CC2)ccc1Cl ZINC000596646441 1035955108 /nfs/dbraw/zinc/95/51/08/1035955108.db2.gz OOKOMVUVJNFRCR-UHFFFAOYSA-N 2 1 346.824 4.323 20 0 EIADMP c1ccc(C[NH+]2CCC([NH2+][C@H]3CCOC4(CCCCC4)C3)CC2)cc1 ZINC000268993240 1036021934 /nfs/dbraw/zinc/02/19/34/1036021934.db2.gz WOPZJZLIPGFQTA-NRFANRHFSA-N 2 1 342.527 4.123 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@H]4C[C@]43C)CC2)cs1 ZINC000502279967 1036031820 /nfs/dbraw/zinc/03/18/20/1036031820.db2.gz HRUGPQKXPDNUDZ-ILZDJORESA-N 2 1 347.572 4.086 20 0 EIADMP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)C1 ZINC000571700907 1036133300 /nfs/dbraw/zinc/13/33/00/1036133300.db2.gz BOEPSEZGMPATGM-PMPSAXMXSA-N 2 1 345.487 4.186 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc3cc[nH]c32)[C@@H]1c1cccs1 ZINC000237176769 1036168759 /nfs/dbraw/zinc/16/87/59/1036168759.db2.gz MJUUVTRWKDEJFD-FXAWDEMLSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc3cc[nH]c32)[C@@H]1c1cccs1 ZINC000237176769 1036168782 /nfs/dbraw/zinc/16/87/82/1036168782.db2.gz MJUUVTRWKDEJFD-FXAWDEMLSA-N 2 1 339.508 4.402 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)C1 ZINC000502415623 1036198772 /nfs/dbraw/zinc/19/87/72/1036198772.db2.gz MWJJJMOAJQQOHD-QZTJIDSGSA-N 2 1 332.536 4.017 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)C1 ZINC000502415623 1036198784 /nfs/dbraw/zinc/19/87/84/1036198784.db2.gz MWJJJMOAJQQOHD-QZTJIDSGSA-N 2 1 332.536 4.017 20 0 EIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]Cc2ncc(C[NH+](C)C)s2)C1 ZINC000414507617 1036224952 /nfs/dbraw/zinc/22/49/52/1036224952.db2.gz BHLYRRVTUOUMIR-JQHSSLGASA-N 2 1 343.540 4.267 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)oc1C ZINC000502708265 1036543648 /nfs/dbraw/zinc/54/36/48/1036543648.db2.gz OVGFYDXPYWWLPT-YLJYHZDGSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)oc1C ZINC000502708265 1036543695 /nfs/dbraw/zinc/54/36/95/1036543695.db2.gz OVGFYDXPYWWLPT-YLJYHZDGSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)oc1C ZINC000502708262 1036545021 /nfs/dbraw/zinc/54/50/21/1036545021.db2.gz OVGFYDXPYWWLPT-FXAWDEMLSA-N 2 1 326.484 4.112 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)oc1C ZINC000502708262 1036545058 /nfs/dbraw/zinc/54/50/58/1036545058.db2.gz OVGFYDXPYWWLPT-FXAWDEMLSA-N 2 1 326.484 4.112 20 0 EIADMP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000502723870 1036583715 /nfs/dbraw/zinc/58/37/15/1036583715.db2.gz RZINJQFLCBFOSQ-IPJJNNNSSA-N 2 1 344.543 4.356 20 0 EIADMP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000502723868 1036588274 /nfs/dbraw/zinc/58/82/74/1036588274.db2.gz RZINJQFLCBFOSQ-CNNODRBYSA-N 2 1 344.543 4.356 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCCC[C@H]1CCc1ccccc1 ZINC000502763160 1036632215 /nfs/dbraw/zinc/63/22/15/1036632215.db2.gz PTIMLSJCQJZWDU-NRFANRHFSA-N 2 1 325.500 4.459 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCC[C@H]1CCc1ccccc1 ZINC000502763160 1036632228 /nfs/dbraw/zinc/63/22/28/1036632228.db2.gz PTIMLSJCQJZWDU-NRFANRHFSA-N 2 1 325.500 4.459 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486479365 1036727964 /nfs/dbraw/zinc/72/79/64/1036727964.db2.gz VFVYEWZFCSNSIK-QGQQZZQASA-N 2 1 334.507 4.290 20 0 EIADMP COC1([C@H](C)[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)CCCC1 ZINC000421828655 1036787453 /nfs/dbraw/zinc/78/74/53/1036787453.db2.gz DSAGICYHLUPHPW-MSOLQXFVSA-N 2 1 330.516 4.149 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccncc1Cl ZINC000421819195 1036805343 /nfs/dbraw/zinc/80/53/43/1036805343.db2.gz FQUIXCPPFAWWAS-HNNXBMFYSA-N 2 1 331.891 4.426 20 0 EIADMP Fc1ccc2cc(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)[nH]c2c1 ZINC000486704838 1036821758 /nfs/dbraw/zinc/82/17/58/1036821758.db2.gz BSPGGGUNPIUPJE-UHFFFAOYSA-N 2 1 337.442 4.061 20 0 EIADMP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc4nc[nH]c4c3)cc2)CC1 ZINC000589638952 1036856064 /nfs/dbraw/zinc/85/60/64/1036856064.db2.gz IUMFECKHDJCUNW-UHFFFAOYSA-N 2 1 348.494 4.085 20 0 EIADMP CC[N@H+](Cc1ncc(-c2ccccc2)o1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999842 1036919920 /nfs/dbraw/zinc/91/99/20/1036919920.db2.gz YXWQYBBIHSIUPN-UHFFFAOYSA-N 2 1 349.478 4.425 20 0 EIADMP CC[N@@H+](Cc1ncc(-c2ccccc2)o1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999842 1036919939 /nfs/dbraw/zinc/91/99/39/1036919939.db2.gz YXWQYBBIHSIUPN-UHFFFAOYSA-N 2 1 349.478 4.425 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)CCCOc2ccc3ccccc3c2)CC1 ZINC000590058426 1036965107 /nfs/dbraw/zinc/96/51/07/1036965107.db2.gz GMLUGZPZJVQXKU-UHFFFAOYSA-N 2 1 340.511 4.413 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271842544 1037030463 /nfs/dbraw/zinc/03/04/63/1037030463.db2.gz HCSFFYORJQOBNA-CQSZACIVSA-N 2 1 327.497 4.031 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ncc(-c3ccc(F)cc3)o2)CC1 ZINC000590787202 1037167791 /nfs/dbraw/zinc/16/77/91/1037167791.db2.gz USUHIQQQSDVTCJ-UHFFFAOYSA-N 2 1 345.462 4.033 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)[C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168416356 1037238960 /nfs/dbraw/zinc/23/89/60/1037238960.db2.gz IMFUMACMMGSCJH-YPAWHYETSA-N 2 1 344.518 4.445 20 0 EIADMP CCOCCC1(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000272711313 1037274512 /nfs/dbraw/zinc/27/45/12/1037274512.db2.gz COBHMDYZFCHCLH-TZIWHRDSSA-N 2 1 344.543 4.084 20 0 EIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@H]3CCC[N@@H+](C(C)C)C3)o2)cc1 ZINC000591712665 1037543132 /nfs/dbraw/zinc/54/31/32/1037543132.db2.gz ROLHXZAGXCYOMZ-GOSISDBHSA-N 2 1 326.484 4.465 20 0 EIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@H]3CCC[N@H+](C(C)C)C3)o2)cc1 ZINC000591712665 1037543140 /nfs/dbraw/zinc/54/31/40/1037543140.db2.gz ROLHXZAGXCYOMZ-GOSISDBHSA-N 2 1 326.484 4.465 20 0 EIADMP c1sc(C2CCCCC2)nc1C[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000573497382 1037569680 /nfs/dbraw/zinc/56/96/80/1037569680.db2.gz XJIWWWTYHJCQNP-SJORKVTESA-N 2 1 333.545 4.012 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CS[C@@H](C(C)C)C2)cc1 ZINC000488427695 1037586193 /nfs/dbraw/zinc/58/61/93/1037586193.db2.gz XYGDJSFQFLTUCR-UCLAIMLFSA-N 2 1 329.513 4.361 20 0 EIADMP [NH3+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)C1 ZINC000414652228 1037676510 /nfs/dbraw/zinc/67/65/10/1037676510.db2.gz GRXVTSFACPKPTG-LBPRGKRZSA-N 2 1 340.414 4.215 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000513788216 1037741600 /nfs/dbraw/zinc/74/16/00/1037741600.db2.gz MZURTVNXXXMGTR-MJGOQNOKSA-N 2 1 328.500 4.145 20 0 EIADMP c1ccc([C@H]2C[C@@H]([NH2+]Cc3ccc(-c4ccncc4)cc3)CC[NH2+]2)cc1 ZINC000422773192 1037830772 /nfs/dbraw/zinc/83/07/72/1037830772.db2.gz TXUVACJESDDCPT-XZOQPEGZSA-N 2 1 343.474 4.332 20 0 EIADMP Cc1nc(-c2ccc([C@@H](C)[NH2+][C@@H](C)c3c[nH+]ccc3N)cc2)cs1 ZINC000422810747 1037838677 /nfs/dbraw/zinc/83/86/77/1037838677.db2.gz UTOPXWJYMIIFMM-OLZOCXBDSA-N 2 1 338.480 4.338 20 0 EIADMP Cc1cc(Br)cc(C)c1C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422831107 1037843625 /nfs/dbraw/zinc/84/36/25/1037843625.db2.gz WGYRSJKZHWNHBV-ZWKOTPCHSA-N 2 1 345.284 4.300 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1CN[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422885705 1037854716 /nfs/dbraw/zinc/85/47/16/1037854716.db2.gz UZHWUEWLEJXHDK-VSDWSMLSSA-N 2 1 349.522 4.295 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2CN[C@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000422874199 1037858459 /nfs/dbraw/zinc/85/84/59/1037858459.db2.gz CGFMFZGQGORYSN-ZQMYSKGWSA-N 2 1 349.522 4.153 20 0 EIADMP C[C@@H]([NH2+]CC1(Sc2ccccc2)CCCC1)c1c[nH+]ccc1N ZINC000422903669 1037864293 /nfs/dbraw/zinc/86/42/93/1037864293.db2.gz FZYMFIWDLBWKFS-OAHLLOKOSA-N 2 1 327.497 4.250 20 0 EIADMP CC(C)Sc1ccc([C@H](C)[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000423181038 1038033803 /nfs/dbraw/zinc/03/38/03/1038033803.db2.gz CAQPIFNIWLLHFS-KRWDZBQOSA-N 2 1 343.540 4.413 20 0 EIADMP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(F)c2ccccc21 ZINC000423187375 1038043845 /nfs/dbraw/zinc/04/38/45/1038043845.db2.gz MRTFROCOSINCJH-MRXNPFEDSA-N 2 1 337.442 4.204 20 0 EIADMP Clc1cccc([C@@H]2CC[C@H]([NH2+]CCC[NH2+]Cc3cccnc3)C2)c1 ZINC000423191781 1038048094 /nfs/dbraw/zinc/04/80/94/1038048094.db2.gz TYPBVVVFUXXWPC-QUCCMNQESA-N 2 1 343.902 4.141 20 0 EIADMP Fc1ccc([C@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423215515 1038056404 /nfs/dbraw/zinc/05/64/04/1038056404.db2.gz QRUTTYFPUAPALP-AOMKIAJQSA-N 2 1 349.453 4.053 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)NC[C@@H]([NH3+])c1ccccc1 ZINC000423246122 1038076732 /nfs/dbraw/zinc/07/67/32/1038076732.db2.gz PHILJKRCFDWWEB-RDTXWAMCSA-N 2 1 337.492 4.469 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1csc(-c2ccccc2F)n1 ZINC000423277791 1038107576 /nfs/dbraw/zinc/10/75/76/1038107576.db2.gz ORXFPEWYOYTDEQ-WOSRLPQWSA-N 2 1 333.476 4.117 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]CCC[N@@H+]2CCCC[C@@H]2C)C1 ZINC000467312504 1038148251 /nfs/dbraw/zinc/14/82/51/1038148251.db2.gz FUWZWUMYNRSPNV-XUVXKRRUSA-N 2 1 329.532 4.270 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC[NH2+]1 ZINC000423371377 1038189734 /nfs/dbraw/zinc/18/97/34/1038189734.db2.gz FLMDNIIDAFPYIN-LSBZLQRGSA-N 2 1 346.421 4.108 20 0 EIADMP COCc1cc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)ccc1OC ZINC000157883892 1038211499 /nfs/dbraw/zinc/21/14/99/1038211499.db2.gz JYKDDURBPKHUOP-MSOLQXFVSA-N 2 1 348.531 4.147 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423444691 1038224016 /nfs/dbraw/zinc/22/40/16/1038224016.db2.gz LXLOFJCCFZWHPP-XMSQKQJNSA-N 2 1 349.522 4.045 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](C)[NH3+] ZINC000423435291 1038235289 /nfs/dbraw/zinc/23/52/89/1038235289.db2.gz DNIZTMRGBXCOEW-YIZRAAEISA-N 2 1 328.300 4.111 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccc(Cl)n2)CC1 ZINC000173628481 1038429043 /nfs/dbraw/zinc/42/90/43/1038429043.db2.gz CBFZFFRKBJFRAS-UHFFFAOYSA-N 2 1 343.902 4.079 20 0 EIADMP COc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c(C)c1 ZINC000539062447 1038807440 /nfs/dbraw/zinc/80/74/40/1038807440.db2.gz YYHSKXHOXIWKKN-PGRDOPGGSA-N 2 1 338.495 4.004 20 0 EIADMP Cc1cc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c(C)s1 ZINC000608510636 1038842295 /nfs/dbraw/zinc/84/22/95/1038842295.db2.gz YOJSUVALRGUGLD-IBGZPJMESA-N 2 1 328.525 4.319 20 0 EIADMP Cc1cc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c(C)s1 ZINC000608510636 1038842296 /nfs/dbraw/zinc/84/22/96/1038842296.db2.gz YOJSUVALRGUGLD-IBGZPJMESA-N 2 1 328.525 4.319 20 0 EIADMP Cc1cc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C)s1 ZINC000608510636 1038842297 /nfs/dbraw/zinc/84/22/97/1038842297.db2.gz YOJSUVALRGUGLD-IBGZPJMESA-N 2 1 328.525 4.319 20 0 EIADMP Cc1cc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)s1 ZINC000608510636 1038842298 /nfs/dbraw/zinc/84/22/98/1038842298.db2.gz YOJSUVALRGUGLD-IBGZPJMESA-N 2 1 328.525 4.319 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cccc(OCC[NH+](C)C)c1 ZINC000480904317 1038860005 /nfs/dbraw/zinc/86/00/05/1038860005.db2.gz VZGGUVHZSRGCJQ-CABCVRRESA-N 2 1 348.437 4.317 20 0 EIADMP C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cccc(OCC[NH+](C)C)c1 ZINC000480904320 1038860471 /nfs/dbraw/zinc/86/04/71/1038860471.db2.gz VZGGUVHZSRGCJQ-GJZGRUSLSA-N 2 1 348.437 4.317 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539160619 1038863436 /nfs/dbraw/zinc/86/34/36/1038863436.db2.gz QKFXDEDQGIWJGV-DYVFJYSZSA-N 2 1 326.406 4.088 20 0 EIADMP CC[C@H](C)[C@@H]([NH2+]C1CC[NH+](CCOC)CC1)c1ccc(Cl)cc1 ZINC000462117781 1038936031 /nfs/dbraw/zinc/93/60/31/1038936031.db2.gz CKBSXWKDUHALHY-HNAYVOBHSA-N 2 1 338.923 4.128 20 0 EIADMP C[NH+](C)C1CCC([N@@H+](Cc2ccccc2)C2CCSCC2)CC1 ZINC001168328474 1038940420 /nfs/dbraw/zinc/94/04/20/1038940420.db2.gz HYDFGNDFPLXJCW-UHFFFAOYSA-N 2 1 332.557 4.257 20 0 EIADMP C[NH+]1CCC([NH2+][C@H]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000462122747 1038944117 /nfs/dbraw/zinc/94/41/17/1038944117.db2.gz UCEDIHGBYAPWMH-ROUUACIJSA-N 2 1 340.433 4.415 20 0 EIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2oc3ccc(OC)cc3c2C)C1 ZINC000481019935 1038958059 /nfs/dbraw/zinc/95/80/59/1038958059.db2.gz GWVZSYGTDQAYPF-HOTGVXAUSA-N 2 1 330.472 4.132 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2oc3ccc(OC)cc3c2C)C1 ZINC000481019935 1038958081 /nfs/dbraw/zinc/95/80/81/1038958081.db2.gz GWVZSYGTDQAYPF-HOTGVXAUSA-N 2 1 330.472 4.132 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccc(Br)cc2)C1 ZINC000481027710 1038966842 /nfs/dbraw/zinc/96/68/42/1038966842.db2.gz WRTCKLVHDILORN-RHSMWYFYSA-N 2 1 339.321 4.222 20 0 EIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537622404 1038985678 /nfs/dbraw/zinc/98/56/78/1038985678.db2.gz XZRSIVPZWRWOEP-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537622404 1038985700 /nfs/dbraw/zinc/98/57/00/1038985700.db2.gz XZRSIVPZWRWOEP-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537622404 1038985718 /nfs/dbraw/zinc/98/57/18/1038985718.db2.gz XZRSIVPZWRWOEP-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3F)o2)C1 ZINC000537622404 1038985736 /nfs/dbraw/zinc/98/57/36/1038985736.db2.gz XZRSIVPZWRWOEP-INIZCTEOSA-N 2 1 330.447 4.249 20 0 EIADMP CC[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CCOCC1 ZINC000552045319 1039067132 /nfs/dbraw/zinc/06/71/32/1039067132.db2.gz CYNOXBPYIUZFFU-HRTMPFAESA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCc2ccccc21 ZINC000481185242 1039086868 /nfs/dbraw/zinc/08/68/68/1039086868.db2.gz WNSHJXDLVADSTJ-RZFNWQHOSA-N 2 1 334.507 4.217 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1cccc(F)c1 ZINC000481184836 1039087596 /nfs/dbraw/zinc/08/75/96/1039087596.db2.gz GAMOIFNXJKCGGH-XMSQKQJNSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1cccc(F)c1 ZINC000481184836 1039087612 /nfs/dbraw/zinc/08/76/12/1039087612.db2.gz GAMOIFNXJKCGGH-XMSQKQJNSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCc2ccccc21 ZINC000481185239 1039088545 /nfs/dbraw/zinc/08/85/45/1039088545.db2.gz WNSHJXDLVADSTJ-AAIMPIBUSA-N 2 1 334.507 4.217 20 0 EIADMP CSc1ccccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000481187264 1039092424 /nfs/dbraw/zinc/09/24/24/1039092424.db2.gz ZAKFLJTZFYBXGZ-PXNSSMCTSA-N 2 1 340.536 4.409 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2c(OC(F)F)ccc3ccccc32)CCN1C ZINC000552071542 1039099602 /nfs/dbraw/zinc/09/96/02/1039099602.db2.gz NCIXWUOSDYUGET-GOEBONIOSA-N 2 1 348.437 4.356 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2c(OC(F)F)ccc3ccccc32)CCN1C ZINC000552071542 1039099624 /nfs/dbraw/zinc/09/96/24/1039099624.db2.gz NCIXWUOSDYUGET-GOEBONIOSA-N 2 1 348.437 4.356 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2c(OC(F)F)ccc3ccccc32)CCN1C ZINC000552071543 1039101336 /nfs/dbraw/zinc/10/13/36/1039101336.db2.gz NCIXWUOSDYUGET-HOCLYGCPSA-N 2 1 348.437 4.356 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2c(OC(F)F)ccc3ccccc32)CCN1C ZINC000552071543 1039101385 /nfs/dbraw/zinc/10/13/85/1039101385.db2.gz NCIXWUOSDYUGET-HOCLYGCPSA-N 2 1 348.437 4.356 20 0 EIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccccc1OC(F)F ZINC000120544095 1039154212 /nfs/dbraw/zinc/15/42/12/1039154212.db2.gz LJNUSOCUFPRKTC-GFCCVEGCSA-N 2 1 326.431 4.248 20 0 EIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccccc2OCc2ccccc2)C1 ZINC000481309905 1039257766 /nfs/dbraw/zinc/25/77/66/1039257766.db2.gz NBTWJEGDINKQBU-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccccc2OCc2ccccc2)C1 ZINC000481309905 1039257804 /nfs/dbraw/zinc/25/78/04/1039257804.db2.gz NBTWJEGDINKQBU-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550798009 1039312435 /nfs/dbraw/zinc/31/24/35/1039312435.db2.gz UZERYWRDMFHCAU-YESZJQIVSA-N 2 1 328.422 4.389 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550798009 1039312459 /nfs/dbraw/zinc/31/24/59/1039312459.db2.gz UZERYWRDMFHCAU-YESZJQIVSA-N 2 1 328.422 4.389 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2c1cccc2F ZINC000513863838 1039327643 /nfs/dbraw/zinc/32/76/43/1039327643.db2.gz MSJYBGFNYCEWLY-NRFANRHFSA-N 2 1 326.459 4.443 20 0 EIADMP C[C@H](CC(F)(F)F)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000552280652 1039358262 /nfs/dbraw/zinc/35/82/62/1039358262.db2.gz ORKYQNPLWOJHAU-ODIFPOPNSA-N 2 1 328.422 4.360 20 0 EIADMP C[N@H+]1CCC[C@]2(CC[NH+](CCCOc3cccc4ccccc43)C2)C1 ZINC000555598029 1039423480 /nfs/dbraw/zinc/42/34/80/1039423480.db2.gz MTZRHORSVDBKEY-QFIPXVFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[NH+]1CCC[C@]2(CC[N@H+](CCCOc3cccc4ccccc43)C2)C1 ZINC000555598029 1039423496 /nfs/dbraw/zinc/42/34/96/1039423496.db2.gz MTZRHORSVDBKEY-QFIPXVFZSA-N 2 1 338.495 4.026 20 0 EIADMP C[NH+]1CCC[C@]2(CC[N@@H+](CCCOc3cccc4ccccc43)C2)C1 ZINC000555598029 1039423509 /nfs/dbraw/zinc/42/35/09/1039423509.db2.gz MTZRHORSVDBKEY-QFIPXVFZSA-N 2 1 338.495 4.026 20 0 EIADMP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000121892967 1039526551 /nfs/dbraw/zinc/52/65/51/1039526551.db2.gz MIZZYFSLPUJHNR-OXQOHEQNSA-N 2 1 328.500 4.098 20 0 EIADMP Cc1cc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc(F)c1F ZINC001143610389 1039549267 /nfs/dbraw/zinc/54/92/67/1039549267.db2.gz WZMNJTCPDOCXNF-SFHVURJKSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1cc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc(F)c1F ZINC001143610389 1039549291 /nfs/dbraw/zinc/54/92/91/1039549291.db2.gz WZMNJTCPDOCXNF-SFHVURJKSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1cc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc(F)c1F ZINC001143610389 1039549314 /nfs/dbraw/zinc/54/93/14/1039549314.db2.gz WZMNJTCPDOCXNF-SFHVURJKSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1cc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc(F)c1F ZINC001143610389 1039549343 /nfs/dbraw/zinc/54/93/43/1039549343.db2.gz WZMNJTCPDOCXNF-SFHVURJKSA-N 2 1 344.449 4.227 20 0 EIADMP Cc1ccnc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000514087934 1039589641 /nfs/dbraw/zinc/58/96/41/1039589641.db2.gz JHRCZCHKILILQC-MOPGFXCFSA-N 2 1 337.511 4.473 20 0 EIADMP FC(F)(F)c1ccccc1C1([NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168360813 1039649416 /nfs/dbraw/zinc/64/94/16/1039649416.db2.gz VXYAFTQDMBPFPJ-UHFFFAOYSA-N 2 1 338.417 4.159 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc3ccccc3s2)[C@@H](C)C1 ZINC000550856239 1039654584 /nfs/dbraw/zinc/65/45/84/1039654584.db2.gz ITARHSAFPBFCMO-LPHOPBHVSA-N 2 1 346.540 4.128 20 0 EIADMP C[C@H]1C[C@H](Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC[N@H+]1C ZINC000899874947 1039755219 /nfs/dbraw/zinc/75/52/19/1039755219.db2.gz QKHDSSPNTCLBMC-NWDGAFQWSA-N 2 1 339.361 4.028 20 0 EIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537647393 1039805183 /nfs/dbraw/zinc/80/51/83/1039805183.db2.gz MZGWVJYFTVTNNF-HXUWFJFHSA-N 2 1 342.527 4.172 20 0 EIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537647393 1039805190 /nfs/dbraw/zinc/80/51/90/1039805190.db2.gz MZGWVJYFTVTNNF-HXUWFJFHSA-N 2 1 342.527 4.172 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537647393 1039805194 /nfs/dbraw/zinc/80/51/94/1039805194.db2.gz MZGWVJYFTVTNNF-HXUWFJFHSA-N 2 1 342.527 4.172 20 0 EIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2cccc(OC3CCCC3)c2)C1 ZINC000537647393 1039805197 /nfs/dbraw/zinc/80/51/97/1039805197.db2.gz MZGWVJYFTVTNNF-HXUWFJFHSA-N 2 1 342.527 4.172 20 0 EIADMP Fc1ccc2c(c1)[C@@H]([NH+]1CCC(c3[nH+]cc4n3CCCC4)CC1)CC2 ZINC000434688143 1039810655 /nfs/dbraw/zinc/81/06/55/1039810655.db2.gz ISNQZJDCKCAMMC-FQEVSTJZSA-N 2 1 339.458 4.225 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1cn2ccccc2n1 ZINC000550885494 1039811612 /nfs/dbraw/zinc/81/16/12/1039811612.db2.gz FMTXDCTUWLYEBS-SFHVURJKSA-N 2 1 348.494 4.171 20 0 EIADMP c1cc(CCC[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cs1 ZINC000434684571 1039816328 /nfs/dbraw/zinc/81/63/28/1039816328.db2.gz LTCQRVDMUDXJKS-UHFFFAOYSA-N 2 1 329.513 4.093 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H](CO)C2CCCCC2)cc1 ZINC000550898347 1039818517 /nfs/dbraw/zinc/81/85/17/1039818517.db2.gz XHPJBKLYMSLUCL-UZLBHIALSA-N 2 1 341.499 4.020 20 0 EIADMP CC(C)[N@@H+]1CCc2nc(C[NH2+]C[C@@H]3CCC[C@@H](C)[C@@H]3C)sc2C1 ZINC000481823511 1039850067 /nfs/dbraw/zinc/85/00/67/1039850067.db2.gz KJKHGCHOQCKQPY-PMPSAXMXSA-N 2 1 335.561 4.072 20 0 EIADMP CC(C)[N@H+]1CCc2nc(C[NH2+]C[C@@H]3CCC[C@@H](C)[C@@H]3C)sc2C1 ZINC000481823511 1039850074 /nfs/dbraw/zinc/85/00/74/1039850074.db2.gz KJKHGCHOQCKQPY-PMPSAXMXSA-N 2 1 335.561 4.072 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CC(C)(C)C[C@H]3C)CC2)cs1 ZINC000434754670 1039861232 /nfs/dbraw/zinc/86/12/32/1039861232.db2.gz IVZCHNYOFHUNPB-QAPCUYQASA-N 2 1 349.588 4.332 20 0 EIADMP CCc1ncc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)s1 ZINC000537659943 1039872962 /nfs/dbraw/zinc/87/29/62/1039872962.db2.gz UEOGOVRALHRFQK-INIZCTEOSA-N 2 1 335.561 4.182 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)s1 ZINC000551050761 1039916780 /nfs/dbraw/zinc/91/67/80/1039916780.db2.gz BQYDVIOAJONAQS-QSFXBCCZSA-N 2 1 328.525 4.413 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)s1 ZINC000551050761 1039916808 /nfs/dbraw/zinc/91/68/08/1039916808.db2.gz BQYDVIOAJONAQS-QSFXBCCZSA-N 2 1 328.525 4.413 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000551093867 1039977104 /nfs/dbraw/zinc/97/71/04/1039977104.db2.gz USDSVXNNNIXPEE-LJQANCHMSA-N 2 1 336.470 4.266 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)C[C@@H]1c1ccccc1 ZINC000551176643 1040021229 /nfs/dbraw/zinc/02/12/29/1040021229.db2.gz YRWVBNJCMUQONC-JPAWQOSXSA-N 2 1 338.470 4.497 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)C[C@@H]1c1ccccc1 ZINC000551176643 1040021251 /nfs/dbraw/zinc/02/12/51/1040021251.db2.gz YRWVBNJCMUQONC-JPAWQOSXSA-N 2 1 338.470 4.497 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1cccc(F)c1 ZINC000482133275 1040028829 /nfs/dbraw/zinc/02/88/29/1040028829.db2.gz IXPFWZXKRSIRKW-CVEARBPZSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccc(F)c1 ZINC000482133275 1040028850 /nfs/dbraw/zinc/02/88/50/1040028850.db2.gz IXPFWZXKRSIRKW-CVEARBPZSA-N 2 1 332.488 4.450 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(OCc2ccccc2C)cc1 ZINC000482122667 1040034342 /nfs/dbraw/zinc/03/43/42/1040034342.db2.gz UJJMVECKYKSOKR-GOSISDBHSA-N 2 1 349.478 4.430 20 0 EIADMP COC1CCC(C)(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000479447863 1040376146 /nfs/dbraw/zinc/37/61/46/1040376146.db2.gz DRMJOMMKMZWRPQ-DWOCFRCJSA-N 2 1 344.543 4.082 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2c(s1)CCC2 ZINC000479467131 1040391833 /nfs/dbraw/zinc/39/18/33/1040391833.db2.gz VDPXLYFPHNQKBN-AEFFLSMTSA-N 2 1 340.536 4.410 20 0 EIADMP CC(C)COc1ccc(C(C)(C)C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000482643060 1040401853 /nfs/dbraw/zinc/40/18/53/1040401853.db2.gz ODJBWYZZBYIQOU-IEBWSBKVSA-N 2 1 332.532 4.071 20 0 EIADMP Cc1cccc2[nH]c(C[N@H+]3CCC[C@@H](c4ncc5n4CCCC5)C3)cc21 ZINC000668104513 1040430333 /nfs/dbraw/zinc/43/03/33/1040430333.db2.gz IRFSOLYIYFGVAX-QGZVFWFLSA-N 2 1 348.494 4.389 20 0 EIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(-c2ccncc2)cc1 ZINC000479519620 1040436916 /nfs/dbraw/zinc/43/69/16/1040436916.db2.gz UIUYFRHBXFKDMA-YTXWROIDSA-N 2 1 335.495 4.416 20 0 EIADMP Cn1c[nH+]cc1CCC[NH+]1CCC(F)(Cc2ccc(Cl)cc2)CC1 ZINC000515497144 1040803694 /nfs/dbraw/zinc/80/36/94/1040803694.db2.gz UVAMRCKFOMAVHO-UHFFFAOYSA-N 2 1 349.881 4.053 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@H]1C ZINC000539838133 1040820078 /nfs/dbraw/zinc/82/00/78/1040820078.db2.gz LAWFABGJPQUATP-NVXWUHKLSA-N 2 1 340.458 4.209 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@H]1C ZINC000539838133 1040820082 /nfs/dbraw/zinc/82/00/82/1040820082.db2.gz LAWFABGJPQUATP-NVXWUHKLSA-N 2 1 340.458 4.209 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@H]1C ZINC000539838133 1040820089 /nfs/dbraw/zinc/82/00/89/1040820089.db2.gz LAWFABGJPQUATP-NVXWUHKLSA-N 2 1 340.458 4.209 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(F)cc2C(F)(F)F)[C@@H](C)C1 ZINC000539834794 1040828919 /nfs/dbraw/zinc/82/89/19/1040828919.db2.gz FZURXILMAVCPNV-LRDDRELGSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(F)cc2C(F)(F)F)[C@@H](C)C1 ZINC000539834794 1040828943 /nfs/dbraw/zinc/82/89/43/1040828943.db2.gz FZURXILMAVCPNV-LRDDRELGSA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(F)cc2C(F)(F)F)[C@@H](C)C1 ZINC000539834794 1040828944 /nfs/dbraw/zinc/82/89/44/1040828944.db2.gz FZURXILMAVCPNV-LRDDRELGSA-N 2 1 332.385 4.007 20 0 EIADMP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000669846973 1040851399 /nfs/dbraw/zinc/85/13/99/1040851399.db2.gz UIKYOLMWUFUGSM-HKBOAZHASA-N 2 1 332.507 4.407 20 0 EIADMP CCc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cc1 ZINC000462727848 1040860828 /nfs/dbraw/zinc/86/08/28/1040860828.db2.gz XJQJBCOOMDPBBI-QUCCMNQESA-N 2 1 328.525 4.483 20 0 EIADMP CCc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)cc1 ZINC000462727848 1040860836 /nfs/dbraw/zinc/86/08/36/1040860836.db2.gz XJQJBCOOMDPBBI-QUCCMNQESA-N 2 1 328.525 4.483 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CCc1ccc(Oc2ccc(F)cc2)cc1 ZINC000537938878 1040899396 /nfs/dbraw/zinc/89/93/96/1040899396.db2.gz UUEVICWWFTXIIJ-IIBYNOLFSA-N 2 1 342.458 4.090 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000537952085 1040918582 /nfs/dbraw/zinc/91/85/82/1040918582.db2.gz PJKBCEQAMVFONV-GCJKJVERSA-N 2 1 338.495 4.004 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000462796985 1040951491 /nfs/dbraw/zinc/95/14/91/1040951491.db2.gz ALEGNUVKWCEITL-VLCRHTCISA-N 2 1 344.543 4.212 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+]C1(c2ccc(C(F)(F)F)cc2)CCCC1 ZINC000505482222 1040979534 /nfs/dbraw/zinc/97/95/34/1040979534.db2.gz ZKVVKMUZEZXGAL-UHFFFAOYSA-N 2 1 337.389 4.269 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)c2cccc(Br)c21 ZINC000483734456 1040986410 /nfs/dbraw/zinc/98/64/10/1040986410.db2.gz XDQFQMGZLSZLQF-IATRGZMQSA-N 2 1 337.305 4.070 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)c2cccc(Br)c21 ZINC000483734456 1040986439 /nfs/dbraw/zinc/98/64/39/1040986439.db2.gz XDQFQMGZLSZLQF-IATRGZMQSA-N 2 1 337.305 4.070 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000483741369 1040995627 /nfs/dbraw/zinc/99/56/27/1040995627.db2.gz FTAXEQCWBIEJNK-JJXUHFIVSA-N 2 1 326.484 4.372 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000483741369 1040995655 /nfs/dbraw/zinc/99/56/55/1040995655.db2.gz FTAXEQCWBIEJNK-JJXUHFIVSA-N 2 1 326.484 4.372 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000483729139 1040998978 /nfs/dbraw/zinc/99/89/78/1040998978.db2.gz OLWXYLCKDDCTBF-LVCYWYKZSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000483729139 1040998996 /nfs/dbraw/zinc/99/89/96/1040998996.db2.gz OLWXYLCKDDCTBF-LVCYWYKZSA-N 2 1 338.495 4.399 20 0 EIADMP FC(F)(F)C1CCC([NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)CC1 ZINC000436294413 1041060879 /nfs/dbraw/zinc/06/08/79/1041060879.db2.gz ORBPGJCXCTWBLN-DQPZFDDXSA-N 2 1 332.454 4.494 20 0 EIADMP CCc1cnccc1[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000538114956 1041066089 /nfs/dbraw/zinc/06/60/89/1041066089.db2.gz IEJLDHQWVIKUKH-GOSISDBHSA-N 2 1 337.511 4.002 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@@H](C)C1 ZINC000436317364 1041085857 /nfs/dbraw/zinc/08/58/57/1041085857.db2.gz UZEUBPKAFHZRKB-QXRTWZOPSA-N 2 1 340.433 4.271 20 0 EIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000480257840 1041121513 /nfs/dbraw/zinc/12/15/13/1041121513.db2.gz FODZEXFDCBIUCA-HNNXBMFYSA-N 2 1 338.948 4.427 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3ccc4c(c3)CCC4)CC2)[nH+]c1 ZINC000484132336 1041142213 /nfs/dbraw/zinc/14/22/13/1041142213.db2.gz RJUGLNVJNHZQPI-QGZVFWFLSA-N 2 1 335.495 4.198 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000540141003 1041155586 /nfs/dbraw/zinc/15/55/86/1041155586.db2.gz VIKRDUYHGRUDGB-DYXWJJEUSA-N 2 1 340.511 4.491 20 0 EIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2cccnc2)C2CC2)CC1 ZINC000540151494 1041198667 /nfs/dbraw/zinc/19/86/67/1041198667.db2.gz QAGIFJWOQSSAST-MAODMQOUSA-N 2 1 327.516 4.165 20 0 EIADMP CCC[C@H]([NH2+]C1CCN(c2cc(C)[nH+]c(C)n2)CC1)C1CCCCC1 ZINC000484294786 1041200274 /nfs/dbraw/zinc/20/02/74/1041200274.db2.gz UJLJRYWJGLZJEL-FQEVSTJZSA-N 2 1 344.547 4.401 20 0 EIADMP CCC[C@H](Cc1ccccc1)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000540170078 1041212477 /nfs/dbraw/zinc/21/24/77/1041212477.db2.gz YPCJTHBRBQKVHN-OAQYLSRUSA-N 2 1 344.543 4.023 20 0 EIADMP COc1cccc(C[C@@H](C)[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000540181509 1041244360 /nfs/dbraw/zinc/24/43/60/1041244360.db2.gz LBEIFLGKQXWEFK-IAGOWNOFSA-N 2 1 349.478 4.471 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)c(OCCC)c1 ZINC000538405792 1041301941 /nfs/dbraw/zinc/30/19/41/1041301941.db2.gz FDYWVCQGDGOCJS-QGZVFWFLSA-N 2 1 346.515 4.177 20 0 EIADMP CCCOc1ccc([C@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)c(OCCC)c1 ZINC000538405791 1041302562 /nfs/dbraw/zinc/30/25/62/1041302562.db2.gz FDYWVCQGDGOCJS-KRWDZBQOSA-N 2 1 346.515 4.177 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)C[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000463076622 1041321187 /nfs/dbraw/zinc/32/11/87/1041321187.db2.gz KLDJBHSPMMNVJY-KDURUIRLSA-N 2 1 343.559 4.002 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)C)C1 ZINC000540261238 1041328314 /nfs/dbraw/zinc/32/83/14/1041328314.db2.gz XIANTHRQDXOUMZ-WMLDXEAASA-N 2 1 328.422 4.334 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+]C/C=C\c3ccccc3)CC2)cc1 ZINC000463128413 1041349806 /nfs/dbraw/zinc/34/98/06/1041349806.db2.gz QPXNSRVPUVXMGF-DAXSKMNVSA-N 2 1 338.470 4.136 20 0 EIADMP Cc1cccc([C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)C2)c2cccc(F)c2)c1 ZINC000554725212 1041353151 /nfs/dbraw/zinc/35/31/51/1041353151.db2.gz PPYKYJGZXBXLJN-UWJYYQICSA-N 2 1 326.459 4.155 20 0 EIADMP Cc1cccc([C@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)c2cccc(F)c2)c1 ZINC000554725212 1041353169 /nfs/dbraw/zinc/35/31/69/1041353169.db2.gz PPYKYJGZXBXLJN-UWJYYQICSA-N 2 1 326.459 4.155 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)C1(c2ccccc2)CCCC1 ZINC000554734346 1041366403 /nfs/dbraw/zinc/36/64/03/1041366403.db2.gz JRLPSQQKFVYBIN-ROUUACIJSA-N 2 1 325.500 4.318 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1C[C@H]1c1ccccc1 ZINC000463162024 1041378363 /nfs/dbraw/zinc/37/83/63/1041378363.db2.gz JZSOVVDYWQIKTR-VXKWHMMOSA-N 2 1 335.495 4.176 20 0 EIADMP COc1ccc(C2([NH2+]C3CC[NH+]([C@H]4CCCC[C@H]4C)CC3)CC2)cc1 ZINC000538524306 1041391767 /nfs/dbraw/zinc/39/17/67/1041391767.db2.gz MHWNSXOBKWNNIH-UTKZUKDTSA-N 2 1 342.527 4.317 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]2Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463190111 1041406239 /nfs/dbraw/zinc/40/62/39/1041406239.db2.gz IADGPQJUGRINTR-MSYGRNIXSA-N 2 1 334.507 4.260 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]2Cc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000463190111 1041406244 /nfs/dbraw/zinc/40/62/44/1041406244.db2.gz IADGPQJUGRINTR-MSYGRNIXSA-N 2 1 334.507 4.260 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)[C@H](C)c1ccccc1 ZINC000463194922 1041409791 /nfs/dbraw/zinc/40/97/91/1041409791.db2.gz XBPCBQVNYBGVGH-VQTJNVASSA-N 2 1 336.523 4.475 20 0 EIADMP CCS[C@@H]1CCCC[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463187573 1041416156 /nfs/dbraw/zinc/41/61/56/1041416156.db2.gz BPNXQKLDODRYRW-NHCUHLMSSA-N 2 1 346.584 4.347 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463188315 1041417831 /nfs/dbraw/zinc/41/78/31/1041417831.db2.gz CIFDTCISOAMZPS-GHTZIAJQSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cc(C)ccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463188315 1041417834 /nfs/dbraw/zinc/41/78/34/1041417834.db2.gz CIFDTCISOAMZPS-GHTZIAJQSA-N 2 1 338.495 4.146 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463207402 1041419553 /nfs/dbraw/zinc/41/95/53/1041419553.db2.gz SQVYGBXETXBYRB-GHTZIAJQSA-N 2 1 338.495 4.146 20 0 EIADMP CCCCOc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+]2C)cc1OC ZINC000540377594 1041428079 /nfs/dbraw/zinc/42/80/79/1041428079.db2.gz QHYHLNPFPKZLNH-SJLPKXTDSA-N 2 1 334.504 4.009 20 0 EIADMP Clc1ccc([C@H]2CCC[C@@H]2[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000414889621 1041433413 /nfs/dbraw/zinc/43/34/13/1041433413.db2.gz YWPSAXDATSBGET-UXHICEINSA-N 2 1 343.902 4.141 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1N(C)C ZINC000480634112 1041447350 /nfs/dbraw/zinc/44/73/50/1041447350.db2.gz ZMQNUJHQHXWMSA-IAGOWNOFSA-N 2 1 335.511 4.054 20 0 EIADMP Fc1ccccc1CCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463246079 1041452569 /nfs/dbraw/zinc/45/25/69/1041452569.db2.gz BKWWAKSFARRUDM-UHFFFAOYSA-N 2 1 340.486 4.055 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1Nc1ccc2c(c1)nc(C(C)(C)C)n2C ZINC000538627236 1041458955 /nfs/dbraw/zinc/45/89/55/1041458955.db2.gz CQXJSYYYIJEEAP-IIAWOOMASA-N 2 1 328.504 4.011 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000538627236 1041458963 /nfs/dbraw/zinc/45/89/63/1041458963.db2.gz CQXJSYYYIJEEAP-IIAWOOMASA-N 2 1 328.504 4.011 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000538627236 1041458968 /nfs/dbraw/zinc/45/89/68/1041458968.db2.gz CQXJSYYYIJEEAP-IIAWOOMASA-N 2 1 328.504 4.011 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C[C@@H](C)CC(C)C)CC2)cs1 ZINC000554859341 1041459144 /nfs/dbraw/zinc/45/91/44/1041459144.db2.gz OOOLITSKDYFXIW-INIZCTEOSA-N 2 1 337.577 4.189 20 0 EIADMP C[N@@H+]1CCC[C@@H]1CC[NH2+][C@@H](COCc1ccccc1)c1ccccc1 ZINC000540445430 1041460358 /nfs/dbraw/zinc/46/03/58/1041460358.db2.gz NJFDBDIAKRVGJV-YADHBBJMSA-N 2 1 338.495 4.018 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@@H](COCc1ccccc1)c1ccccc1 ZINC000540445430 1041460362 /nfs/dbraw/zinc/46/03/62/1041460362.db2.gz NJFDBDIAKRVGJV-YADHBBJMSA-N 2 1 338.495 4.018 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)o1 ZINC000538718506 1041487763 /nfs/dbraw/zinc/48/77/63/1041487763.db2.gz WXAAEUYVXZCPEP-KRWDZBQOSA-N 2 1 342.458 4.312 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)o1 ZINC000538718506 1041487769 /nfs/dbraw/zinc/48/77/69/1041487769.db2.gz WXAAEUYVXZCPEP-KRWDZBQOSA-N 2 1 342.458 4.312 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccccc2OC2CCCC2)[C@@H](C)C1 ZINC000538738290 1041507500 /nfs/dbraw/zinc/50/75/00/1041507500.db2.gz LRPRUKRMVPGWLD-FXAWDEMLSA-N 2 1 330.516 4.170 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2OC2CCCC2)[C@@H](C)C1 ZINC000538738290 1041507512 /nfs/dbraw/zinc/50/75/12/1041507512.db2.gz LRPRUKRMVPGWLD-FXAWDEMLSA-N 2 1 330.516 4.170 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2OC2CCCC2)[C@@H](C)C1 ZINC000538738290 1041507527 /nfs/dbraw/zinc/50/75/27/1041507527.db2.gz LRPRUKRMVPGWLD-FXAWDEMLSA-N 2 1 330.516 4.170 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2OC2CCCC2)[C@@H](C)C1 ZINC000538738290 1041507538 /nfs/dbraw/zinc/50/75/38/1041507538.db2.gz LRPRUKRMVPGWLD-FXAWDEMLSA-N 2 1 330.516 4.170 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c(OC)ccc3ccccc32)[C@H](C)C1 ZINC000538738761 1041513148 /nfs/dbraw/zinc/51/31/48/1041513148.db2.gz XOMNFXNLWGXCPN-UZLBHIALSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c(OC)ccc3ccccc32)[C@H](C)C1 ZINC000538738761 1041513159 /nfs/dbraw/zinc/51/31/59/1041513159.db2.gz XOMNFXNLWGXCPN-UZLBHIALSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c(OC)ccc3ccccc32)[C@H](C)C1 ZINC000538738761 1041513179 /nfs/dbraw/zinc/51/31/79/1041513179.db2.gz XOMNFXNLWGXCPN-UZLBHIALSA-N 2 1 326.484 4.011 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000540708629 1041606681 /nfs/dbraw/zinc/60/66/81/1041606681.db2.gz ZMGCHYBLRFFWJO-ZWKOTPCHSA-N 2 1 338.417 4.193 20 0 EIADMP COc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1 ZINC000540962865 1041754240 /nfs/dbraw/zinc/75/42/40/1041754240.db2.gz XRCHRDRUYPJUDB-RXVVDRJESA-N 2 1 338.495 4.004 20 0 EIADMP C[NH+](C)CC1CC[NH+](Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000437580532 1041841799 /nfs/dbraw/zinc/84/17/99/1041841799.db2.gz KEALGPDOAHJURU-UHFFFAOYSA-N 2 1 334.813 4.132 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)c1 ZINC000464069680 1041854197 /nfs/dbraw/zinc/85/41/97/1041854197.db2.gz FGTNTOHZIQVIRM-FDFHNCONSA-N 2 1 344.543 4.212 20 0 EIADMP C[C@H](Cc1ccsc1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000541234373 1041859768 /nfs/dbraw/zinc/85/97/68/1041859768.db2.gz DXGODMGBKMCXES-YLJYHZDGSA-N 2 1 328.525 4.133 20 0 EIADMP C[C@H](Cc1ccsc1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000541234373 1041859769 /nfs/dbraw/zinc/85/97/69/1041859769.db2.gz DXGODMGBKMCXES-YLJYHZDGSA-N 2 1 328.525 4.133 20 0 EIADMP C[C@H](Cc1ccsc1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000541234373 1041859771 /nfs/dbraw/zinc/85/97/71/1041859771.db2.gz DXGODMGBKMCXES-YLJYHZDGSA-N 2 1 328.525 4.133 20 0 EIADMP C[C@H](NCc1cccc(OC(C)(C)C)n1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603187 1042038272 /nfs/dbraw/zinc/03/82/72/1042038272.db2.gz ORGLHWFQCXOBAK-IRXDYDNUSA-N 2 1 345.531 4.002 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541603187 1042038276 /nfs/dbraw/zinc/03/82/76/1042038276.db2.gz ORGLHWFQCXOBAK-IRXDYDNUSA-N 2 1 345.531 4.002 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000541603187 1042038283 /nfs/dbraw/zinc/03/82/83/1042038283.db2.gz ORGLHWFQCXOBAK-IRXDYDNUSA-N 2 1 345.531 4.002 20 0 EIADMP C[N@H+](Cc1cc(Cl)cc(C(F)(F)F)c1)CC1CC[NH+](C)CC1 ZINC000438112692 1042054877 /nfs/dbraw/zinc/05/48/77/1042054877.db2.gz BWMTZYANDCSPAT-UHFFFAOYSA-N 2 1 334.813 4.132 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CC[C@@](C)(c4ccccc4)C3)CC2)[nH+]1 ZINC000438190837 1042083269 /nfs/dbraw/zinc/08/32/69/1042083269.db2.gz NRSFRKGUEVKLPO-FYYLOGMGSA-N 2 1 349.522 4.459 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CC[C@](C)(c4ccccc4)C3)CC2)[nH+]1 ZINC000438190839 1042083830 /nfs/dbraw/zinc/08/38/30/1042083830.db2.gz NRSFRKGUEVKLPO-GGAORHGYSA-N 2 1 349.522 4.459 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@H+](CCOc2ccc(C(C)C)c(C)c2)C1 ZINC000464769885 1042149817 /nfs/dbraw/zinc/14/98/17/1042149817.db2.gz BAFRCCMBFTUWGR-LJQANCHMSA-N 2 1 332.532 4.161 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCOc2ccc(C(C)C)c(C)c2)C1 ZINC000464769885 1042149818 /nfs/dbraw/zinc/14/98/18/1042149818.db2.gz BAFRCCMBFTUWGR-LJQANCHMSA-N 2 1 332.532 4.161 20 0 EIADMP C[C@H](c1ccc(F)cc1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464832151 1042188982 /nfs/dbraw/zinc/18/89/82/1042188982.db2.gz BVJFWQIOWBYLJM-MJGOQNOKSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@H](c1ccc(F)cc1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464832151 1042188984 /nfs/dbraw/zinc/18/89/84/1042188984.db2.gz BVJFWQIOWBYLJM-MJGOQNOKSA-N 2 1 326.459 4.341 20 0 EIADMP C[C@H](c1ccc(F)cc1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464832151 1042188985 /nfs/dbraw/zinc/18/89/85/1042188985.db2.gz BVJFWQIOWBYLJM-MJGOQNOKSA-N 2 1 326.459 4.341 20 0 EIADMP COc1ccc(Oc2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000542322935 1042388282 /nfs/dbraw/zinc/38/82/82/1042388282.db2.gz NGRSGYTZFYGJTN-FUHWJXTLSA-N 2 1 340.467 4.060 20 0 EIADMP COc1ccc2cc(C[NH2+]CCCC[N@H+]3CCC[C@@H](C)C3)ccc2c1 ZINC000518268147 1042442251 /nfs/dbraw/zinc/44/22/51/1042442251.db2.gz YYNYCYQOIQAUGO-GOSISDBHSA-N 2 1 340.511 4.450 20 0 EIADMP C[C@H]([NH2+]CCOC1CCCCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492398271 1042633639 /nfs/dbraw/zinc/63/36/39/1042633639.db2.gz GVDWKSMOSKSGOY-PZJWPPBQSA-N 2 1 344.543 4.226 20 0 EIADMP C/C(=C\c1ccccc1)C[N@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000426391109 1042637642 /nfs/dbraw/zinc/63/76/42/1042637642.db2.gz OCPUZOCUSHAOJD-GHRIWEEISA-N 2 1 332.451 4.111 20 0 EIADMP c1csc(C[N@@H+]2CCC[C@H](CNc3cc[nH+]c4ccccc34)C2)c1 ZINC000518893856 1042742621 /nfs/dbraw/zinc/74/26/21/1042742621.db2.gz ILTDTPPHBCAOLA-MRXNPFEDSA-N 2 1 337.492 4.042 20 0 EIADMP C[N@@H+](CCOc1ccccc1Cl)Cc1cc(-n2ccnc2)cs1 ZINC000542465340 1042801423 /nfs/dbraw/zinc/80/14/23/1042801423.db2.gz HUEHGRBHYGJSOW-UHFFFAOYSA-N 2 1 347.871 4.098 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1nccs1 ZINC000639046975 1042819609 /nfs/dbraw/zinc/81/96/09/1042819609.db2.gz YNXSJFAYBXCQKZ-HHXXYDBFSA-N 2 1 341.524 4.204 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1nccs1 ZINC000639046975 1042819612 /nfs/dbraw/zinc/81/96/12/1042819612.db2.gz YNXSJFAYBXCQKZ-HHXXYDBFSA-N 2 1 341.524 4.204 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310099002 1042828009 /nfs/dbraw/zinc/82/80/09/1042828009.db2.gz WRNMJHGYJZREEX-RXVVDRJESA-N 2 1 326.459 4.389 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310496028 1042838747 /nfs/dbraw/zinc/83/87/47/1042838747.db2.gz IGVQSMDGTQGHOW-ZIFCJYIRSA-N 2 1 326.459 4.387 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccccc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310496028 1042838750 /nfs/dbraw/zinc/83/87/50/1042838750.db2.gz IGVQSMDGTQGHOW-ZIFCJYIRSA-N 2 1 326.459 4.387 20 0 EIADMP CC(C)OCC[NH+]1CCC([NH2+][C@@H](C)c2ccc3ccccc3c2)CC1 ZINC000177485859 1042839181 /nfs/dbraw/zinc/83/91/81/1042839181.db2.gz WHJHEKHBMJJRGU-SFHVURJKSA-N 2 1 340.511 4.380 20 0 EIADMP Cc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC000310522232 1042839357 /nfs/dbraw/zinc/83/93/57/1042839357.db2.gz NVJWGIYVOVMALP-YLJYHZDGSA-N 2 1 326.459 4.134 20 0 EIADMP FC1(F)CCC[C@H](C[NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000311007381 1042849893 /nfs/dbraw/zinc/84/98/93/1042849893.db2.gz WOYAWOMPCPZDHJ-LWYYNNOASA-N 2 1 348.481 4.312 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2cc[nH]c21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311064202 1042852225 /nfs/dbraw/zinc/85/22/25/1042852225.db2.gz JCQRFOBBWYZVPE-UTKZUKDTSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H]([NH2+]Cc1coc2ccccc12)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311129922 1042853907 /nfs/dbraw/zinc/85/39/07/1042853907.db2.gz WJBKMGOAOKRSBJ-IEBWSBKVSA-N 2 1 334.463 4.433 20 0 EIADMP CCCOc1cccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000311221587 1042855385 /nfs/dbraw/zinc/85/53/85/1042855385.db2.gz VGIXUEVRUDCTMN-NRFANRHFSA-N 2 1 338.495 4.087 20 0 EIADMP c1cc(C[NH+]2CCCCC2)ccc1C[N@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000520575621 1042899427 /nfs/dbraw/zinc/89/94/27/1042899427.db2.gz WNIPTQWPYKYQRX-YADHBBJMSA-N 2 1 342.527 4.064 20 0 EIADMP CC(C)Oc1ccc(CN2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1Cl ZINC000493367850 1042900511 /nfs/dbraw/zinc/90/05/11/1042900511.db2.gz WBMFYIWTMYBVTO-AEFFLSMTSA-N 2 1 336.907 4.043 20 0 EIADMP C[C@H]1CC([NH2+]Cc2cccc(F)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168005030 1042954379 /nfs/dbraw/zinc/95/43/79/1042954379.db2.gz DZAJJHRMXAMKMU-IRXDYDNUSA-N 2 1 326.459 4.357 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)CCO1 ZINC000507791857 1042974272 /nfs/dbraw/zinc/97/42/72/1042974272.db2.gz DEELGINHOSLZLF-HMXCVIKNSA-N 2 1 336.564 4.168 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)[C@@H](OC)c2ccccc2)c1 ZINC000493905182 1042974612 /nfs/dbraw/zinc/97/46/12/1042974612.db2.gz HBVMIRPPKPMYKF-LAUBAEHRSA-N 2 1 326.484 4.004 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C2Cc3ccccc3C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168006363 1043000102 /nfs/dbraw/zinc/00/01/02/1043000102.db2.gz NONMJRSHUDZXQQ-OPMZPASUSA-N 2 1 334.507 4.185 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccnc(Cl)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168006941 1043010879 /nfs/dbraw/zinc/01/08/79/1043010879.db2.gz PSHGUCPCZMUBCZ-HGKCTWBKSA-N 2 1 343.902 4.266 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccnc(Cl)c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168006941 1043010885 /nfs/dbraw/zinc/01/08/85/1043010885.db2.gz PSHGUCPCZMUBCZ-HGKCTWBKSA-N 2 1 343.902 4.266 20 0 EIADMP Cc1nc2ccc(C[NH2+]C[C@@H]3CCC[N@H+](CC(C)C)C3)cc2s1 ZINC000494170650 1043025627 /nfs/dbraw/zinc/02/56/27/1043025627.db2.gz FITQWQQODNXEGF-KRWDZBQOSA-N 2 1 331.529 4.062 20 0 EIADMP CC[C@@H]1C[C@H](C[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813142 1043056852 /nfs/dbraw/zinc/05/68/52/1043056852.db2.gz JDTJNAOBNBVIIP-BDKRGJGYSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813142 1043056864 /nfs/dbraw/zinc/05/68/64/1043056864.db2.gz JDTJNAOBNBVIIP-BDKRGJGYSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813142 1043056874 /nfs/dbraw/zinc/05/68/74/1043056874.db2.gz JDTJNAOBNBVIIP-BDKRGJGYSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813142 1043056888 /nfs/dbraw/zinc/05/68/88/1043056888.db2.gz JDTJNAOBNBVIIP-BDKRGJGYSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813142 1043056900 /nfs/dbraw/zinc/05/69/00/1043056900.db2.gz JDTJNAOBNBVIIP-BDKRGJGYSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813147 1043057483 /nfs/dbraw/zinc/05/74/83/1043057483.db2.gz JDTJNAOBNBVIIP-ZHHKINOHSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813147 1043057491 /nfs/dbraw/zinc/05/74/91/1043057491.db2.gz JDTJNAOBNBVIIP-ZHHKINOHSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813147 1043057496 /nfs/dbraw/zinc/05/74/96/1043057496.db2.gz JDTJNAOBNBVIIP-ZHHKINOHSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813147 1043057508 /nfs/dbraw/zinc/05/75/08/1043057508.db2.gz JDTJNAOBNBVIIP-ZHHKINOHSA-N 2 1 344.543 4.177 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813147 1043057520 /nfs/dbraw/zinc/05/75/20/1043057520.db2.gz JDTJNAOBNBVIIP-ZHHKINOHSA-N 2 1 344.543 4.177 20 0 EIADMP Cc1cnc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)cn1 ZINC000427837927 1043232282 /nfs/dbraw/zinc/23/22/82/1043232282.db2.gz AOBPAXNUMZCXQF-SFHVURJKSA-N 2 1 338.499 4.012 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CC[C@@H]3CCCC[N@@H+]3C)oc21 ZINC000543518913 1043236006 /nfs/dbraw/zinc/23/60/06/1043236006.db2.gz SSAQEGDKPNAMNN-WBVHZDCISA-N 2 1 330.472 4.357 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CC[C@@H]3CCCC[N@H+]3C)oc21 ZINC000543518913 1043236014 /nfs/dbraw/zinc/23/60/14/1043236014.db2.gz SSAQEGDKPNAMNN-WBVHZDCISA-N 2 1 330.472 4.357 20 0 EIADMP CCSc1cc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)ccn1 ZINC000427885460 1043250306 /nfs/dbraw/zinc/25/03/06/1043250306.db2.gz MDTGMMPZMZJPIS-APWZRJJASA-N 2 1 347.572 4.326 20 0 EIADMP c1c[nH]c([C@H]2CCC[NH+]2CCCCC[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000077266677 1043272471 /nfs/dbraw/zinc/27/24/71/1043272471.db2.gz GYDGRFNBCFSBRP-NHCUHLMSSA-N 2 1 340.515 4.487 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCc2cccs2)CC1 ZINC000727759006 1043284496 /nfs/dbraw/zinc/28/44/96/1043284496.db2.gz LZRNUVXORPRGSV-UHFFFAOYSA-N 2 1 328.525 4.135 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C1CCSCC1 ZINC000187283862 1043337742 /nfs/dbraw/zinc/33/77/42/1043337742.db2.gz QYYNBDUVRHHSTB-FUHIMQAGSA-N 2 1 332.557 4.161 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C1CCSCC1 ZINC000187283862 1043337759 /nfs/dbraw/zinc/33/77/59/1043337759.db2.gz QYYNBDUVRHHSTB-FUHIMQAGSA-N 2 1 332.557 4.161 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)cc1 ZINC000665269586 1043450540 /nfs/dbraw/zinc/45/05/40/1043450540.db2.gz IZPQQJKBKBMCLQ-SZNDQCEHSA-N 2 1 332.451 4.101 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCc3cc(N)ccc32)CC1 ZINC000665270988 1043458637 /nfs/dbraw/zinc/45/86/37/1043458637.db2.gz DVDQJNOFZCGRAK-YDPRHXJPSA-N 2 1 349.522 4.289 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467363820 1043577659 /nfs/dbraw/zinc/57/76/59/1043577659.db2.gz GBQFDCAWLNURDZ-RTBURBONSA-N 2 1 340.515 4.035 20 0 EIADMP CCCCc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC000765972580 1043603487 /nfs/dbraw/zinc/60/34/87/1043603487.db2.gz BCXNEPZXYKOBRM-PGRDOPGGSA-N 2 1 344.543 4.323 20 0 EIADMP C[N@@H+]1CCC[C@H]1CC[NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000543051644 1043684423 /nfs/dbraw/zinc/68/44/23/1043684423.db2.gz JMVASEPCPSWSLN-ICSRJNTNSA-N 2 1 343.902 4.093 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000543051644 1043684426 /nfs/dbraw/zinc/68/44/26/1043684426.db2.gz JMVASEPCPSWSLN-ICSRJNTNSA-N 2 1 343.902 4.093 20 0 EIADMP CC[NH+](CC)CC1CC[NH+](Cc2csc(CCC(C)C)n2)CC1 ZINC000521327424 1043702792 /nfs/dbraw/zinc/70/27/92/1043702792.db2.gz JVXPKJMHKUSBBH-UHFFFAOYSA-N 2 1 337.577 4.286 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]CC[C@@H](C)[NH+]3CCCCC3)oc21 ZINC000542486725 1043722311 /nfs/dbraw/zinc/72/23/11/1043722311.db2.gz LIVBICOCDLPYNU-CVEARBPZSA-N 2 1 330.472 4.357 20 0 EIADMP COCCC[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000442633206 1043773848 /nfs/dbraw/zinc/77/38/48/1043773848.db2.gz CDGXCWBEZAATNH-PXNSSMCTSA-N 2 1 336.495 4.148 20 0 EIADMP COCCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000521477541 1043786951 /nfs/dbraw/zinc/78/69/51/1043786951.db2.gz RLFSCTLNDBHCCU-YPAWHYETSA-N 2 1 344.543 4.084 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCc2ccccc21 ZINC000682076071 1043803224 /nfs/dbraw/zinc/80/32/24/1043803224.db2.gz JPVHBZXIFBBPNS-QFIPXVFZSA-N 2 1 335.495 4.307 20 0 EIADMP C[NH+](C)[C@H](C[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)C1CC1 ZINC000442711332 1043815739 /nfs/dbraw/zinc/81/57/39/1043815739.db2.gz DQVPWBLFJQOHAS-RYQLBKOJSA-N 2 1 340.433 4.271 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000191550227 1043825900 /nfs/dbraw/zinc/82/59/00/1043825900.db2.gz VFIVEOUOCMHTAC-IAGOWNOFSA-N 2 1 340.433 4.199 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2Cc3[nH]c4ccccc4c3C2)c1 ZINC000442773801 1043830898 /nfs/dbraw/zinc/83/08/98/1043830898.db2.gz DBJRVCXUTIOIOU-LJQANCHMSA-N 2 1 347.506 4.265 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H](COc2ccccc2)c2ccccc2)CC1 ZINC000543106608 1043850944 /nfs/dbraw/zinc/85/09/44/1043850944.db2.gz BVSMASXMPQEKND-JOCHJYFZSA-N 2 1 338.495 4.269 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1ccnn1-c1ccccc1)C(C)C ZINC000467383899 1043885928 /nfs/dbraw/zinc/88/59/28/1043885928.db2.gz GXLBUYBVWGRMIN-GOSISDBHSA-N 2 1 328.504 4.032 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2ccccc2n1 ZINC000195138748 1044026409 /nfs/dbraw/zinc/02/64/09/1044026409.db2.gz DQALDPSPLPZFMJ-AZUAARDMSA-N 2 1 345.490 4.408 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc2ccccc2n1 ZINC000195138748 1044026434 /nfs/dbraw/zinc/02/64/34/1044026434.db2.gz DQALDPSPLPZFMJ-AZUAARDMSA-N 2 1 345.490 4.408 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc2ccccc2n1 ZINC000195138760 1044027026 /nfs/dbraw/zinc/02/70/26/1044027026.db2.gz DQALDPSPLPZFMJ-UYAOXDASSA-N 2 1 345.490 4.408 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc2ccccc2n1 ZINC000195138760 1044027043 /nfs/dbraw/zinc/02/70/43/1044027043.db2.gz DQALDPSPLPZFMJ-UYAOXDASSA-N 2 1 345.490 4.408 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCc1c(F)cccc1Cl ZINC000429244500 1044071582 /nfs/dbraw/zinc/07/15/82/1044071582.db2.gz LCZKAGIIJFJDLY-UHFFFAOYSA-N 2 1 337.870 4.193 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCc1c(F)cccc1Cl ZINC000429244500 1044071600 /nfs/dbraw/zinc/07/16/00/1044071600.db2.gz LCZKAGIIJFJDLY-UHFFFAOYSA-N 2 1 337.870 4.193 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(Cl)ccc1O ZINC000186518100 1044165059 /nfs/dbraw/zinc/16/50/59/1044165059.db2.gz IGAVCYDGDUFXDE-SOUVJXGZSA-N 2 1 336.907 4.349 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3c4ccccc4[nH]c32)C1 ZINC000675728295 1044460355 /nfs/dbraw/zinc/46/03/55/1044460355.db2.gz FVLGTTIIQYEYGU-UZLBHIALSA-N 2 1 325.500 4.255 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCc2c1ccc(Cl)c2Cl ZINC000675817272 1044514610 /nfs/dbraw/zinc/51/46/10/1044514610.db2.gz ULLDFHUHNVPPDL-ZBEGNZNMSA-N 2 1 338.282 4.412 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCc3ccc(C(F)(F)F)cc3)CC[C@H]21 ZINC000675897597 1044543013 /nfs/dbraw/zinc/54/30/13/1044543013.db2.gz HEQAPAHQZUHIOA-FUHWJXTLSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCc3ccc(C(F)(F)F)cc3)CC[C@H]21 ZINC000675897597 1044543024 /nfs/dbraw/zinc/54/30/24/1044543024.db2.gz HEQAPAHQZUHIOA-FUHWJXTLSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCc3ccc(C(F)(F)F)cc3)CC[C@H]21 ZINC000675897597 1044543033 /nfs/dbraw/zinc/54/30/33/1044543033.db2.gz HEQAPAHQZUHIOA-FUHWJXTLSA-N 2 1 340.433 4.054 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CC[C@H](c2cc(C)cc(C)c2)C1 ZINC000543412782 1044556003 /nfs/dbraw/zinc/55/60/03/1044556003.db2.gz OAVUYJDJTGYWTG-IBGZPJMESA-N 2 1 346.478 4.182 20 0 EIADMP c1ccc(C[C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000480753802 1044582398 /nfs/dbraw/zinc/58/23/98/1044582398.db2.gz BUMSKTPRWUPYRM-SIKLNZKXSA-N 2 1 326.528 4.252 20 0 EIADMP Cc1ccccc1[C@H]([NH2+]CCc1c[nH+]cn1C)[C@@H]1CCC[C@H](C)C1 ZINC001168724427 1044597838 /nfs/dbraw/zinc/59/78/38/1044597838.db2.gz WCBBJAYPNAXICG-YRISNDGFSA-N 2 1 325.500 4.428 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2C)C1 ZINC000443644183 1044598787 /nfs/dbraw/zinc/59/87/87/1044598787.db2.gz UGHNSSSAVHEWRQ-HNNXBMFYSA-N 2 1 328.422 4.178 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@H]1C ZINC000443650241 1044622352 /nfs/dbraw/zinc/62/23/52/1044622352.db2.gz CNRDIWCSZUYYLO-PBHICJAKSA-N 2 1 328.422 4.318 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@H]1C ZINC000443650241 1044622365 /nfs/dbraw/zinc/62/23/65/1044622365.db2.gz CNRDIWCSZUYYLO-PBHICJAKSA-N 2 1 328.422 4.318 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@H]1C ZINC000443650241 1044622376 /nfs/dbraw/zinc/62/23/76/1044622376.db2.gz CNRDIWCSZUYYLO-PBHICJAKSA-N 2 1 328.422 4.318 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000443658961 1044648205 /nfs/dbraw/zinc/64/82/05/1044648205.db2.gz OMWAELMAUFEAQA-WMLDXEAASA-N 2 1 328.422 4.176 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000443658961 1044648219 /nfs/dbraw/zinc/64/82/19/1044648219.db2.gz OMWAELMAUFEAQA-WMLDXEAASA-N 2 1 328.422 4.176 20 0 EIADMP Cc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)oc1C ZINC000282358325 1044685603 /nfs/dbraw/zinc/68/56/03/1044685603.db2.gz VZZQRQURFVARHI-HNNXBMFYSA-N 2 1 345.487 4.064 20 0 EIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000522383985 1044688628 /nfs/dbraw/zinc/68/86/28/1044688628.db2.gz WXEYBUQDGYNCOJ-OAHLLOKOSA-N 2 1 348.437 4.435 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)C1 ZINC000522383985 1044688642 /nfs/dbraw/zinc/68/86/42/1044688642.db2.gz WXEYBUQDGYNCOJ-OAHLLOKOSA-N 2 1 348.437 4.435 20 0 EIADMP FC1(F)CCC[NH+](CCCCC[N@@H+]2CCCC(F)(F)CC2)CC1 ZINC000625769167 1044867232 /nfs/dbraw/zinc/86/72/32/1044867232.db2.gz DDSCLBWNQNSESE-UHFFFAOYSA-N 2 1 338.433 4.399 20 0 EIADMP Fc1ccccc1C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000191692350 1044909698 /nfs/dbraw/zinc/90/96/98/1044909698.db2.gz MMVIOGWRHDDVQC-QFIPXVFZSA-N 2 1 338.470 4.326 20 0 EIADMP Fc1ccccc1C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000191693382 1044915954 /nfs/dbraw/zinc/91/59/54/1044915954.db2.gz QZVQIMHCSYXDAF-JTSKRJEESA-N 2 1 338.470 4.183 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@H]3CCSC4(CCC4)C3)CC2)cc1 ZINC000922840787 1044985249 /nfs/dbraw/zinc/98/52/49/1044985249.db2.gz SURCPBTWUXIYJS-FQEVSTJZSA-N 2 1 344.568 4.101 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cn2ccc(-c3ccsc3)n2)CC1 ZINC000738067225 1045033780 /nfs/dbraw/zinc/03/37/80/1045033780.db2.gz IIFGKFNWMPYSLJ-UHFFFAOYSA-N 2 1 346.544 4.013 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CC[C@H](C[NH3+])[C@H](C)C2)oc1-c1ccc(Cl)cc1 ZINC000923494883 1045134939 /nfs/dbraw/zinc/13/49/39/1045134939.db2.gz PYRMSXMOXSPFOQ-IVMMDQJWSA-N 2 1 347.890 4.281 20 0 EIADMP c1c2ccccc2oc1C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000394047263 1045143968 /nfs/dbraw/zinc/14/39/68/1045143968.db2.gz JYYUGAVRDYJDBG-IBGZPJMESA-N 2 1 334.463 4.435 20 0 EIADMP c1c2ccccc2oc1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000394047263 1045143980 /nfs/dbraw/zinc/14/39/80/1045143980.db2.gz JYYUGAVRDYJDBG-IBGZPJMESA-N 2 1 334.463 4.435 20 0 EIADMP C[C@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)c1ccc2ccccc2c1 ZINC000495483850 1045149310 /nfs/dbraw/zinc/14/93/10/1045149310.db2.gz BCAPFDQQBBLEFR-SFHVURJKSA-N 2 1 338.495 4.135 20 0 EIADMP CC[N@H+]1CC[C@H](N[C@H]2CCOc3c(Cl)c(Cl)ccc32)[C@@H](C)C1 ZINC000766259413 1045250795 /nfs/dbraw/zinc/25/07/95/1045250795.db2.gz YLSAAUYOGXAUSR-CQDKDKBSSA-N 2 1 343.298 4.137 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000495728076 1045316548 /nfs/dbraw/zinc/31/65/48/1045316548.db2.gz WCUDFFWKQFZUEQ-JKSUJKDBSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc(F)cc1 ZINC000495728076 1045316554 /nfs/dbraw/zinc/31/65/54/1045316554.db2.gz WCUDFFWKQFZUEQ-JKSUJKDBSA-N 2 1 332.488 4.450 20 0 EIADMP CCCOc1c(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cccc1OCC ZINC000237002527 1045373784 /nfs/dbraw/zinc/37/37/84/1045373784.db2.gz OKULLWYLGWEMDE-UHFFFAOYSA-N 2 1 348.531 4.273 20 0 EIADMP CCCCCCOc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000915681646 1045446573 /nfs/dbraw/zinc/44/65/73/1045446573.db2.gz FMOHFPITTWQQBT-WOJBJXKFSA-N 2 1 330.516 4.362 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001168498141 1045454807 /nfs/dbraw/zinc/45/48/07/1045454807.db2.gz QTXMWMNPGDULOT-NQIIRXRSSA-N 2 1 340.486 4.211 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001168498141 1045454811 /nfs/dbraw/zinc/45/48/11/1045454811.db2.gz QTXMWMNPGDULOT-NQIIRXRSSA-N 2 1 340.486 4.211 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001168498141 1045454812 /nfs/dbraw/zinc/45/48/12/1045454812.db2.gz QTXMWMNPGDULOT-NQIIRXRSSA-N 2 1 340.486 4.211 20 0 EIADMP c1ccc(Sc2ccc(C[NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)cc2)cc1 ZINC000533607795 1045649001 /nfs/dbraw/zinc/64/90/01/1045649001.db2.gz CIRJATGWKMDJSE-SFHVURJKSA-N 2 1 338.520 4.412 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc2c(c1)CCCO2 ZINC000768101095 1045715464 /nfs/dbraw/zinc/71/54/64/1045715464.db2.gz HISCZRPDWNOOSY-FXAWDEMLSA-N 2 1 330.516 4.173 20 0 EIADMP COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768207020 1045743064 /nfs/dbraw/zinc/74/30/64/1045743064.db2.gz NZDNYJHZSPJBJJ-UHFFFAOYSA-N 2 1 332.875 4.042 20 0 EIADMP C[C@H]1CC[C@@H]([NH+]2CCC([NH2+]Cc3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170156947 1045780476 /nfs/dbraw/zinc/78/04/76/1045780476.db2.gz IRFWZRNFGWTUSD-KBXCAEBGSA-N 2 1 340.433 4.448 20 0 EIADMP CC[C@@H]1C[C@@H]([N@@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170188950 1045920855 /nfs/dbraw/zinc/92/08/55/1045920855.db2.gz ABUPYMWCKAGVFT-XSDIEEQYSA-N 2 1 330.516 4.025 20 0 EIADMP FC1(F)CCCC[C@@H]1C[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170206010 1045926647 /nfs/dbraw/zinc/92/66/47/1045926647.db2.gz QGMUZIFQPJXYFS-UXHICEINSA-N 2 1 348.481 4.410 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001170206010 1045926656 /nfs/dbraw/zinc/92/66/56/1045926656.db2.gz QGMUZIFQPJXYFS-UXHICEINSA-N 2 1 348.481 4.410 20 0 EIADMP FC1(F)CCCC[C@@H]1C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001170206010 1045926670 /nfs/dbraw/zinc/92/66/70/1045926670.db2.gz QGMUZIFQPJXYFS-UXHICEINSA-N 2 1 348.481 4.410 20 0 EIADMP C[C@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(c2ccccc2F)CC1 ZINC001170260301 1045959873 /nfs/dbraw/zinc/95/98/73/1045959873.db2.gz HQVHYASNGXHDPM-OAHLLOKOSA-N 2 1 346.877 4.360 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(SC(F)(F)F)cc2)CC[N@@H+]1C ZINC000769484502 1045972171 /nfs/dbraw/zinc/97/21/71/1045972171.db2.gz KPBUZWKDBOLFDI-GXTWGEPZSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(SC(F)(F)F)cc2)CC[NH+]1C ZINC000769484502 1045972220 /nfs/dbraw/zinc/97/22/20/1045972220.db2.gz KPBUZWKDBOLFDI-GXTWGEPZSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(SC(F)(F)F)cc2)CC[N@H+]1C ZINC000769484502 1045972190 /nfs/dbraw/zinc/97/21/90/1045972190.db2.gz KPBUZWKDBOLFDI-GXTWGEPZSA-N 2 1 332.435 4.213 20 0 EIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(SC(F)(F)F)cc2)CC[NH+]1C ZINC000769484502 1045972231 /nfs/dbraw/zinc/97/22/31/1045972231.db2.gz KPBUZWKDBOLFDI-GXTWGEPZSA-N 2 1 332.435 4.213 20 0 EIADMP c1cc2c[nH+]cc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)c2[nH]1 ZINC001170333249 1046005078 /nfs/dbraw/zinc/00/50/78/1046005078.db2.gz LMTYKCVBFPBEQS-LDLYASANSA-N 2 1 332.451 4.170 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc3c[nH]nc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000124056052 1046213650 /nfs/dbraw/zinc/21/36/50/1046213650.db2.gz NFIPLXHZFKSXIP-DYESRHJHSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc3c[nH]nc3c2)CC[N@H+]1Cc1ccccc1 ZINC000124056052 1046213666 /nfs/dbraw/zinc/21/36/66/1046213666.db2.gz NFIPLXHZFKSXIP-DYESRHJHSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc3c[nH]nc3c2)CC[NH+]1Cc1ccccc1 ZINC000124056052 1046213680 /nfs/dbraw/zinc/21/36/80/1046213680.db2.gz NFIPLXHZFKSXIP-DYESRHJHSA-N 2 1 348.494 4.048 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc3c[nH]nc3c2)CC[NH+]1Cc1ccccc1 ZINC000124056052 1046213693 /nfs/dbraw/zinc/21/36/93/1046213693.db2.gz NFIPLXHZFKSXIP-DYESRHJHSA-N 2 1 348.494 4.048 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cccnc2Cl)CC1)CC1CC1 ZINC000770597240 1046234229 /nfs/dbraw/zinc/23/42/29/1046234229.db2.gz MCDJIFZXIAVQLT-UHFFFAOYSA-N 2 1 335.923 4.069 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc3c(c2)COC3)CC1)CC1CC1 ZINC000770597875 1046234716 /nfs/dbraw/zinc/23/47/16/1046234716.db2.gz QVFKXMNCPWAVKU-UHFFFAOYSA-N 2 1 342.527 4.051 20 0 EIADMP Cc1[nH+]ccc(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1Cl ZINC000497251759 1046518071 /nfs/dbraw/zinc/51/80/71/1046518071.db2.gz ZWHMYUZBWDUWEV-SUMWQHHRSA-N 2 1 335.904 4.022 20 0 EIADMP CC[C@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C1CCCCC1 ZINC000162789073 1046522013 /nfs/dbraw/zinc/52/20/13/1046522013.db2.gz CXHMYIGBACRFHI-FQEVSTJZSA-N 2 1 347.547 4.452 20 0 EIADMP C[NH+](C)Cc1c(F)cc(NC2CC(C)(C)[NH+](C)C(C)(C)C2)cc1F ZINC001170454397 1046544280 /nfs/dbraw/zinc/54/42/80/1046544280.db2.gz QZQLCDQRUILIJJ-UHFFFAOYSA-N 2 1 339.474 4.090 20 0 EIADMP CCCCOc1cc(C[N@@H+](C)[C@H]2CC[NH+](CC)C[C@H]2C)ccc1OC ZINC000536658860 1046624239 /nfs/dbraw/zinc/62/42/39/1046624239.db2.gz PPTKFBNCRVCPAE-MJGOQNOKSA-N 2 1 348.531 4.036 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@H](C)C1 ZINC000536660001 1046626058 /nfs/dbraw/zinc/62/60/58/1046626058.db2.gz SASDIZZBPCSPCK-NVXWUHKLSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@H](C)C1 ZINC000536660001 1046626073 /nfs/dbraw/zinc/62/60/73/1046626073.db2.gz SASDIZZBPCSPCK-NVXWUHKLSA-N 2 1 340.458 4.067 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@H](C)C1 ZINC000536660001 1046626080 /nfs/dbraw/zinc/62/60/80/1046626080.db2.gz SASDIZZBPCSPCK-NVXWUHKLSA-N 2 1 340.458 4.067 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[N@@H+]1C ZINC000536660055 1046628841 /nfs/dbraw/zinc/62/88/41/1046628841.db2.gz VCRMDIHVFPCHCQ-YOEHRIQHSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[N@H+]1C ZINC000536660055 1046628854 /nfs/dbraw/zinc/62/88/54/1046628854.db2.gz VCRMDIHVFPCHCQ-YOEHRIQHSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[NH+]1C ZINC000536660055 1046628862 /nfs/dbraw/zinc/62/88/62/1046628862.db2.gz VCRMDIHVFPCHCQ-YOEHRIQHSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3cccc(F)c3)s2)CC[NH+]1C ZINC000536660055 1046628866 /nfs/dbraw/zinc/62/88/66/1046628866.db2.gz VCRMDIHVFPCHCQ-YOEHRIQHSA-N 2 1 332.488 4.469 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cc(C)c(C)cc2OC(F)F)C[C@H]1C ZINC000536662081 1046631025 /nfs/dbraw/zinc/63/10/25/1046631025.db2.gz NSCXMZUIAFZNCO-NVXWUHKLSA-N 2 1 340.458 4.209 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)c1cccc(Br)c1 ZINC000127321778 1046648483 /nfs/dbraw/zinc/64/84/83/1046648483.db2.gz ZDRIGNCSAIXETF-ZDUSSCGKSA-N 2 1 336.277 4.037 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1cccc(Br)c1 ZINC000127321778 1046648502 /nfs/dbraw/zinc/64/85/02/1046648502.db2.gz ZDRIGNCSAIXETF-ZDUSSCGKSA-N 2 1 336.277 4.037 20 0 EIADMP c1ccc(C[C@H](C[NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000459435876 1046669449 /nfs/dbraw/zinc/66/94/49/1046669449.db2.gz XNZWQLMXCXHEID-OAQYLSRUSA-N 2 1 334.507 4.229 20 0 EIADMP C[C@H](CC[NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000459444186 1046674956 /nfs/dbraw/zinc/67/49/56/1046674956.db2.gz REPHXYIOJSVNGY-CQSZACIVSA-N 2 1 340.433 4.415 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)[C@H](C)C1 ZINC000536682261 1046684570 /nfs/dbraw/zinc/68/45/70/1046684570.db2.gz BJCDJJXDORATLU-IERDGZPVSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc3cc(OC)ccc3c2)[C@H](C)C1 ZINC000536682261 1046684571 /nfs/dbraw/zinc/68/45/71/1046684571.db2.gz BJCDJJXDORATLU-IERDGZPVSA-N 2 1 326.484 4.011 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc3cc(OC)ccc3c2)[C@H](C)C1 ZINC000536682261 1046684575 /nfs/dbraw/zinc/68/45/75/1046684575.db2.gz BJCDJJXDORATLU-IERDGZPVSA-N 2 1 326.484 4.011 20 0 EIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000536695093 1046687682 /nfs/dbraw/zinc/68/76/82/1046687682.db2.gz LUOZRHBJUTXIFD-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000536695093 1046687689 /nfs/dbraw/zinc/68/76/89/1046687689.db2.gz LUOZRHBJUTXIFD-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000536695093 1046687692 /nfs/dbraw/zinc/68/76/92/1046687692.db2.gz LUOZRHBJUTXIFD-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000536695093 1046687699 /nfs/dbraw/zinc/68/76/99/1046687699.db2.gz LUOZRHBJUTXIFD-HNNXBMFYSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2c(OC)ccc3ccccc32)C1 ZINC000536697293 1046694582 /nfs/dbraw/zinc/69/45/82/1046694582.db2.gz OLWWFHGSSIAAOT-KRWDZBQOSA-N 2 1 326.484 4.012 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000127612782 1046706868 /nfs/dbraw/zinc/70/68/68/1046706868.db2.gz QVHCJBFDKYHHOO-QGZVFWFLSA-N 2 1 347.890 4.026 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000127612782 1046706884 /nfs/dbraw/zinc/70/68/84/1046706884.db2.gz QVHCJBFDKYHHOO-QGZVFWFLSA-N 2 1 347.890 4.026 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cc(F)ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000379644802 1046738960 /nfs/dbraw/zinc/73/89/60/1046738960.db2.gz CPYLNOWWZTYXQS-BUVFEPMLSA-N 2 1 338.470 4.456 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cc(F)ccc32)CC[N@H+]1Cc1ccccc1 ZINC000379644802 1046738980 /nfs/dbraw/zinc/73/89/80/1046738980.db2.gz CPYLNOWWZTYXQS-BUVFEPMLSA-N 2 1 338.470 4.456 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CCc4cc(Cl)ccc43)CC2)[nH+]1 ZINC000128219376 1046783058 /nfs/dbraw/zinc/78/30/58/1046783058.db2.gz GIRKWVSHERXPNT-LJQANCHMSA-N 2 1 341.886 4.289 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000536832779 1046809380 /nfs/dbraw/zinc/80/93/80/1046809380.db2.gz NDZRRNFYLCXKLR-UYAOXDASSA-N 2 1 342.527 4.391 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)C1 ZINC000536832779 1046809382 /nfs/dbraw/zinc/80/93/82/1046809382.db2.gz NDZRRNFYLCXKLR-UYAOXDASSA-N 2 1 342.527 4.391 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000536859834 1046828047 /nfs/dbraw/zinc/82/80/47/1046828047.db2.gz WTZMNZPRZCTSPG-NIKGAXFTSA-N 2 1 331.891 4.407 20 0 EIADMP COc1ccc([C@@H]([NH2+]CCCC[N@H+]2CCCC[C@@H]2C)C2CC2)cc1 ZINC000536947129 1046877394 /nfs/dbraw/zinc/87/73/94/1046877394.db2.gz KCKJLLIOMZRTIG-UWJYYQICSA-N 2 1 330.516 4.391 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2nc(Cl)ccc21 ZINC000806131037 1047155763 /nfs/dbraw/zinc/15/57/63/1047155763.db2.gz FPYYJZKDYWFBBI-SFHVURJKSA-N 2 1 343.902 4.352 20 0 EIADMP COc1cccc2c1CC[C@@H]2[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556103678 1047454497 /nfs/dbraw/zinc/45/44/97/1047454497.db2.gz ULFRTTDSRNYXDU-YYWHXJBOSA-N 2 1 336.479 4.108 20 0 EIADMP COc1cccc2c1CC[C@@H]2[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556103678 1047454502 /nfs/dbraw/zinc/45/45/02/1047454502.db2.gz ULFRTTDSRNYXDU-YYWHXJBOSA-N 2 1 336.479 4.108 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170120360 1047476794 /nfs/dbraw/zinc/47/67/94/1047476794.db2.gz GBMJJHJTIQBRRH-CZUORRHYSA-N 2 1 326.406 4.144 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCc2cc(F)c(F)c(F)c2)C[C@H]1c1ccccc1 ZINC000556167963 1047524226 /nfs/dbraw/zinc/52/42/26/1047524226.db2.gz ZLJOYEUSEKNBJO-APWZRJJASA-N 2 1 348.412 4.072 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2cc(F)c(F)c(F)c2)C[C@H]1c1ccccc1 ZINC000556167963 1047524238 /nfs/dbraw/zinc/52/42/38/1047524238.db2.gz ZLJOYEUSEKNBJO-APWZRJJASA-N 2 1 348.412 4.072 20 0 EIADMP FC1(F)CC[C@H](CC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000898016710 1047530924 /nfs/dbraw/zinc/53/09/24/1047530924.db2.gz ATVYBJXUSTVZET-GOSISDBHSA-N 2 1 336.470 4.109 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)C[C@H]1c1ccccc1 ZINC000556178414 1047540608 /nfs/dbraw/zinc/54/06/08/1047540608.db2.gz GWLLOFHRLCQYFN-UNMCSNQZSA-N 2 1 333.479 4.136 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)C[C@H]1c1ccccc1 ZINC000556178414 1047540632 /nfs/dbraw/zinc/54/06/32/1047540632.db2.gz GWLLOFHRLCQYFN-UNMCSNQZSA-N 2 1 333.479 4.136 20 0 EIADMP Cc1cccnc1C(C)(C)C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556195250 1047556455 /nfs/dbraw/zinc/55/64/55/1047556455.db2.gz UGFIPPFCMRIORP-UXHICEINSA-N 2 1 337.511 4.093 20 0 EIADMP Cc1cccnc1C(C)(C)C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556195250 1047556479 /nfs/dbraw/zinc/55/64/79/1047556479.db2.gz UGFIPPFCMRIORP-UXHICEINSA-N 2 1 337.511 4.093 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+][C@@H](c3ccncc3)C3CC3)CC23CC3)cc1 ZINC000898319173 1047621403 /nfs/dbraw/zinc/62/14/03/1047621403.db2.gz AGVIOLJACPGLIP-FGZHOGPDSA-N 2 1 347.506 4.320 20 0 EIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+][C@@H](c3ccncc3)C3CC3)CC23CC3)cc1 ZINC000898319173 1047621414 /nfs/dbraw/zinc/62/14/14/1047621414.db2.gz AGVIOLJACPGLIP-FGZHOGPDSA-N 2 1 347.506 4.320 20 0 EIADMP CCc1cnc(CC[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)s1 ZINC000130287339 1047670231 /nfs/dbraw/zinc/67/02/31/1047670231.db2.gz SZXCFVSFCJGSIF-AWEZNQCLSA-N 2 1 340.496 4.093 20 0 EIADMP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc3nc[nH]c3c2)CC1 ZINC000550620039 1047763634 /nfs/dbraw/zinc/76/36/34/1047763634.db2.gz SVDQBPKJEFYNBU-UHFFFAOYSA-N 2 1 348.494 4.085 20 0 EIADMP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000556589895 1047835024 /nfs/dbraw/zinc/83/50/24/1047835024.db2.gz QPMLMMWPJMIJCC-ZCLUNYJNSA-N 2 1 330.516 4.041 20 0 EIADMP CC1([NH+]2CCCC2)CC[NH+]([C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171057375 1047872289 /nfs/dbraw/zinc/87/22/89/1047872289.db2.gz YLIIJZCSKYLSPB-KRWDZBQOSA-N 2 1 332.919 4.148 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc(-n3cccn3)c2)c1 ZINC000131350193 1047881437 /nfs/dbraw/zinc/88/14/37/1047881437.db2.gz LEVCQIJJXCYRRO-UHFFFAOYSA-N 2 1 348.494 4.002 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@]2(C)CC2(Cl)Cl)cc1 ZINC000824771218 1047924495 /nfs/dbraw/zinc/92/44/95/1047924495.db2.gz ACHWBVQJXDCZCS-MLGOLLRUSA-N 2 1 338.282 4.415 20 0 EIADMP CC1(C)[C@@H]2C[C@@H]([N@@H+](Cc3ccccc3F)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170741016 1047960342 /nfs/dbraw/zinc/96/03/42/1047960342.db2.gz XCQZCKOUSVONKL-LMZXCBKASA-N 2 1 330.491 4.332 20 0 EIADMP CC1(C)[C@@H]2C[C@H]([NH2+][C@@H]3CC[N@H+](Cc4ccccc4)CC3(C)C)C[C@@H]21 ZINC001170738863 1047971899 /nfs/dbraw/zinc/97/18/99/1047971899.db2.gz PUMGACMYGWQSJW-IYWMVGAKSA-N 2 1 326.528 4.311 20 0 EIADMP CC1(C)[C@@H]2C[C@H]([NH2+][C@@H]3CC[N@@H+](Cc4ccccc4)CC3(C)C)C[C@@H]21 ZINC001170738863 1047971906 /nfs/dbraw/zinc/97/19/06/1047971906.db2.gz PUMGACMYGWQSJW-IYWMVGAKSA-N 2 1 326.528 4.311 20 0 EIADMP Cc1ccc2c(C[N@H+](C)Cc3ccc(-n4ccnc4)cc3)c[nH]c2c1 ZINC001136975243 1048006134 /nfs/dbraw/zinc/00/61/34/1048006134.db2.gz BTAANORTCAAEFP-UHFFFAOYSA-N 2 1 330.435 4.294 20 0 EIADMP CC1(C)[C@@H]2C[C@H]([NH+]3CCC4(CC[N@@H+](Cc5ccoc5)C4)CC3)C[C@@H]21 ZINC001170749441 1048038214 /nfs/dbraw/zinc/03/82/14/1048038214.db2.gz FCGIZISTRNXDQF-REPLKXPHSA-N 2 1 328.500 4.002 20 0 EIADMP CC[N@H+](CCn1cc[nH+]c1C)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000499055367 1048132035 /nfs/dbraw/zinc/13/20/35/1048132035.db2.gz MRPWWZFQTFQOEI-NRFANRHFSA-N 2 1 337.442 4.442 20 0 EIADMP CC[N@@H+](CCn1cc[nH+]c1C)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000499055367 1048132054 /nfs/dbraw/zinc/13/20/54/1048132054.db2.gz MRPWWZFQTFQOEI-NRFANRHFSA-N 2 1 337.442 4.442 20 0 EIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170763696 1048159741 /nfs/dbraw/zinc/15/97/41/1048159741.db2.gz AXLRHIVEQJLEAN-ACDBMABISA-N 2 1 330.491 4.157 20 0 EIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170763696 1048159751 /nfs/dbraw/zinc/15/97/51/1048159751.db2.gz AXLRHIVEQJLEAN-ACDBMABISA-N 2 1 330.491 4.157 20 0 EIADMP C[N@H+](Cc1ccc(C(F)(F)F)c(Cl)c1)CC1CC[NH+](C)CC1 ZINC001143807613 1048201980 /nfs/dbraw/zinc/20/19/80/1048201980.db2.gz FVILTNBBHLTCKI-UHFFFAOYSA-N 2 1 334.813 4.132 20 0 EIADMP Cc1cccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000499149814 1048357358 /nfs/dbraw/zinc/35/73/58/1048357358.db2.gz UOESPUQAFULPBK-WBDAEOGXSA-N 2 1 334.507 4.323 20 0 EIADMP Oc1cccc2c1CC[C@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499153569 1048361883 /nfs/dbraw/zinc/36/18/83/1048361883.db2.gz RVFXRCBDDJZJFB-VQQMMKBISA-N 2 1 348.490 4.165 20 0 EIADMP CN(C)c1cccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000499154461 1048362989 /nfs/dbraw/zinc/36/29/89/1048362989.db2.gz UOSYCBJDBFUDCR-MUSUJDOFSA-N 2 1 349.522 4.038 20 0 EIADMP CCC[NH+](CCC)c1ccc(NCc2ncc(C[NH+](C)C)s2)cc1 ZINC000846057356 1048792974 /nfs/dbraw/zinc/79/29/74/1048792974.db2.gz LAOKRLOEIRZYBZ-UHFFFAOYSA-N 2 1 346.544 4.443 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@]2(C)C[C@@]2(F)Cl)CC[N@@H+]1Cc1ccccc1 ZINC000846030262 1048798353 /nfs/dbraw/zinc/79/83/53/1048798353.db2.gz ABCXSGPOCRZZHF-OWYHZJEWSA-N 2 1 338.898 4.334 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@]2(C)C[C@@]2(F)Cl)CC[N@H+]1Cc1ccccc1 ZINC000846030262 1048798368 /nfs/dbraw/zinc/79/83/68/1048798368.db2.gz ABCXSGPOCRZZHF-OWYHZJEWSA-N 2 1 338.898 4.334 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@@](C)(O)c2ccccc2)cc1 ZINC000846044253 1048803987 /nfs/dbraw/zinc/80/39/87/1048803987.db2.gz NTMNZXRLVRSWAG-PNLZDCPESA-N 2 1 349.478 4.128 20 0 EIADMP C[NH+]1CCC(C2CC[NH+](Cc3cc(F)c(F)cc3Cl)CC2)CC1 ZINC001144727179 1048825842 /nfs/dbraw/zinc/82/58/42/1048825842.db2.gz UMRYITHJUKBIGK-UHFFFAOYSA-N 2 1 342.861 4.172 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2cccs2)CC1 ZINC000134155801 1048888535 /nfs/dbraw/zinc/88/85/35/1048888535.db2.gz ZLEXLAPNQAVHKY-UHFFFAOYSA-N 2 1 346.544 4.082 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc3cc[nH]c32)CC[N@@H+]1Cc1ccccc1 ZINC000237695332 1048977061 /nfs/dbraw/zinc/97/70/61/1048977061.db2.gz JOSAJMPZFNWJTB-UWJYYQICSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc3cc[nH]c32)CC[N@H+]1Cc1ccccc1 ZINC000237695332 1048977078 /nfs/dbraw/zinc/97/70/78/1048977078.db2.gz JOSAJMPZFNWJTB-UWJYYQICSA-N 2 1 333.479 4.311 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911504 1049197412 /nfs/dbraw/zinc/19/74/12/1049197412.db2.gz XXXKVWWTYHVKKL-KZNAEPCWSA-N 2 1 332.919 4.179 20 0 EIADMP COc1ccc2c(NCc3cc(C)[nH+]c(N4CCCC4)c3)cc[nH+]c2c1 ZINC000811853464 1049300829 /nfs/dbraw/zinc/30/08/29/1049300829.db2.gz BMNQQMMIQARNQK-UHFFFAOYSA-N 2 1 348.450 4.159 20 0 EIADMP CC[C@@H]([NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C1CCOCC1 ZINC000348095363 1049413120 /nfs/dbraw/zinc/41/31/20/1049413120.db2.gz KZGFXGBEFLANCZ-FOIQADDNSA-N 2 1 327.472 4.037 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000136688071 1049500865 /nfs/dbraw/zinc/50/08/65/1049500865.db2.gz OIDHOQDDCPKWOA-HXUWFJFHSA-N 2 1 344.543 4.226 20 0 EIADMP Cc1cc(C[NH+](C)C)cc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1 ZINC000820836049 1049564900 /nfs/dbraw/zinc/56/49/00/1049564900.db2.gz IZFYUQIMOOCFGF-AVRDEDQJSA-N 2 1 337.511 4.132 20 0 EIADMP Cc1csc(C2([NH2+][C@@H](C)c3cccc(C[NH+](C)C)c3)CCC2)n1 ZINC000820835813 1049566501 /nfs/dbraw/zinc/56/65/01/1049566501.db2.gz GDMZVNBFLGBXIM-HNNXBMFYSA-N 2 1 329.513 4.243 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc3[nH]ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000080338893 1049579685 /nfs/dbraw/zinc/57/96/85/1049579685.db2.gz XORJODDTUXQPOY-PXNSSMCTSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2cccc3[nH]ccc32)CC[N@H+]1Cc1ccccc1 ZINC000080338893 1049579700 /nfs/dbraw/zinc/57/97/00/1049579700.db2.gz XORJODDTUXQPOY-PXNSSMCTSA-N 2 1 333.479 4.311 20 0 EIADMP CC(C)(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2c(F)cccc2C1 ZINC001171414304 1049647602 /nfs/dbraw/zinc/64/76/02/1049647602.db2.gz PRYURWAFNMPKPZ-KZNAEPCWSA-N 2 1 332.507 4.301 20 0 EIADMP CSCCCCC[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716641417 1049700211 /nfs/dbraw/zinc/70/02/11/1049700211.db2.gz ZVBLVQHJQDBAAB-UFYCRDLUSA-N 2 1 332.557 4.162 20 0 EIADMP CC1(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)CC(F)(F)C1 ZINC000716691666 1049700436 /nfs/dbraw/zinc/70/04/36/1049700436.db2.gz JICNGSHUMMIDBZ-BZSNNMDCSA-N 2 1 334.454 4.065 20 0 EIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)c1cccc(O)c1 ZINC000716693174 1049700712 /nfs/dbraw/zinc/70/07/12/1049700712.db2.gz OGBURNTVXIMOMX-PLWAMTLXSA-N 2 1 336.479 4.096 20 0 EIADMP C[C@H](C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)CC(F)(F)F ZINC000716680016 1049702421 /nfs/dbraw/zinc/70/24/21/1049702421.db2.gz PKASZECXGJWRAE-OWLYRPNTSA-N 2 1 340.433 4.218 20 0 EIADMP Fc1cc2c(cc1F)C[C@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001171486352 1049715627 /nfs/dbraw/zinc/71/56/27/1049715627.db2.gz BPLIABWPBCWRNO-RBUKOAKNSA-N 2 1 348.481 4.163 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171496520 1049722829 /nfs/dbraw/zinc/72/28/29/1049722829.db2.gz CWNPFIVRHUUGST-SFHVURJKSA-N 2 1 336.470 4.018 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557457 1049755196 /nfs/dbraw/zinc/75/51/96/1049755196.db2.gz CEDMNRXDUBVDAG-JBACZVJFSA-N 2 1 326.528 4.367 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C)C2 ZINC001171573110 1049758261 /nfs/dbraw/zinc/75/82/61/1049758261.db2.gz GNFQTFOEDBDFRO-ACRUOGEOSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C)C2 ZINC001171573110 1049758267 /nfs/dbraw/zinc/75/82/67/1049758267.db2.gz GNFQTFOEDBDFRO-ACRUOGEOSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1cccc2c1CC[C@H]([N@@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C)C2 ZINC001171573110 1049758275 /nfs/dbraw/zinc/75/82/75/1049758275.db2.gz GNFQTFOEDBDFRO-ACRUOGEOSA-N 2 1 326.528 4.191 20 0 EIADMP COc1ccc([C@H]2CC[N@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)cc1 ZINC001171643384 1049781290 /nfs/dbraw/zinc/78/12/90/1049781290.db2.gz SFDQMQLJFYMXEY-KRWDZBQOSA-N 2 1 330.516 4.136 20 0 EIADMP C[NH2+]Cc1ccc2c(ccn2[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC001171744478 1049789589 /nfs/dbraw/zinc/78/95/89/1049789589.db2.gz HARYVHNJWSHJRN-DYESRHJHSA-N 2 1 333.479 4.196 20 0 EIADMP C[C@H]1C[C@H](n2c3ccccc3c3c2CC[NH2+]C3)C[N@H+]1Cc1ccccc1 ZINC001171758559 1049790004 /nfs/dbraw/zinc/79/00/04/1049790004.db2.gz YFEPCTJRVFZIBL-HKUYNNGSSA-N 2 1 345.490 4.123 20 0 EIADMP C[NH2+]CCc1cn([C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171760333 1049791292 /nfs/dbraw/zinc/79/12/92/1049791292.db2.gz UDOQZCXTVGNIOX-GHTZIAJQSA-N 2 1 347.506 4.239 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH+]1CCC([N@H+](C)C2CC2)CC1 ZINC001171964831 1049826266 /nfs/dbraw/zinc/82/62/66/1049826266.db2.gz KJIJJEOBNZUYIU-CQSZACIVSA-N 2 1 340.433 4.195 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001171964831 1049826268 /nfs/dbraw/zinc/82/62/68/1049826268.db2.gz KJIJJEOBNZUYIU-CQSZACIVSA-N 2 1 340.433 4.195 20 0 EIADMP CN1CCC([N@@H+](C2CCCC2)[C@@H]2CCc3cccc(F)c3C2)CC1 ZINC001171010078 1049828877 /nfs/dbraw/zinc/82/88/77/1049828877.db2.gz KOKSVYVXQGWFKN-LJQANCHMSA-N 2 1 330.491 4.022 20 0 EIADMP CCCC[C@H](COC)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813881966 1049831299 /nfs/dbraw/zinc/83/12/99/1049831299.db2.gz YEELAEXDSUOMAY-XCSKNGGISA-N 2 1 344.543 4.367 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCCCCCCCO)CC[N@H+]1Cc1ccccc1 ZINC001171974586 1049836133 /nfs/dbraw/zinc/83/61/33/1049836133.db2.gz IAQCLUDBHGWDBE-NRFANRHFSA-N 2 1 346.559 4.352 20 0 EIADMP CC1(C)C[C@H](n2cc3ccc(C[NH3+])cc3n2)CC[N@H+]1Cc1ccccc1 ZINC001171976342 1049837932 /nfs/dbraw/zinc/83/79/32/1049837932.db2.gz RJPKADPWNVBUEV-HXUWFJFHSA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@H]([NH+]2CC[C@@H](c3ccncc3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171983727 1049838778 /nfs/dbraw/zinc/83/87/78/1049838778.db2.gz GNPYKHHGKJIARF-FGZHOGPDSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CC[C@@H](c3ccncc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983727 1049838780 /nfs/dbraw/zinc/83/87/80/1049838780.db2.gz GNPYKHHGKJIARF-FGZHOGPDSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CC[C@@H](c3ccncc3)C2)CC[NH+]1Cc1ccccc1 ZINC001171983727 1049838781 /nfs/dbraw/zinc/83/87/81/1049838781.db2.gz GNPYKHHGKJIARF-FGZHOGPDSA-N 2 1 349.522 4.314 20 0 EIADMP CC1(C)C[C@@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CCO1 ZINC001171978672 1049838999 /nfs/dbraw/zinc/83/89/99/1049838999.db2.gz IJPMVEBTECYQFG-PMACEKPBSA-N 2 1 344.543 4.224 20 0 EIADMP CC1(C)C[C@H]([NH+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001171982375 1049839416 /nfs/dbraw/zinc/83/94/16/1049839416.db2.gz RHRIFDWWVCSZOK-CEXWTWQISA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@H]([N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001171982375 1049839418 /nfs/dbraw/zinc/83/94/18/1049839418.db2.gz RHRIFDWWVCSZOK-CEXWTWQISA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001171982375 1049839419 /nfs/dbraw/zinc/83/94/19/1049839419.db2.gz RHRIFDWWVCSZOK-CEXWTWQISA-N 2 1 348.481 4.407 20 0 EIADMP CCOCC1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171986313 1049840798 /nfs/dbraw/zinc/84/07/98/1049840798.db2.gz HEXJOEJKONIIOQ-NRFANRHFSA-N 2 1 344.543 4.178 20 0 EIADMP CC1(C)C[C@H]([NH+]2CC[C@H](C(F)(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171987845 1049841020 /nfs/dbraw/zinc/84/10/20/1049841020.db2.gz KOOYREGVYRUNKH-DLBZAZTESA-N 2 1 340.433 4.314 20 0 EIADMP CC1(C)C[C@H]([N@@H+]2CC[C@H](C(F)(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171987845 1049841022 /nfs/dbraw/zinc/84/10/22/1049841022.db2.gz KOOYREGVYRUNKH-DLBZAZTESA-N 2 1 340.433 4.314 20 0 EIADMP CC1(C)C[C@H]([N@H+]2CC[C@H](C(F)(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171987845 1049841027 /nfs/dbraw/zinc/84/10/27/1049841027.db2.gz KOOYREGVYRUNKH-DLBZAZTESA-N 2 1 340.433 4.314 20 0 EIADMP CCCN(CCC[NH+](C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987394 1049841193 /nfs/dbraw/zinc/84/11/93/1049841193.db2.gz USAPMTIVLRHNHE-NRFANRHFSA-N 2 1 345.575 4.093 20 0 EIADMP F[C@@H]1CCCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070338 1049843525 /nfs/dbraw/zinc/84/35/25/1049843525.db2.gz ZFSNHYUYEKLLCT-MXEMCNAFSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070338 1049843526 /nfs/dbraw/zinc/84/35/26/1049843526.db2.gz ZFSNHYUYEKLLCT-MXEMCNAFSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070338 1049843528 /nfs/dbraw/zinc/84/35/28/1049843528.db2.gz ZFSNHYUYEKLLCT-MXEMCNAFSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@@H]1CCCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070338 1049843532 /nfs/dbraw/zinc/84/35/32/1049843532.db2.gz ZFSNHYUYEKLLCT-MXEMCNAFSA-N 2 1 330.491 4.396 20 0 EIADMP C[N@@H+](CCc1cccnc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076444 1049845202 /nfs/dbraw/zinc/84/52/02/1049845202.db2.gz YQBUQILZRJSANY-JKHIJQBDSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1cccnc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076444 1049845204 /nfs/dbraw/zinc/84/52/04/1049845204.db2.gz YQBUQILZRJSANY-JKHIJQBDSA-N 2 1 349.522 4.142 20 0 EIADMP C[NH+](CCc1cccnc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076444 1049845207 /nfs/dbraw/zinc/84/52/07/1049845207.db2.gz YQBUQILZRJSANY-JKHIJQBDSA-N 2 1 349.522 4.142 20 0 EIADMP c1ccc(CC[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001172063656 1049850179 /nfs/dbraw/zinc/85/01/79/1049850179.db2.gz AYQWAVFRWBPYJH-NUNAXRQHSA-N 2 1 334.507 4.404 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(c3ccccc3)CCCCC1)C2 ZINC001172100538 1049850366 /nfs/dbraw/zinc/85/03/66/1049850366.db2.gz DSRAGEFHZIBLGD-WKCHPHFGSA-N 2 1 326.528 4.493 20 0 EIADMP F[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172066832 1049851902 /nfs/dbraw/zinc/85/19/02/1049851902.db2.gz KJYDCJVWQXLQOM-SSSFQFABSA-N 2 1 330.491 4.442 20 0 EIADMP CC(C)(C)OCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067894 1049852087 /nfs/dbraw/zinc/85/20/87/1049852087.db2.gz HPBDIYFXNXGZDA-WKCHPHFGSA-N 2 1 344.543 4.367 20 0 EIADMP Cc1cnccc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070014 1049853566 /nfs/dbraw/zinc/85/35/66/1049853566.db2.gz ZUMUFTZUQGHSCJ-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP c1csc(CC[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172069548 1049853627 /nfs/dbraw/zinc/85/36/27/1049853627.db2.gz UYNVJCYPUOYOKZ-OWZKRDHZSA-N 2 1 340.536 4.466 20 0 EIADMP C[C@@H]1OC2(CC[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)CC2)c2ccccc21 ZINC001172133960 1049855007 /nfs/dbraw/zinc/85/50/07/1049855007.db2.gz UUGCNAIWIKHFIE-OKYOBFRVSA-N 2 1 340.511 4.084 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccc1)Cc1cccnc1)C2 ZINC001172123000 1049858358 /nfs/dbraw/zinc/85/83/58/1049858358.db2.gz XARZRQDCIXVRLY-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccc1)Cc1cccnc1)C2 ZINC001172123000 1049858361 /nfs/dbraw/zinc/85/83/61/1049858361.db2.gz XARZRQDCIXVRLY-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+](Cc1ccccc1)Cc1cccnc1)C2 ZINC001172123000 1049858363 /nfs/dbraw/zinc/85/83/63/1049858363.db2.gz XARZRQDCIXVRLY-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+](Cc1ccccc1)Cc1cccnc1)C2 ZINC001172123000 1049858365 /nfs/dbraw/zinc/85/83/65/1049858365.db2.gz XARZRQDCIXVRLY-ZBYYUNFXSA-N 2 1 335.495 4.099 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H](Cc3ccc(F)cc3)C1)C2 ZINC001172120244 1049858998 /nfs/dbraw/zinc/85/89/98/1049858998.db2.gz BKGHHRHQISALQU-WJMWBRGCSA-N 2 1 330.491 4.096 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H](Cc3ccc(F)cc3)C1)C2 ZINC001172120244 1049858999 /nfs/dbraw/zinc/85/89/99/1049858999.db2.gz BKGHHRHQISALQU-WJMWBRGCSA-N 2 1 330.491 4.096 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H](Cc3ccc(F)cc3)C1)C2 ZINC001172120244 1049859000 /nfs/dbraw/zinc/85/90/00/1049859000.db2.gz BKGHHRHQISALQU-WJMWBRGCSA-N 2 1 330.491 4.096 20 0 EIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@H](Cc3ccc(F)cc3)C1)C2 ZINC001172120244 1049859001 /nfs/dbraw/zinc/85/90/01/1049859001.db2.gz BKGHHRHQISALQU-WJMWBRGCSA-N 2 1 330.491 4.096 20 0 EIADMP CC[C@@H](C)OCC[C@H](C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172355843 1049894586 /nfs/dbraw/zinc/89/45/86/1049894586.db2.gz WQAJDXWGMKZMFR-VQTJNVASSA-N 2 1 346.559 4.424 20 0 EIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171045970 1049898291 /nfs/dbraw/zinc/89/82/91/1049898291.db2.gz VXTDYPZLYUSGGW-SFHVURJKSA-N 2 1 334.935 4.250 20 0 EIADMP CC(C)COCC[C@H](C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172475348 1049908376 /nfs/dbraw/zinc/90/83/76/1049908376.db2.gz IMVNEBDQPIPAAC-FQEVSTJZSA-N 2 1 346.559 4.282 20 0 EIADMP c1ccc(-c2cccc(C[N@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)c2)nc1 ZINC000246098455 1049908430 /nfs/dbraw/zinc/90/84/30/1049908430.db2.gz JCHQEAJKRRBCGZ-NZQKXSOJSA-N 2 1 347.506 4.197 20 0 EIADMP CC(C)COCC[C@H](C)[NH+]1CCC([NH3+])(c2cccc(Cl)c2)CC1 ZINC001172469197 1049909155 /nfs/dbraw/zinc/90/91/55/1049909155.db2.gz SQSVQTJUOHUYFC-INIZCTEOSA-N 2 1 338.923 4.041 20 0 EIADMP [NH3+]C1(c2ccccc2F)CC[NH+]([C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172557687 1049932570 /nfs/dbraw/zinc/93/25/70/1049932570.db2.gz PWBPRDQEFURMET-RTBURBONSA-N 2 1 338.470 4.412 20 0 EIADMP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001172566477 1049936766 /nfs/dbraw/zinc/93/67/66/1049936766.db2.gz FWEXDQYZQQJVLE-REBRKWNGSA-N 2 1 342.861 4.154 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CC(C)(C)OC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001172646515 1049955216 /nfs/dbraw/zinc/95/52/16/1049955216.db2.gz BOCVJGHRPFMQAR-PKOBYXMFSA-N 2 1 344.543 4.365 20 0 EIADMP C[C@H]1C[C@H]([NH2+]C2CC(C)(C)OC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC001172646515 1049955224 /nfs/dbraw/zinc/95/52/24/1049955224.db2.gz BOCVJGHRPFMQAR-PKOBYXMFSA-N 2 1 344.543 4.365 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172721646 1049965191 /nfs/dbraw/zinc/96/51/91/1049965191.db2.gz IIPPCFCULXSBKH-UFYCRDLUSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172721646 1049965195 /nfs/dbraw/zinc/96/51/95/1049965195.db2.gz IIPPCFCULXSBKH-UFYCRDLUSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172721646 1049965198 /nfs/dbraw/zinc/96/51/98/1049965198.db2.gz IIPPCFCULXSBKH-UFYCRDLUSA-N 2 1 332.919 4.146 20 0 EIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1OC ZINC000246813391 1050001863 /nfs/dbraw/zinc/00/18/63/1050001863.db2.gz AUDKQPLJWRNLTN-JENIJYKNSA-N 2 1 348.531 4.398 20 0 EIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000246813391 1050001870 /nfs/dbraw/zinc/00/18/70/1050001870.db2.gz AUDKQPLJWRNLTN-JENIJYKNSA-N 2 1 348.531 4.398 20 0 EIADMP Cc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)c1 ZINC000247120128 1050015230 /nfs/dbraw/zinc/01/52/30/1050015230.db2.gz RBPJYASZGUNPQP-RBUKOAKNSA-N 2 1 338.495 4.067 20 0 EIADMP Cc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)c1 ZINC000247120128 1050015234 /nfs/dbraw/zinc/01/52/34/1050015234.db2.gz RBPJYASZGUNPQP-RBUKOAKNSA-N 2 1 338.495 4.067 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(OC(F)F)c2)C1 ZINC000247119581 1050015385 /nfs/dbraw/zinc/01/53/85/1050015385.db2.gz UOBHUIYPOZZHSX-CABCVRRESA-N 2 1 326.431 4.059 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccccc2OC(F)F)C1 ZINC000247239836 1050018873 /nfs/dbraw/zinc/01/88/73/1050018873.db2.gz YVJHJHZGSCRUKS-GOEBONIOSA-N 2 1 326.431 4.061 20 0 EIADMP Cc1cccc2[nH]cc(CC[NH2+][C@@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)c21 ZINC000519719051 1050020800 /nfs/dbraw/zinc/02/08/00/1050020800.db2.gz XFBPGBSBBOODBB-IRLDBZIGSA-N 2 1 347.506 4.444 20 0 EIADMP Cc1cccc2[nH]cc(CC[NH2+][C@@H]3CC[N@H+](C)[C@H](c4ccccc4)C3)c21 ZINC000519719051 1050020806 /nfs/dbraw/zinc/02/08/06/1050020806.db2.gz XFBPGBSBBOODBB-IRLDBZIGSA-N 2 1 347.506 4.444 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1N(C)C ZINC000248408756 1050055549 /nfs/dbraw/zinc/05/55/49/1050055549.db2.gz VVPWURMSYYSBGE-BZSNNMDCSA-N 2 1 329.532 4.056 20 0 EIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000248728261 1050075361 /nfs/dbraw/zinc/07/53/61/1050075361.db2.gz VFIVEOUOCMHTAC-SJORKVTESA-N 2 1 340.433 4.199 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cnn1C(C)(C)C ZINC000248738789 1050076588 /nfs/dbraw/zinc/07/65/88/1050076588.db2.gz XVXXDQCIOXZNSA-SJORKVTESA-N 2 1 334.552 4.109 20 0 EIADMP Fc1cc(F)cc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000248878542 1050082004 /nfs/dbraw/zinc/08/20/04/1050082004.db2.gz KCTPEMPFXWIGPZ-MZADTFQBSA-N 2 1 342.433 4.250 20 0 EIADMP Fc1cc(F)cc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000248878542 1050082009 /nfs/dbraw/zinc/08/20/09/1050082009.db2.gz KCTPEMPFXWIGPZ-MZADTFQBSA-N 2 1 342.433 4.250 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000090046554 1050152492 /nfs/dbraw/zinc/15/24/92/1050152492.db2.gz MALQIVZUPVOWJJ-HLLBOEOZSA-N 2 1 335.561 4.052 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc(F)c3cccnc23)C1 ZINC001177289269 1050177731 /nfs/dbraw/zinc/17/77/31/1050177731.db2.gz BZVNKCWKQZBBJQ-CALCHBBNSA-N 2 1 343.490 4.222 20 0 EIADMP COc1ccc(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c2ccccc12 ZINC001177293858 1050178276 /nfs/dbraw/zinc/17/82/76/1050178276.db2.gz AHEPMIMUVXBDGW-HDICACEKSA-N 2 1 340.511 4.306 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2cc(F)cc(F)c2)C1 ZINC001177261384 1050183544 /nfs/dbraw/zinc/18/35/44/1050183544.db2.gz CFBITXDBCVKORT-MRXNPFEDSA-N 2 1 344.449 4.487 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CCc1c(F)cccc1F ZINC001177328025 1050192416 /nfs/dbraw/zinc/19/24/16/1050192416.db2.gz CDKITBIQWDDHOS-UHFFFAOYSA-N 2 1 346.465 4.255 20 0 EIADMP Cc1cc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)c(OC(F)F)cc1C ZINC001177416789 1050210682 /nfs/dbraw/zinc/21/06/82/1050210682.db2.gz WSNOLTKVKJLPCM-AWEZNQCLSA-N 2 1 340.458 4.116 20 0 EIADMP C[C@@H]1CCC[C@](C[NH2+]C2CCC3(COC(C)(C)C3)CC2)([NH+](C)C)C1 ZINC001177441408 1050220689 /nfs/dbraw/zinc/22/06/89/1050220689.db2.gz ALTXUIWVQFKMDQ-SDEKRAFDSA-N 2 1 336.564 4.214 20 0 EIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC001206303579 1050223841 /nfs/dbraw/zinc/22/38/41/1050223841.db2.gz CYKPHKCOEPBEQW-HNNXBMFYSA-N 2 1 334.813 4.310 20 0 EIADMP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172882240 1050224439 /nfs/dbraw/zinc/22/44/39/1050224439.db2.gz MBMYGHIKWMIKOE-MXASKKJJSA-N 2 1 338.948 4.426 20 0 EIADMP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172882240 1050224447 /nfs/dbraw/zinc/22/44/47/1050224447.db2.gz MBMYGHIKWMIKOE-MXASKKJJSA-N 2 1 338.948 4.426 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CC2(c3ccc(F)cc3)CCCCC2)CC1(C)C ZINC001177487787 1050225638 /nfs/dbraw/zinc/22/56/38/1050225638.db2.gz PNCUNPNPNPMMTB-IBGZPJMESA-N 2 1 332.507 4.490 20 0 EIADMP COc1ccccc1[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000091284473 1050247099 /nfs/dbraw/zinc/24/70/99/1050247099.db2.gz BSYNNMADZKSCCJ-HRAATJIYSA-N 2 1 328.500 4.000 20 0 EIADMP COc1ccccc1[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000091284476 1050247667 /nfs/dbraw/zinc/24/76/67/1050247667.db2.gz BSYNNMADZKSCCJ-IERDGZPVSA-N 2 1 328.500 4.000 20 0 EIADMP CC[C@@H](C[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC001177668759 1050274226 /nfs/dbraw/zinc/27/42/26/1050274226.db2.gz CNHNQGRCNOUQAM-YADHBBJMSA-N 2 1 336.523 4.334 20 0 EIADMP CCCOC1CCC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC001173093541 1050285426 /nfs/dbraw/zinc/28/54/26/1050285426.db2.gz VTBNLSKWPJDWAS-UHFFFAOYSA-N 2 1 344.543 4.021 20 0 EIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+][C@H]1CCCc2c(cccc2OC)C1 ZINC001177741880 1050291796 /nfs/dbraw/zinc/29/17/96/1050291796.db2.gz DZCQLOHBHKPSCG-VQTJNVASSA-N 2 1 344.543 4.187 20 0 EIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+][C@H]1CCCc2c(cccc2OC)C1 ZINC001177741880 1050291807 /nfs/dbraw/zinc/29/18/07/1050291807.db2.gz DZCQLOHBHKPSCG-VQTJNVASSA-N 2 1 344.543 4.187 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCSC[C@@H]2c2ccccc2)CC1 ZINC001173114541 1050309187 /nfs/dbraw/zinc/30/91/87/1050309187.db2.gz OGVIAEUERPWKGO-SOAGJPPSSA-N 2 1 332.557 4.430 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@H]3CCC[C@H](C)CC3)CC2)cs1 ZINC001177855427 1050317606 /nfs/dbraw/zinc/31/76/06/1050317606.db2.gz VTPXUUUDOZSMJC-WMZOPIPTSA-N 2 1 349.588 4.476 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1c(Cl)cccc1OC(F)F ZINC001177910446 1050323821 /nfs/dbraw/zinc/32/38/21/1050323821.db2.gz AUMYIAFIBGOXBG-UHFFFAOYSA-N 2 1 343.805 4.016 20 0 EIADMP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c(C)c1 ZINC001177920113 1050329850 /nfs/dbraw/zinc/32/98/50/1050329850.db2.gz QOWRSFDKPXFVTA-FXAWDEMLSA-N 2 1 344.524 4.238 20 0 EIADMP COc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c(C)c1 ZINC001177920113 1050329854 /nfs/dbraw/zinc/32/98/54/1050329854.db2.gz QOWRSFDKPXFVTA-FXAWDEMLSA-N 2 1 344.524 4.238 20 0 EIADMP CCc1ccc([C@H](CNc2cc(C)[nH+]c(C)n2)[NH+](CC)CC)cc1 ZINC001186594282 1050374192 /nfs/dbraw/zinc/37/41/92/1050374192.db2.gz QUIOKZAUZJQVJW-IBGZPJMESA-N 2 1 326.488 4.151 20 0 EIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Cl)c(Br)c2)CC1 ZINC001206317557 1050385198 /nfs/dbraw/zinc/38/51/98/1050385198.db2.gz HGAJZGHKHAZGKE-OAHLLOKOSA-N 2 1 345.712 4.053 20 0 EIADMP CCc1ccc(C[C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001173237245 1050394907 /nfs/dbraw/zinc/39/49/07/1050394907.db2.gz GPIMETLQGHZWRZ-CVDCTZTESA-N 2 1 336.523 4.292 20 0 EIADMP CCc1sc(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)cc1Br ZINC001206317878 1050395776 /nfs/dbraw/zinc/39/57/76/1050395776.db2.gz KETJQLPRCNZLEE-OAHLLOKOSA-N 2 1 345.350 4.024 20 0 EIADMP CCSC[C@H](C)[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001173299049 1050401508 /nfs/dbraw/zinc/40/15/08/1050401508.db2.gz AIIGQEFRPFWKIF-FUHWJXTLSA-N 2 1 336.545 4.098 20 0 EIADMP C[C@H]1C[C@H](CC[NH2+]Cc2ccc(F)cc2F)C[N@H+]1Cc1ccccc1 ZINC001178207954 1050403398 /nfs/dbraw/zinc/40/33/98/1050403398.db2.gz JKLCUJDGELSWEZ-WMZOPIPTSA-N 2 1 344.449 4.355 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CC[C@@H](C)SC2)C[N@H+]1Cc1ccccc1 ZINC001178207161 1050403876 /nfs/dbraw/zinc/40/38/76/1050403876.db2.gz APOXJDJCPXDXKK-LFGUQSLTSA-N 2 1 332.557 4.161 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccnc(Cl)c2)CC1)CC(C)C ZINC000773737353 1050429089 /nfs/dbraw/zinc/42/90/89/1050429089.db2.gz ZUNGEQKBVGMNGF-UHFFFAOYSA-N 2 1 337.939 4.315 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc2ccoc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001178330265 1050437210 /nfs/dbraw/zinc/43/72/10/1050437210.db2.gz ALMSVPXXIXCOGO-UTKZUKDTSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC001173545628 1050477054 /nfs/dbraw/zinc/47/70/54/1050477054.db2.gz CBXSTIYOYDDEPT-AHIWAGSCSA-N 2 1 329.315 4.244 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CC[N@@H+](C)C[C@@H]1C ZINC001173545628 1050477058 /nfs/dbraw/zinc/47/70/58/1050477058.db2.gz CBXSTIYOYDDEPT-AHIWAGSCSA-N 2 1 329.315 4.244 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001173549692 1050485010 /nfs/dbraw/zinc/48/50/10/1050485010.db2.gz IFRAEYXVJVMOGN-DDUZABMNSA-N 2 1 341.326 4.198 20 0 EIADMP Cc1cc(C[N@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)cc(C)c1-c1ccc(F)cc1 ZINC001206211317 1050530749 /nfs/dbraw/zinc/53/07/49/1050530749.db2.gz NJZHDJAOCWXFKH-UXHICEINSA-N 2 1 344.449 4.371 20 0 EIADMP Cc1cc(C[N@@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)cc(C)c1-c1ccc(F)cc1 ZINC001206211317 1050530765 /nfs/dbraw/zinc/53/07/65/1050530765.db2.gz NJZHDJAOCWXFKH-UXHICEINSA-N 2 1 344.449 4.371 20 0 EIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(Br)cc1Cl)C1CC1 ZINC001178873640 1050577993 /nfs/dbraw/zinc/57/79/93/1050577993.db2.gz WMGGNWYOXLKIRQ-UHFFFAOYSA-N 2 1 345.712 4.067 20 0 EIADMP COc1cc2ccccc2cc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001179878253 1050815750 /nfs/dbraw/zinc/81/57/50/1050815750.db2.gz NQYFDFLSFKJNMR-GOSISDBHSA-N 2 1 338.495 4.156 20 0 EIADMP COc1cc2ccccc2cc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001179878253 1050815757 /nfs/dbraw/zinc/81/57/57/1050815757.db2.gz NQYFDFLSFKJNMR-GOSISDBHSA-N 2 1 338.495 4.156 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030499 1050858961 /nfs/dbraw/zinc/85/89/61/1050858961.db2.gz NRDOSSHPRXNNBK-AZUAARDMSA-N 2 1 342.527 4.098 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030499 1050858972 /nfs/dbraw/zinc/85/89/72/1050858972.db2.gz NRDOSSHPRXNNBK-AZUAARDMSA-N 2 1 342.527 4.098 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030499 1050858974 /nfs/dbraw/zinc/85/89/74/1050858974.db2.gz NRDOSSHPRXNNBK-AZUAARDMSA-N 2 1 342.527 4.098 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc3c(c2)CCCO3)C1 ZINC001180030499 1050858980 /nfs/dbraw/zinc/85/89/80/1050858980.db2.gz NRDOSSHPRXNNBK-AZUAARDMSA-N 2 1 342.527 4.098 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(OC)c(C(C)(C)C)c2)CC1 ZINC001180161579 1050904910 /nfs/dbraw/zinc/90/49/10/1050904910.db2.gz ICXCIHXOUGDBLX-UHFFFAOYSA-N 2 1 332.532 4.299 20 0 EIADMP C[C@@H](C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267120 1050941145 /nfs/dbraw/zinc/94/11/45/1050941145.db2.gz OSNQAAMBLHLISM-ICSRJNTNSA-N 2 1 340.486 4.383 20 0 EIADMP C[C@@H](C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267120 1050941151 /nfs/dbraw/zinc/94/11/51/1050941151.db2.gz OSNQAAMBLHLISM-ICSRJNTNSA-N 2 1 340.486 4.383 20 0 EIADMP C[C@@H](C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267120 1050941171 /nfs/dbraw/zinc/94/11/71/1050941171.db2.gz OSNQAAMBLHLISM-ICSRJNTNSA-N 2 1 340.486 4.383 20 0 EIADMP C[C@H](C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267121 1050943094 /nfs/dbraw/zinc/94/30/94/1050943094.db2.gz OSNQAAMBLHLISM-QUCCMNQESA-N 2 1 340.486 4.383 20 0 EIADMP C[C@H](C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267121 1050943106 /nfs/dbraw/zinc/94/31/06/1050943106.db2.gz OSNQAAMBLHLISM-QUCCMNQESA-N 2 1 340.486 4.383 20 0 EIADMP C[C@H](C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267121 1050943113 /nfs/dbraw/zinc/94/31/13/1050943113.db2.gz OSNQAAMBLHLISM-QUCCMNQESA-N 2 1 340.486 4.383 20 0 EIADMP Cc1cc(C)cc(CC[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001180267397 1050943180 /nfs/dbraw/zinc/94/31/80/1050943180.db2.gz VMXUOQCPDWMLPG-QHCPKHFHSA-N 2 1 336.523 4.300 20 0 EIADMP Cc1cc(C)cc(CC[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001180267397 1050943195 /nfs/dbraw/zinc/94/31/95/1050943195.db2.gz VMXUOQCPDWMLPG-QHCPKHFHSA-N 2 1 336.523 4.300 20 0 EIADMP Cc1cc(C)cc(CC[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001180267397 1050943208 /nfs/dbraw/zinc/94/32/08/1050943208.db2.gz VMXUOQCPDWMLPG-QHCPKHFHSA-N 2 1 336.523 4.300 20 0 EIADMP Cc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)s2)cc1 ZINC000620109486 1051025568 /nfs/dbraw/zinc/02/55/68/1051025568.db2.gz JLZQDFKRUGVFEU-MSOLQXFVSA-N 2 1 326.509 4.440 20 0 EIADMP Cc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000153489088 1051056863 /nfs/dbraw/zinc/05/68/63/1051056863.db2.gz DMNJQWANWBTTDJ-RTBURBONSA-N 2 1 338.495 4.067 20 0 EIADMP Cc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000153489088 1051056879 /nfs/dbraw/zinc/05/68/79/1051056879.db2.gz DMNJQWANWBTTDJ-RTBURBONSA-N 2 1 338.495 4.067 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775388778 1051186999 /nfs/dbraw/zinc/18/69/99/1051186999.db2.gz TVIZAXSSTPSNNB-SUMWQHHRSA-N 2 1 340.483 4.310 20 0 EIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1)c1cc(F)cc(F)c1 ZINC001181276061 1051196389 /nfs/dbraw/zinc/19/63/89/1051196389.db2.gz IKTYXRWDARYOQY-QRWLVFNGSA-N 2 1 336.470 4.455 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SCC(F)(F)F)cc2)C1 ZINC000163221561 1051253211 /nfs/dbraw/zinc/25/32/11/1051253211.db2.gz QVDKKCRJVVTASO-UONOGXRCSA-N 2 1 346.462 4.333 20 0 EIADMP Clc1ccc2ccc(C[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)nc2c1 ZINC001191071792 1051341406 /nfs/dbraw/zinc/34/14/06/1051341406.db2.gz ZVBPIAIKIDBUHB-MRXNPFEDSA-N 2 1 343.902 4.196 20 0 EIADMP Clc1ccc2ccc(C[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)nc2c1 ZINC001191071792 1051341420 /nfs/dbraw/zinc/34/14/20/1051341420.db2.gz ZVBPIAIKIDBUHB-MRXNPFEDSA-N 2 1 343.902 4.196 20 0 EIADMP Cc1nc(C)c([C@H](C)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000268792342 1051390590 /nfs/dbraw/zinc/39/05/90/1051390590.db2.gz MOOZIEJJXIBASU-ALKREAHSSA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000268792342 1051390605 /nfs/dbraw/zinc/39/06/05/1051390605.db2.gz MOOZIEJJXIBASU-ALKREAHSSA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000268792342 1051390616 /nfs/dbraw/zinc/39/06/16/1051390616.db2.gz MOOZIEJJXIBASU-ALKREAHSSA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000268792342 1051390636 /nfs/dbraw/zinc/39/06/36/1051390636.db2.gz MOOZIEJJXIBASU-ALKREAHSSA-N 2 1 343.540 4.321 20 0 EIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+]C1CCC(c2ccc(OC)cc2)CC1 ZINC001182152820 1051406624 /nfs/dbraw/zinc/40/66/24/1051406624.db2.gz TVWIZJAVUIQVNY-PGYGNJIDSA-N 2 1 332.532 4.431 20 0 EIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+]C1CCC(c2ccc(OC)cc2)CC1 ZINC001182152820 1051406634 /nfs/dbraw/zinc/40/66/34/1051406634.db2.gz TVWIZJAVUIQVNY-PGYGNJIDSA-N 2 1 332.532 4.431 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000271879926 1051555042 /nfs/dbraw/zinc/55/50/42/1051555042.db2.gz PEQLCIXJWCBADN-NSHDSACASA-N 2 1 348.244 4.051 20 0 EIADMP CC(F)(F)CCC[NH+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001175381762 1051562390 /nfs/dbraw/zinc/56/23/90/1051562390.db2.gz JRSSWBMLNQBFGO-OALUTQOASA-N 2 1 336.470 4.266 20 0 EIADMP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000775490374 1051575890 /nfs/dbraw/zinc/57/58/90/1051575890.db2.gz WQDSGNOVRIZTMU-LQWHRVPQSA-N 2 1 340.486 4.429 20 0 EIADMP C[N@H+]1C[C@@H](C[NH2+][C@H]2CC[C@@](C)(c3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC001182542185 1051636033 /nfs/dbraw/zinc/63/60/33/1051636033.db2.gz CKLFNZKYPJBNHJ-AYVPJYCDSA-N 2 1 348.534 4.432 20 0 EIADMP CC(C)C[N@H+](Cc1ccc(Cl)c(F)c1)CC1CC[NH+](C)CC1 ZINC001175601727 1051667652 /nfs/dbraw/zinc/66/76/52/1051667652.db2.gz RURLQIBIKLNXTI-UHFFFAOYSA-N 2 1 326.887 4.279 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158098118 1051709281 /nfs/dbraw/zinc/70/92/81/1051709281.db2.gz HVYGODQRFLCXCG-ZFWWWQNUSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000158098118 1051709288 /nfs/dbraw/zinc/70/92/88/1051709288.db2.gz HVYGODQRFLCXCG-ZFWWWQNUSA-N 2 1 347.503 4.250 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000158103529 1051713331 /nfs/dbraw/zinc/71/33/31/1051713331.db2.gz VWGONZGOKZVIMA-KBPBESRZSA-N 2 1 346.462 4.333 20 0 EIADMP Cc1ccc(C[C@H](C)[NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC001183281084 1051813097 /nfs/dbraw/zinc/81/30/97/1051813097.db2.gz LQUNGGYLYYEMQN-ZRCGQRJVSA-N 2 1 336.523 4.284 20 0 EIADMP C[C@@H]1CC[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CC[C@@H]1C[NH3+] ZINC001205618045 1051845120 /nfs/dbraw/zinc/84/51/20/1051845120.db2.gz QWIXBGCGQDSBAQ-TZMCWYRMSA-N 2 1 332.435 4.105 20 0 EIADMP C[C@@H]1CC[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CC[C@H]1C[NH3+] ZINC001205618044 1051845725 /nfs/dbraw/zinc/84/57/25/1051845725.db2.gz QWIXBGCGQDSBAQ-OCCSQVGLSA-N 2 1 332.435 4.105 20 0 EIADMP CC(C)(C)OC[C@H]1CCC[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001176007763 1051871757 /nfs/dbraw/zinc/87/17/57/1051871757.db2.gz AQBCARMUXZKQAD-OAQYLSRUSA-N 2 1 344.543 4.452 20 0 EIADMP Cc1nc(-c2ccc(CC[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@@H]3C)s2)cs1 ZINC000164469619 1052032048 /nfs/dbraw/zinc/03/20/48/1052032048.db2.gz WFPMFNCRTBEFOW-HEHGZKQESA-N 2 1 349.569 4.041 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]CCCCn3cc[nH+]c3C)c(C)c2c1 ZINC000164658198 1052035170 /nfs/dbraw/zinc/03/51/70/1052035170.db2.gz AXTOSFILVBRMQE-OAHLLOKOSA-N 2 1 341.455 4.386 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3ccccc32)[C@@H]1c1cccs1 ZINC000164960339 1052046619 /nfs/dbraw/zinc/04/66/19/1052046619.db2.gz HNFQAAFVRZQAHY-YVWKXTFCSA-N 2 1 326.509 4.408 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3ccccc32)[C@@H]1c1cccs1 ZINC000164960339 1052046631 /nfs/dbraw/zinc/04/66/31/1052046631.db2.gz HNFQAAFVRZQAHY-YVWKXTFCSA-N 2 1 326.509 4.408 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cc1 ZINC000165002201 1052046775 /nfs/dbraw/zinc/04/67/75/1052046775.db2.gz IPPUPIQEFLIDHE-VPWXQRGCSA-N 2 1 344.524 4.490 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)cc1 ZINC000165002201 1052046788 /nfs/dbraw/zinc/04/67/88/1052046788.db2.gz IPPUPIQEFLIDHE-VPWXQRGCSA-N 2 1 344.524 4.490 20 0 EIADMP COCc1ccc(C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)cc1 ZINC001177171019 1052234524 /nfs/dbraw/zinc/23/45/24/1052234524.db2.gz RKURYFFZNYCOOU-UHFFFAOYSA-N 2 1 340.511 4.081 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)cc1 ZINC000171126834 1052396259 /nfs/dbraw/zinc/39/62/59/1052396259.db2.gz SOLCIVAWHIDBLI-QFIPXVFZSA-N 2 1 331.463 4.022 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000379903732 1052565068 /nfs/dbraw/zinc/56/50/68/1052565068.db2.gz IIFFGIZEADSVOW-GGPKGHCWSA-N 2 1 326.484 4.101 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000671298591 1052590891 /nfs/dbraw/zinc/59/08/91/1052590891.db2.gz RNQHKZKSIOUJQD-MSOLQXFVSA-N 2 1 338.417 4.193 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1OCC ZINC000623339362 1052628146 /nfs/dbraw/zinc/62/81/46/1052628146.db2.gz WNGHTURHUOWGAX-WBVHZDCISA-N 2 1 334.504 4.007 20 0 EIADMP CCOc1ccc([C@@H](C)[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1OCC ZINC000623339362 1052628149 /nfs/dbraw/zinc/62/81/49/1052628149.db2.gz WNGHTURHUOWGAX-WBVHZDCISA-N 2 1 334.504 4.007 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCCNc3ccccc32)CC1 ZINC000192687683 1052630080 /nfs/dbraw/zinc/63/00/80/1052630080.db2.gz MHGRULDOIOBBLR-HSZRJFAPSA-N 2 1 349.522 4.496 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc3n[nH]cc32)C1 ZINC000623357956 1052631380 /nfs/dbraw/zinc/63/13/80/1052631380.db2.gz IXFVMUTVALEXQW-KRWDZBQOSA-N 2 1 348.494 4.085 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(CN[C@@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357196 1052634534 /nfs/dbraw/zinc/63/45/34/1052634534.db2.gz BZJDZANHKHMQGR-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CN[C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623357196 1052634536 /nfs/dbraw/zinc/63/45/36/1052634536.db2.gz BZJDZANHKHMQGR-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(CN[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623357196 1052634538 /nfs/dbraw/zinc/63/45/38/1052634538.db2.gz BZJDZANHKHMQGR-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357196 1052634539 /nfs/dbraw/zinc/63/45/39/1052634539.db2.gz BZJDZANHKHMQGR-WIYYLYMNSA-N 2 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357196 1052634541 /nfs/dbraw/zinc/63/45/41/1052634541.db2.gz BZJDZANHKHMQGR-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623357196 1052634545 /nfs/dbraw/zinc/63/45/45/1052634545.db2.gz BZJDZANHKHMQGR-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H]1CCCC[NH+]1Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623357196 1052634549 /nfs/dbraw/zinc/63/45/49/1052634549.db2.gz BZJDZANHKHMQGR-WIYYLYMNSA-N 3 1 343.559 4.023 20 0 EIADMP CC(C)Oc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623363358 1052635680 /nfs/dbraw/zinc/63/56/80/1052635680.db2.gz PTOYWPKJNXCLKN-PKOBYXMFSA-N 2 1 332.532 4.257 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(F)c(Br)c1 ZINC000623533198 1052669710 /nfs/dbraw/zinc/66/97/10/1052669710.db2.gz WLFVJZLMRKNZCD-WCQYABFASA-N 2 1 343.284 4.112 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(F)c(Br)c1 ZINC000623533198 1052669714 /nfs/dbraw/zinc/66/97/14/1052669714.db2.gz WLFVJZLMRKNZCD-WCQYABFASA-N 2 1 343.284 4.112 20 0 EIADMP C[C@H]1C[C@H](NC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@H+]1C ZINC000178606548 1052709727 /nfs/dbraw/zinc/70/97/27/1052709727.db2.gz BVCFPAQWUIFOCA-IFXJQAMLSA-N 2 1 330.422 4.127 20 0 EIADMP CC(C)OCCCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000180463455 1052800635 /nfs/dbraw/zinc/80/06/35/1052800635.db2.gz UREQFCINUUQEPT-FDFHNCONSA-N 2 1 344.543 4.082 20 0 EIADMP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000623861234 1052824429 /nfs/dbraw/zinc/82/44/29/1052824429.db2.gz SJGQZRZFOOYSFG-DJJJIMSYSA-N 2 1 343.902 4.273 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1nccn1C ZINC000182534560 1052938988 /nfs/dbraw/zinc/93/89/88/1052938988.db2.gz BNAOCXRYBXIXJE-QGZVFWFLSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1)c1nccn1C ZINC000182534560 1052938991 /nfs/dbraw/zinc/93/89/91/1052938991.db2.gz BNAOCXRYBXIXJE-QGZVFWFLSA-N 2 1 340.515 4.035 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cccc(F)c1F ZINC000183216302 1052967003 /nfs/dbraw/zinc/96/70/03/1052967003.db2.gz AEQASKKXURQALZ-OAHLLOKOSA-N 2 1 330.422 4.411 20 0 EIADMP Fc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000380899479 1053047600 /nfs/dbraw/zinc/04/76/00/1053047600.db2.gz FIQRJAWLZHIJBK-QGZVFWFLSA-N 2 1 332.850 4.091 20 0 EIADMP C[C@H]([NH2+]C1CC(c2ccccc2)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381292742 1053063136 /nfs/dbraw/zinc/06/31/36/1053063136.db2.gz XSUKPMYVVGHJHO-RCQCBQKRSA-N 2 1 334.507 4.433 20 0 EIADMP C[C@@H]([NH2+]C1CC(c2ccccc2)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381292743 1053063732 /nfs/dbraw/zinc/06/37/32/1053063732.db2.gz XSUKPMYVVGHJHO-UGAAUXFBSA-N 2 1 334.507 4.433 20 0 EIADMP c1ccc(CC2CC[NH+](CCC[N@H+]3CCC[C@@H](C4CC4)C3)CC2)cc1 ZINC001194806911 1053107381 /nfs/dbraw/zinc/10/73/81/1053107381.db2.gz NWYZQTHOQDFEJR-HSZRJFAPSA-N 2 1 340.555 4.453 20 0 EIADMP C[C@@H]([NH2+]Cc1sccc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381895143 1053108696 /nfs/dbraw/zinc/10/86/96/1053108696.db2.gz UEJAWGRKOWHVIO-ZBFHGGJFSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@@H]([NH2+]Cc1sccc1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381895143 1053108706 /nfs/dbraw/zinc/10/87/06/1053108706.db2.gz UEJAWGRKOWHVIO-ZBFHGGJFSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCCO2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000850457046 1053233801 /nfs/dbraw/zinc/23/38/01/1053233801.db2.gz FPPOJNVWOYMCJC-QKLQHJQFSA-N 2 1 342.527 4.315 20 0 EIADMP Cc1c([C@H](C)NCCC[N@H+]2CCCC[C@H]2C)cnn1-c1ccccc1 ZINC000764627577 1053237781 /nfs/dbraw/zinc/23/77/81/1053237781.db2.gz JKQFUUUMTAZEOM-MSOLQXFVSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cnn1-c1ccccc1 ZINC000764627577 1053237812 /nfs/dbraw/zinc/23/78/12/1053237812.db2.gz JKQFUUUMTAZEOM-MSOLQXFVSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1c([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cnn1-c1ccccc1 ZINC000764627577 1053237831 /nfs/dbraw/zinc/23/78/31/1053237831.db2.gz JKQFUUUMTAZEOM-MSOLQXFVSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)CSC(C)(C)C)CC1 ZINC000765051891 1053425524 /nfs/dbraw/zinc/42/55/24/1053425524.db2.gz OAGNFWYKVOIIDV-KRWDZBQOSA-N 2 1 334.573 4.469 20 0 EIADMP CCC[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)C1CCCCC1 ZINC000765248733 1053476280 /nfs/dbraw/zinc/47/62/80/1053476280.db2.gz BQGDFHXELXRFLF-IBGZPJMESA-N 2 1 326.488 4.414 20 0 EIADMP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000865451793 1053513289 /nfs/dbraw/zinc/51/32/89/1053513289.db2.gz ZZBVISCHKCSWNZ-UHFFFAOYSA-N 2 1 331.529 4.182 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000865451793 1053513301 /nfs/dbraw/zinc/51/33/01/1053513301.db2.gz ZZBVISCHKCSWNZ-UHFFFAOYSA-N 2 1 331.529 4.182 20 0 EIADMP FC(F)(F)c1ccccc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000385614824 1053535505 /nfs/dbraw/zinc/53/55/05/1053535505.db2.gz OOKWEDXLBCRIRO-QGZVFWFLSA-N 2 1 348.412 4.317 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)COc2ccccc2)cc1 ZINC000765435649 1053545885 /nfs/dbraw/zinc/54/58/85/1053545885.db2.gz CLOUPGVXRJAIEY-SJORKVTESA-N 2 1 335.451 4.299 20 0 EIADMP C[C@@]1(C[NH2+]Cc2ccc(C(F)F)nc2)CC[N@H+](Cc2ccccc2)C1 ZINC000865555378 1053545875 /nfs/dbraw/zinc/54/58/75/1053545875.db2.gz YTCVZXHBBBPMKZ-FQEVSTJZSA-N 2 1 345.437 4.021 20 0 EIADMP C[C@@]1(C[NH2+]Cc2ccc(C(F)F)nc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000865555378 1053545898 /nfs/dbraw/zinc/54/58/98/1053545898.db2.gz YTCVZXHBBBPMKZ-FQEVSTJZSA-N 2 1 345.437 4.021 20 0 EIADMP Fc1ccccc1C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000429509931 1053619124 /nfs/dbraw/zinc/61/91/24/1053619124.db2.gz GSPVDARRPKWYRD-URVUXULASA-N 2 1 338.470 4.326 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)CCc1cccnc1 ZINC000866233187 1053658535 /nfs/dbraw/zinc/65/85/35/1053658535.db2.gz SGRDREPNVNFFFO-GOSISDBHSA-N 2 1 325.500 4.033 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866239242 1053660980 /nfs/dbraw/zinc/66/09/80/1053660980.db2.gz RYYFKZPLNXNRRL-GFCCVEGCSA-N 2 1 333.863 4.006 20 0 EIADMP C[C@H](CCc1cncc2ccccc21)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000866368858 1053706484 /nfs/dbraw/zinc/70/64/84/1053706484.db2.gz FEQKURPPEVUXQO-QGZVFWFLSA-N 2 1 325.500 4.020 20 0 EIADMP C[C@H](Cc1cccs1)[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000690007591 1053742042 /nfs/dbraw/zinc/74/20/42/1053742042.db2.gz SPBAGCJURPZFBJ-YLJYHZDGSA-N 2 1 328.525 4.181 20 0 EIADMP COc1ccc(C)cc1C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386612532 1053802670 /nfs/dbraw/zinc/80/26/70/1053802670.db2.gz KQHGRCAASPCOBQ-ICSRJNTNSA-N 2 1 338.495 4.004 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCC[C@@]1(C)Cc1ccc(F)c(Cl)c1 ZINC001197003450 1053820332 /nfs/dbraw/zinc/82/03/32/1053820332.db2.gz HHZBRQUBIAFYHA-SFHVURJKSA-N 2 1 335.854 4.081 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCC[C@@]1(C)Cc1ccc(F)c(Cl)c1 ZINC001197003450 1053820347 /nfs/dbraw/zinc/82/03/47/1053820347.db2.gz HHZBRQUBIAFYHA-SFHVURJKSA-N 2 1 335.854 4.081 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429515150 1053852979 /nfs/dbraw/zinc/85/29/79/1053852979.db2.gz AYHXBRLUSRFHAI-UWJYYQICSA-N 2 1 326.459 4.041 20 0 EIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1CC[C@@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026244 1054060511 /nfs/dbraw/zinc/06/05/11/1054060511.db2.gz BPFQQULXDYHFPO-CABCVRRESA-N 2 1 340.433 4.156 20 0 EIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CC[C@@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026244 1054060525 /nfs/dbraw/zinc/06/05/25/1054060525.db2.gz BPFQQULXDYHFPO-CABCVRRESA-N 2 1 340.433 4.156 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CC[C@@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026244 1054060533 /nfs/dbraw/zinc/06/05/33/1054060533.db2.gz BPFQQULXDYHFPO-CABCVRRESA-N 2 1 340.433 4.156 20 0 EIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CC[C@@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026244 1054060543 /nfs/dbraw/zinc/06/05/43/1054060543.db2.gz BPFQQULXDYHFPO-CABCVRRESA-N 2 1 340.433 4.156 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCC[C@H]1c1ccccc1Cl ZINC000542667113 1054180111 /nfs/dbraw/zinc/18/01/11/1054180111.db2.gz WYFZVZWIYUGQNX-LJHODMEESA-N 2 1 331.891 4.407 20 0 EIADMP CCC[N@@H+](CC1CC(F)(F)C1)C1CCN(Cc2ccccc2)CC1 ZINC001198640488 1054215335 /nfs/dbraw/zinc/21/53/35/1054215335.db2.gz DEAOZNKHKKAKCH-UHFFFAOYSA-N 2 1 336.470 4.408 20 0 EIADMP CCSc1ccccc1C[N@@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001198819702 1054274069 /nfs/dbraw/zinc/27/40/69/1054274069.db2.gz GTPNZWQDADXVQO-BGYRXZFFSA-N 2 1 330.541 4.106 20 0 EIADMP CCSc1ccccc1C[N@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001198819702 1054274089 /nfs/dbraw/zinc/27/40/89/1054274089.db2.gz GTPNZWQDADXVQO-BGYRXZFFSA-N 2 1 330.541 4.106 20 0 EIADMP CCSc1ccccc1C[NH+]1C[C@@]23C[N@H+](C)C[C@]2(C1)CCCC3 ZINC001198819702 1054274108 /nfs/dbraw/zinc/27/41/08/1054274108.db2.gz GTPNZWQDADXVQO-BGYRXZFFSA-N 2 1 330.541 4.106 20 0 EIADMP CCSc1ccccc1C[NH+]1C[C@@]23C[N@@H+](C)C[C@]2(C1)CCCC3 ZINC001198819702 1054274122 /nfs/dbraw/zinc/27/41/22/1054274122.db2.gz GTPNZWQDADXVQO-BGYRXZFFSA-N 2 1 330.541 4.106 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCOC3(CCCC3)C2)CC1 ZINC000872025610 1054341525 /nfs/dbraw/zinc/34/15/25/1054341525.db2.gz QBDJOTDILLFBJN-OAQYLSRUSA-N 2 1 342.527 4.041 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)CC1 ZINC000872036620 1054353113 /nfs/dbraw/zinc/35/31/13/1054353113.db2.gz XRZVVOKYNUKNCY-QMMLZNLJSA-N 2 1 344.543 4.395 20 0 EIADMP CC[C@H]([NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)[C@@H]1CCCOC1 ZINC000872040802 1054356974 /nfs/dbraw/zinc/35/69/74/1054356974.db2.gz CJAKGHSESZZJMG-CVAIRZPRSA-N 2 1 327.472 4.037 20 0 EIADMP CC[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000872066301 1054374022 /nfs/dbraw/zinc/37/40/22/1054374022.db2.gz GWMCKXHFCUYFPH-DLBZAZTESA-N 2 1 328.422 4.219 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@@H]1CCOC(C)(C)C1 ZINC001199267675 1054375664 /nfs/dbraw/zinc/37/56/64/1054375664.db2.gz QJGWWHLOXFOBHG-FXAWDEMLSA-N 2 1 330.516 4.108 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+][C@H]1CCOC(C)(C)C1 ZINC001199267679 1054377778 /nfs/dbraw/zinc/37/77/78/1054377778.db2.gz QJGWWHLOXFOBHG-XLIONFOSSA-N 2 1 330.516 4.108 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(OC(F)F)c(F)c1 ZINC001199336160 1054394251 /nfs/dbraw/zinc/39/42/51/1054394251.db2.gz IDTFXUFRASPOAM-CQSZACIVSA-N 2 1 344.421 4.171 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1 ZINC000872131114 1054406697 /nfs/dbraw/zinc/40/66/97/1054406697.db2.gz PPDNDUIRIBZDHE-LBPRGKRZSA-N 2 1 329.410 4.014 20 0 EIADMP [NH3+][C@@H](C[C@H]1CCC[N@@H+](Cc2csc(C3CC3)n2)C1)C1CCCC1 ZINC000872156696 1054412949 /nfs/dbraw/zinc/41/29/49/1054412949.db2.gz LFYVEBYXQZGNLJ-KDOFPFPSSA-N 2 1 333.545 4.140 20 0 EIADMP C[C@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000858152183 1054426852 /nfs/dbraw/zinc/42/68/52/1054426852.db2.gz HBLCPDYQNWWYLE-SSKFGXFMSA-N 2 1 341.543 4.311 20 0 EIADMP C[C@]1(CN[C@H]2CCCc3scnc32)CC[N@@H+](Cc2ccccc2)C1 ZINC000858414664 1054484726 /nfs/dbraw/zinc/48/47/26/1054484726.db2.gz FWWSCRMYXDMFKV-FXAWDEMLSA-N 2 1 341.524 4.022 20 0 EIADMP CC(C)c1nc(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC001199981504 1054510914 /nfs/dbraw/zinc/51/09/14/1054510914.db2.gz VJHNEUFACZJBBF-UHFFFAOYSA-N 2 1 343.540 4.063 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000873200356 1054510975 /nfs/dbraw/zinc/51/09/75/1054510975.db2.gz FECIIOLMBDAHBR-GFCCVEGCSA-N 2 1 343.521 4.197 20 0 EIADMP C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000873200356 1054510990 /nfs/dbraw/zinc/51/09/90/1054510990.db2.gz FECIIOLMBDAHBR-GFCCVEGCSA-N 2 1 343.521 4.197 20 0 EIADMP CCNc1ccccc1C[NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC001200941773 1054596532 /nfs/dbraw/zinc/59/65/32/1054596532.db2.gz JMUKRTWXLCCPLB-GOSISDBHSA-N 2 1 325.500 4.119 20 0 EIADMP C[NH+](C)[C@@H]1CCC[N@@H+](CCCOc2ccc3ccccc3c2)CC1 ZINC000429546259 1054723545 /nfs/dbraw/zinc/72/35/45/1054723545.db2.gz BRLIKWSJCHJCAW-HXUWFJFHSA-N 2 1 326.484 4.025 20 0 EIADMP Cc1nc2ccccn2c1NC1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001201470224 1054811718 /nfs/dbraw/zinc/81/17/18/1054811718.db2.gz OAGRTFAEGNMCEW-UXHICEINSA-N 2 1 344.462 4.375 20 0 EIADMP Cc1[nH+]c2ccccn2c1NC1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001201470224 1054811719 /nfs/dbraw/zinc/81/17/19/1054811719.db2.gz OAGRTFAEGNMCEW-UXHICEINSA-N 2 1 344.462 4.375 20 0 EIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2cc(F)ccc2F)C[N@H+]1Cc1ccccc1 ZINC001201492023 1054818309 /nfs/dbraw/zinc/81/83/09/1054818309.db2.gz PANQHTNAIMUPLH-AEFFLSMTSA-N 2 1 344.449 4.355 20 0 EIADMP C[NH+](C)Cc1cccc(NC2=C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001201474612 1054827974 /nfs/dbraw/zinc/82/79/74/1054827974.db2.gz HEXACQTXISVTPF-PKTZIBPZSA-N 2 1 347.506 4.481 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(F)F)c(F)c2)C1 ZINC001201557109 1054847291 /nfs/dbraw/zinc/84/72/91/1054847291.db2.gz DVALHEDSYMPMML-HNNXBMFYSA-N 2 1 328.422 4.221 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(F)F)c(F)c2)C1 ZINC001201557109 1054847295 /nfs/dbraw/zinc/84/72/95/1054847295.db2.gz DVALHEDSYMPMML-HNNXBMFYSA-N 2 1 328.422 4.221 20 0 EIADMP c1ccc(CCC[NH+]2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)cc1 ZINC001201662089 1054879753 /nfs/dbraw/zinc/87/97/53/1054879753.db2.gz FLNQCWJMVQWXDO-UHFFFAOYSA-N 2 1 349.522 4.002 20 0 EIADMP CCCCCC[N@@H+]1CCc2c(C[NH+](C)Cc3ccco3)cncc2C1 ZINC001201751841 1054896448 /nfs/dbraw/zinc/89/64/48/1054896448.db2.gz XFQCOSGYWGODBF-UHFFFAOYSA-N 2 1 341.499 4.245 20 0 EIADMP CCCCCC[N@H+]1CCc2c(C[NH+](C)Cc3ccco3)cncc2C1 ZINC001201751841 1054896450 /nfs/dbraw/zinc/89/64/50/1054896450.db2.gz XFQCOSGYWGODBF-UHFFFAOYSA-N 2 1 341.499 4.245 20 0 EIADMP CCCCCC[NH+]1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001201751841 1054896453 /nfs/dbraw/zinc/89/64/53/1054896453.db2.gz XFQCOSGYWGODBF-UHFFFAOYSA-N 2 1 341.499 4.245 20 0 EIADMP CCCCCC[NH+]1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001201751841 1054896457 /nfs/dbraw/zinc/89/64/57/1054896457.db2.gz XFQCOSGYWGODBF-UHFFFAOYSA-N 2 1 341.499 4.245 20 0 EIADMP CCCCCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201755213 1054897821 /nfs/dbraw/zinc/89/78/21/1054897821.db2.gz UPSUUPRRYPCDPR-CEWLAPEOSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201755213 1054897828 /nfs/dbraw/zinc/89/78/28/1054897828.db2.gz UPSUUPRRYPCDPR-CEWLAPEOSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201755213 1054897834 /nfs/dbraw/zinc/89/78/34/1054897834.db2.gz UPSUUPRRYPCDPR-CEWLAPEOSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001201755213 1054897838 /nfs/dbraw/zinc/89/78/38/1054897838.db2.gz UPSUUPRRYPCDPR-CEWLAPEOSA-N 2 1 329.532 4.194 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(Cl)c2N)[C@@H]1c1cccs1 ZINC000877055177 1055008315 /nfs/dbraw/zinc/00/83/15/1055008315.db2.gz QEWFPIMDIQQQGI-RDTXWAMCSA-N 2 1 349.931 4.156 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cccc(Cl)c2N)[C@@H]1c1cccs1 ZINC000877055177 1055008333 /nfs/dbraw/zinc/00/83/33/1055008333.db2.gz QEWFPIMDIQQQGI-RDTXWAMCSA-N 2 1 349.931 4.156 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc2cc[nH]c2c1 ZINC000862324736 1055049283 /nfs/dbraw/zinc/04/92/83/1055049283.db2.gz UGDNLLLVSHYCAG-UHFFFAOYSA-N 2 1 348.494 4.301 20 0 EIADMP Cc1cc([NH+]2CCCCCC2)ccc1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000671766318 1055072063 /nfs/dbraw/zinc/07/20/63/1055072063.db2.gz CWVSLAHOOGJBMC-RTBURBONSA-N 2 1 327.516 4.414 20 0 EIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](CCC(F)(F)F)C[C@H]21 ZINC001202328549 1055142272 /nfs/dbraw/zinc/14/22/72/1055142272.db2.gz HNJRBGOQNWHGLN-FVQBIDKESA-N 2 1 346.462 4.233 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+](CCC(F)(F)F)C[C@H]21 ZINC001202328549 1055142275 /nfs/dbraw/zinc/14/22/75/1055142275.db2.gz HNJRBGOQNWHGLN-FVQBIDKESA-N 2 1 346.462 4.233 20 0 EIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+](CCC(F)(F)F)C[C@H]21 ZINC001202328549 1055142278 /nfs/dbraw/zinc/14/22/78/1055142278.db2.gz HNJRBGOQNWHGLN-FVQBIDKESA-N 2 1 346.462 4.233 20 0 EIADMP CC(C)[N@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+](CCCC(F)(F)F)C[C@@H]21 ZINC001202415394 1055162157 /nfs/dbraw/zinc/16/21/57/1055162157.db2.gz KCJJOWUGQBRIMA-BZSNNMDCSA-N 2 1 340.433 4.439 20 0 EIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+](CCCC(F)(F)F)C[C@@H]21 ZINC001202415394 1055162166 /nfs/dbraw/zinc/16/21/66/1055162166.db2.gz KCJJOWUGQBRIMA-BZSNNMDCSA-N 2 1 340.433 4.439 20 0 EIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+](CCCC(F)(F)F)C[C@@H]21 ZINC001202415394 1055162170 /nfs/dbraw/zinc/16/21/70/1055162170.db2.gz KCJJOWUGQBRIMA-BZSNNMDCSA-N 2 1 340.433 4.439 20 0 EIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+](CCCC(F)(F)F)C[C@@H]21 ZINC001202415394 1055162176 /nfs/dbraw/zinc/16/21/76/1055162176.db2.gz KCJJOWUGQBRIMA-BZSNNMDCSA-N 2 1 340.433 4.439 20 0 EIADMP C[N@@H+](CCCC(F)(F)F)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001202433326 1055183834 /nfs/dbraw/zinc/18/38/34/1055183834.db2.gz MPFSEVYUWYGEMC-UHFFFAOYSA-N 2 1 328.422 4.173 20 0 EIADMP CC[NH+](CC)CCCC1CC[NH+](Cc2cc(-c3ccco3)on2)CC1 ZINC000542947759 1056833291 /nfs/dbraw/zinc/83/32/91/1056833291.db2.gz HZLYIFGFOAPSGZ-UHFFFAOYSA-N 2 1 345.487 4.269 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000379737955 1060260017 /nfs/dbraw/zinc/26/00/17/1060260017.db2.gz CRMVDNLARQSITM-MGPUTAFESA-N 2 1 343.540 4.323 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2cnccc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000388982831 1060280212 /nfs/dbraw/zinc/28/02/12/1060280212.db2.gz RCJPPVGROIXVEJ-WZONZLPQSA-N 2 1 345.490 4.235 20 0 EIADMP C[C@H]1CCCC[C@H]1C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001168825266 1060431447 /nfs/dbraw/zinc/43/14/47/1060431447.db2.gz HRUOHJMONODKKW-ICSRJNTNSA-N 2 1 329.532 4.446 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccccc1Br)C2 ZINC001169124259 1060649519 /nfs/dbraw/zinc/64/95/19/1060649519.db2.gz BFCXBWYXSHPULW-BASYENTBSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccccc1Br)C2 ZINC001169124259 1060649527 /nfs/dbraw/zinc/64/95/27/1060649527.db2.gz BFCXBWYXSHPULW-BASYENTBSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1ccccc1Br)C2 ZINC001169124259 1060649528 /nfs/dbraw/zinc/64/95/28/1060649528.db2.gz BFCXBWYXSHPULW-BASYENTBSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1ccccc1Br)C2 ZINC001169124259 1060649535 /nfs/dbraw/zinc/64/95/35/1060649535.db2.gz BFCXBWYXSHPULW-BASYENTBSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCc1ccc(CCc3ccccc3)cc1)C2 ZINC001169124002 1060649623 /nfs/dbraw/zinc/64/96/23/1060649623.db2.gz OZRFIQSMOIIFSG-BKFWDETESA-N 2 1 348.534 4.229 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147033 1060666254 /nfs/dbraw/zinc/66/62/54/1060666254.db2.gz RMUHRKPLVPREKM-JONQDZQNSA-N 2 1 339.310 4.408 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CC[C@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147033 1060666261 /nfs/dbraw/zinc/66/62/61/1060666261.db2.gz RMUHRKPLVPREKM-JONQDZQNSA-N 2 1 339.310 4.408 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CC[C@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147033 1060666271 /nfs/dbraw/zinc/66/62/71/1060666271.db2.gz RMUHRKPLVPREKM-JONQDZQNSA-N 2 1 339.310 4.408 20 0 EIADMP C[N@H+]1CC[C@H](c2ccc(N[C@@H]3CC(C)(C)C[C@](C)(C[NH3+])C3)cc2)C1 ZINC001169148770 1060668092 /nfs/dbraw/zinc/66/80/92/1060668092.db2.gz ZYHNFNMFNAQZES-FBBABVLZSA-N 2 1 329.532 4.061 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)CCC[C@H]1C[NH3+] ZINC001206013210 1060863427 /nfs/dbraw/zinc/86/34/27/1060863427.db2.gz QIVIPSVBQFYZPO-MNOVXSKESA-N 2 1 335.706 4.454 20 0 EIADMP Cc1nc(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)sc1C(C)(C)C ZINC001169782253 1060964508 /nfs/dbraw/zinc/96/45/08/1060964508.db2.gz YBVJQCCJKUTNMG-UHFFFAOYSA-N 2 1 335.561 4.057 20 0 EIADMP CCC[C@]1(COC)CCC[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001169780628 1060965722 /nfs/dbraw/zinc/96/57/22/1060965722.db2.gz OKHLTRJELCJOND-JOCHJYFZSA-N 2 1 344.543 4.454 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000532225068 1032102497 /nfs/dbraw/zinc/10/24/97/1032102497.db2.gz KFTFQOYVURGCFD-AZUAARDMSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556102 1032451697 /nfs/dbraw/zinc/45/16/97/1032451697.db2.gz JTQAXXBMAOOBNC-MAUKXSAKSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556102 1032451704 /nfs/dbraw/zinc/45/17/04/1032451704.db2.gz JTQAXXBMAOOBNC-MAUKXSAKSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@@H]1C[N@H+](CCCC[NH2+]Cc2ccc(C(C)(C)C)s2)C[C@H](C)O1 ZINC000533200164 1032543799 /nfs/dbraw/zinc/54/37/99/1032543799.db2.gz MSLORNNIHLLARD-IYBDPMFKSA-N 2 1 338.561 4.025 20 0 EIADMP CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccccc1OC(F)F ZINC000178703991 1032544692 /nfs/dbraw/zinc/54/46/92/1032544692.db2.gz MMFIPKGASXCVPN-CJNGLKHVSA-N 2 1 337.414 4.170 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000180239896 1032598544 /nfs/dbraw/zinc/59/85/44/1032598544.db2.gz BEVMBTGTPWETNH-UHFFFAOYSA-N 2 1 333.479 4.393 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1nccn1C ZINC000246063798 1032652123 /nfs/dbraw/zinc/65/21/23/1032652123.db2.gz RORWEVBYPNVFMV-XLIONFOSSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1nccn1C ZINC000246063798 1032652129 /nfs/dbraw/zinc/65/21/29/1032652129.db2.gz RORWEVBYPNVFMV-XLIONFOSSA-N 2 1 340.515 4.035 20 0 EIADMP CCC1(C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CCOCC1 ZINC000512396970 1032664693 /nfs/dbraw/zinc/66/46/93/1032664693.db2.gz XVRRFJOWCCLKSY-CTNGQTDRSA-N 2 1 344.543 4.084 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)c(C)c2c1 ZINC000643545899 1018893196 /nfs/dbraw/zinc/89/31/96/1018893196.db2.gz FDTBVDSAEFNJQP-LSDHHAIUSA-N 2 1 328.456 4.075 20 0 EIADMP C[N@@H+](Cc1cc(-n2ccnc2)cs1)Cc1ccc(F)c(Cl)c1 ZINC000432793261 1032811594 /nfs/dbraw/zinc/81/15/94/1032811594.db2.gz OFOZRGZRTYBXTA-UHFFFAOYSA-N 2 1 335.835 4.358 20 0 EIADMP Cc1[nH+]ccn1CC[N@@H+]1CCC[C@@H]1c1ccc(Br)c(C)c1 ZINC000430227930 1019525372 /nfs/dbraw/zinc/52/53/72/1019525372.db2.gz QSFZXCFZBQWXMT-QGZVFWFLSA-N 2 1 348.288 4.100 20 0 EIADMP Cc1[nH+]ccn1CC[N@H+]1CCC[C@@H]1c1ccc(Br)c(C)c1 ZINC000430227930 1019525380 /nfs/dbraw/zinc/52/53/80/1019525380.db2.gz QSFZXCFZBQWXMT-QGZVFWFLSA-N 2 1 348.288 4.100 20 0 EIADMP CC[C@H](N[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1nc(C)cs1 ZINC000274895908 1019841193 /nfs/dbraw/zinc/84/11/93/1019841193.db2.gz KEXFROIPLNLWLA-NEWSRXKRSA-N 2 1 343.540 4.403 20 0 EIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(Cl)cn1 ZINC000274886557 1019843465 /nfs/dbraw/zinc/84/34/65/1019843465.db2.gz IQTUIZATKQCOEH-OAHLLOKOSA-N 2 1 329.875 4.182 20 0 EIADMP Fc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000180104981 1020059168 /nfs/dbraw/zinc/05/91/68/1020059168.db2.gz LGIYGHUIYIOZNV-FRIKZZABSA-N 2 1 338.470 4.153 20 0 EIADMP Fc1ccc(/C=C\C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1F ZINC000510209680 1020464380 /nfs/dbraw/zinc/46/43/80/1020464380.db2.gz RANQYVITXUPMRA-DAXSKMNVSA-N 2 1 342.433 4.232 20 0 EIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000398172927 1020513869 /nfs/dbraw/zinc/51/38/69/1020513869.db2.gz IGWVBDGHPDVTFL-SPEDKVCISA-N 2 1 338.495 4.256 20 0 EIADMP CC[C@H](CC(F)(F)F)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547830238 1020774791 /nfs/dbraw/zinc/77/47/91/1020774791.db2.gz KLSCIUISJUWKSL-DJIMGWMZSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)CS1 ZINC000655714692 1020911996 /nfs/dbraw/zinc/91/19/96/1020911996.db2.gz AMQNEZATMXAVIC-LPHOPBHVSA-N 2 1 344.524 4.285 20 0 EIADMP CC[NH+](CC)CCC[N@@H+](Cc1ccc2c(c1)OCO2)C1CCCCC1 ZINC001167318190 1021070362 /nfs/dbraw/zinc/07/03/62/1021070362.db2.gz FOQILPPJDBVWNX-UHFFFAOYSA-N 2 1 346.515 4.282 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCCc3ccc(O)cc32)C1 ZINC000340471530 1021079401 /nfs/dbraw/zinc/07/94/01/1021079401.db2.gz XWTNGHHCUSWIKV-LLGFUMIMSA-N 2 1 330.516 4.117 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccncc1F ZINC000340475464 1021096356 /nfs/dbraw/zinc/09/63/56/1021096356.db2.gz RQXNUJXCUNCVMM-IRXDYDNUSA-N 2 1 341.474 4.446 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1ccncc1F ZINC000340475464 1021096364 /nfs/dbraw/zinc/09/63/64/1021096364.db2.gz RQXNUJXCUNCVMM-IRXDYDNUSA-N 2 1 341.474 4.446 20 0 EIADMP Cc1cc(C)c(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c(C)n1 ZINC001167326760 1021129198 /nfs/dbraw/zinc/12/91/98/1021129198.db2.gz QGKZBCNRPCDZRP-FQEVSTJZSA-N 2 1 329.532 4.095 20 0 EIADMP Cc1cc(C)c(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c(C)n1 ZINC001167326760 1021129205 /nfs/dbraw/zinc/12/92/05/1021129205.db2.gz QGKZBCNRPCDZRP-FQEVSTJZSA-N 2 1 329.532 4.095 20 0 EIADMP C[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccncc1F ZINC000340529766 1021201618 /nfs/dbraw/zinc/20/16/18/1021201618.db2.gz CYUAWLWYHWAPDO-IPJUCJBFSA-N 2 1 341.474 4.315 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1ccc2cnccc2c1 ZINC000683765483 1021381428 /nfs/dbraw/zinc/38/14/28/1021381428.db2.gz QOIIGBZGNSVNCH-UHFFFAOYSA-N 2 1 333.479 4.365 20 0 EIADMP CC[N@@H+](C)Cc1cccc(CNC2CC[NH+](C3CCCCC3)CC2)c1 ZINC000123888493 1021553331 /nfs/dbraw/zinc/55/33/31/1021553331.db2.gz HZYJQOFNGHMIIM-UHFFFAOYSA-N 2 1 343.559 4.025 20 0 EIADMP CC[N@H+](C)Cc1cccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000123888493 1021553350 /nfs/dbraw/zinc/55/33/50/1021553350.db2.gz HZYJQOFNGHMIIM-UHFFFAOYSA-N 3 1 343.559 4.025 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000123888493 1021553367 /nfs/dbraw/zinc/55/33/67/1021553367.db2.gz HZYJQOFNGHMIIM-UHFFFAOYSA-N 3 1 343.559 4.025 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1csc(-c2ccccc2)n1 ZINC000414085166 1021824571 /nfs/dbraw/zinc/82/45/71/1021824571.db2.gz YCHDIZMNQGUJPL-CABCVRRESA-N 2 1 340.496 4.302 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000549011474 1021836390 /nfs/dbraw/zinc/83/63/90/1021836390.db2.gz VVUDIDZHDOBEGM-UHFFFAOYSA-N 2 1 346.887 4.148 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3[nH]ccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379632389 1021846132 /nfs/dbraw/zinc/84/61/32/1021846132.db2.gz SLGCWNOGMCOFDO-LAUBAEHRSA-N 2 1 333.479 4.311 20 0 EIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc3[nH]ccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379632389 1021846135 /nfs/dbraw/zinc/84/61/35/1021846135.db2.gz SLGCWNOGMCOFDO-LAUBAEHRSA-N 2 1 333.479 4.311 20 0 EIADMP CC[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000414168508 1022014835 /nfs/dbraw/zinc/01/48/35/1022014835.db2.gz AFEPZGYBROJFMW-YOEHRIQHSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1csc(-c2ccccc2)n1 ZINC000414169529 1022018610 /nfs/dbraw/zinc/01/86/10/1022018610.db2.gz BGFOFIAVLFHPPW-HZPDHXFCSA-N 2 1 329.513 4.193 20 0 EIADMP COc1ccc2cc([C@@H](C)[NH2+]CC[C@@H]3CCC[N@@H+](C)C3)ccc2c1 ZINC000414171313 1022024143 /nfs/dbraw/zinc/02/41/43/1022024143.db2.gz DFFQWXZJZKMYHY-SJORKVTESA-N 2 1 326.484 4.231 20 0 EIADMP CC[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1OC(F)F ZINC000414172932 1022029385 /nfs/dbraw/zinc/02/93/85/1022029385.db2.gz FUCDELJDGFKITB-HOCLYGCPSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[N@H+](C)C[C@@H]1CCn2cc[nH+]c2C1 ZINC000377861679 1022058566 /nfs/dbraw/zinc/05/85/66/1022058566.db2.gz SKJQCZDGKLGLBT-UONOGXRCSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[N@@H+](C)C[C@@H]1CCn2cc[nH+]c2C1 ZINC000377861679 1022058587 /nfs/dbraw/zinc/05/85/87/1022058587.db2.gz SKJQCZDGKLGLBT-UONOGXRCSA-N 2 1 337.389 4.157 20 0 EIADMP COc1ccc([C@@H]([NH2+]CC[C@H]2CCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000414199431 1022105956 /nfs/dbraw/zinc/10/59/56/1022105956.db2.gz XAUHQFMPDFKMPA-GCJKJVERSA-N 2 1 338.495 4.106 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1cncs1 ZINC000155768508 1022139803 /nfs/dbraw/zinc/13/98/03/1022139803.db2.gz DWCCRZDBAOPXLF-HOTGVXAUSA-N 2 1 329.513 4.226 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cnc1F ZINC000892572157 1022234965 /nfs/dbraw/zinc/23/49/65/1022234965.db2.gz UKLKAIVBOOMIFV-QGZVFWFLSA-N 2 1 341.474 4.193 20 0 EIADMP CO[C@@](C)([C@@H](C)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C1CC1 ZINC000414235541 1022251362 /nfs/dbraw/zinc/25/13/62/1022251362.db2.gz JXHFFDNDYIKHNP-MDOVXXIYSA-N 2 1 327.472 4.035 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CCC[C@H]([NH+](C)C)CC3)s2)cc1C ZINC000656257134 1022256209 /nfs/dbraw/zinc/25/62/09/1022256209.db2.gz HOBFBUPFVMANGO-SFHVURJKSA-N 2 1 343.540 4.343 20 0 EIADMP Cc1ccc(-c2ncc(C[N@@H+]3CCC[C@H]([NH+](C)C)CC3)s2)cc1C ZINC000656257134 1022256226 /nfs/dbraw/zinc/25/62/26/1022256226.db2.gz HOBFBUPFVMANGO-SFHVURJKSA-N 2 1 343.540 4.343 20 0 EIADMP Cc1cc(F)ncc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000892580270 1022313584 /nfs/dbraw/zinc/31/35/84/1022313584.db2.gz ILYADIVFSWCELC-QGZVFWFLSA-N 2 1 341.474 4.193 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CC[C@H]2CC2(Cl)Cl)C1 ZINC001167426424 1022326908 /nfs/dbraw/zinc/32/69/08/1022326908.db2.gz WTHVXJBNNBZTRA-PMPSAXMXSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CC[C@H]2CC2(Cl)Cl)C1 ZINC001167426424 1022326928 /nfs/dbraw/zinc/32/69/28/1022326928.db2.gz WTHVXJBNNBZTRA-PMPSAXMXSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CC[C@H]2CC2(Cl)Cl)C1 ZINC001167426424 1022326945 /nfs/dbraw/zinc/32/69/45/1022326945.db2.gz WTHVXJBNNBZTRA-PMPSAXMXSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CC[C@H]2CC2(Cl)Cl)C1 ZINC001167426424 1022326969 /nfs/dbraw/zinc/32/69/69/1022326969.db2.gz WTHVXJBNNBZTRA-PMPSAXMXSA-N 2 1 333.347 4.157 20 0 EIADMP c1ccc(-c2cccc(CNC[C@H]3CC[N@H+]3C3CCCCC3)c2)nc1 ZINC001203155727 1022384820 /nfs/dbraw/zinc/38/48/20/1022384820.db2.gz FNZMVOPYFPDOPP-OAQYLSRUSA-N 2 1 335.495 4.245 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000236810962 1022491243 /nfs/dbraw/zinc/49/12/43/1022491243.db2.gz LDAIZSBXTCCVEG-OAHLLOKOSA-N 2 1 332.875 4.422 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000236810962 1022491258 /nfs/dbraw/zinc/49/12/58/1022491258.db2.gz LDAIZSBXTCCVEG-OAHLLOKOSA-N 2 1 332.875 4.422 20 0 EIADMP FC(F)(F)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000374437439 1022760830 /nfs/dbraw/zinc/76/08/30/1022760830.db2.gz PQRJFVMVEGQDFJ-ALOPSCKCSA-N 2 1 326.406 4.114 20 0 EIADMP COc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000311058171 1022819872 /nfs/dbraw/zinc/81/98/72/1022819872.db2.gz WIHIIKPSQURYFO-QUCCMNQESA-N 2 1 338.495 4.258 20 0 EIADMP C[C@@H]1CCC[N@H+]1C1CC[NH+](CC2CCC(C(F)(F)F)CC2)CC1 ZINC000376499000 1022846493 /nfs/dbraw/zinc/84/64/93/1022846493.db2.gz CIRUGPXFRVZHJM-QQFBHYJXSA-N 2 1 332.454 4.304 20 0 EIADMP CC(C)(C)[C@H]([NH2+]Cc1cc(C2CC[NH2+]CC2)no1)c1cccc(F)c1 ZINC000425893708 1022969972 /nfs/dbraw/zinc/96/99/72/1022969972.db2.gz DWYCKNMHGSOYAP-LJQANCHMSA-N 2 1 345.462 4.158 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC2(OC)CCC(c3ccccc3)CC2)[C@@H](C)C1 ZINC000581292420 1022969556 /nfs/dbraw/zinc/96/95/56/1022969556.db2.gz HVJXTFYSGNRFTE-YOLZPYMBSA-N 2 1 344.543 4.049 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CC2(OC)CCC(c3ccccc3)CC2)[C@@H](C)C1 ZINC000581292419 1022971706 /nfs/dbraw/zinc/97/17/06/1022971706.db2.gz HVJXTFYSGNRFTE-PMJAUZGISA-N 2 1 344.543 4.049 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(C)nc2C)cc1F ZINC000363947637 1023029628 /nfs/dbraw/zinc/02/96/28/1023029628.db2.gz JDEGJYGTIHUPMY-CQSZACIVSA-N 2 1 338.430 4.182 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1cncs1 ZINC000156186549 1023115847 /nfs/dbraw/zinc/11/58/47/1023115847.db2.gz SFOQRWXVGBYLHK-CVEARBPZSA-N 2 1 329.513 4.368 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCN(c3ccccc3)C2)cc1 ZINC000153856877 1023347651 /nfs/dbraw/zinc/34/76/51/1023347651.db2.gz AURFVGHRHOUMBD-FXAWDEMLSA-N 2 1 346.478 4.110 20 0 EIADMP CCCCOc1ccc(C[N@H+](C)C2CC[NH+](CCC)CC2)cc1OC ZINC000510434154 1023377058 /nfs/dbraw/zinc/37/70/58/1023377058.db2.gz BKCHZDDINUOOEB-UHFFFAOYSA-N 2 1 348.531 4.180 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)C2CC[NH+](CCC)CC2)cc1OC ZINC000510434154 1023377067 /nfs/dbraw/zinc/37/70/67/1023377067.db2.gz BKCHZDDINUOOEB-UHFFFAOYSA-N 2 1 348.531 4.180 20 0 EIADMP Cc1ccc(-c2ncc(C[N@H+]3CCCC[C@H]3[C@@H]3CC[NH2+]C3)s2)cc1 ZINC000415038597 1023403488 /nfs/dbraw/zinc/40/34/88/1023403488.db2.gz IABAIWHEXITKRM-MJGOQNOKSA-N 2 1 341.524 4.083 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc(-n2cccn2)c1 ZINC000415078502 1023422464 /nfs/dbraw/zinc/42/24/64/1023422464.db2.gz GMVOBEPCFYCGHG-RBDMOPTHSA-N 2 1 346.478 4.016 20 0 EIADMP CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000415100273 1023444477 /nfs/dbraw/zinc/44/44/77/1023444477.db2.gz HUMIFGBOZKTVKT-YESZJQIVSA-N 2 1 328.504 4.018 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000570946462 1023486538 /nfs/dbraw/zinc/48/65/38/1023486538.db2.gz VMCYSDRZIPSCBG-SQGPQFPESA-N 2 1 348.494 4.124 20 0 EIADMP CC[NH+]1CCC([N@H+](C)C[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000500139458 1023537945 /nfs/dbraw/zinc/53/79/45/1023537945.db2.gz OFPVNUWYFMAFJM-AWEZNQCLSA-N 2 1 328.422 4.225 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)C[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000500139458 1023537951 /nfs/dbraw/zinc/53/79/51/1023537951.db2.gz OFPVNUWYFMAFJM-AWEZNQCLSA-N 2 1 328.422 4.225 20 0 EIADMP COc1ccsc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C)[C@@H]1c1ccccc1 ZINC000364312265 1023605260 /nfs/dbraw/zinc/60/52/60/1023605260.db2.gz BTBQEGLLVHVWBE-QILLFSRXSA-N 2 1 330.497 4.100 20 0 EIADMP CC[NH+](CC)Cc1cc(OC)ccc1NCCC[N@H+]1CCCC[C@H]1C ZINC001167753919 1023634053 /nfs/dbraw/zinc/63/40/53/1023634053.db2.gz MNUVOSBNUYFTQS-GOSISDBHSA-N 2 1 347.547 4.213 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCNc1ccc(SC2CC[NH2+]CC2)cc1 ZINC001167755032 1023640484 /nfs/dbraw/zinc/64/04/84/1023640484.db2.gz YZGHKSBOAQRRKD-KRWDZBQOSA-N 2 1 347.572 4.207 20 0 EIADMP COc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000390543209 1023661103 /nfs/dbraw/zinc/66/11/03/1023661103.db2.gz HTSYRMKGUREAPE-NRFANRHFSA-N 2 1 338.495 4.086 20 0 EIADMP COc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000390543209 1023661107 /nfs/dbraw/zinc/66/11/07/1023661107.db2.gz HTSYRMKGUREAPE-NRFANRHFSA-N 2 1 338.495 4.086 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[N@@H+]2CCC[C@H]2c2cnn(C)c2C)cc1 ZINC000377694835 1023688074 /nfs/dbraw/zinc/68/80/74/1023688074.db2.gz FJIRYSDDHXCGJB-BTYIYWSLSA-N 2 1 349.482 4.121 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[N@H+]2CCC[C@H]2c2cnn(C)c2C)cc1 ZINC000377694835 1023688080 /nfs/dbraw/zinc/68/80/80/1023688080.db2.gz FJIRYSDDHXCGJB-BTYIYWSLSA-N 2 1 349.482 4.121 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[N@H+](C)C[C@H]1CCc2[nH+]ccn2C1 ZINC000377699909 1023695131 /nfs/dbraw/zinc/69/51/31/1023695131.db2.gz QVWBJDVLRYCWDP-UONOGXRCSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[N@@H+](C)C[C@H]1CCc2[nH+]ccn2C1 ZINC000377699909 1023695134 /nfs/dbraw/zinc/69/51/34/1023695134.db2.gz QVWBJDVLRYCWDP-UONOGXRCSA-N 2 1 337.389 4.157 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)o1 ZINC000377750838 1023741841 /nfs/dbraw/zinc/74/18/41/1023741841.db2.gz WTCJWEDELPJKBG-SJORKVTESA-N 2 1 328.431 4.111 20 0 EIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@@H](c4cccnc4)C3)C2)cc1 ZINC000500382547 1023770194 /nfs/dbraw/zinc/77/01/94/1023770194.db2.gz HQVZFYDPXTVPIL-MQSCRBSSSA-N 2 1 349.522 4.220 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CCCOc2ccc(Cl)cc2Cl)[C@H](C)C1 ZINC000468851336 1023995358 /nfs/dbraw/zinc/99/53/58/1023995358.db2.gz FOXFAKNTJGTJHV-CJNGLKHVSA-N 2 1 345.314 4.082 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cc3cnccc3o2)CC[N@@H+]1Cc1ccccc1 ZINC000651637989 1024062459 /nfs/dbraw/zinc/06/24/59/1024062459.db2.gz HEEBYAABMNNZDA-PXNSSMCTSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cc3cnccc3o2)CC[N@H+]1Cc1ccccc1 ZINC000651637989 1024062477 /nfs/dbraw/zinc/06/24/77/1024062477.db2.gz HEEBYAABMNNZDA-PXNSSMCTSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2cc3cnccc3o2)CC[NH+]1Cc1ccccc1 ZINC000651637989 1024062497 /nfs/dbraw/zinc/06/24/97/1024062497.db2.gz HEEBYAABMNNZDA-PXNSSMCTSA-N 2 1 349.478 4.313 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cc3cnccc3o2)CC[NH+]1Cc1ccccc1 ZINC000651637989 1024062515 /nfs/dbraw/zinc/06/25/15/1024062515.db2.gz HEEBYAABMNNZDA-PXNSSMCTSA-N 2 1 349.478 4.313 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000510696124 1024242152 /nfs/dbraw/zinc/24/21/52/1024242152.db2.gz QALCQHGTNWGAMP-HTAPYJJXSA-N 2 1 338.470 4.297 20 0 EIADMP Cc1cccc([C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2cccc(F)c2)c1 ZINC000510696124 1024242174 /nfs/dbraw/zinc/24/21/74/1024242174.db2.gz QALCQHGTNWGAMP-HTAPYJJXSA-N 2 1 338.470 4.297 20 0 EIADMP Cc1cccc([C@H]([NH2+]C2CCN(C3CC3)CC2)c2cccc(F)c2)c1 ZINC000510698931 1024252235 /nfs/dbraw/zinc/25/22/35/1024252235.db2.gz ADIANPLCNCZDCB-QFIPXVFZSA-N 2 1 338.470 4.440 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCC[C@@H]2CCCF)CC1 ZINC000510756707 1024401122 /nfs/dbraw/zinc/40/11/22/1024401122.db2.gz SGXWXNMYNUTMPD-NQIIRXRSSA-N 2 1 332.507 4.467 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)cc1 ZINC000432244384 1024727259 /nfs/dbraw/zinc/72/72/59/1024727259.db2.gz BKAAADZZIWFFSA-UHFFFAOYSA-N 2 1 341.257 4.484 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481305 1024825211 /nfs/dbraw/zinc/82/52/11/1024825211.db2.gz MWFKQSDJOWAXQU-BBTUJRGHSA-N 2 1 337.511 4.205 20 0 EIADMP Brc1ccc2c(c1)[C@H]([NH2+]C1CC([NH+]3CCCCC3)C1)CC2 ZINC000510948835 1024862903 /nfs/dbraw/zinc/86/29/03/1024862903.db2.gz JGHCLBIAUHCYHA-LEOMRAHMSA-N 2 1 349.316 4.043 20 0 EIADMP CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]CCCn1cc[nH+]c1C ZINC000510957678 1024864899 /nfs/dbraw/zinc/86/48/99/1024864899.db2.gz IPAGWLSRJDTSEZ-INIZCTEOSA-N 2 1 340.298 4.499 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCC[C@H]1c1ccc(OC(C)C)cc1 ZINC000510961553 1024867719 /nfs/dbraw/zinc/86/77/19/1024867719.db2.gz MKNKJIIIRYAPEW-LEWJYISDSA-N 2 1 341.499 4.295 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCC[C@H]1c1ccc(OC(C)C)cc1 ZINC000510961556 1024867962 /nfs/dbraw/zinc/86/79/62/1024867962.db2.gz MKNKJIIIRYAPEW-SFTDATJTSA-N 2 1 341.499 4.295 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCC[C@@H]1c1ccc(OC(C)C)cc1 ZINC000510961555 1024868132 /nfs/dbraw/zinc/86/81/32/1024868132.db2.gz MKNKJIIIRYAPEW-RTWAWAEBSA-N 2 1 341.499 4.295 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc(-c3cccnc3)c2)CC1 ZINC000535813089 1024959820 /nfs/dbraw/zinc/95/98/20/1024959820.db2.gz BAHSKKUKSPTLIE-UHFFFAOYSA-N 2 1 337.511 4.301 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCC1 ZINC000342026980 1025041210 /nfs/dbraw/zinc/04/12/10/1025041210.db2.gz WIEPQODTCTYBSD-QGZVFWFLSA-N 2 1 337.389 4.341 20 0 EIADMP CC1(C)CC[C@H]([NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)c2ccccc21 ZINC000684612475 1025069552 /nfs/dbraw/zinc/06/95/52/1025069552.db2.gz UOANEFWKNRZIRH-NQIIRXRSSA-N 2 1 342.527 4.032 20 0 EIADMP FC(F)(F)c1ccc(-c2cccc(C[N@@H+]3CCC[NH2+]CC3)c2)cc1 ZINC001204667355 1025597802 /nfs/dbraw/zinc/59/78/02/1025597802.db2.gz JCZHZHWGCBXLAU-UHFFFAOYSA-N 2 1 334.385 4.168 20 0 EIADMP FC(F)(F)c1ccc(-c2cccc(C[N@H+]3CCC[NH2+]CC3)c2)cc1 ZINC001204667355 1025597820 /nfs/dbraw/zinc/59/78/20/1025597820.db2.gz JCZHZHWGCBXLAU-UHFFFAOYSA-N 2 1 334.385 4.168 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1c1ccc(OC)c(OC)c1 ZINC001167825459 1025602516 /nfs/dbraw/zinc/60/25/16/1025602516.db2.gz JHQOVICCIUBRFH-HKUYNNGSSA-N 2 1 348.531 4.351 20 0 EIADMP Cc1cccc2[nH]c(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)cc21 ZINC000657285883 1025612524 /nfs/dbraw/zinc/61/25/24/1025612524.db2.gz OJOUNPGUVWAECH-UHFFFAOYSA-N 2 1 333.479 4.231 20 0 EIADMP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000643524153 1025677501 /nfs/dbraw/zinc/67/75/01/1025677501.db2.gz QLGZEWXEDHDCHO-RZUBCFFCSA-N 2 1 349.453 4.323 20 0 EIADMP CCC(CC)(C[NH2+]Cc1ncc(C[NH+](C)C)s1)c1ccccc1 ZINC000512037048 1025817884 /nfs/dbraw/zinc/81/78/84/1025817884.db2.gz DMGKNBGCYLEGMN-UHFFFAOYSA-N 2 1 331.529 4.052 20 0 EIADMP Cc1noc(C)c1[C@H](C)[NH2+]Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000663597968 1025830806 /nfs/dbraw/zinc/83/08/06/1025830806.db2.gz LGSJUVWWMDNAGH-HNNXBMFYSA-N 2 1 327.472 4.128 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc(-c2ccccc2Br)s1)[C@H](C)[NH3+] ZINC000415014152 1025855600 /nfs/dbraw/zinc/85/56/00/1025855600.db2.gz LMDKTYVZBLAIPK-WDEREUQCSA-N 2 1 339.302 4.003 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)C(c1ccccc1)c1ccccc1 ZINC000278955961 1025864296 /nfs/dbraw/zinc/86/42/96/1025864296.db2.gz LVLYXNODVCPAEX-MOPGFXCFSA-N 2 1 345.490 4.256 20 0 EIADMP C[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000432409158 1025878537 /nfs/dbraw/zinc/87/85/37/1025878537.db2.gz FGQFWCAWVCEDBS-MSOLQXFVSA-N 2 1 348.531 4.015 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCc3ccccc3OC2)cc1 ZINC000511052772 1025885335 /nfs/dbraw/zinc/88/53/35/1025885335.db2.gz ZHMBATLGOFEXQA-JXFKEZNVSA-N 2 1 347.462 4.225 20 0 EIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H](Cc2cccc(OC)c2)C1 ZINC001167841622 1025885938 /nfs/dbraw/zinc/88/59/38/1025885938.db2.gz NEKYNVCMKZZVFX-PZJWPPBQSA-N 2 1 346.559 4.460 20 0 EIADMP COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2CCCCn2ccnc2C)c1 ZINC000344034482 1025889783 /nfs/dbraw/zinc/88/97/83/1025889783.db2.gz FASLQLGNNBFDKQ-UZLBHIALSA-N 2 1 327.472 4.063 20 0 EIADMP COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2CCCCn2cc[nH+]c2C)c1 ZINC000344034482 1025889792 /nfs/dbraw/zinc/88/97/92/1025889792.db2.gz FASLQLGNNBFDKQ-UZLBHIALSA-N 2 1 327.472 4.063 20 0 EIADMP COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2CCCCn2cc[nH+]c2C)c1 ZINC000344034482 1025889796 /nfs/dbraw/zinc/88/97/96/1025889796.db2.gz FASLQLGNNBFDKQ-UZLBHIALSA-N 2 1 327.472 4.063 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1cc2ccccc2s1 ZINC000432425679 1025921254 /nfs/dbraw/zinc/92/12/54/1025921254.db2.gz WLPDSZJATQFXPX-JKSUJKDBSA-N 2 1 332.513 4.053 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1cc2ccccc2s1 ZINC000432425679 1025921272 /nfs/dbraw/zinc/92/12/72/1025921272.db2.gz WLPDSZJATQFXPX-JKSUJKDBSA-N 2 1 332.513 4.053 20 0 EIADMP CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C1(C)C ZINC000344066013 1025956270 /nfs/dbraw/zinc/95/62/70/1025956270.db2.gz DPOAMVDZCSKLEK-NIKGAXFTSA-N 2 1 327.472 4.035 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CCCO1 ZINC000432433116 1025972595 /nfs/dbraw/zinc/97/25/95/1025972595.db2.gz ZORANQBABCGQMQ-UTKZUKDTSA-N 2 1 348.506 4.148 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)s1 ZINC000512105004 1026005985 /nfs/dbraw/zinc/00/59/85/1026005985.db2.gz KPBARWIQPLWGMJ-QZTJIDSGSA-N 2 1 329.513 4.021 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1ccnn1-c1ccccc1 ZINC000279123746 1026113204 /nfs/dbraw/zinc/11/32/04/1026113204.db2.gz LYCNKMOEPJWYOI-UHFFFAOYSA-N 2 1 348.494 4.002 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Oc2cccnc2)cc1 ZINC000894521698 1026122743 /nfs/dbraw/zinc/12/27/43/1026122743.db2.gz ZYQGRPBNQJSYJC-BPIHKTFHSA-N 2 1 337.467 4.150 20 0 EIADMP CC(C)C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccccn1 ZINC001167974271 1026173574 /nfs/dbraw/zinc/17/35/74/1026173574.db2.gz TWMHDQHFKNYGQL-QYYYHEGRSA-N 2 1 327.516 4.164 20 0 EIADMP CC(C)C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccccn1 ZINC001167974271 1026173582 /nfs/dbraw/zinc/17/35/82/1026173582.db2.gz TWMHDQHFKNYGQL-QYYYHEGRSA-N 2 1 327.516 4.164 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000072097767 1026217791 /nfs/dbraw/zinc/21/77/91/1026217791.db2.gz SBFHMOFUFYYPSU-UHFFFAOYSA-N 2 1 326.459 4.170 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC2([C@H](C)CCO)CCC2)cc1 ZINC000344301525 1026229009 /nfs/dbraw/zinc/22/90/09/1026229009.db2.gz JNUMHOOVUSUWAS-SJORKVTESA-N 2 1 341.499 4.020 20 0 EIADMP C[C@@H](c1ncc(-c2ccccc2)o1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000152248084 1026253195 /nfs/dbraw/zinc/25/31/95/1026253195.db2.gz SQHSNBPWVWESRE-KRWDZBQOSA-N 2 1 339.483 4.210 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(CC2=Cc3ccccc3OC2)C1 ZINC000512192740 1026345992 /nfs/dbraw/zinc/34/59/92/1026345992.db2.gz BUEFTMLBGBGJEH-RBUKOAKNSA-N 2 1 340.511 4.049 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CCO2 ZINC001167981779 1026367834 /nfs/dbraw/zinc/36/78/34/1026367834.db2.gz JQPKWHUZXXBIEH-RGPMPMONSA-N 2 1 346.902 4.159 20 0 EIADMP Clc1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)CCO2 ZINC001167981779 1026367845 /nfs/dbraw/zinc/36/78/45/1026367845.db2.gz JQPKWHUZXXBIEH-RGPMPMONSA-N 2 1 346.902 4.159 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccc(OC)cc1 ZINC000163484654 1026382172 /nfs/dbraw/zinc/38/21/72/1026382172.db2.gz LGMGRFQZICBRJS-HXUWFJFHSA-N 2 1 339.483 4.108 20 0 EIADMP CCOc1ccc([C@@H](CC)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1OCC ZINC000152466753 1026586630 /nfs/dbraw/zinc/58/66/30/1026586630.db2.gz ULVCCFQPFKQDSA-QFBILLFUSA-N 2 1 346.515 4.009 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC000563353723 1026624016 /nfs/dbraw/zinc/62/40/16/1026624016.db2.gz FPAQQNSYJPYHIV-UHFFFAOYSA-N 2 1 331.463 4.295 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC000563353723 1026624028 /nfs/dbraw/zinc/62/40/28/1026624028.db2.gz FPAQQNSYJPYHIV-UHFFFAOYSA-N 2 1 331.463 4.295 20 0 EIADMP Fc1ccccc1C[N@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000432664768 1026689805 /nfs/dbraw/zinc/68/98/05/1026689805.db2.gz OJFKBVJKTJCGAA-GOSISDBHSA-N 2 1 330.472 4.032 20 0 EIADMP Fc1ccccc1C[N@@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000432664768 1026689811 /nfs/dbraw/zinc/68/98/11/1026689811.db2.gz OJFKBVJKTJCGAA-GOSISDBHSA-N 2 1 330.472 4.032 20 0 EIADMP COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(-n3ccnc3)cs2)o1 ZINC000344898921 1026700455 /nfs/dbraw/zinc/70/04/55/1026700455.db2.gz VPUWFVKTQFFFOT-QGZVFWFLSA-N 2 1 343.452 4.010 20 0 EIADMP c1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH2+][C@H](c4cccnc4)C4CC4)[C@H]3C2)cc1 ZINC000507463488 1026804569 /nfs/dbraw/zinc/80/45/69/1026804569.db2.gz UCGSBTBJCOGUAY-MLCQCVOFSA-N 2 1 347.506 4.033 20 0 EIADMP Cc1nccn1CCCCS[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000582666647 1026921465 /nfs/dbraw/zinc/92/14/65/1026921465.db2.gz XMZHRKWKBNMEPR-FQEVSTJZSA-N 2 1 343.540 4.370 20 0 EIADMP Cc1[nH+]ccn1CCCCS[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000582666647 1026921476 /nfs/dbraw/zinc/92/14/76/1026921476.db2.gz XMZHRKWKBNMEPR-FQEVSTJZSA-N 2 1 343.540 4.370 20 0 EIADMP Cc1[nH+]ccn1CCCCS[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000582666647 1026921486 /nfs/dbraw/zinc/92/14/86/1026921486.db2.gz XMZHRKWKBNMEPR-FQEVSTJZSA-N 2 1 343.540 4.370 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cc(F)ccc2F)CC1 ZINC000519846786 1027017324 /nfs/dbraw/zinc/01/73/24/1027017324.db2.gz VXFVZCGLBMYZKV-UHFFFAOYSA-N 2 1 344.449 4.498 20 0 EIADMP CC[NH+]1CCC([NH2+][C@H](CCOC)c2ccc(Cl)c(Cl)c2)CC1 ZINC000342805906 1027072882 /nfs/dbraw/zinc/07/28/82/1027072882.db2.gz LEVUONDNTVULPF-QGZVFWFLSA-N 2 1 345.314 4.145 20 0 EIADMP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CC2([NH+](C)C)CCCCC2)cc1OC ZINC000474484558 1027121407 /nfs/dbraw/zinc/12/14/07/1027121407.db2.gz KUTGCCJCHFPODC-DLBZAZTESA-N 2 1 348.531 4.050 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCOC(C)(C)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168036134 1027138076 /nfs/dbraw/zinc/13/80/76/1027138076.db2.gz UBGWQLGWIYNOKQ-YHELAOLJSA-N 2 1 344.543 4.223 20 0 EIADMP Cc1cc(NC[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302504976 1027322055 /nfs/dbraw/zinc/32/20/55/1027322055.db2.gz WBRVNHILBAMCQG-KBXCAEBGSA-N 2 1 333.838 4.287 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cccc(O)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168040510 1027397802 /nfs/dbraw/zinc/39/78/02/1027397802.db2.gz NQYKMRXBJAHTJJ-RMFSNUHRSA-N 2 1 338.495 4.266 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cccc(O)c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168040510 1027397825 /nfs/dbraw/zinc/39/78/25/1027397825.db2.gz NQYKMRXBJAHTJJ-RMFSNUHRSA-N 2 1 338.495 4.266 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cccc(O)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040510 1027397852 /nfs/dbraw/zinc/39/78/52/1027397852.db2.gz NQYKMRXBJAHTJJ-RMFSNUHRSA-N 2 1 338.495 4.266 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc(O)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040510 1027397871 /nfs/dbraw/zinc/39/78/71/1027397871.db2.gz NQYKMRXBJAHTJJ-RMFSNUHRSA-N 2 1 338.495 4.266 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cccc(N(C)C)c2)cc1 ZINC000119882305 1027407601 /nfs/dbraw/zinc/40/76/01/1027407601.db2.gz KXTBOHYHJRJKSK-INIZCTEOSA-N 2 1 334.467 4.098 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCc2ccc(C(C)(C)C)cc2C1 ZINC000511201627 1027432481 /nfs/dbraw/zinc/43/24/81/1027432481.db2.gz RQJNQMTVILKAKZ-UHFFFAOYSA-N 2 1 325.500 4.328 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCc2ccc(C(C)(C)C)cc2C1 ZINC000511201627 1027432484 /nfs/dbraw/zinc/43/24/84/1027432484.db2.gz RQJNQMTVILKAKZ-UHFFFAOYSA-N 2 1 325.500 4.328 20 0 EIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc2ccccc2c1OC(F)F ZINC000519855779 1027436564 /nfs/dbraw/zinc/43/65/64/1027436564.db2.gz BEEJFSJNUMJNSZ-ZDUSSCGKSA-N 2 1 345.393 4.068 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H](C)C3CCCCC3)CC2)cs1 ZINC000474721408 1027439840 /nfs/dbraw/zinc/43/98/40/1027439840.db2.gz HHQSQEAMXDYHOT-INIZCTEOSA-N 2 1 349.588 4.476 20 0 EIADMP CCOC[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000474724646 1027440926 /nfs/dbraw/zinc/44/09/26/1027440926.db2.gz CLKJQMIZHQUYAM-HFSMHLIXSA-N 2 1 330.516 4.007 20 0 EIADMP Clc1ccc(CCC[N@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)cc1 ZINC000441410721 1027529607 /nfs/dbraw/zinc/52/96/07/1027529607.db2.gz LTMXLAKPEYUKPX-PXNSSMCTSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441410721 1027529609 /nfs/dbraw/zinc/52/96/09/1027529609.db2.gz LTMXLAKPEYUKPX-PXNSSMCTSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000441410721 1027529612 /nfs/dbraw/zinc/52/96/12/1027529612.db2.gz LTMXLAKPEYUKPX-PXNSSMCTSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000441410721 1027529617 /nfs/dbraw/zinc/52/96/17/1027529617.db2.gz LTMXLAKPEYUKPX-PXNSSMCTSA-N 2 1 332.919 4.221 20 0 EIADMP Clc1ccc(CCC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000441410721 1027529623 /nfs/dbraw/zinc/52/96/23/1027529623.db2.gz LTMXLAKPEYUKPX-PXNSSMCTSA-N 2 1 332.919 4.221 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCOCC2)cc1)c1ccc(Cl)cc1 ZINC000112517442 1027581236 /nfs/dbraw/zinc/58/12/36/1027581236.db2.gz HTADKICGZWLZHS-INIZCTEOSA-N 2 1 344.886 4.023 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@H]3CCC[C@H](CC(C)C)C3)CC2)nc(C)[nH+]1 ZINC000474881714 1027728877 /nfs/dbraw/zinc/72/88/77/1027728877.db2.gz WKXKXQNNSOLCBV-QUCCMNQESA-N 2 1 344.547 4.257 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCc2ccc(Br)cc21 ZINC000338012557 1027760197 /nfs/dbraw/zinc/76/01/97/1027760197.db2.gz SDDRQCFPGXADGS-QGZVFWFLSA-N 2 1 348.288 4.011 20 0 EIADMP Cc1cc([C@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)c(C)s1 ZINC000162231904 1027837364 /nfs/dbraw/zinc/83/73/64/1027837364.db2.gz SUYYHIMZIPCQEL-AWEZNQCLSA-N 2 1 344.528 4.091 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCc3c2cccc3C)cc1F ZINC000153692928 1027872499 /nfs/dbraw/zinc/87/24/99/1027872499.db2.gz MUUBPXHVNIWXAB-HXUWFJFHSA-N 2 1 335.426 4.405 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188657889 1028013789 /nfs/dbraw/zinc/01/37/89/1028013789.db2.gz FWUYJXWUEOMHOY-CKEIUWERSA-N 2 1 340.433 4.055 20 0 EIADMP COc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1F ZINC000192688631 1028056044 /nfs/dbraw/zinc/05/60/44/1028056044.db2.gz GLQOQHJBVSAVJY-HNAYVOBHSA-N 2 1 348.487 4.069 20 0 EIADMP COc1cccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1F ZINC000192688631 1028056067 /nfs/dbraw/zinc/05/60/67/1028056067.db2.gz GLQOQHJBVSAVJY-HNAYVOBHSA-N 2 1 348.487 4.069 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000188977880 1028057177 /nfs/dbraw/zinc/05/71/77/1028057177.db2.gz YDGWLUAAGIXWFR-ZDUSSCGKSA-N 2 1 330.394 4.109 20 0 EIADMP CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346132367 1028273505 /nfs/dbraw/zinc/27/35/05/1028273505.db2.gz BVIAVWMHJGQXDU-GOSISDBHSA-N 2 1 338.480 4.147 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000346143614 1028278379 /nfs/dbraw/zinc/27/83/79/1028278379.db2.gz DVCWYVKNDOLQGY-HXUWFJFHSA-N 2 1 346.478 4.345 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@@]3(C2)CCCCO3)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168048486 1028299633 /nfs/dbraw/zinc/29/96/33/1028299633.db2.gz VXDAOMLZXPHMNN-WOIUINJBSA-N 2 1 342.527 4.073 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H]1c1cccc(C)c1 ZINC000346164585 1028300567 /nfs/dbraw/zinc/30/05/67/1028300567.db2.gz DJZGMCXOHVNMMR-OAQYLSRUSA-N 2 1 332.451 4.221 20 0 EIADMP Cc1ccc([C@H]2CCC[N@H+]2Cc2cn(-c3cc[nH+]cc3)nc2C)s1 ZINC000346205298 1028328411 /nfs/dbraw/zinc/32/84/11/1028328411.db2.gz LYPRIIGMRSXBAQ-GOSISDBHSA-N 2 1 338.480 4.283 20 0 EIADMP COCc1ccc(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)o1 ZINC000125504511 1028416413 /nfs/dbraw/zinc/41/64/13/1028416413.db2.gz IZVNWKNFOZYEKY-KRWDZBQOSA-N 2 1 342.483 4.090 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccc4c(n3)CCC4)cc2)C1 ZINC000564711607 1028485578 /nfs/dbraw/zinc/48/55/78/1028485578.db2.gz VLXZZHXHDDBGSQ-GOSISDBHSA-N 2 1 349.522 4.092 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)ccc1SC ZINC000126686868 1028657575 /nfs/dbraw/zinc/65/75/75/1028657575.db2.gz AXURZYIFVIDNTE-HZTRTUMWSA-N 2 1 334.529 4.083 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)ccc1SC ZINC000126686868 1028657583 /nfs/dbraw/zinc/65/75/83/1028657583.db2.gz AXURZYIFVIDNTE-HZTRTUMWSA-N 2 1 334.529 4.083 20 0 EIADMP Cc1cc(C[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)cc(C)c1O ZINC000583408121 1028669200 /nfs/dbraw/zinc/66/92/00/1028669200.db2.gz IYGRYYCDYREIEM-GOSISDBHSA-N 2 1 338.495 4.324 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3cccnc32)CC[N@@H+]1Cc1ccccc1 ZINC000080338938 1028714935 /nfs/dbraw/zinc/71/49/35/1028714935.db2.gz IGFJWDKCVHPEHE-GCJKJVERSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3cccnc32)CC[N@H+]1Cc1ccccc1 ZINC000080338938 1028714955 /nfs/dbraw/zinc/71/49/55/1028714955.db2.gz IGFJWDKCVHPEHE-GCJKJVERSA-N 2 1 345.490 4.378 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccnc(Cl)c2)c1 ZINC000161720798 1028742769 /nfs/dbraw/zinc/74/27/69/1028742769.db2.gz JOQSFSNQFFPRSW-OAHLLOKOSA-N 2 1 331.891 4.426 20 0 EIADMP C[C@@H](CC[NH2+][C@H]1CC2(CCC2)Oc2ccccc21)[NH+]1CCCCC1 ZINC000346868721 1028803056 /nfs/dbraw/zinc/80/30/56/1028803056.db2.gz CLLIAUIEOVXVDK-HKUYNNGSSA-N 2 1 328.500 4.287 20 0 EIADMP Cc1nc(F)ccc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000278285144 1028821374 /nfs/dbraw/zinc/82/13/74/1028821374.db2.gz BFSSEEUKWSVAEW-INIZCTEOSA-N 2 1 341.474 4.193 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CNc2ccccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000635021327 1028831559 /nfs/dbraw/zinc/83/15/59/1028831559.db2.gz NXESBSKLAMBYHW-JBACZVJFSA-N 2 1 349.522 4.086 20 0 EIADMP CCCCOc1ccc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)cc1OCC ZINC000508540927 1028872045 /nfs/dbraw/zinc/87/20/45/1028872045.db2.gz IBYJGYZQZALWGW-IBGZPJMESA-N 2 1 348.531 4.038 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)C[C@H]2CCC[NH+](C)C2)cc1OCC ZINC000508540927 1028872046 /nfs/dbraw/zinc/87/20/46/1028872046.db2.gz IBYJGYZQZALWGW-IBGZPJMESA-N 2 1 348.531 4.038 20 0 EIADMP CCCCOc1ccc(C[NH+](C)C[C@H]2CCC[N@H+](C)C2)cc1OCC ZINC000508540927 1028872048 /nfs/dbraw/zinc/87/20/48/1028872048.db2.gz IBYJGYZQZALWGW-IBGZPJMESA-N 2 1 348.531 4.038 20 0 EIADMP CCCCOc1ccc(C[NH+](C)C[C@H]2CCC[N@@H+](C)C2)cc1OCC ZINC000508540927 1028872050 /nfs/dbraw/zinc/87/20/50/1028872050.db2.gz IBYJGYZQZALWGW-IBGZPJMESA-N 2 1 348.531 4.038 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccccc2OC(F)F)C1 ZINC000151127631 1029120290 /nfs/dbraw/zinc/12/02/90/1029120290.db2.gz YVJHJHZGSCRUKS-HOCLYGCPSA-N 2 1 326.431 4.061 20 0 EIADMP C[C@@H]1CC([N@H+]2CC[C@H](c3ccncc3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053359 1029160026 /nfs/dbraw/zinc/16/00/26/1029160026.db2.gz OCGOLJUOUGSCFN-KNKQGSTJSA-N 2 1 349.522 4.313 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cccc(COC)c2)CC1)CC1CC1 ZINC000536140773 1029247895 /nfs/dbraw/zinc/24/78/95/1029247895.db2.gz LQLAVLURBVKAMA-UHFFFAOYSA-N 2 1 344.543 4.167 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000583957369 1029417060 /nfs/dbraw/zinc/41/70/60/1029417060.db2.gz VVSFGDNBXSTBSZ-QKNCTXAOSA-N 2 1 338.417 4.325 20 0 EIADMP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000583957369 1029417077 /nfs/dbraw/zinc/41/70/77/1029417077.db2.gz VVSFGDNBXSTBSZ-QKNCTXAOSA-N 2 1 338.417 4.325 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000475281268 1029496625 /nfs/dbraw/zinc/49/66/25/1029496625.db2.gz PWKAYWQMCYOSJW-WMZOPIPTSA-N 2 1 336.470 4.312 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000523017342 1029552422 /nfs/dbraw/zinc/55/24/22/1029552422.db2.gz KUGMSOPHWMBAOX-OAHLLOKOSA-N 2 1 340.458 4.401 20 0 EIADMP CSc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000192920287 1029646615 /nfs/dbraw/zinc/64/66/15/1029646615.db2.gz XYWCAFOCGUIQDF-LJQANCHMSA-N 2 1 326.509 4.020 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C2CC(CF)(CF)C2)C1 ZINC000657838663 1029715839 /nfs/dbraw/zinc/71/58/39/1029715839.db2.gz WYPYFDUQKDYYKE-INIZCTEOSA-N 2 1 336.470 4.096 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000301386763 1029721475 /nfs/dbraw/zinc/72/14/75/1029721475.db2.gz WCONIRANVJRVMO-INIZCTEOSA-N 2 1 329.875 4.343 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000301535017 1029751928 /nfs/dbraw/zinc/75/19/28/1029751928.db2.gz TTXJTQWOFZQZCL-UHFFFAOYSA-N 2 1 329.875 4.083 20 0 EIADMP C[N@H+](Cc1ccccc1)CC1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000301535017 1029751937 /nfs/dbraw/zinc/75/19/37/1029751937.db2.gz TTXJTQWOFZQZCL-UHFFFAOYSA-N 2 1 329.875 4.083 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)s1 ZINC000708528745 1029813376 /nfs/dbraw/zinc/81/33/76/1029813376.db2.gz IGKGJNJDPDFCDV-ZBFHGGJFSA-N 2 1 334.916 4.259 20 0 EIADMP C[N@H+]1CC[C@@H](C[NH2+]C/C=C/c2ccc(F)c(F)c2)[C@@H]1c1cccs1 ZINC000375751955 1029859762 /nfs/dbraw/zinc/85/97/62/1029859762.db2.gz YWUBBPJFJMGRDR-CILJEUCVSA-N 2 1 348.462 4.322 20 0 EIADMP c1c2ccccc2[nH]c1CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000090577288 1029867341 /nfs/dbraw/zinc/86/73/41/1029867341.db2.gz OELBWTKCVZMGIT-UHFFFAOYSA-N 2 1 347.506 4.007 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](c2cccnc2)C(C)C)CC1 ZINC000091287536 1029882885 /nfs/dbraw/zinc/88/28/85/1029882885.db2.gz WZBJNBVSLPNMIT-QFIPXVFZSA-N 2 1 337.511 4.341 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1cccnc1 ZINC000091313588 1029883524 /nfs/dbraw/zinc/88/35/24/1029883524.db2.gz TXPDWNSVXUDSTC-FXAWDEMLSA-N 2 1 343.540 4.342 20 0 EIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccnc1 ZINC000091313588 1029883526 /nfs/dbraw/zinc/88/35/26/1029883526.db2.gz TXPDWNSVXUDSTC-FXAWDEMLSA-N 2 1 343.540 4.342 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000657864819 1029890250 /nfs/dbraw/zinc/89/02/50/1029890250.db2.gz RYQPWSRTROZTFR-NSHDSACASA-N 2 1 345.796 4.085 20 0 EIADMP COc1ccccc1-c1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)cc1 ZINC000092072857 1029900459 /nfs/dbraw/zinc/90/04/59/1029900459.db2.gz DMSQHTKSJWTHRD-IBGZPJMESA-N 2 1 347.462 4.465 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccc(F)cn1 ZINC000092743138 1029937389 /nfs/dbraw/zinc/93/73/89/1029937389.db2.gz KTQROGSSAPSUHK-KRWDZBQOSA-N 2 1 341.474 4.448 20 0 EIADMP Cc1sccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390846017 1030035405 /nfs/dbraw/zinc/03/54/05/1030035405.db2.gz FJQGZSMODPTHHC-IHWFROFDSA-N 2 1 326.509 4.342 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000657875699 1030142422 /nfs/dbraw/zinc/14/24/22/1030142422.db2.gz HSGZOLSWTBAQGI-OCCSQVGLSA-N 2 1 348.840 4.221 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2c(Cl)cccc2Cl)CCC1 ZINC000447571377 1030157765 /nfs/dbraw/zinc/15/77/65/1030157765.db2.gz XXIAANBZCJNINZ-CZUORRHYSA-N 2 1 341.326 4.345 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2CCCCS2)C3)cc1 ZINC000447601364 1030223103 /nfs/dbraw/zinc/22/31/03/1030223103.db2.gz PKMPQMPGHGZDEZ-IYWMVGAKSA-N 2 1 330.541 4.057 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657887327 1030227798 /nfs/dbraw/zinc/22/77/98/1030227798.db2.gz GZSZUFGMQRCRIN-GMXVVIOVSA-N 2 1 345.712 4.236 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657887327 1030227817 /nfs/dbraw/zinc/22/78/17/1030227817.db2.gz GZSZUFGMQRCRIN-GMXVVIOVSA-N 2 1 345.712 4.236 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)Cc3ccc(F)cc3)C2)s1 ZINC000685412420 1030285632 /nfs/dbraw/zinc/28/56/32/1030285632.db2.gz PEEQQOIGVZQJLF-KRWDZBQOSA-N 2 1 332.488 4.150 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)Cc3ccc(F)cc3)C2)s1 ZINC000685412420 1030285640 /nfs/dbraw/zinc/28/56/40/1030285640.db2.gz PEEQQOIGVZQJLF-KRWDZBQOSA-N 2 1 332.488 4.150 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)Cc3ccc(F)cc3)C2)s1 ZINC000685412420 1030285652 /nfs/dbraw/zinc/28/56/52/1030285652.db2.gz PEEQQOIGVZQJLF-KRWDZBQOSA-N 2 1 332.488 4.150 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)Cc3ccc(F)cc3)C2)s1 ZINC000685412420 1030285670 /nfs/dbraw/zinc/28/56/70/1030285670.db2.gz PEEQQOIGVZQJLF-KRWDZBQOSA-N 2 1 332.488 4.150 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2c(F)cccc2Cl)[C@@H](C)C1 ZINC000447728299 1030291778 /nfs/dbraw/zinc/29/17/78/1030291778.db2.gz LBGSGTHZSMZWOD-KBXCAEBGSA-N 2 1 326.887 4.074 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2c(F)cccc2Cl)[C@@H](C)C1 ZINC000447728299 1030291802 /nfs/dbraw/zinc/29/18/02/1030291802.db2.gz LBGSGTHZSMZWOD-KBXCAEBGSA-N 2 1 326.887 4.074 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2c(F)cccc2Cl)[C@@H](C)C1 ZINC000447728299 1030291836 /nfs/dbraw/zinc/29/18/36/1030291836.db2.gz LBGSGTHZSMZWOD-KBXCAEBGSA-N 2 1 326.887 4.074 20 0 EIADMP C/C=C\COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CC[N@H+](C(C)C)C2)cc1 ZINC000685455691 1030340874 /nfs/dbraw/zinc/34/08/74/1030340874.db2.gz LFXUHYOGVFTFRB-SFMFPFJOSA-N 2 1 344.543 4.283 20 0 EIADMP C[N@@H+](Cc1cc(-n2ccnc2)cs1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000685476881 1030367589 /nfs/dbraw/zinc/36/75/89/1030367589.db2.gz WHOOVCGCQSHLJP-BETUJISGSA-N 2 1 343.418 4.487 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000657892739 1030376390 /nfs/dbraw/zinc/37/63/90/1030376390.db2.gz XSQDDSYCGVBMMO-XKQJLSEDSA-N 2 1 328.422 4.099 20 0 EIADMP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000657892739 1030376410 /nfs/dbraw/zinc/37/64/10/1030376410.db2.gz XSQDDSYCGVBMMO-XKQJLSEDSA-N 2 1 328.422 4.099 20 0 EIADMP CSCC1CCC([NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000708573365 1030397490 /nfs/dbraw/zinc/39/74/90/1030397490.db2.gz IWENDDZNZUOBEN-RCKXYERXSA-N 2 1 346.584 4.266 20 0 EIADMP CC[C@@H]1C[C@@H]([NH2+]CC2([NH2+][C@@H](C)c3ccccc3)CCCC2)CCO1 ZINC000648456723 1030502512 /nfs/dbraw/zinc/50/25/12/1030502512.db2.gz HVYJEXAKUAAAON-YSIASYRMSA-N 2 1 330.516 4.197 20 0 EIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000470013468 1030551551 /nfs/dbraw/zinc/55/15/51/1030551551.db2.gz OCTKQXGMSMZBHJ-KRWDZBQOSA-N 2 1 326.484 4.058 20 0 EIADMP CSc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000685614100 1030566379 /nfs/dbraw/zinc/56/63/79/1030566379.db2.gz HAHMKBMUZGRERF-KRWDZBQOSA-N 2 1 346.565 4.472 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(OCc3ccccc3)cc2)CC[N@@H+]1C ZINC000530666080 1030625164 /nfs/dbraw/zinc/62/51/64/1030625164.db2.gz SANQCXAFOLTDLP-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(OCc3ccccc3)cc2)CC[N@H+]1C ZINC000530666080 1030625180 /nfs/dbraw/zinc/62/51/80/1030625180.db2.gz SANQCXAFOLTDLP-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(OCc3ccccc3)cc2)CC[NH+]1C ZINC000530666080 1030625194 /nfs/dbraw/zinc/62/51/94/1030625194.db2.gz SANQCXAFOLTDLP-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(OCc3ccccc3)cc2)CC[NH+]1C ZINC000530666080 1030625214 /nfs/dbraw/zinc/62/52/14/1030625214.db2.gz SANQCXAFOLTDLP-NQIIRXRSSA-N 2 1 338.495 4.180 20 0 EIADMP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000657939002 1030648251 /nfs/dbraw/zinc/64/82/51/1030648251.db2.gz SRVYFQRIFYIWDJ-GFCCVEGCSA-N 2 1 346.824 4.141 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1coc2ccccc12 ZINC000398108252 1030698397 /nfs/dbraw/zinc/69/83/97/1030698397.db2.gz CDZZNAMKPLQJRD-LAUBAEHRSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1coc2ccccc12 ZINC000398108252 1030698411 /nfs/dbraw/zinc/69/84/11/1030698411.db2.gz CDZZNAMKPLQJRD-LAUBAEHRSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(C(F)F)nc1 ZINC000657969674 1030704237 /nfs/dbraw/zinc/70/42/37/1030704237.db2.gz SXQAHJCPXGNHDC-OFQRWUPVSA-N 2 1 337.458 4.323 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2ccncc2Cl)cc1 ZINC000527640968 1030794560 /nfs/dbraw/zinc/79/45/60/1030794560.db2.gz ONWZHDPFOXJCPN-MRXNPFEDSA-N 2 1 343.902 4.399 20 0 EIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2ccncc2Cl)cc1 ZINC000527640968 1030794577 /nfs/dbraw/zinc/79/45/77/1030794577.db2.gz ONWZHDPFOXJCPN-MRXNPFEDSA-N 2 1 343.902 4.399 20 0 EIADMP Clc1cnccc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000527652086 1030803045 /nfs/dbraw/zinc/80/30/45/1030803045.db2.gz ZRGBFYJEUSNRJK-UHFFFAOYSA-N 2 1 343.902 4.401 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccccn1 ZINC000658064690 1030803389 /nfs/dbraw/zinc/80/33/89/1030803389.db2.gz QDBVLIPEOCQMGL-ZVXPMLRVSA-N 2 1 349.522 4.075 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccccn1 ZINC000658064687 1030803801 /nfs/dbraw/zinc/80/38/01/1030803801.db2.gz QDBVLIPEOCQMGL-KTDPBYDISA-N 2 1 349.522 4.075 20 0 EIADMP CC[C@H](COCC1CC1)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000658090001 1030818446 /nfs/dbraw/zinc/81/84/46/1030818446.db2.gz DKRBQKAOCCYZII-DNVCBOLYSA-N 2 1 327.472 4.037 20 0 EIADMP c1ccc([C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C2CCC2)nc1 ZINC000527769573 1030851079 /nfs/dbraw/zinc/85/10/79/1030851079.db2.gz AJBGUCUBOOMUIT-NRFANRHFSA-N 2 1 327.516 4.310 20 0 EIADMP C[C@@H](NC[C@@H]1CC[N@@H+]1C1CCCCC1)c1cnc2ccsc2c1 ZINC000527949014 1030964205 /nfs/dbraw/zinc/96/42/05/1030964205.db2.gz NQICBPAWJMESSN-PBHICJAKSA-N 2 1 329.513 4.354 20 0 EIADMP Cc1cncc([C@@H](C)[NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000658320181 1030977355 /nfs/dbraw/zinc/97/73/55/1030977355.db2.gz PLRQHZYWPSYAOD-KNQAVFIVSA-N 2 1 349.522 4.343 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319277 1030982475 /nfs/dbraw/zinc/98/24/75/1030982475.db2.gz YWDQQYRVJZEESP-FCHUYYIVSA-N 2 1 349.522 4.425 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CSCCc2ccccc21 ZINC000532459797 1031098833 /nfs/dbraw/zinc/09/88/33/1031098833.db2.gz MGUXAHSFRAMYGF-XLIONFOSSA-N 2 1 332.557 4.261 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cccc3cccnc32)C[C@@H]1c1ccccc1 ZINC000340213237 1031189388 /nfs/dbraw/zinc/18/93/88/1031189388.db2.gz VDTBZFZNZFNWFT-NHCUHLMSSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2cccc3cccnc32)C[C@@H]1c1ccccc1 ZINC000340213237 1031189404 /nfs/dbraw/zinc/18/94/04/1031189404.db2.gz VDTBZFZNZFNWFT-NHCUHLMSSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@@H+]1CC[C@H](N[C@@H]2CCCOc3ccccc32)C[C@@H]1c1ccccc1 ZINC000340219128 1031193366 /nfs/dbraw/zinc/19/33/66/1031193366.db2.gz IHHBPSSBEMVQKX-CEWLAPEOSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@H+]1CC[C@H](N[C@@H]2CCCOc3ccccc32)C[C@@H]1c1ccccc1 ZINC000340219128 1031193381 /nfs/dbraw/zinc/19/33/81/1031193381.db2.gz IHHBPSSBEMVQKX-CEWLAPEOSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCOc3ccccc32)C[C@@H]1c1ccccc1 ZINC000340219128 1031193397 /nfs/dbraw/zinc/19/33/97/1031193397.db2.gz IHHBPSSBEMVQKX-CEWLAPEOSA-N 2 1 336.479 4.325 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCOc3ccccc32)C[C@@H]1c1ccccc1 ZINC000340219128 1031193417 /nfs/dbraw/zinc/19/34/17/1031193417.db2.gz IHHBPSSBEMVQKX-CEWLAPEOSA-N 2 1 336.479 4.325 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCC1 ZINC000340306991 1031207153 /nfs/dbraw/zinc/20/71/53/1031207153.db2.gz WDZYUMRCPRISIP-VQTJNVASSA-N 2 1 330.516 4.008 20 0 EIADMP CCOCCC1(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCC1 ZINC000340306991 1031207160 /nfs/dbraw/zinc/20/71/60/1031207160.db2.gz WDZYUMRCPRISIP-VQTJNVASSA-N 2 1 330.516 4.008 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccccc1OCc1ccccc1 ZINC000532507300 1031229357 /nfs/dbraw/zinc/22/93/57/1031229357.db2.gz RGQQYFDMWJSTCR-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP Fc1ccccc1-c1ncc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)s1 ZINC000449015208 1031343805 /nfs/dbraw/zinc/34/38/05/1031343805.db2.gz KQADVHDIAVVFNI-CYBMUJFWSA-N 2 1 342.443 4.052 20 0 EIADMP COc1cccc2c(C[N@H+]3CC[C@H](C[NH+](C)CC4CC4)C3)cccc12 ZINC000449035686 1031370212 /nfs/dbraw/zinc/37/02/12/1031370212.db2.gz HRDWMIDBRJOJSB-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cccc2c(C[NH+]3CC[C@H](C[N@H+](C)CC4CC4)C3)cccc12 ZINC000449035686 1031370224 /nfs/dbraw/zinc/37/02/24/1031370224.db2.gz HRDWMIDBRJOJSB-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1cccc2c(C[NH+]3CC[C@H](C[N@@H+](C)CC4CC4)C3)cccc12 ZINC000449035686 1031370239 /nfs/dbraw/zinc/37/02/39/1031370239.db2.gz HRDWMIDBRJOJSB-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000449086964 1031417902 /nfs/dbraw/zinc/41/79/02/1031417902.db2.gz FBIRVAFSCGBBEP-IBGZPJMESA-N 2 1 329.875 4.461 20 0 EIADMP CCc1nc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)cs1 ZINC000531655489 1031448061 /nfs/dbraw/zinc/44/80/61/1031448061.db2.gz MFSTZXMKEBWOLJ-MRXNPFEDSA-N 2 1 335.561 4.182 20 0 EIADMP CCc1nc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)cs1 ZINC000531655489 1031448070 /nfs/dbraw/zinc/44/80/70/1031448070.db2.gz MFSTZXMKEBWOLJ-MRXNPFEDSA-N 2 1 335.561 4.182 20 0 EIADMP C[C@H]([NH2+]CCC[NH+](C)C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000531677320 1031468138 /nfs/dbraw/zinc/46/81/38/1031468138.db2.gz OQWSYAMYYOCVRO-INIZCTEOSA-N 2 1 330.447 4.007 20 0 EIADMP COc1cccc2c(C[NH2+]C[C@@H]3CCC[N@H+](C(C)C)C3)cccc12 ZINC000449133308 1031469627 /nfs/dbraw/zinc/46/96/27/1031469627.db2.gz XXYBMWXJHQAYMA-KRWDZBQOSA-N 2 1 326.484 4.058 20 0 EIADMP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc2ccccc21 ZINC000449133138 1031470828 /nfs/dbraw/zinc/47/08/28/1031470828.db2.gz XFFDDVFUNJBPBV-QGZVFWFLSA-N 2 1 326.484 4.058 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]Cc3csc(C)c3)CC2)cs1 ZINC000449149647 1031483705 /nfs/dbraw/zinc/48/37/05/1031483705.db2.gz OESAAUWDQJGEMY-UHFFFAOYSA-N 2 1 349.569 4.077 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ncccc2Cl)CC1)CC1CC1 ZINC000528434403 1031490872 /nfs/dbraw/zinc/49/08/72/1031490872.db2.gz ZVJBGVSGAXKJSI-UHFFFAOYSA-N 2 1 335.923 4.069 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(C)(C)c1ccc(F)cc1Cl ZINC000531718367 1031517230 /nfs/dbraw/zinc/51/72/30/1031517230.db2.gz WNYOXBZCPLLBQG-XNJGSVPQSA-N 2 1 326.887 4.075 20 0 EIADMP COc1cccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@H]3C)cc2)c1 ZINC000531725044 1031525644 /nfs/dbraw/zinc/52/56/44/1031525644.db2.gz GKOGDKVOLNRRMT-HYFFOGBASA-N 2 1 338.495 4.181 20 0 EIADMP CC1(C)CC([NH2+]Cc2cnc(-c3ccccc3F)s2)CC(C)(C)[NH2+]1 ZINC000449222901 1031555282 /nfs/dbraw/zinc/55/52/82/1031555282.db2.gz WVAOOPHDIYMLJC-UHFFFAOYSA-N 2 1 347.503 4.348 20 0 EIADMP C[N@H+](Cc1cccc2ccoc21)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000449238425 1031575026 /nfs/dbraw/zinc/57/50/26/1031575026.db2.gz GJUYYFIUXKEAEJ-UHFFFAOYSA-N 2 1 335.451 4.176 20 0 EIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cc(-c2ccccc2)nn1C ZINC000453101496 1031593456 /nfs/dbraw/zinc/59/34/56/1031593456.db2.gz YIJLNXWNAZDIBR-HNNXBMFYSA-N 2 1 340.515 4.047 20 0 EIADMP Cn1cc2c(n1)CCC[C@@H]2[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449312737 1031629540 /nfs/dbraw/zinc/62/95/40/1031629540.db2.gz NDCJBWCRXPAFTM-SFHVURJKSA-N 2 1 346.563 4.066 20 0 EIADMP CCOc1ccc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cc1 ZINC000065976618 1031639694 /nfs/dbraw/zinc/63/96/94/1031639694.db2.gz RHBNPGFRESXPIY-UHFFFAOYSA-N 2 1 326.484 4.215 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1)c1cccc(Cl)c1 ZINC000375979331 1031642951 /nfs/dbraw/zinc/64/29/51/1031642951.db2.gz DPJUGSTWYJJNMN-QSFXBCCZSA-N 2 1 343.902 4.121 20 0 EIADMP C[C@@H](C[NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)c1cccc(Cl)c1 ZINC000375979331 1031642971 /nfs/dbraw/zinc/64/29/71/1031642971.db2.gz DPJUGSTWYJJNMN-QSFXBCCZSA-N 2 1 343.902 4.121 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(-c2ccccc2)nn1C ZINC000453142142 1031647879 /nfs/dbraw/zinc/64/78/79/1031647879.db2.gz FBRHTXHTFICETI-INIZCTEOSA-N 2 1 340.515 4.001 20 0 EIADMP CC[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453184463 1031687034 /nfs/dbraw/zinc/68/70/34/1031687034.db2.gz ZZHTURGNDMOUHT-DWLFOUALSA-N 2 1 337.511 4.423 20 0 EIADMP COCCC(C)(C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453198906 1031708130 /nfs/dbraw/zinc/70/81/30/1031708130.db2.gz PESYJQNADREOQK-PWRODBHTSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000453234220 1031756775 /nfs/dbraw/zinc/75/67/75/1031756775.db2.gz ZQBOSQKDUWOVQR-SFTDATJTSA-N 2 1 337.511 4.423 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000453234220 1031756785 /nfs/dbraw/zinc/75/67/85/1031756785.db2.gz ZQBOSQKDUWOVQR-SFTDATJTSA-N 2 1 337.511 4.423 20 0 EIADMP CC(C)[C@@H]1C[C@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000449493650 1031788504 /nfs/dbraw/zinc/78/85/04/1031788504.db2.gz LXIPYKOQZGAACF-FKVLARQCSA-N 2 1 344.543 4.080 20 0 EIADMP CC(C)[C@@H]1C[C@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000449493650 1031788520 /nfs/dbraw/zinc/78/85/20/1031788520.db2.gz LXIPYKOQZGAACF-FKVLARQCSA-N 2 1 344.543 4.080 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCCC2(F)F)CC1 ZINC000453317175 1031843889 /nfs/dbraw/zinc/84/38/89/1031843889.db2.gz JNDUPHDVMAWPPT-LMDPOFIKSA-N 2 1 336.470 4.455 20 0 EIADMP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000449560107 1031847901 /nfs/dbraw/zinc/84/79/01/1031847901.db2.gz GEUWPKXYXNJYOZ-MUCWCHJTSA-N 2 1 342.527 4.325 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000131210693 1031863902 /nfs/dbraw/zinc/86/39/02/1031863902.db2.gz JBDRVZYZRJUUFO-LJQANCHMSA-N 2 1 328.500 4.143 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2c(F)cccc2F)cc1 ZINC000531954639 1031869216 /nfs/dbraw/zinc/86/92/16/1031869216.db2.gz AEYNKRNSJFPSIL-CQSZACIVSA-N 2 1 341.405 4.352 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(Oc2ccccc2Cl)CC1 ZINC000132251292 1031909612 /nfs/dbraw/zinc/90/96/12/1031909612.db2.gz ATHFDDFSTSKILU-UHFFFAOYSA-N 2 1 347.890 4.169 20 0 EIADMP CCN(c1ccccc1)c1ccc(C[NH2+][C@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000531980182 1031927849 /nfs/dbraw/zinc/92/78/49/1031927849.db2.gz AOEPSNZGRMTPHM-GCJKJVERSA-N 2 1 337.511 4.274 20 0 EIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000453598095 1032021063 /nfs/dbraw/zinc/02/10/63/1032021063.db2.gz PESMWUPXAUCYIM-UHFFFAOYSA-N 2 1 334.813 4.323 20 0 EIADMP CC(C)(C)c1cccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001168264687 1032027603 /nfs/dbraw/zinc/02/76/03/1032027603.db2.gz LTKYTYDHUCOSQM-WIYYLYMNSA-N 2 1 326.528 4.433 20 0 EIADMP CC(C)(C)c1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001168264687 1032027620 /nfs/dbraw/zinc/02/76/20/1032027620.db2.gz LTKYTYDHUCOSQM-WIYYLYMNSA-N 2 1 326.528 4.433 20 0 EIADMP CC(C)(C)c1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001168264687 1032027631 /nfs/dbraw/zinc/02/76/31/1032027631.db2.gz LTKYTYDHUCOSQM-WIYYLYMNSA-N 2 1 326.528 4.433 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000532120800 1032050561 /nfs/dbraw/zinc/05/05/61/1032050561.db2.gz LIVLJYIEKMWQTL-CYGODWOOSA-N 2 1 347.506 4.414 20 0 EIADMP C[C@@H]([NH2+]CCc1c(F)cccc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000544424367 1032054508 /nfs/dbraw/zinc/05/45/08/1032054508.db2.gz LGDLBJZRLUBRJV-HUUCEWRRSA-N 2 1 338.898 4.264 20 0 EIADMP CSCc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000512977694 1034277573 /nfs/dbraw/zinc/27/75/73/1034277573.db2.gz QFUFCPAKVUORFD-UHFFFAOYSA-N 2 1 340.536 4.304 20 0 EIADMP C[C@@H](NCCC[N@H+]1CCCC[C@H]1C)c1ccccc1OC(F)F ZINC000320373537 1034396900 /nfs/dbraw/zinc/39/69/00/1034396900.db2.gz UJNAFFSIHRJNQY-HUUCEWRRSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccccc1OC(F)F ZINC000320373537 1034396922 /nfs/dbraw/zinc/39/69/22/1034396922.db2.gz UJNAFFSIHRJNQY-HUUCEWRRSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccccc1OC(F)F ZINC000320373537 1034396935 /nfs/dbraw/zinc/39/69/35/1034396935.db2.gz UJNAFFSIHRJNQY-HUUCEWRRSA-N 2 1 326.431 4.203 20 0 EIADMP Cc1cc2cc(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)ccc2[nH]1 ZINC000513117656 1034591205 /nfs/dbraw/zinc/59/12/05/1034591205.db2.gz UNANTQUJKBUPGS-UHFFFAOYSA-N 2 1 333.479 4.231 20 0 EIADMP C[N@@H+](CCc1cc(Cl)ccc1Cl)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513145051 1034655544 /nfs/dbraw/zinc/65/55/44/1034655544.db2.gz PNQQRMZQYUSLHE-XYPWUTKMSA-N 2 1 327.299 4.093 20 0 EIADMP C[NH+](CCc1cc(Cl)ccc1Cl)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000513145051 1034655551 /nfs/dbraw/zinc/65/55/51/1034655551.db2.gz PNQQRMZQYUSLHE-XYPWUTKMSA-N 2 1 327.299 4.093 20 0 EIADMP C[NH+](CCc1cc(Cl)ccc1Cl)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000513145051 1034655556 /nfs/dbraw/zinc/65/55/56/1034655556.db2.gz PNQQRMZQYUSLHE-XYPWUTKMSA-N 2 1 327.299 4.093 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000509921700 1034850620 /nfs/dbraw/zinc/85/06/20/1034850620.db2.gz BBCLHUXFOWCZPX-UETJRYKRSA-N 2 1 344.543 4.481 20 0 EIADMP c1ccc2c(c1)C=C(C[N@H+]1CCC[C@@H](C[NH+]3CCCCCC3)C1)CO2 ZINC000513420436 1034926948 /nfs/dbraw/zinc/92/69/48/1034926948.db2.gz OCOWMJMYZLPTGO-IBGZPJMESA-N 2 1 340.511 4.050 20 0 EIADMP c1ccc2c(c1)C=C(C[N@@H+]1CCC[C@@H](C[NH+]3CCCCCC3)C1)CO2 ZINC000513420436 1034926953 /nfs/dbraw/zinc/92/69/53/1034926953.db2.gz OCOWMJMYZLPTGO-IBGZPJMESA-N 2 1 340.511 4.050 20 0 EIADMP Cc1nc(C)c(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)s1 ZINC000513493702 1034985042 /nfs/dbraw/zinc/98/50/42/1034985042.db2.gz CDCMRPVIUGMDNV-KXBFYZLASA-N 2 1 343.540 4.150 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420283191 1035496927 /nfs/dbraw/zinc/49/69/27/1035496927.db2.gz BSEMODCKBXHAOC-DUVNUKRYSA-N 2 1 347.890 4.424 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420283191 1035496935 /nfs/dbraw/zinc/49/69/35/1035496935.db2.gz BSEMODCKBXHAOC-DUVNUKRYSA-N 2 1 347.890 4.424 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2C[C@H](C[NH3+])C[C@@H]2C)oc1-c1ccc(Cl)cc1 ZINC000420306832 1035505939 /nfs/dbraw/zinc/50/59/39/1035505939.db2.gz AWPZJLMPNYYPPQ-UBHSHLNASA-N 2 1 333.863 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2C[C@H](C[NH3+])C[C@@H]2C)oc1-c1ccc(Cl)cc1 ZINC000420306832 1035505954 /nfs/dbraw/zinc/50/59/54/1035505954.db2.gz AWPZJLMPNYYPPQ-UBHSHLNASA-N 2 1 333.863 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315679 1035509127 /nfs/dbraw/zinc/50/91/27/1035509127.db2.gz XEPDGSZYZDPIMX-CSFVBSKPSA-N 2 1 345.874 4.034 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315679 1035509147 /nfs/dbraw/zinc/50/91/47/1035509147.db2.gz XEPDGSZYZDPIMX-CSFVBSKPSA-N 2 1 345.874 4.034 20 0 EIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420328278 1035530959 /nfs/dbraw/zinc/53/09/59/1035530959.db2.gz ZVTDIVMAVVLURT-HOTGVXAUSA-N 2 1 329.513 4.111 20 0 EIADMP Cc1c(Cl)c(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)nc2ccccc12 ZINC000420413039 1035571791 /nfs/dbraw/zinc/57/17/91/1035571791.db2.gz ZKTGYKCENZBJNV-HNAYVOBHSA-N 2 1 343.902 4.161 20 0 EIADMP Cc1c(Cl)c(C[N@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)nc2ccccc12 ZINC000420413039 1035571806 /nfs/dbraw/zinc/57/18/06/1035571806.db2.gz ZKTGYKCENZBJNV-HNAYVOBHSA-N 2 1 343.902 4.161 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](CSc1ccccc1)C(C)C ZINC000491031779 1035776366 /nfs/dbraw/zinc/77/63/66/1035776366.db2.gz NWUFFEDQEJYUPS-VQIMIIECSA-N 2 1 331.529 4.234 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@H]3CC)CC2)cs1 ZINC000502035237 1035813105 /nfs/dbraw/zinc/81/31/05/1035813105.db2.gz QZBHHYZFBKJSAX-IEBWSBKVSA-N 2 1 349.588 4.476 20 0 EIADMP C[N@H+](Cc1ccc(OCc2ccccc2)cc1)CC1CC[NH+](C)CC1 ZINC000513729913 1035837825 /nfs/dbraw/zinc/83/78/25/1035837825.db2.gz SSJHJQJGKZRGDS-UHFFFAOYSA-N 2 1 338.495 4.039 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)CC2CC[NH+](C)CC2)cc1OCC ZINC000513736687 1035929142 /nfs/dbraw/zinc/92/91/42/1035929142.db2.gz IYEVSJBDYHZCPP-UHFFFAOYSA-N 2 1 348.531 4.038 20 0 EIADMP C[N@H+](Cc1ccc(Cl)c(C(F)(F)F)c1)CC1CC[NH+](C)CC1 ZINC000513736413 1035940773 /nfs/dbraw/zinc/94/07/73/1035940773.db2.gz AQIFXOZFZWDRIW-UHFFFAOYSA-N 2 1 334.813 4.132 20 0 EIADMP FC1(F)CC[C@@H](C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC000485496601 1035969772 /nfs/dbraw/zinc/96/97/72/1035969772.db2.gz UMTJKSGMZBODCB-LJQANCHMSA-N 2 1 348.481 4.410 20 0 EIADMP C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000502258110 1036015178 /nfs/dbraw/zinc/01/51/78/1036015178.db2.gz QYEBPULHCLQPJZ-NJYSJTHYSA-N 2 1 329.532 4.064 20 0 EIADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000502258110 1036015203 /nfs/dbraw/zinc/01/52/03/1036015203.db2.gz QYEBPULHCLQPJZ-NJYSJTHYSA-N 2 1 329.532 4.064 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C/C=C\c1ccc(F)c(F)c1 ZINC000571366257 1036046815 /nfs/dbraw/zinc/04/68/15/1036046815.db2.gz WOEYIAHBGJWCSU-XQRVVYSFSA-N 2 1 333.426 4.149 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C/C=C\c1ccc(F)c(F)c1 ZINC000571366257 1036046835 /nfs/dbraw/zinc/04/68/35/1036046835.db2.gz WOEYIAHBGJWCSU-XQRVVYSFSA-N 2 1 333.426 4.149 20 0 EIADMP C[C@@H]([NH2+]C1(C[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)CCCC1)c1ccccc1 ZINC000571492435 1036054529 /nfs/dbraw/zinc/05/45/29/1036054529.db2.gz XOSHOUYOPBKZCY-AJYBTWMASA-N 2 1 330.516 4.196 20 0 EIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)C1 ZINC000502415622 1036201080 /nfs/dbraw/zinc/20/10/80/1036201080.db2.gz MWJJJMOAJQQOHD-MSOLQXFVSA-N 2 1 332.536 4.017 20 0 EIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)C1 ZINC000502415622 1036201113 /nfs/dbraw/zinc/20/11/13/1036201113.db2.gz MWJJJMOAJQQOHD-MSOLQXFVSA-N 2 1 332.536 4.017 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc3cc[nH]c32)[C@@H]1c1cccs1 ZINC000237183984 1036213883 /nfs/dbraw/zinc/21/38/83/1036213883.db2.gz MJUUVTRWKDEJFD-YLJYHZDGSA-N 2 1 339.508 4.402 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2cccc3cc[nH]c32)[C@@H]1c1cccs1 ZINC000237183984 1036213902 /nfs/dbraw/zinc/21/39/02/1036213902.db2.gz MJUUVTRWKDEJFD-YLJYHZDGSA-N 2 1 339.508 4.402 20 0 EIADMP COc1ccc(C2CCC([NH2+]C[C@@H]3CC[N@H+](C(C)C)C3)CC2)cc1 ZINC000571807298 1036258906 /nfs/dbraw/zinc/25/89/06/1036258906.db2.gz XWHHSHZXOHLBSZ-ZJRDLVKKSA-N 2 1 330.516 4.041 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+]C3CC4(C3)CCCCC4)CC2)oc1C ZINC000421320896 1036269517 /nfs/dbraw/zinc/26/95/17/1036269517.db2.gz CZBHUUJXZGSHNU-UHFFFAOYSA-N 2 1 345.531 4.206 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC12CCSCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000421384976 1036344413 /nfs/dbraw/zinc/34/44/13/1036344413.db2.gz QAJVINTXXXXKEL-IHPCNDPISA-N 2 1 344.568 4.020 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cnn(C2CCCC2)c1 ZINC000502727534 1036582893 /nfs/dbraw/zinc/58/28/93/1036582893.db2.gz NRVMEIMBNUTJDW-MSOLQXFVSA-N 2 1 332.536 4.303 20 0 EIADMP C[N@H+](Cc1ccc(C(F)(F)F)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168387311 1036681476 /nfs/dbraw/zinc/68/14/76/1036681476.db2.gz CMBZBDVHCNVWGZ-UHFFFAOYSA-N 2 1 326.406 4.012 20 0 EIADMP C[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168387311 1036681493 /nfs/dbraw/zinc/68/14/93/1036681493.db2.gz CMBZBDVHCNVWGZ-UHFFFAOYSA-N 2 1 326.406 4.012 20 0 EIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccncc1Cl ZINC000421823453 1036780965 /nfs/dbraw/zinc/78/09/65/1036780965.db2.gz ZRILSZVKLKUJSY-HNNXBMFYSA-N 2 1 329.875 4.182 20 0 EIADMP CC(C)C[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043716 1036884384 /nfs/dbraw/zinc/88/43/84/1036884384.db2.gz HDLPTYWMRGXHNR-DOTOQJQBSA-N 2 1 328.422 4.334 20 0 EIADMP CC(C)C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043716 1036884386 /nfs/dbraw/zinc/88/43/86/1036884386.db2.gz HDLPTYWMRGXHNR-DOTOQJQBSA-N 2 1 328.422 4.334 20 0 EIADMP C[N@H+](CCC[NH2+]Cc1cnc(-c2ccco2)s1)C1CCCCC1 ZINC000486932168 1036895008 /nfs/dbraw/zinc/89/50/08/1036895008.db2.gz GOFNKJFFNGBJNB-UHFFFAOYSA-N 2 1 333.501 4.147 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1cnc(-c2ccco2)s1)C1CCCCC1 ZINC000486932168 1036895009 /nfs/dbraw/zinc/89/50/09/1036895009.db2.gz GOFNKJFFNGBJNB-UHFFFAOYSA-N 2 1 333.501 4.147 20 0 EIADMP CC[N@@H+](CCO[C@H]1CCCC[C@H]1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999651 1036917509 /nfs/dbraw/zinc/91/75/09/1036917509.db2.gz QIMFCIVCMWQDNE-NQIIRXRSSA-N 2 1 332.532 4.165 20 0 EIADMP CC[N@@H+](Cc1cc(-c2ccccc2)no1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999478 1036919004 /nfs/dbraw/zinc/91/90/04/1036919004.db2.gz KZUWFDVIZBFIFL-UHFFFAOYSA-N 2 1 349.478 4.425 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(C[NH2+]C[C@H]3CCSC3)cc2)C1 ZINC000486985698 1036935370 /nfs/dbraw/zinc/93/53/70/1036935370.db2.gz HXLYYRMMWIDVKE-FUHIMQAGSA-N 2 1 332.557 4.007 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(C[NH2+]C[C@@H]3CCSC3)cc2)C1 ZINC000486985701 1036935457 /nfs/dbraw/zinc/93/54/57/1036935457.db2.gz HXLYYRMMWIDVKE-QKLQHJQFSA-N 2 1 332.557 4.007 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000271742248 1037004178 /nfs/dbraw/zinc/00/41/78/1037004178.db2.gz QLBLMUSTWUUYTN-WDEREUQCSA-N 2 1 341.286 4.067 20 0 EIADMP c1cc2cccc(C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)C4(CC4)C3)c2[nH]1 ZINC000569722678 1037018034 /nfs/dbraw/zinc/01/80/34/1037018034.db2.gz APMKPYLVVWKNNP-NRFANRHFSA-N 2 1 345.490 4.455 20 0 EIADMP c1cc2cccc(C[NH2+][C@H]3CC[N@@H+](Cc4ccccc4)C4(CC4)C3)c2[nH]1 ZINC000569722678 1037018047 /nfs/dbraw/zinc/01/80/47/1037018047.db2.gz APMKPYLVVWKNNP-NRFANRHFSA-N 2 1 345.490 4.455 20 0 EIADMP CCS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000590243508 1037020216 /nfs/dbraw/zinc/02/02/16/1037020216.db2.gz PDJDLFLXPWRRAS-VNTMZGSJSA-N 2 1 332.557 4.476 20 0 EIADMP CCS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000590243508 1037020230 /nfs/dbraw/zinc/02/02/30/1037020230.db2.gz PDJDLFLXPWRRAS-VNTMZGSJSA-N 2 1 332.557 4.476 20 0 EIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CCCn3cc[nH+]c3C)oc21 ZINC000271874107 1037040949 /nfs/dbraw/zinc/04/09/49/1037040949.db2.gz NLSYOOHQYZAYSX-CQSZACIVSA-N 2 1 327.428 4.077 20 0 EIADMP COCC[C@@H]([NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccco1 ZINC000272536344 1037216040 /nfs/dbraw/zinc/21/60/40/1037216040.db2.gz JXAXVJXMHKDYAQ-DNVCBOLYSA-N 2 1 339.439 4.202 20 0 EIADMP CSc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000573528408 1037564804 /nfs/dbraw/zinc/56/48/04/1037564804.db2.gz AFVFOLAHOFNOGB-CRAIPNDOSA-N 2 1 346.565 4.470 20 0 EIADMP CSc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000573528408 1037564821 /nfs/dbraw/zinc/56/48/21/1037564821.db2.gz AFVFOLAHOFNOGB-CRAIPNDOSA-N 2 1 346.565 4.470 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CS[C@H](C(C)C)C2)cc1 ZINC000488427691 1037586592 /nfs/dbraw/zinc/58/65/92/1037586592.db2.gz XYGDJSFQFLTUCR-FNHZYXHNSA-N 2 1 329.513 4.361 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CS1 ZINC000488430809 1037589753 /nfs/dbraw/zinc/58/97/53/1037589753.db2.gz ZHFNGWDYEUDJLM-RNQOJCNYSA-N 2 1 332.557 4.159 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CS1 ZINC000488430809 1037589764 /nfs/dbraw/zinc/58/97/64/1037589764.db2.gz ZHFNGWDYEUDJLM-RNQOJCNYSA-N 2 1 332.557 4.159 20 0 EIADMP CC(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)CS1 ZINC000488437681 1037595658 /nfs/dbraw/zinc/59/56/58/1037595658.db2.gz WJUOJGJWOCYGFG-UXPWSPDFSA-N 2 1 332.557 4.332 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CS[C@@H](C(C)C)C2)CC1 ZINC000488449922 1037606051 /nfs/dbraw/zinc/60/60/51/1037606051.db2.gz PJYSOXGRURLBFB-WOJBJXKFSA-N 2 1 332.557 4.079 20 0 EIADMP C[N@@H+](Cc1cccc(OCc2ccccc2Cl)c1)C1CC[NH2+]CC1 ZINC000414649229 1037651945 /nfs/dbraw/zinc/65/19/45/1037651945.db2.gz CDOSCYMSOCZPSA-UHFFFAOYSA-N 2 1 344.886 4.103 20 0 EIADMP c1ccc([C@H]2C[C@H]([NH2+]Cc3ccc(-c4ccncc4)cc3)CC[NH2+]2)cc1 ZINC000422773189 1037830466 /nfs/dbraw/zinc/83/04/66/1037830466.db2.gz TXUVACJESDDCPT-DHIUTWEWSA-N 2 1 343.474 4.332 20 0 EIADMP C[C@@H](CC[NH2+][C@@H](C)c1c[nH+]ccc1N)c1cccc(C(F)(F)F)c1 ZINC000422803325 1037835830 /nfs/dbraw/zinc/83/58/30/1037835830.db2.gz CPJYLGINQGHFMN-STQMWFEESA-N 2 1 337.389 4.357 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c2ccccc21 ZINC000422792886 1037839331 /nfs/dbraw/zinc/83/93/31/1037839331.db2.gz ZYSCPOHCGXBQJG-PKTZIBPZSA-N 3 1 349.522 4.297 20 0 EIADMP [NH3+][C@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c2ccccc21 ZINC000422792887 1037840261 /nfs/dbraw/zinc/84/02/61/1037840261.db2.gz ZYSCPOHCGXBQJG-XZOQPEGZSA-N 3 1 349.522 4.297 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(OC(F)(F)F)cc1 ZINC000422813898 1037840565 /nfs/dbraw/zinc/84/05/65/1037840565.db2.gz YXAPRZZAIYTMPI-JECHBYEQSA-N 2 1 336.357 4.381 20 0 EIADMP C[C@H]([NH2+]CC(C)(C)c1cccc(C(F)(F)F)c1)c1c[nH+]ccc1N ZINC000422912079 1037865651 /nfs/dbraw/zinc/86/56/51/1037865651.db2.gz VGKRHEKJKKSTOL-LBPRGKRZSA-N 2 1 337.389 4.141 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H](C)C[C@@H]3CCCCC[NH2+]3)o2)cs1 ZINC000422947076 1037884596 /nfs/dbraw/zinc/88/45/96/1037884596.db2.gz PSDSTPMVNGOMBV-ZFWWWQNUSA-N 2 1 333.501 4.112 20 0 EIADMP Cc1nc(-c2ccc(C[NH2+][C@@H](C)C[C@H]3CCCCC[NH2+]3)o2)cs1 ZINC000422947073 1037885876 /nfs/dbraw/zinc/88/58/76/1037885876.db2.gz PSDSTPMVNGOMBV-DZGCQCFKSA-N 2 1 333.501 4.112 20 0 EIADMP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423093428 1037954155 /nfs/dbraw/zinc/95/41/55/1037954155.db2.gz HKTDJSRNZAWWBY-SJFSSXKUSA-N 2 1 328.887 4.134 20 0 EIADMP CC(C)Oc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000574226558 1037955139 /nfs/dbraw/zinc/95/51/39/1037955139.db2.gz LXEUECOKWKUMSH-OTWHNJEPSA-N 2 1 348.531 4.014 20 0 EIADMP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)c1 ZINC000423103032 1037961305 /nfs/dbraw/zinc/96/13/05/1037961305.db2.gz XJCLKYUGIRMILD-LRGNLBRXSA-N 2 1 342.433 4.294 20 0 EIADMP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)c1 ZINC000423103031 1037962471 /nfs/dbraw/zinc/96/24/71/1037962471.db2.gz XJCLKYUGIRMILD-FIRPJDEBSA-N 2 1 342.433 4.294 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1c[nH+]ccc1N ZINC000423101944 1037964200 /nfs/dbraw/zinc/96/42/00/1037964200.db2.gz WPJIPUXKPBYPHE-WHOFXGATSA-N 2 1 335.373 4.110 20 0 EIADMP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H](Cc2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423127488 1037976498 /nfs/dbraw/zinc/97/64/98/1037976498.db2.gz UBKOBEJXPQQDNE-QGTPRVQTSA-N 2 1 334.385 4.142 20 0 EIADMP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423146209 1038000441 /nfs/dbraw/zinc/00/04/41/1038000441.db2.gz OPPUROHPGBOIAQ-JWWIWJDOSA-N 2 1 328.887 4.134 20 0 EIADMP CC[C@H](C[NH2+][C@@H](c1ccc(OC)cc1)[C@H]1CCC[NH2+]1)CC(F)(F)F ZINC000423174916 1038030336 /nfs/dbraw/zinc/03/03/36/1038030336.db2.gz DAPCRHYZNUFUFU-XKQJLSEDSA-N 2 1 344.421 4.057 20 0 EIADMP Fc1ccc([C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2ccc(Cl)cc2)cc1 ZINC000423218145 1038063401 /nfs/dbraw/zinc/06/34/01/1038063401.db2.gz VCFAFIKZDFCHOH-LIRRHRJNSA-N 2 1 332.850 4.158 20 0 EIADMP C[N@@H+](CCCOc1cccc(C(C)(C)C)c1)C[C@@H]1CCC[NH+](C)C1 ZINC000607358494 1038076362 /nfs/dbraw/zinc/07/63/62/1038076362.db2.gz PGUNULQIPFHEAM-GOSISDBHSA-N 2 1 332.532 4.027 20 0 EIADMP C[NH+](CCCOc1cccc(C(C)(C)C)c1)C[C@@H]1CCC[N@H+](C)C1 ZINC000607358494 1038076384 /nfs/dbraw/zinc/07/63/84/1038076384.db2.gz PGUNULQIPFHEAM-GOSISDBHSA-N 2 1 332.532 4.027 20 0 EIADMP C[NH+](CCCOc1cccc(C(C)(C)C)c1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000607358494 1038076414 /nfs/dbraw/zinc/07/64/14/1038076414.db2.gz PGUNULQIPFHEAM-GOSISDBHSA-N 2 1 332.532 4.027 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@@H]3C1)CCCO2 ZINC000489557418 1038115214 /nfs/dbraw/zinc/11/52/14/1038115214.db2.gz YMMGWIIWAFEFKI-HDMKZQKVSA-N 2 1 334.891 4.079 20 0 EIADMP Cc1cc(Cl)c2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CCCO2 ZINC000489557418 1038115259 /nfs/dbraw/zinc/11/52/59/1038115259.db2.gz YMMGWIIWAFEFKI-HDMKZQKVSA-N 2 1 334.891 4.079 20 0 EIADMP Fc1ccc(F)c([C@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2Cl)c1 ZINC000423339409 1038151974 /nfs/dbraw/zinc/15/19/74/1038151974.db2.gz IRGCGGWGKBMQFW-LJQANCHMSA-N 2 1 348.824 4.217 20 0 EIADMP Cc1cccc(-c2n[nH]cc2C[NH2+]CCC[N@@H+](C)C2CCCCC2)c1 ZINC000504085241 1038158214 /nfs/dbraw/zinc/15/82/14/1038158214.db2.gz DCBKHHXUTXWMFN-UHFFFAOYSA-N 2 1 340.515 4.129 20 0 EIADMP Cc1cccc(-c2n[nH]cc2C[NH2+]CCC[N@H+](C)C2CCCCC2)c1 ZINC000504085241 1038158229 /nfs/dbraw/zinc/15/82/29/1038158229.db2.gz DCBKHHXUTXWMFN-UHFFFAOYSA-N 2 1 340.515 4.129 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000594005501 1038242072 /nfs/dbraw/zinc/24/20/72/1038242072.db2.gz PZMJTERFYOYRFX-INIZCTEOSA-N 2 1 329.875 4.343 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccc1F ZINC000423468187 1038245614 /nfs/dbraw/zinc/24/56/14/1038245614.db2.gz JNYZWLUZSLCMEN-URLQWDBASA-N 2 1 330.422 4.009 20 0 EIADMP FC(F)Oc1ccc([C@@H]([NH2+]CCC[NH2+]C2CC2)c2ccccc2)cc1 ZINC000423556915 1038294813 /nfs/dbraw/zinc/29/48/13/1038294813.db2.gz NBOOFVKFAYMBSS-IBGZPJMESA-N 2 1 346.421 4.109 20 0 EIADMP CC[N@H+]1CC[C@@H](CN[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167132 1038367211 /nfs/dbraw/zinc/36/72/11/1038367211.db2.gz FYARYIKMISZVGT-OXJNMPFZSA-N 2 1 328.887 4.361 20 0 EIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167132 1038367232 /nfs/dbraw/zinc/36/72/32/1038367232.db2.gz FYARYIKMISZVGT-OXJNMPFZSA-N 2 1 328.887 4.361 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167132 1038367250 /nfs/dbraw/zinc/36/72/50/1038367250.db2.gz FYARYIKMISZVGT-OXJNMPFZSA-N 2 1 328.887 4.361 20 0 EIADMP C[C@H](c1ccccc1Br)[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000490296164 1038458950 /nfs/dbraw/zinc/45/89/50/1038458950.db2.gz DAIDTGWHCNMIOH-CHWSQXEVSA-N 2 1 334.261 4.113 20 0 EIADMP C[C@H]1CC2(C[N@H+]1Cc1csc(C3CCCCC3)n1)CC[NH2+]CC2 ZINC000424290587 1038769304 /nfs/dbraw/zinc/76/93/04/1038769304.db2.gz MXFDIYBCDUUIPA-HNNXBMFYSA-N 2 1 333.545 4.155 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000539080271 1038826753 /nfs/dbraw/zinc/82/67/53/1038826753.db2.gz TZPXPGUIHXGXPZ-NEPJUHHUSA-N 2 1 326.271 4.485 20 0 EIADMP Brc1cccc(C2([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CCC2)c1 ZINC000252734256 1038860617 /nfs/dbraw/zinc/86/06/17/1038860617.db2.gz GLCNSMUQVVOPGN-SJORKVTESA-N 2 1 349.316 4.045 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000539163213 1038864779 /nfs/dbraw/zinc/86/47/79/1038864779.db2.gz ONUNWJJIMVWOOT-KSSFIOAISA-N 2 1 340.433 4.476 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[N@@H+]1C ZINC000537615491 1038893185 /nfs/dbraw/zinc/89/31/85/1038893185.db2.gz WEEFGGHKBIBXNL-RHSMWYFYSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[N@H+]1C ZINC000537615491 1038893188 /nfs/dbraw/zinc/89/31/88/1038893188.db2.gz WEEFGGHKBIBXNL-RHSMWYFYSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[NH+]1C ZINC000537615491 1038893193 /nfs/dbraw/zinc/89/31/93/1038893193.db2.gz WEEFGGHKBIBXNL-RHSMWYFYSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)CC[NH+]1C ZINC000537615491 1038893203 /nfs/dbraw/zinc/89/32/03/1038893203.db2.gz WEEFGGHKBIBXNL-RHSMWYFYSA-N 2 1 332.488 4.469 20 0 EIADMP CCCOc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCC[N@H+]2C)cc1OC ZINC000539252276 1038896784 /nfs/dbraw/zinc/89/67/84/1038896784.db2.gz ILKJDAFIPRPSJX-AEFFLSMTSA-N 2 1 334.504 4.009 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@H]2c2ccc(OC)c(F)c2)C1 ZINC000481039923 1038988315 /nfs/dbraw/zinc/98/83/15/1038988315.db2.gz QINATYYIUFKGPW-KPFFTGBYSA-N 2 1 348.506 4.182 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccsc1 ZINC000481185337 1039089095 /nfs/dbraw/zinc/08/90/95/1039089095.db2.gz GEJARYXQCORFNZ-PXNSSMCTSA-N 2 1 328.525 4.181 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccsc1 ZINC000481185337 1039089118 /nfs/dbraw/zinc/08/91/18/1039089118.db2.gz GEJARYXQCORFNZ-PXNSSMCTSA-N 2 1 328.525 4.181 20 0 EIADMP CCCOc1ccc(CN(C)[C@@H]2CC[N@@H+](CC)[C@@H](C)C2)cc1OCC ZINC000552071109 1039102566 /nfs/dbraw/zinc/10/25/66/1039102566.db2.gz PTRQOOFOOMKJQX-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP CCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)cc1OCC ZINC000552071109 1039102586 /nfs/dbraw/zinc/10/25/86/1039102586.db2.gz PTRQOOFOOMKJQX-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP CCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)cc1OCC ZINC000552071109 1039102620 /nfs/dbraw/zinc/10/26/20/1039102620.db2.gz PTRQOOFOOMKJQX-PKOBYXMFSA-N 2 1 348.531 4.179 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2c(OC(F)F)ccc3ccccc32)CCN1C ZINC000552071544 1039102852 /nfs/dbraw/zinc/10/28/52/1039102852.db2.gz NCIXWUOSDYUGET-ZBFHGGJFSA-N 2 1 348.437 4.356 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2c(OC(F)F)ccc3ccccc32)CCN1C ZINC000552071544 1039102887 /nfs/dbraw/zinc/10/28/87/1039102887.db2.gz NCIXWUOSDYUGET-ZBFHGGJFSA-N 2 1 348.437 4.356 20 0 EIADMP Cc1ncc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)s1 ZINC000090417977 1039223738 /nfs/dbraw/zinc/22/37/38/1039223738.db2.gz RGCXYAPLSABFQA-JDFRZJQESA-N 2 1 335.542 4.247 20 0 EIADMP Cc1ncc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)s1 ZINC000090406550 1039224623 /nfs/dbraw/zinc/22/46/23/1039224623.db2.gz HMAZGXVJIRAFOE-UKRRQHHQSA-N 2 1 335.542 4.076 20 0 EIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccccc2OCc2ccccc2)C1 ZINC000481309903 1039260852 /nfs/dbraw/zinc/26/08/52/1039260852.db2.gz NBTWJEGDINKQBU-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccccc2OCc2ccccc2)C1 ZINC000481309903 1039260897 /nfs/dbraw/zinc/26/08/97/1039260897.db2.gz NBTWJEGDINKQBU-ICSRJNTNSA-N 2 1 338.495 4.258 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)c(C)c1OC ZINC000552225100 1039275291 /nfs/dbraw/zinc/27/52/91/1039275291.db2.gz AICKNZZEGWEGDU-SJLPKXTDSA-N 2 1 348.531 4.175 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000481322927 1039292495 /nfs/dbraw/zinc/29/24/95/1039292495.db2.gz NYEMHFXCEYJGSL-MGPQQGTHSA-N 2 1 345.314 4.081 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)[C@@H]2COc3ccccc32)cc1 ZINC000090845038 1039307262 /nfs/dbraw/zinc/30/72/62/1039307262.db2.gz NZYHVNFHVORNQK-XFQAVAEZSA-N 2 1 347.462 4.396 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550798006 1039311619 /nfs/dbraw/zinc/31/16/19/1039311619.db2.gz UZERYWRDMFHCAU-IXDOHACOSA-N 2 1 328.422 4.389 20 0 EIADMP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550798006 1039311631 /nfs/dbraw/zinc/31/16/31/1039311631.db2.gz UZERYWRDMFHCAU-IXDOHACOSA-N 2 1 328.422 4.389 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@@H+](CC)C1 ZINC000481339687 1039319881 /nfs/dbraw/zinc/31/98/81/1039319881.db2.gz QZXOQCIGDRZKGU-GOEBONIOSA-N 2 1 326.937 4.142 20 0 EIADMP Fc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000513858760 1039339192 /nfs/dbraw/zinc/33/91/92/1039339192.db2.gz DFRSBEOITUMAKH-QRWLVFNGSA-N 2 1 344.499 4.376 20 0 EIADMP Fc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000513858760 1039339204 /nfs/dbraw/zinc/33/92/04/1039339204.db2.gz DFRSBEOITUMAKH-QRWLVFNGSA-N 2 1 344.499 4.376 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCOc2c(C)cc(Cl)cc21 ZINC000122475606 1039724084 /nfs/dbraw/zinc/72/40/84/1039724084.db2.gz SBRPJJPTCZMEBW-GOSISDBHSA-N 2 1 347.890 4.437 20 0 EIADMP C[C@H]1C[C@@H](Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC[N@H+]1C ZINC000899874948 1039756821 /nfs/dbraw/zinc/75/68/21/1039756821.db2.gz QKHDSSPNTCLBMC-RYUDHWBXSA-N 2 1 339.361 4.028 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(F)c1 ZINC000123004127 1039848377 /nfs/dbraw/zinc/84/83/77/1039848377.db2.gz VZXMNCJFVXKCLY-MRXNPFEDSA-N 2 1 342.458 4.281 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCc2cccc3cccnc32)C[C@@H]1c1ccccc1 ZINC000556050199 1039888132 /nfs/dbraw/zinc/88/81/32/1039888132.db2.gz DCGZXGVXCLYKFW-FCHUYYIVSA-N 2 1 345.490 4.202 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCc2cccc3cccnc32)C[C@@H]1c1ccccc1 ZINC000556050199 1039888144 /nfs/dbraw/zinc/88/81/44/1039888144.db2.gz DCGZXGVXCLYKFW-FCHUYYIVSA-N 2 1 345.490 4.202 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC[N@@H+]1C ZINC000482010784 1039948292 /nfs/dbraw/zinc/94/82/92/1039948292.db2.gz CLUZNNAZIVUWJU-DJIMGWMZSA-N 2 1 341.524 4.260 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC[N@H+]1C ZINC000482010784 1039948304 /nfs/dbraw/zinc/94/83/04/1039948304.db2.gz CLUZNNAZIVUWJU-DJIMGWMZSA-N 2 1 341.524 4.260 20 0 EIADMP c1[nH+]c(C2CC[NH+](Cc3coc4ccccc34)CC2)n2c1CCCC2 ZINC000435061450 1040039775 /nfs/dbraw/zinc/03/97/75/1040039775.db2.gz ZJVLUSWGQNQRND-UHFFFAOYSA-N 2 1 335.451 4.345 20 0 EIADMP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000551267687 1040130772 /nfs/dbraw/zinc/13/07/72/1040130772.db2.gz SLEAXSPUKYIQAD-IAGOWNOFSA-N 2 1 339.527 4.298 20 0 EIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(F)cc2F)CC1 ZINC000551271035 1040133539 /nfs/dbraw/zinc/13/35/39/1040133539.db2.gz JKRJOOLDTGWQQE-UHFFFAOYSA-N 2 1 344.449 4.498 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(OC(F)F)cc1 ZINC000482328907 1040180440 /nfs/dbraw/zinc/18/04/40/1040180440.db2.gz IVLIDVYIAYJZSV-YJBOKZPZSA-N 2 1 340.458 4.449 20 0 EIADMP Cc1sc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)nc1-c1ccc(Cl)cc1 ZINC000514737462 1040181240 /nfs/dbraw/zinc/18/12/40/1040181240.db2.gz BYFOVBHIHHNCDC-HUUCEWRRSA-N 2 1 335.904 4.131 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1F ZINC000482448466 1040256554 /nfs/dbraw/zinc/25/65/54/1040256554.db2.gz ODIXJCIWRLEVIY-SJLPKXTDSA-N 2 1 344.449 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc(F)cc1F ZINC000482448466 1040256572 /nfs/dbraw/zinc/25/65/72/1040256572.db2.gz ODIXJCIWRLEVIY-SJLPKXTDSA-N 2 1 344.449 4.180 20 0 EIADMP Cc1oc2ccccc2c1C[N@H+](Cc1ccccn1)[C@H]1CCC[NH2+]CC1 ZINC000435395058 1040351375 /nfs/dbraw/zinc/35/13/75/1040351375.db2.gz QPGIBFUVLIVLJA-IBGZPJMESA-N 2 1 349.478 4.281 20 0 EIADMP Cc1oc2ccccc2c1C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH2+]CC1 ZINC000435395058 1040351395 /nfs/dbraw/zinc/35/13/95/1040351395.db2.gz QPGIBFUVLIVLJA-IBGZPJMESA-N 2 1 349.478 4.281 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000479461029 1040370213 /nfs/dbraw/zinc/37/02/13/1040370213.db2.gz AQMLGMKUMBHULA-RXVVDRJESA-N 2 1 341.474 4.030 20 0 EIADMP CC(C)[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000479461029 1040370229 /nfs/dbraw/zinc/37/02/29/1040370229.db2.gz AQMLGMKUMBHULA-RXVVDRJESA-N 2 1 341.474 4.030 20 0 EIADMP CCC1(Cc2ccccc2)CC[NH+]([C@@H]2CC[N@H+]3CCC[C@H]3C2)CC1 ZINC000479540537 1040446492 /nfs/dbraw/zinc/44/64/92/1040446492.db2.gz GHACOGIEPKFVBY-LEWJYISDSA-N 2 1 326.528 4.348 20 0 EIADMP Brc1ccc2c(c1)CC[C@@H]2[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479540936 1040446602 /nfs/dbraw/zinc/44/66/02/1040446602.db2.gz KAYKMUZJHXGNMT-HTWSVDAQSA-N 2 1 349.316 4.043 20 0 EIADMP CCOc1cccc2cc([C@H](C)[NH2+]C3CC[NH+](C4CCC4)CC3)oc21 ZINC000539498392 1040488485 /nfs/dbraw/zinc/48/84/85/1040488485.db2.gz NTYYXUXUVGFFSD-HNNXBMFYSA-N 2 1 342.483 4.499 20 0 EIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000539500224 1040492318 /nfs/dbraw/zinc/49/23/18/1040492318.db2.gz VCCSMAYZGQBXQB-HOTGVXAUSA-N 2 1 326.484 4.439 20 0 EIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000539500224 1040492328 /nfs/dbraw/zinc/49/23/28/1040492328.db2.gz VCCSMAYZGQBXQB-HOTGVXAUSA-N 2 1 326.484 4.439 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C3CCC(C)CC3)CC2)cs1 ZINC000553789999 1040525635 /nfs/dbraw/zinc/52/56/35/1040525635.db2.gz IWDPIUJLEUZIFC-UHFFFAOYSA-N 2 1 335.561 4.086 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@H](C)CCC(C)(C)C)CC2)oc1C ZINC000551789391 1040603365 /nfs/dbraw/zinc/60/33/65/1040603365.db2.gz NEWSAGRHZJXABW-OAHLLOKOSA-N 2 1 335.536 4.308 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(F)c(C(F)(F)F)c3)C2)CC1 ZINC000515253917 1040610908 /nfs/dbraw/zinc/61/09/08/1040610908.db2.gz AICRCZSQWYZKES-HNNXBMFYSA-N 2 1 344.396 4.008 20 0 EIADMP Cc1c([C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)cnn1-c1cccc(Cl)c1 ZINC000479871024 1040732886 /nfs/dbraw/zinc/73/28/86/1040732886.db2.gz FFGPKYFEGYFEQM-AWEZNQCLSA-N 2 1 348.922 4.073 20 0 EIADMP Fc1cccc(-c2ccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCC4)C3)o2)c1F ZINC000483263685 1040798473 /nfs/dbraw/zinc/79/84/73/1040798473.db2.gz PGAPSOMFZZCLCB-HNNXBMFYSA-N 2 1 346.421 4.143 20 0 EIADMP Fc1cccc(-c2ccc(C[N@H+]3CC[C@@H](C[NH+]4CCCC4)C3)o2)c1F ZINC000483263685 1040798487 /nfs/dbraw/zinc/79/84/87/1040798487.db2.gz PGAPSOMFZZCLCB-HNNXBMFYSA-N 2 1 346.421 4.143 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CCN(Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295837 1040807945 /nfs/dbraw/zinc/80/79/45/1040807945.db2.gz ZZIIQRCVOXXBNU-OAHLLOKOSA-N 2 1 348.437 4.389 20 0 EIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295837 1040807951 /nfs/dbraw/zinc/80/79/51/1040807951.db2.gz ZZIIQRCVOXXBNU-OAHLLOKOSA-N 2 1 348.437 4.389 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295837 1040807953 /nfs/dbraw/zinc/80/79/53/1040807953.db2.gz ZZIIQRCVOXXBNU-OAHLLOKOSA-N 2 1 348.437 4.389 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295837 1040807956 /nfs/dbraw/zinc/80/79/56/1040807956.db2.gz ZZIIQRCVOXXBNU-OAHLLOKOSA-N 2 1 348.437 4.389 20 0 EIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295837 1040807959 /nfs/dbraw/zinc/80/79/59/1040807959.db2.gz ZZIIQRCVOXXBNU-OAHLLOKOSA-N 2 1 348.437 4.389 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cc(Cl)cc(Cl)c2OC)C[C@H]1C ZINC000539816805 1040809269 /nfs/dbraw/zinc/80/92/69/1040809269.db2.gz DIRFXEZYNUPJKL-IUODEOHRSA-N 2 1 345.314 4.307 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(F)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000539816874 1040809783 /nfs/dbraw/zinc/80/97/83/1040809783.db2.gz BKSUWNBVUFUJND-WBMJQRKESA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(F)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000539816874 1040809788 /nfs/dbraw/zinc/80/97/88/1040809788.db2.gz BKSUWNBVUFUJND-WBMJQRKESA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(F)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000539816874 1040809796 /nfs/dbraw/zinc/80/97/96/1040809796.db2.gz BKSUWNBVUFUJND-WBMJQRKESA-N 2 1 332.385 4.007 20 0 EIADMP CSc1ccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000539830615 1040824179 /nfs/dbraw/zinc/82/41/79/1040824179.db2.gz IOSGFQKDSVALQG-HXUWFJFHSA-N 2 1 340.536 4.362 20 0 EIADMP CSc1ccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000539830615 1040824180 /nfs/dbraw/zinc/82/41/80/1040824180.db2.gz IOSGFQKDSVALQG-HXUWFJFHSA-N 2 1 340.536 4.362 20 0 EIADMP CSc1ccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000539830615 1040824189 /nfs/dbraw/zinc/82/41/89/1040824189.db2.gz IOSGFQKDSVALQG-HXUWFJFHSA-N 2 1 340.536 4.362 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cnc(-c3ccc(C)cc3)s2)[C@H](C)C1 ZINC000539835703 1040828060 /nfs/dbraw/zinc/82/80/60/1040828060.db2.gz PAMZFRRVIUKVTQ-APWZRJJASA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cnc(-c3ccc(C)cc3)s2)[C@H](C)C1 ZINC000539835703 1040828083 /nfs/dbraw/zinc/82/80/83/1040828083.db2.gz PAMZFRRVIUKVTQ-APWZRJJASA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cnc(-c3ccc(C)cc3)s2)[C@H](C)C1 ZINC000539835703 1040828087 /nfs/dbraw/zinc/82/80/87/1040828087.db2.gz PAMZFRRVIUKVTQ-APWZRJJASA-N 2 1 343.540 4.281 20 0 EIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000539836093 1040831397 /nfs/dbraw/zinc/83/13/97/1040831397.db2.gz REOWYFZJTNBEKD-SFHVURJKSA-N 2 1 346.906 4.036 20 0 EIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000539836093 1040831398 /nfs/dbraw/zinc/83/13/98/1040831398.db2.gz REOWYFZJTNBEKD-SFHVURJKSA-N 2 1 346.906 4.036 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000539836093 1040831404 /nfs/dbraw/zinc/83/14/04/1040831404.db2.gz REOWYFZJTNBEKD-SFHVURJKSA-N 2 1 346.906 4.036 20 0 EIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000539836093 1040831405 /nfs/dbraw/zinc/83/14/05/1040831405.db2.gz REOWYFZJTNBEKD-SFHVURJKSA-N 2 1 346.906 4.036 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000480007906 1040849968 /nfs/dbraw/zinc/84/99/68/1040849968.db2.gz KSZYCRIKOKMRPD-WOJBJXKFSA-N 2 1 346.559 4.328 20 0 EIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCOc3ccc4ccccc4c3)CC[C@H]21 ZINC000483479438 1040872881 /nfs/dbraw/zinc/87/28/81/1040872881.db2.gz DWSGJCBCXCTQIF-RBBKRZOGSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCOc3ccc4ccccc4c3)CC[C@H]21 ZINC000483479438 1040872893 /nfs/dbraw/zinc/87/28/93/1040872893.db2.gz DWSGJCBCXCTQIF-RBBKRZOGSA-N 2 1 338.495 4.025 20 0 EIADMP C[NH+]1CCC[C@H]2C[N@@H+](CCCOc3ccc4ccccc4c3)CC[C@H]21 ZINC000483479438 1040872897 /nfs/dbraw/zinc/87/28/97/1040872897.db2.gz DWSGJCBCXCTQIF-RBBKRZOGSA-N 2 1 338.495 4.025 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](c2ccccc2F)C2CCOCC2)C1 ZINC000903090961 1040898714 /nfs/dbraw/zinc/89/87/14/1040898714.db2.gz KAKOUIHRIQXDMR-UTKZUKDTSA-N 2 1 348.506 4.003 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1cscn1 ZINC000537944566 1040910684 /nfs/dbraw/zinc/91/06/84/1040910684.db2.gz GHSOJDIGEDRANI-SOLBZPMBSA-N 2 1 329.513 4.094 20 0 EIADMP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@@H]3C)cc2)cc1 ZINC000537988488 1040965582 /nfs/dbraw/zinc/96/55/82/1040965582.db2.gz VGGQQABYWYUOLS-PNLZDCPESA-N 2 1 338.495 4.181 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@@H]3CC[C@H](c4ccccc4)C3)C2)cc1 ZINC000436241153 1040990528 /nfs/dbraw/zinc/99/05/28/1040990528.db2.gz QNCYICSGDBNDEB-YFNKSVMNSA-N 2 1 348.534 4.477 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000483743790 1040994182 /nfs/dbraw/zinc/99/41/82/1040994182.db2.gz IGWXXKDABRIHOF-UKTARXLSSA-N 2 1 345.314 4.222 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000483743790 1040994199 /nfs/dbraw/zinc/99/41/99/1040994199.db2.gz IGWXXKDABRIHOF-UKTARXLSSA-N 2 1 345.314 4.222 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000483755957 1041000154 /nfs/dbraw/zinc/00/01/54/1041000154.db2.gz QCMNEYBSHUVOFM-CMKODMSKSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000483755957 1041000169 /nfs/dbraw/zinc/00/01/69/1041000169.db2.gz QCMNEYBSHUVOFM-CMKODMSKSA-N 2 1 338.495 4.399 20 0 EIADMP COCCC1(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)CCCCC1 ZINC000436280475 1041024853 /nfs/dbraw/zinc/02/48/53/1041024853.db2.gz KLIURNXJOSTUEW-UHFFFAOYSA-N 2 1 344.543 4.011 20 0 EIADMP COCCC1(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)CCCCC1 ZINC000436280475 1041024857 /nfs/dbraw/zinc/02/48/57/1041024857.db2.gz KLIURNXJOSTUEW-UHFFFAOYSA-N 2 1 344.543 4.011 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)C1 ZINC000462889308 1041051042 /nfs/dbraw/zinc/05/10/42/1041051042.db2.gz SJINKFOZHFMYAK-DLBZAZTESA-N 2 1 327.516 4.156 20 0 EIADMP C[N@H+]1CCC[C@@H](CNc2cc[nH+]c3ccccc23)[C@@H]1c1cccs1 ZINC000462880166 1041063427 /nfs/dbraw/zinc/06/34/27/1041063427.db2.gz AYCYIJGZNYDHIW-MGPUTAFESA-N 2 1 337.492 4.213 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)c1cscn1 ZINC000903454380 1041067637 /nfs/dbraw/zinc/06/76/37/1041067637.db2.gz BPRHLOCYAWICET-WZGPROSRSA-N 2 1 341.524 4.094 20 0 EIADMP COc1cc([C@H](C)[NH2+]CC[C@@H]2CCCC[N@@H+]2C)ccc1OC(C)C ZINC000538154821 1041097875 /nfs/dbraw/zinc/09/78/75/1041097875.db2.gz MTNAIKQHBRTUQQ-WMZOPIPTSA-N 2 1 334.504 4.007 20 0 EIADMP COc1cc([C@H](C)[NH2+]CC[C@@H]2CCCC[N@H+]2C)ccc1OC(C)C ZINC000538154821 1041097896 /nfs/dbraw/zinc/09/78/96/1041097896.db2.gz MTNAIKQHBRTUQQ-WMZOPIPTSA-N 2 1 334.504 4.007 20 0 EIADMP CC[C@H]([NH2+]CC1([NH2+][C@H](C)c2ccccc2)CCCC1)[C@H]1CCOC1 ZINC000484141040 1041132692 /nfs/dbraw/zinc/13/26/92/1041132692.db2.gz VISRCJNNNABISC-HOJAQTOUSA-N 2 1 330.516 4.055 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2cc[nH+]c3ccsc32)C1 ZINC000484146084 1041137530 /nfs/dbraw/zinc/13/75/30/1041137530.db2.gz TUTMGENXRLLYES-JKSUJKDBSA-N 2 1 329.513 4.387 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cc[nH+]c3ccsc32)C1 ZINC000484146084 1041137544 /nfs/dbraw/zinc/13/75/44/1041137544.db2.gz TUTMGENXRLLYES-JKSUJKDBSA-N 2 1 329.513 4.387 20 0 EIADMP COc1ccc([C@H](CCC(C)C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000480268311 1041138119 /nfs/dbraw/zinc/13/81/19/1041138119.db2.gz STSDXAFWCRDFFP-NRFANRHFSA-N 2 1 330.516 4.389 20 0 EIADMP COc1ccc([C@@H](CCC(C)C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000480268313 1041141200 /nfs/dbraw/zinc/14/12/00/1041141200.db2.gz STSDXAFWCRDFFP-OAQYLSRUSA-N 2 1 330.516 4.389 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000540148279 1041194241 /nfs/dbraw/zinc/19/42/41/1041194241.db2.gz YKEWNEZPRJDYCY-UZLBHIALSA-N 2 1 326.509 4.268 20 0 EIADMP Cc1cc(C)cc(OC[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167960764 1041201339 /nfs/dbraw/zinc/20/13/39/1041201339.db2.gz BURNLQVMBHECDN-XSLAUPDRSA-N 2 1 342.527 4.066 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(OCC(C)C)cc1 ZINC000540170137 1041215149 /nfs/dbraw/zinc/21/51/49/1041215149.db2.gz ZBLONICDPGCQLL-DLBZAZTESA-N 2 1 329.488 4.213 20 0 EIADMP COc1cccc(C[C@@H](C)[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000540181511 1041245751 /nfs/dbraw/zinc/24/57/51/1041245751.db2.gz LBEIFLGKQXWEFK-SJORKVTESA-N 2 1 349.478 4.471 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H](C)Oc2ccccc2)cc1 ZINC000540183731 1041247918 /nfs/dbraw/zinc/24/79/18/1041247918.db2.gz SWAUZAVGCZOJRE-SJORKVTESA-N 2 1 335.451 4.299 20 0 EIADMP COC1(C[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)CCCCC1 ZINC000480369809 1041257352 /nfs/dbraw/zinc/25/73/52/1041257352.db2.gz IOSRWFVIBKRLSF-SFHVURJKSA-N 2 1 330.516 4.151 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]CCOC3CCCCCC3)CC2)cc1 ZINC000463127387 1041349519 /nfs/dbraw/zinc/34/95/19/1041349519.db2.gz NDYOQEQRHKELNU-UHFFFAOYSA-N 2 1 344.543 4.023 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cccc(F)c2F)CC[N@@H+]1Cc1ccccc1 ZINC000463130488 1041354264 /nfs/dbraw/zinc/35/42/64/1041354264.db2.gz WUSQRFQFVWUWJF-LPHOPBHVSA-N 2 1 344.449 4.150 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2cccc(F)c2F)CC[N@H+]1Cc1ccccc1 ZINC000463130488 1041354276 /nfs/dbraw/zinc/35/42/76/1041354276.db2.gz WUSQRFQFVWUWJF-LPHOPBHVSA-N 2 1 344.449 4.150 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H](Cc3ccccc3)C3CC3)CC2)cc1 ZINC000463120821 1041360569 /nfs/dbraw/zinc/36/05/69/1041360569.db2.gz ABEVCOAIOKBHRY-DEOSSOPVSA-N 2 1 348.534 4.304 20 0 EIADMP C[C@@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314575 1041360747 /nfs/dbraw/zinc/36/07/47/1041360747.db2.gz QCMNEYBSHUVOFM-NSHGMRRFSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@H]1CCN(C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314575 1041360759 /nfs/dbraw/zinc/36/07/59/1041360759.db2.gz QCMNEYBSHUVOFM-NSHGMRRFSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314575 1041360766 /nfs/dbraw/zinc/36/07/66/1041360766.db2.gz QCMNEYBSHUVOFM-NSHGMRRFSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000540314575 1041360779 /nfs/dbraw/zinc/36/07/79/1041360779.db2.gz QCMNEYBSHUVOFM-NSHGMRRFSA-N 2 1 338.495 4.399 20 0 EIADMP C[NH+]1CCC([NH2+][C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)CC1 ZINC000540318869 1041366606 /nfs/dbraw/zinc/36/66/06/1041366606.db2.gz TUTIUBSGKBUAEO-MRXNPFEDSA-N 2 1 346.824 4.494 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000463137450 1041373318 /nfs/dbraw/zinc/37/33/18/1041373318.db2.gz QZDDPCOHFMNSSW-XLIONFOSSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccccc2F)CC[N@H+]1Cc1ccccc1 ZINC000463137450 1041373328 /nfs/dbraw/zinc/37/33/28/1041373328.db2.gz QZDDPCOHFMNSSW-XLIONFOSSA-N 2 1 326.459 4.011 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cnc2ccsc2c1 ZINC000480601051 1041412306 /nfs/dbraw/zinc/41/23/06/1041412306.db2.gz NJGQNWWIWBYHFB-OWCLPIDISA-N 2 1 331.529 4.315 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cnc2ccsc2c1 ZINC000480601051 1041412312 /nfs/dbraw/zinc/41/23/12/1041412312.db2.gz NJGQNWWIWBYHFB-OWCLPIDISA-N 2 1 331.529 4.315 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+]CC3(C4CC4)CCC3)CC2)cc1 ZINC000463206910 1041419657 /nfs/dbraw/zinc/41/96/57/1041419657.db2.gz QTEDDPWMCYODBA-UHFFFAOYSA-N 2 1 330.491 4.003 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCC3(CCCC3)O2)cc1 ZINC000554816153 1041423397 /nfs/dbraw/zinc/42/33/97/1041423397.db2.gz KUZWMSAGCUNOTO-OXQOHEQNSA-N 2 1 339.483 4.323 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc(F)c(F)c(F)c1 ZINC000480606331 1041430693 /nfs/dbraw/zinc/43/06/93/1041430693.db2.gz DDHUWCMPJAZXFO-UONOGXRCSA-N 2 1 328.422 4.267 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](Cc1ccccc1Cl)c1ccccc1 ZINC000540407630 1041437337 /nfs/dbraw/zinc/43/73/37/1041437337.db2.gz LHCXPVGUFJUITI-FQEVSTJZSA-N 2 1 339.870 4.419 20 0 EIADMP Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000924668088 1041438537 /nfs/dbraw/zinc/43/85/37/1041438537.db2.gz OIPCMYGZFPIQCS-CVEARBPZSA-N 2 1 341.499 4.374 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000480659345 1041458952 /nfs/dbraw/zinc/45/89/52/1041458952.db2.gz FLWYDUWMAUDAFJ-SFHVURJKSA-N 2 1 330.516 4.220 20 0 EIADMP C[N@@H+]1CCC[C@H]1CC[NH2+][C@@H](COCc1ccccc1)c1ccccc1 ZINC000540445428 1041461019 /nfs/dbraw/zinc/46/10/19/1041461019.db2.gz NJFDBDIAKRVGJV-VXKWHMMOSA-N 2 1 338.495 4.018 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@@H](COCc1ccccc1)c1ccccc1 ZINC000540445428 1041461025 /nfs/dbraw/zinc/46/10/25/1041461025.db2.gz NJFDBDIAKRVGJV-VXKWHMMOSA-N 2 1 338.495 4.018 20 0 EIADMP COc1cc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC000195133215 1041484356 /nfs/dbraw/zinc/48/43/56/1041484356.db2.gz KOGIPFUHFQOKQY-WMZOPIPTSA-N 2 1 342.458 4.007 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)C[C@H]1C ZINC000538718696 1041487710 /nfs/dbraw/zinc/48/77/10/1041487710.db2.gz IGLRUKDKEUFGHL-OXQOHEQNSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc3cc(OC)ccc3c2)C[C@H]1C ZINC000538718696 1041487718 /nfs/dbraw/zinc/48/77/18/1041487718.db2.gz IGLRUKDKEUFGHL-OXQOHEQNSA-N 2 1 326.484 4.153 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc3cc(OC)ccc3c2)C[C@H]1C ZINC000538718696 1041487722 /nfs/dbraw/zinc/48/77/22/1041487722.db2.gz IGLRUKDKEUFGHL-OXQOHEQNSA-N 2 1 326.484 4.153 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463290711 1041489544 /nfs/dbraw/zinc/48/95/44/1041489544.db2.gz UCUIYQRKXLVBKS-QESAQDPVSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463290711 1041489548 /nfs/dbraw/zinc/48/95/48/1041489548.db2.gz UCUIYQRKXLVBKS-QESAQDPVSA-N 2 1 344.543 4.223 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)o1 ZINC000538719184 1041489622 /nfs/dbraw/zinc/48/96/22/1041489622.db2.gz QOFJBWBKYQYVHN-QGZVFWFLSA-N 2 1 342.458 4.312 20 0 EIADMP Cc1cc(F)ccc1-c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)o1 ZINC000538719184 1041489629 /nfs/dbraw/zinc/48/96/29/1041489629.db2.gz QOFJBWBKYQYVHN-QGZVFWFLSA-N 2 1 342.458 4.312 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cnc(C3CC3)s2)CC1 ZINC000538721343 1041490825 /nfs/dbraw/zinc/49/08/25/1041490825.db2.gz DDRYBWSEMDZQAI-MRXNPFEDSA-N 2 1 347.572 4.497 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@H]1C ZINC000538719072 1041490878 /nfs/dbraw/zinc/49/08/78/1041490878.db2.gz JPKJEUARIVNSLD-RDTXWAMCSA-N 2 1 346.906 4.035 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@H]1C ZINC000538719072 1041490885 /nfs/dbraw/zinc/49/08/85/1041490885.db2.gz JPKJEUARIVNSLD-RDTXWAMCSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@H]1C ZINC000538719072 1041490893 /nfs/dbraw/zinc/49/08/93/1041490893.db2.gz JPKJEUARIVNSLD-RDTXWAMCSA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c[nH]nc2-c2cccc(Cl)c2)C[C@H]1C ZINC000538719072 1041490898 /nfs/dbraw/zinc/49/08/98/1041490898.db2.gz JPKJEUARIVNSLD-RDTXWAMCSA-N 2 1 346.906 4.035 20 0 EIADMP C[N@@H+](C[C@H]1C[C@H]1c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538731490 1041500844 /nfs/dbraw/zinc/50/08/44/1041500844.db2.gz PGEYQDXHYOLBLN-WWNPGLIZSA-N 2 1 334.507 4.244 20 0 EIADMP C[NH+](C[C@H]1C[C@H]1c1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000538731490 1041500854 /nfs/dbraw/zinc/50/08/54/1041500854.db2.gz PGEYQDXHYOLBLN-WWNPGLIZSA-N 2 1 334.507 4.244 20 0 EIADMP C[NH+](C[C@H]1C[C@H]1c1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000538731490 1041500869 /nfs/dbraw/zinc/50/08/69/1041500869.db2.gz PGEYQDXHYOLBLN-WWNPGLIZSA-N 2 1 334.507 4.244 20 0 EIADMP Clc1cc(Cl)cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167961303 1041509580 /nfs/dbraw/zinc/50/95/80/1041509580.db2.gz HRTFJXCSGYBHML-AYHJJNSGSA-N 2 1 339.310 4.488 20 0 EIADMP Clc1cc(Cl)cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167961303 1041509589 /nfs/dbraw/zinc/50/95/89/1041509589.db2.gz HRTFJXCSGYBHML-AYHJJNSGSA-N 2 1 339.310 4.488 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(c2ccnc3ccccc32)CC1 ZINC000516310191 1041510903 /nfs/dbraw/zinc/51/09/03/1041510903.db2.gz FVOHUIMLPQPKSA-UHFFFAOYSA-N 2 1 348.494 4.400 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@H](C)C1 ZINC000538738191 1041511143 /nfs/dbraw/zinc/51/11/43/1041511143.db2.gz FCFHPPVUSHNYAC-DNVCBOLYSA-N 2 1 330.447 4.248 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@H](C)C1 ZINC000538738191 1041511149 /nfs/dbraw/zinc/51/11/49/1041511149.db2.gz FCFHPPVUSHNYAC-DNVCBOLYSA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@H](C)C1 ZINC000538738191 1041511157 /nfs/dbraw/zinc/51/11/57/1041511157.db2.gz FCFHPPVUSHNYAC-DNVCBOLYSA-N 2 1 330.447 4.248 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)[C@H](C)C1 ZINC000538738191 1041511164 /nfs/dbraw/zinc/51/11/64/1041511164.db2.gz FCFHPPVUSHNYAC-DNVCBOLYSA-N 2 1 330.447 4.248 20 0 EIADMP c1sc2ccccc2c1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000538799447 1041538828 /nfs/dbraw/zinc/53/88/28/1041538828.db2.gz GDYBWSBGAIJXDZ-KXBFYZLASA-N 2 1 326.509 4.350 20 0 EIADMP c1sc2ccccc2c1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000538799447 1041538832 /nfs/dbraw/zinc/53/88/32/1041538832.db2.gz GDYBWSBGAIJXDZ-KXBFYZLASA-N 2 1 326.509 4.350 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1 ZINC000540606569 1041560332 /nfs/dbraw/zinc/56/03/32/1041560332.db2.gz LWOYDULCWRLGHY-NRFANRHFSA-N 2 1 340.898 4.475 20 0 EIADMP CCCc1nc(C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)cs1 ZINC000538947747 1041587580 /nfs/dbraw/zinc/58/75/80/1041587580.db2.gz BXMORGICFUEKCZ-UHFFFAOYSA-N 2 1 349.588 4.430 20 0 EIADMP CCCc1nc(C[NH+]2CCC(CC[N@@H+](CC)CC3CC3)CC2)cs1 ZINC000538947747 1041587588 /nfs/dbraw/zinc/58/75/88/1041587588.db2.gz BXMORGICFUEKCZ-UHFFFAOYSA-N 2 1 349.588 4.430 20 0 EIADMP c1ccc(CC[C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000461799872 1041593055 /nfs/dbraw/zinc/59/30/55/1041593055.db2.gz XEAKXVZMZKISIX-TZRRMPRUSA-N 2 1 348.534 4.447 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000539040590 1041616611 /nfs/dbraw/zinc/61/66/11/1041616611.db2.gz DNZHJXOMVWBMAS-JENIJYKNSA-N 2 1 341.474 4.172 20 0 EIADMP CCCCCn1cc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(C)n1 ZINC000540983953 1041765827 /nfs/dbraw/zinc/76/58/27/1041765827.db2.gz ZRAGBXMRYMFEGY-UHFFFAOYSA-N 2 1 346.563 4.268 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000464069681 1041853978 /nfs/dbraw/zinc/85/39/78/1041853978.db2.gz FGTNTOHZIQVIRM-YPAWHYETSA-N 2 1 344.543 4.212 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000464069678 1041854023 /nfs/dbraw/zinc/85/40/23/1041854023.db2.gz FGTNTOHZIQVIRM-BHDDXSALSA-N 2 1 344.543 4.212 20 0 EIADMP CC[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)CC(F)(F)F ZINC000402688695 1041947505 /nfs/dbraw/zinc/94/75/05/1041947505.db2.gz HENLUERVXJSJIO-RYRKJORJSA-N 2 1 342.449 4.465 20 0 EIADMP CCc1cnc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)s1 ZINC000541536925 1042000708 /nfs/dbraw/zinc/00/07/08/1042000708.db2.gz DWKZJHUEZRQZAC-MRXNPFEDSA-N 2 1 335.561 4.182 20 0 EIADMP CCc1cnc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)s1 ZINC000541536925 1042000712 /nfs/dbraw/zinc/00/07/12/1042000712.db2.gz DWKZJHUEZRQZAC-MRXNPFEDSA-N 2 1 335.561 4.182 20 0 EIADMP C[C@H](CCC(F)(F)F)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000541555751 1042010951 /nfs/dbraw/zinc/01/09/51/1042010951.db2.gz IRZJHNOWVWWJBG-HLLBOEOZSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@@H](C[NH2+][C@@H](c1ccccc1)c1ccc(OC(F)F)cc1)C[NH+](C)C ZINC000425943699 1042033346 /nfs/dbraw/zinc/03/33/46/1042033346.db2.gz JSMKSYOVDWNTEB-KXBFYZLASA-N 2 1 348.437 4.165 20 0 EIADMP c1ccc(OCCCCC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000438121442 1042062054 /nfs/dbraw/zinc/06/20/54/1042062054.db2.gz PKEDYNLRPXFFJI-DENIHFKCSA-N 2 1 342.527 4.184 20 0 EIADMP FC(F)(F)c1cccc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)c1 ZINC000517538079 1042064286 /nfs/dbraw/zinc/06/42/86/1042064286.db2.gz HFGYSIKGZBTUNN-UHFFFAOYSA-N 2 1 348.412 4.243 20 0 EIADMP FC(F)(F)c1cccc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)c1 ZINC000517538079 1042064291 /nfs/dbraw/zinc/06/42/91/1042064291.db2.gz HFGYSIKGZBTUNN-UHFFFAOYSA-N 2 1 348.412 4.243 20 0 EIADMP CCCCCOc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000517547199 1042076468 /nfs/dbraw/zinc/07/64/68/1042076468.db2.gz JQOXYCWTUPIUNR-HXUWFJFHSA-N 2 1 332.532 4.466 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CC[C@@](C)(c4ccccc4)C3)CC2)[nH+]c1 ZINC000438194488 1042085255 /nfs/dbraw/zinc/08/52/55/1042085255.db2.gz ZQUBKCZUVCAHSK-FYYLOGMGSA-N 2 1 349.522 4.459 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000464779826 1042160152 /nfs/dbraw/zinc/16/01/52/1042160152.db2.gz PZQPZHGFENNRBO-CABCVRRESA-N 2 1 326.431 4.013 20 0 EIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000464779826 1042160154 /nfs/dbraw/zinc/16/01/54/1042160154.db2.gz PZQPZHGFENNRBO-CABCVRRESA-N 2 1 326.431 4.013 20 0 EIADMP CCc1ccc(-c2ccc(C[NH2+]C[C@@H](C)Cn3cc[nH+]c3C)o2)cc1 ZINC000465006640 1042279412 /nfs/dbraw/zinc/27/94/12/1042279412.db2.gz RTJCCYPGJGKSSD-MRXNPFEDSA-N 2 1 337.467 4.440 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3cc(N)ccc32)CC[N@@H+]1Cc1ccccc1 ZINC000414937355 1042286706 /nfs/dbraw/zinc/28/67/06/1042286706.db2.gz VMTFYKCDXCIJNY-OAOOKAIFSA-N 2 1 349.522 4.289 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3cc(N)ccc32)CC[N@H+]1Cc1ccccc1 ZINC000414937355 1042286710 /nfs/dbraw/zinc/28/67/10/1042286710.db2.gz VMTFYKCDXCIJNY-OAOOKAIFSA-N 2 1 349.522 4.289 20 0 EIADMP CC(C)(C)OCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000669942053 1042538542 /nfs/dbraw/zinc/53/85/42/1042538542.db2.gz SJTQNTKNFDFXIN-IBGZPJMESA-N 2 1 332.532 4.082 20 0 EIADMP CC(C)(C)OCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000669942053 1042538544 /nfs/dbraw/zinc/53/85/44/1042538544.db2.gz SJTQNTKNFDFXIN-IBGZPJMESA-N 2 1 332.532 4.082 20 0 EIADMP CSc1ccc([C@@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)cc1 ZINC000173423698 1042571945 /nfs/dbraw/zinc/57/19/45/1042571945.db2.gz AKCRUMMKKAHEQQ-MRXNPFEDSA-N 2 1 341.524 4.432 20 0 EIADMP CCCCOc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167964269 1042572028 /nfs/dbraw/zinc/57/20/28/1042572028.db2.gz OFEHWOZKZDTKBQ-SEJPIABJSA-N 2 1 342.527 4.361 20 0 EIADMP Cc1cccnc1CCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000296349050 1042576956 /nfs/dbraw/zinc/57/69/56/1042576956.db2.gz IGAFZNYFIKOGPE-KOUNCHBCSA-N 2 1 349.522 4.108 20 0 EIADMP CCC(CC)(C[NH2+]C1CC(n2cccn2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000638638498 1042735583 /nfs/dbraw/zinc/73/55/83/1042735583.db2.gz DNKQCRXUTCBNRV-KKXNLOMOSA-N 2 1 340.515 4.086 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309752665 1042820213 /nfs/dbraw/zinc/82/02/13/1042820213.db2.gz ALUPFKUHCUTAGG-VQIMIIECSA-N 2 1 328.887 4.340 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309752665 1042820216 /nfs/dbraw/zinc/82/02/16/1042820216.db2.gz ALUPFKUHCUTAGG-VQIMIIECSA-N 2 1 328.887 4.340 20 0 EIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3ccccc3Cl)CC2)[nH+]1 ZINC000177347618 1042834814 /nfs/dbraw/zinc/83/48/14/1042834814.db2.gz NYSDTVIXJAMUEE-OAHLLOKOSA-N 2 1 329.875 4.363 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310473096 1042837820 /nfs/dbraw/zinc/83/78/20/1042837820.db2.gz BXUBODHVCUMBPF-SQGPQFPESA-N 2 1 326.459 4.387 20 0 EIADMP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310970371 1042848678 /nfs/dbraw/zinc/84/86/78/1042848678.db2.gz DDQQVYWGAWSCGW-QUCCMNQESA-N 2 1 338.495 4.176 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311069185 1042852484 /nfs/dbraw/zinc/85/24/84/1042852484.db2.gz YRHGWQOOVUJSEN-FQEVSTJZSA-N 2 1 338.495 4.086 20 0 EIADMP CC(C)Oc1ccccc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311069185 1042852485 /nfs/dbraw/zinc/85/24/85/1042852485.db2.gz YRHGWQOOVUJSEN-FQEVSTJZSA-N 2 1 338.495 4.086 20 0 EIADMP C[C@@H]([NH2+]Cc1coc2ccccc12)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311129923 1042853545 /nfs/dbraw/zinc/85/35/45/1042853545.db2.gz WJBKMGOAOKRSBJ-MJGOQNOKSA-N 2 1 334.463 4.433 20 0 EIADMP CCCOc1cccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000311221593 1042855275 /nfs/dbraw/zinc/85/52/75/1042855275.db2.gz VGIXUEVRUDCTMN-OAQYLSRUSA-N 2 1 338.495 4.087 20 0 EIADMP Cc1ccc(Br)cc1C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000190696744 1042965819 /nfs/dbraw/zinc/96/58/19/1042965819.db2.gz CSGIZEPBAQVIIS-UHFFFAOYSA-N 2 1 339.321 4.110 20 0 EIADMP CC(C)Oc1ccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)cc1Cl ZINC000493906946 1042973785 /nfs/dbraw/zinc/97/37/85/1042973785.db2.gz MONLKSYSSRTXAE-UHFFFAOYSA-N 2 1 338.923 4.432 20 0 EIADMP CC(C)Oc1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc1Cl ZINC000493906946 1042973805 /nfs/dbraw/zinc/97/38/05/1042973805.db2.gz MONLKSYSSRTXAE-UHFFFAOYSA-N 2 1 338.923 4.432 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)[C@H](OC)c2ccccc2)c1 ZINC000493905185 1042974294 /nfs/dbraw/zinc/97/42/94/1042974294.db2.gz HBVMIRPPKPMYKF-UWJYYQICSA-N 2 1 326.484 4.004 20 0 EIADMP CC[C@@H]1C[C@H](C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)CCO1 ZINC000507791854 1042974671 /nfs/dbraw/zinc/97/46/71/1042974671.db2.gz DEELGINHOSLZLF-CEWLAPEOSA-N 2 1 336.564 4.168 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)c(F)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168006985 1043011055 /nfs/dbraw/zinc/01/10/55/1043011055.db2.gz QDEAVUFQAJBQTG-HGKCTWBKSA-N 2 1 344.449 4.496 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)c(F)c2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168006985 1043011062 /nfs/dbraw/zinc/01/10/62/1043011062.db2.gz QDEAVUFQAJBQTG-HGKCTWBKSA-N 2 1 344.449 4.496 20 0 EIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(Br)c(Cl)c2)C1 ZINC000494081523 1043014927 /nfs/dbraw/zinc/01/49/27/1043014927.db2.gz ZBUMBUJLQYGBJZ-QWHCGFSZSA-N 2 1 345.712 4.065 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1N(C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183198617 1043039741 /nfs/dbraw/zinc/03/97/41/1043039741.db2.gz FPTWWGJFYBMTKI-IXDOHACOSA-N 2 1 347.522 4.195 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(Oc3ccccc3)o2)C[C@@H]1C ZINC000507809879 1043042167 /nfs/dbraw/zinc/04/21/67/1043042167.db2.gz AMADFQBSMHULST-DLBZAZTESA-N 2 1 328.456 4.377 20 0 EIADMP Cc1cncc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)c1 ZINC000184280783 1043086857 /nfs/dbraw/zinc/08/68/57/1043086857.db2.gz JZALDHCWWVLQOK-PKOBYXMFSA-N 2 1 337.511 4.473 20 0 EIADMP CC1CC[NH+](C2CCC([NH2+]Cc3nc(C(C)(C)C)co3)CC2)CC1 ZINC000921930796 1043117888 /nfs/dbraw/zinc/11/78/88/1043117888.db2.gz QTOHYUVCCSZFPF-UHFFFAOYSA-N 2 1 333.520 4.105 20 0 EIADMP C[C@@H](c1ccncc1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000673857221 1043126941 /nfs/dbraw/zinc/12/69/41/1043126941.db2.gz LEVILVIRXOAPPI-UGKGYDQZSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccncc1)[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000673857221 1043126944 /nfs/dbraw/zinc/12/69/44/1043126944.db2.gz LEVILVIRXOAPPI-UGKGYDQZSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccncc1)[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000673857221 1043126946 /nfs/dbraw/zinc/12/69/46/1043126946.db2.gz LEVILVIRXOAPPI-UGKGYDQZSA-N 2 1 335.495 4.131 20 0 EIADMP C[C@@H](c1ccncc1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000673857221 1043126951 /nfs/dbraw/zinc/12/69/51/1043126951.db2.gz LEVILVIRXOAPPI-UGKGYDQZSA-N 2 1 335.495 4.131 20 0 EIADMP CCSc1cccc(C[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)c1 ZINC000185552372 1043197555 /nfs/dbraw/zinc/19/75/55/1043197555.db2.gz VLVYNIOIASHJFT-UHFFFAOYSA-N 2 1 341.524 4.261 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+]C[C@H]3CCC[C@H](C)C3)CC2)cs1 ZINC000507933416 1043200278 /nfs/dbraw/zinc/20/02/78/1043200278.db2.gz CJBVEYGGORRWEA-WMZOPIPTSA-N 2 1 349.588 4.333 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2[nH]ccc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311138178 1043225077 /nfs/dbraw/zinc/22/50/77/1043225077.db2.gz YESBTBOHVFOTRS-DYESRHJHSA-N 2 1 333.479 4.168 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2cnc3ccccc3c2)CC1 ZINC000727467412 1043226677 /nfs/dbraw/zinc/22/66/77/1043226677.db2.gz WRDSWKCITGFZDI-UHFFFAOYSA-N 2 1 345.490 4.297 20 0 EIADMP c1ccc(C(CC[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000165941855 1043262795 /nfs/dbraw/zinc/26/27/95/1043262795.db2.gz KVWMXYLAHDLPIP-FGZHOGPDSA-N 2 1 334.507 4.425 20 0 EIADMP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CC3([NH3+])CCCC3)s2)cc1 ZINC000665249407 1043272556 /nfs/dbraw/zinc/27/25/56/1043272556.db2.gz PTUZQCCDDUSLEJ-ZDUSSCGKSA-N 2 1 345.512 4.049 20 0 EIADMP Cc1ccc2c(C3=CC[N@H+](CCC[NH+]4CCCCC4)CC3)c[nH]c2c1 ZINC000508187418 1043299126 /nfs/dbraw/zinc/29/91/26/1043299126.db2.gz NKFQGQSIPLYVTI-UHFFFAOYSA-N 2 1 337.511 4.441 20 0 EIADMP Cc1ccc2c(C3=CC[N@@H+](CCC[NH+]4CCCCC4)CC3)c[nH]c2c1 ZINC000508187418 1043299145 /nfs/dbraw/zinc/29/91/45/1043299145.db2.gz NKFQGQSIPLYVTI-UHFFFAOYSA-N 2 1 337.511 4.441 20 0 EIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccccc1 ZINC000674049649 1043349997 /nfs/dbraw/zinc/34/99/97/1043349997.db2.gz VROMDBPTQAQOFU-RTWAWAEBSA-N 2 1 330.516 4.007 20 0 EIADMP COc1ccc([C@@H]2CCNC[C@@H]2[NH2+][C@@H](C)c2csc(C)c2)cc1F ZINC000665259382 1043390817 /nfs/dbraw/zinc/39/08/17/1043390817.db2.gz DJPGWKQECVWJJP-OWQGQXMQSA-N 2 1 348.487 4.001 20 0 EIADMP CCc1nc(C)c(CN(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC000428242692 1043461512 /nfs/dbraw/zinc/46/15/12/1043461512.db2.gz WEBWELBOWQSTNO-VQIMIIECSA-N 2 1 341.499 4.030 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3cccnc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000674336105 1043604532 /nfs/dbraw/zinc/60/45/32/1043604532.db2.gz ZAMKKSBYZHQQOB-AVRDEDQJSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc3cccnc3c2)CC[N@H+]1Cc1ccccc1 ZINC000674336105 1043604556 /nfs/dbraw/zinc/60/45/56/1043604556.db2.gz ZAMKKSBYZHQQOB-AVRDEDQJSA-N 2 1 345.490 4.378 20 0 EIADMP C(=C/C[N@H+]1CCC[C@@H]1c1ccccn1)\C[NH+]1CCC[C@@H]1c1ccccn1 ZINC000674371430 1043646434 /nfs/dbraw/zinc/64/64/34/1043646434.db2.gz QRCNTDULJDXPFL-QDWIBDRMSA-N 2 1 348.494 4.007 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCCC[C@@H]1[C@@H]1CCOC1)[N@@H+](C)Cc1ccccc1 ZINC000474035180 1043696917 /nfs/dbraw/zinc/69/69/17/1043696917.db2.gz OWLPQOXPLDYQJO-ZHHKINOHSA-N 2 1 344.543 4.082 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H](COc2ccccc2)c2ccccc2)CC1 ZINC000543106617 1043851509 /nfs/dbraw/zinc/85/15/09/1043851509.db2.gz BVSMASXMPQEKND-QFIPXVFZSA-N 2 1 338.495 4.269 20 0 EIADMP COc1ccc([C@H]2CCCCC[N@@H+]2CCCn2cc[nH+]c2C)cc1 ZINC000428266603 1043911802 /nfs/dbraw/zinc/91/18/02/1043911802.db2.gz UEFADMJFMJFGBI-HXUWFJFHSA-N 2 1 327.472 4.208 20 0 EIADMP COc1ccc([C@H]2CCCCC[N@H+]2CCCn2cc[nH+]c2C)cc1 ZINC000428266603 1043911838 /nfs/dbraw/zinc/91/18/38/1043911838.db2.gz UEFADMJFMJFGBI-HXUWFJFHSA-N 2 1 327.472 4.208 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2ccccc2F)s1 ZINC000521855888 1044033143 /nfs/dbraw/zinc/03/31/43/1044033143.db2.gz BJWDVPZBSFDNDY-CQSZACIVSA-N 2 1 343.471 4.485 20 0 EIADMP C[C@H]([NH2+]CCc1ccc(F)cc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000428271200 1044066170 /nfs/dbraw/zinc/06/61/70/1044066170.db2.gz YHMKTQBJKAQMKQ-GOEBONIOSA-N 2 1 338.898 4.264 20 0 EIADMP CCn1c2ccccc2c2cc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H](C)C3)ccc21 ZINC000327016913 1044404615 /nfs/dbraw/zinc/40/46/15/1044404615.db2.gz HMJOJOWVVUOPHZ-SJLPKXTDSA-N 2 1 335.495 4.387 20 0 EIADMP C[NH+]1CCC([NH2+][C@@H](Cc2ccccc2Cl)c2ccccc2)CC1 ZINC000675733722 1044452373 /nfs/dbraw/zinc/45/23/73/1044452373.db2.gz KEVAMFRZQHJEFF-FQEVSTJZSA-N 2 1 328.887 4.308 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)o1 ZINC000675787066 1044498734 /nfs/dbraw/zinc/49/87/34/1044498734.db2.gz SVTXWRNOXOGXNX-IEBWSBKVSA-N 2 1 326.484 4.405 20 0 EIADMP CCc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)o1 ZINC000675787066 1044498745 /nfs/dbraw/zinc/49/87/45/1044498745.db2.gz SVTXWRNOXOGXNX-IEBWSBKVSA-N 2 1 326.484 4.405 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCc3ccc(C(F)(F)F)cc3)CC[C@H]21 ZINC000675897598 1044545063 /nfs/dbraw/zinc/54/50/63/1044545063.db2.gz HEQAPAHQZUHIOA-SJLPKXTDSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCc3ccc(C(F)(F)F)cc3)CC[C@H]21 ZINC000675897598 1044545082 /nfs/dbraw/zinc/54/50/82/1044545082.db2.gz HEQAPAHQZUHIOA-SJLPKXTDSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCc3ccc(C(F)(F)F)cc3)CC[C@H]21 ZINC000675897598 1044545095 /nfs/dbraw/zinc/54/50/95/1044545095.db2.gz HEQAPAHQZUHIOA-SJLPKXTDSA-N 2 1 340.433 4.054 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1ccc(Cl)cc1 ZINC000675882628 1044552769 /nfs/dbraw/zinc/55/27/69/1044552769.db2.gz SZLQYLMENUDYBA-MOPGFXCFSA-N 2 1 336.907 4.024 20 0 EIADMP C[C@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(c2ccccc2Cl)CC1 ZINC001168474661 1044555100 /nfs/dbraw/zinc/55/51/00/1044555100.db2.gz TYQGLRCCRJPHOU-OAHLLOKOSA-N 2 1 346.877 4.360 20 0 EIADMP c1ccc(C[C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000480753803 1044583162 /nfs/dbraw/zinc/58/31/62/1044583162.db2.gz BUMSKTPRWUPYRM-UGKGYDQZSA-N 2 1 326.528 4.252 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ncccc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168024271 1044605644 /nfs/dbraw/zinc/60/56/44/1044605644.db2.gz CZYMKNIIAFRCFI-ZRAXVTTISA-N 2 1 335.495 4.100 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C(C)(C)c2ccncc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168025308 1044643304 /nfs/dbraw/zinc/64/33/04/1044643304.db2.gz JIOLMFCFSPWVCG-RMFSNUHRSA-N 2 1 337.511 4.348 20 0 EIADMP C[C@@H]1C[C@@H](NCc2noc3ccccc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168025346 1044657393 /nfs/dbraw/zinc/65/73/93/1044657393.db2.gz JQMCEFRNMRYATC-IZZQQSIFSA-N 2 1 349.478 4.359 20 0 EIADMP C[C@H]1CC([NH2+]Cc2cncc(Cl)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168028703 1044748855 /nfs/dbraw/zinc/74/88/55/1044748855.db2.gz QGEUYLAMUQNHSJ-HOTGVXAUSA-N 2 1 343.902 4.266 20 0 EIADMP Cc1nc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(C)s1 ZINC000676488729 1044767848 /nfs/dbraw/zinc/76/78/48/1044767848.db2.gz CQDDDBDEVAPVIO-CQSZACIVSA-N 2 1 329.513 4.207 20 0 EIADMP Brc1ccccc1[C@@H]1CCC[N@@H+]1CC[C@@H]1CCCC[NH2+]1 ZINC001205000537 1044770967 /nfs/dbraw/zinc/77/09/67/1044770967.db2.gz GOQSTBLDYPJKKE-YOEHRIQHSA-N 2 1 337.305 4.118 20 0 EIADMP Brc1ccccc1[C@@H]1CCC[N@H+]1CC[C@@H]1CCCC[NH2+]1 ZINC001205000537 1044770986 /nfs/dbraw/zinc/77/09/86/1044770986.db2.gz GOQSTBLDYPJKKE-YOEHRIQHSA-N 2 1 337.305 4.118 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CC2Cc3ccccc3C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168033436 1044895296 /nfs/dbraw/zinc/89/52/96/1044895296.db2.gz LPTHDPVZUZIVJU-NHKMSHSESA-N 2 1 348.534 4.433 20 0 EIADMP Cc1nc(C(C)C)oc1C[N@@H+]1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000428962217 1044909284 /nfs/dbraw/zinc/90/92/84/1044909284.db2.gz NGFXGCFBURNXDF-MRXNPFEDSA-N 2 1 342.487 4.019 20 0 EIADMP Cc1nc(C(C)C)oc1C[N@H+]1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000428962217 1044909295 /nfs/dbraw/zinc/90/92/95/1044909295.db2.gz NGFXGCFBURNXDF-MRXNPFEDSA-N 2 1 342.487 4.019 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)ccc1SC(F)F ZINC000766165396 1045003022 /nfs/dbraw/zinc/00/30/22/1045003022.db2.gz HMMUKYUBGFFJEA-SGMGOOAPSA-N 2 1 344.471 4.143 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1SC(F)F ZINC000766165396 1045003035 /nfs/dbraw/zinc/00/30/35/1045003035.db2.gz HMMUKYUBGFFJEA-SGMGOOAPSA-N 2 1 344.471 4.143 20 0 EIADMP CC[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1cccc(Cl)c1 ZINC000673627872 1045048531 /nfs/dbraw/zinc/04/85/31/1045048531.db2.gz WEBYHMHCIMXESU-OALUTQOASA-N 2 1 336.907 4.024 20 0 EIADMP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000495420199 1045089502 /nfs/dbraw/zinc/08/95/02/1045089502.db2.gz FZFPDNDAYGPXHJ-LNLFQRSKSA-N 2 1 326.484 4.403 20 0 EIADMP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000495420199 1045089507 /nfs/dbraw/zinc/08/95/07/1045089507.db2.gz FZFPDNDAYGPXHJ-LNLFQRSKSA-N 2 1 326.484 4.403 20 0 EIADMP COC1(C[C@@H](C)[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCC1 ZINC000429432494 1045133744 /nfs/dbraw/zinc/13/37/44/1045133744.db2.gz XHPNMCZOAMYBFU-HZPDHXFCSA-N 2 1 327.472 4.179 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1F ZINC000495721981 1045313025 /nfs/dbraw/zinc/31/30/25/1045313025.db2.gz AXHDATKRPAJKMO-CVEARBPZSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1F ZINC000495721981 1045313030 /nfs/dbraw/zinc/31/30/30/1045313030.db2.gz AXHDATKRPAJKMO-CVEARBPZSA-N 2 1 332.488 4.450 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cccc3cc[nH]c32)CC1 ZINC000237520530 1045388669 /nfs/dbraw/zinc/38/86/69/1045388669.db2.gz YXJNMQLDPVLTFY-KRWDZBQOSA-N 2 1 333.479 4.483 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000237595320 1045389496 /nfs/dbraw/zinc/38/94/96/1045389496.db2.gz LBUCXXLULATHRN-CRAIPNDOSA-N 2 1 330.422 4.108 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000237595320 1045389507 /nfs/dbraw/zinc/38/95/07/1045389507.db2.gz LBUCXXLULATHRN-CRAIPNDOSA-N 2 1 330.422 4.108 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC000237574398 1045389612 /nfs/dbraw/zinc/38/96/12/1045389612.db2.gz LBUCXXLULATHRN-QAPCUYQASA-N 2 1 330.422 4.108 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)c(F)c2)CC[N@H+]1Cc1ccccc1 ZINC000237574398 1045389624 /nfs/dbraw/zinc/38/96/24/1045389624.db2.gz LBUCXXLULATHRN-QAPCUYQASA-N 2 1 330.422 4.108 20 0 EIADMP Fc1ccc(Cl)cc1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000393751482 1045489860 /nfs/dbraw/zinc/48/98/60/1045489860.db2.gz RXEQTZSSAMOXQC-INIZCTEOSA-N 2 1 332.850 4.091 20 0 EIADMP Fc1ccc(Cl)cc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000393751482 1045489862 /nfs/dbraw/zinc/48/98/62/1045489862.db2.gz RXEQTZSSAMOXQC-INIZCTEOSA-N 2 1 332.850 4.091 20 0 EIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(Br)c1 ZINC000322630203 1045491566 /nfs/dbraw/zinc/49/15/66/1045491566.db2.gz VIGBPICLMXOAND-HMQMGEFJSA-N 2 1 337.305 4.115 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)C(c1ccccc1)c1ccccc1 ZINC000322881304 1045500642 /nfs/dbraw/zinc/50/06/42/1045500642.db2.gz BLOAPIBHLBFSTF-AMZGXZFVSA-N 2 1 334.507 4.422 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000398025059 1045823244 /nfs/dbraw/zinc/82/32/44/1045823244.db2.gz CATARXGKWSWIJB-SPEDKVCISA-N 2 1 338.495 4.256 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000398025059 1045823245 /nfs/dbraw/zinc/82/32/45/1045823245.db2.gz CATARXGKWSWIJB-SPEDKVCISA-N 2 1 338.495 4.256 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000247201882 1045842984 /nfs/dbraw/zinc/84/29/84/1045842984.db2.gz WIKYXDQVCGRQDY-RBUKOAKNSA-N 2 1 340.515 4.035 20 0 EIADMP CC[C@H]1C[C@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)CCO1 ZINC001170176614 1045913518 /nfs/dbraw/zinc/91/35/18/1045913518.db2.gz AAEJAJVUHWWWJQ-OKDVXBPUSA-N 2 1 342.527 4.072 20 0 EIADMP Cc1[nH]c2ccc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)cc2[nH+]1 ZINC001170330616 1046000963 /nfs/dbraw/zinc/00/09/63/1046000963.db2.gz CUNBLIHBNTWHEN-OWZKRDHZSA-N 2 1 346.478 4.479 20 0 EIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc2c(c1)CCCO2 ZINC000153972996 1046016520 /nfs/dbraw/zinc/01/65/20/1046016520.db2.gz BAYZIPXPBFGFNV-IBGZPJMESA-N 2 1 327.472 4.038 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(F)c(Br)c2)CC1 ZINC000037236937 1046090424 /nfs/dbraw/zinc/09/04/24/1046090424.db2.gz VLHMIHOBVLYGOA-GFCCVEGCSA-N 2 1 343.284 4.113 20 0 EIADMP CC(C)C[C@H](C[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccccc1 ZINC000792979128 1046114763 /nfs/dbraw/zinc/11/47/63/1046114763.db2.gz YEAZNKOMKANVHH-IRLDBZIGSA-N 2 1 344.543 4.049 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000747095588 1046119409 /nfs/dbraw/zinc/11/94/09/1046119409.db2.gz PPLMRXBSAJOELZ-VQTJNVASSA-N 2 1 330.516 4.362 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000747095588 1046119412 /nfs/dbraw/zinc/11/94/12/1046119412.db2.gz PPLMRXBSAJOELZ-VQTJNVASSA-N 2 1 330.516 4.362 20 0 EIADMP Cc1cc(C)cc([C@H](C)[NH2+]C2CCN(c3cc(C)[nH+]c(C)n3)CC2)c1 ZINC000162223452 1046157008 /nfs/dbraw/zinc/15/70/08/1046157008.db2.gz AYVCEGOMLJORMC-KRWDZBQOSA-N 2 1 338.499 4.030 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(NCc3ccc(Cl)o3)cc2)CC1 ZINC000770595414 1046232269 /nfs/dbraw/zinc/23/22/69/1046232269.db2.gz UFIVWELPNPUETM-UHFFFAOYSA-N 2 1 347.890 4.323 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000125421612 1046305961 /nfs/dbraw/zinc/30/59/61/1046305961.db2.gz ZPMBSVJLYIKFJS-HNAYVOBHSA-N 2 1 327.472 4.353 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000125421612 1046305992 /nfs/dbraw/zinc/30/59/92/1046305992.db2.gz ZPMBSVJLYIKFJS-HNAYVOBHSA-N 2 1 327.472 4.353 20 0 EIADMP CCc1noc(C)c1CN(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000268119981 1046325961 /nfs/dbraw/zinc/32/59/61/1046325961.db2.gz FRIAGKUGWVWTMP-QFBILLFUSA-N 2 1 341.499 4.030 20 0 EIADMP CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000166227467 1046355224 /nfs/dbraw/zinc/35/52/24/1046355224.db2.gz KMVKARBQAAMMFX-YZGWKJHDSA-N 2 1 330.516 4.011 20 0 EIADMP Cn1c[nH+]cc1CC[NH2+]C1(c2ccc(C(F)(F)F)cc2)CCCC1 ZINC000459403778 1046601610 /nfs/dbraw/zinc/60/16/10/1046601610.db2.gz GSHCUUHCSYXWIL-UHFFFAOYSA-N 2 1 337.389 4.041 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@@H]1C ZINC000536659111 1046611863 /nfs/dbraw/zinc/61/18/63/1046611863.db2.gz FHRSUOVCMROXQR-KSSFIOAISA-N 2 1 346.906 4.035 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@@H]1C ZINC000536659111 1046611876 /nfs/dbraw/zinc/61/18/76/1046611876.db2.gz FHRSUOVCMROXQR-KSSFIOAISA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@@H]1C ZINC000536659111 1046611890 /nfs/dbraw/zinc/61/18/90/1046611890.db2.gz FHRSUOVCMROXQR-KSSFIOAISA-N 2 1 346.906 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c[nH]nc2-c2ccc(Cl)cc2)C[C@@H]1C ZINC000536659111 1046611916 /nfs/dbraw/zinc/61/19/16/1046611916.db2.gz FHRSUOVCMROXQR-KSSFIOAISA-N 2 1 346.906 4.035 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2cc(C)c(Br)s2)C[C@H]1C ZINC000536662002 1046632157 /nfs/dbraw/zinc/63/21/57/1046632157.db2.gz JXYWTJNXUBXDQY-OLZOCXBDSA-N 2 1 345.350 4.124 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(Br)s2)C[C@H]1C ZINC000536662002 1046632169 /nfs/dbraw/zinc/63/21/69/1046632169.db2.gz JXYWTJNXUBXDQY-OLZOCXBDSA-N 2 1 345.350 4.124 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(Br)s2)C[C@H]1C ZINC000536662002 1046632178 /nfs/dbraw/zinc/63/21/78/1046632178.db2.gz JXYWTJNXUBXDQY-OLZOCXBDSA-N 2 1 345.350 4.124 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000127457038 1046674040 /nfs/dbraw/zinc/67/40/40/1046674040.db2.gz RBFSFVRIYGNMRN-UHFFFAOYSA-N 2 1 349.400 4.390 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000127457038 1046674049 /nfs/dbraw/zinc/67/40/49/1046674049.db2.gz RBFSFVRIYGNMRN-UHFFFAOYSA-N 2 1 349.400 4.390 20 0 EIADMP CC[N@H+](CCc1nccs1)CC(C)(C)C[NH+](C)Cc1ccccc1 ZINC000536696212 1046691093 /nfs/dbraw/zinc/69/10/93/1046691093.db2.gz OGWHDDCDEXHMOL-UHFFFAOYSA-N 2 1 345.556 4.166 20 0 EIADMP CC[N@@H+](CCc1nccs1)CC(C)(C)C[NH+](C)Cc1ccccc1 ZINC000536696212 1046691104 /nfs/dbraw/zinc/69/11/04/1046691104.db2.gz OGWHDDCDEXHMOL-UHFFFAOYSA-N 2 1 345.556 4.166 20 0 EIADMP CC[NH+](CCc1nccs1)CC(C)(C)C[N@H+](C)Cc1ccccc1 ZINC000536696212 1046691113 /nfs/dbraw/zinc/69/11/13/1046691113.db2.gz OGWHDDCDEXHMOL-UHFFFAOYSA-N 2 1 345.556 4.166 20 0 EIADMP CC[NH+](CCc1nccs1)CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000536696212 1046691128 /nfs/dbraw/zinc/69/11/28/1046691128.db2.gz OGWHDDCDEXHMOL-UHFFFAOYSA-N 2 1 345.556 4.166 20 0 EIADMP C[C@@H]1C[C@H](NCc2cc(F)ccc2F)CC[N@H+]1Cc1ccccc1 ZINC000379624356 1046714601 /nfs/dbraw/zinc/71/46/01/1046714601.db2.gz JPDRXTPSILBZSN-DNVCBOLYSA-N 2 1 330.422 4.108 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379625287 1046714804 /nfs/dbraw/zinc/71/48/04/1046714804.db2.gz KPWJNFOUVJPFLV-DBXWQHBBSA-N 2 1 340.486 4.399 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379625287 1046714820 /nfs/dbraw/zinc/71/48/20/1046714820.db2.gz KPWJNFOUVJPFLV-DBXWQHBBSA-N 2 1 340.486 4.399 20 0 EIADMP Cc1nc(CC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)sc1C ZINC000127750105 1046723139 /nfs/dbraw/zinc/72/31/39/1046723139.db2.gz CNVJJTDHDXYMBC-CQSZACIVSA-N 2 1 340.496 4.147 20 0 EIADMP Cc1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1Br ZINC000127877069 1046732583 /nfs/dbraw/zinc/73/25/83/1046732583.db2.gz HUYCBJWJUXPIRQ-UHFFFAOYSA-N 2 1 339.321 4.110 20 0 EIADMP CCOc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379643035 1046736830 /nfs/dbraw/zinc/73/68/30/1046736830.db2.gz ASJQLZYYGUZDMV-RXVVDRJESA-N 2 1 338.495 4.228 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCCC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000379651222 1046742535 /nfs/dbraw/zinc/74/25/35/1046742535.db2.gz UJEQNTIMWVEJHV-BHIYHBOVSA-N 2 1 336.470 4.455 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379657622 1046759582 /nfs/dbraw/zinc/75/95/82/1046759582.db2.gz UAPVFNOKVQHUJN-LQWHRVPQSA-N 2 1 338.495 4.399 20 0 EIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379657622 1046759594 /nfs/dbraw/zinc/75/95/94/1046759594.db2.gz UAPVFNOKVQHUJN-LQWHRVPQSA-N 2 1 338.495 4.399 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cccc(F)c1F ZINC000536863774 1046829623 /nfs/dbraw/zinc/82/96/23/1046829623.db2.gz MSKUJLBHWZNHIN-UZLBHIALSA-N 2 1 344.449 4.008 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2OC)C2CCCC2)C1 ZINC000536959189 1046870095 /nfs/dbraw/zinc/87/00/95/1046870095.db2.gz KUXJAFHGOMGCCV-LAUBAEHRSA-N 2 1 330.516 4.248 20 0 EIADMP COc1ccc([C@@H]([NH2+]CCCC[N@H+]2CCCC[C@H]2C)C2CC2)cc1 ZINC000536947128 1046876726 /nfs/dbraw/zinc/87/67/26/1046876726.db2.gz KCKJLLIOMZRTIG-UTKZUKDTSA-N 2 1 330.516 4.391 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000536999916 1046890747 /nfs/dbraw/zinc/89/07/47/1046890747.db2.gz FZTJSTWUJDVXQW-GUYCJALGSA-N 2 1 326.406 4.088 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccc(OCC2CC2)c(F)c1 ZINC000537123100 1046950975 /nfs/dbraw/zinc/95/09/75/1046950975.db2.gz CMRWDMLZFHNVEX-CRAIPNDOSA-N 2 1 334.479 4.140 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(OCC2CC2)c(F)c1 ZINC000537123100 1046950999 /nfs/dbraw/zinc/95/09/99/1046950999.db2.gz CMRWDMLZFHNVEX-CRAIPNDOSA-N 2 1 334.479 4.140 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497839062 1047116268 /nfs/dbraw/zinc/11/62/68/1047116268.db2.gz FTLPMRFFWXGHGJ-UTKZUKDTSA-N 2 1 330.491 4.472 20 0 EIADMP CC[NH+](CC)CCC[N@H+]1CCCCC[C@H]1C[C@@H](O)c1cccs1 ZINC000788482684 1047213400 /nfs/dbraw/zinc/21/34/00/1047213400.db2.gz QLFJBWRDWADLMA-ZWKOTPCHSA-N 2 1 338.561 4.148 20 0 EIADMP COc1ccc(C2([NH2+]C3CC[NH+]([C@@H]4CCC[C@@H](C)C4)CC3)CC2)cc1 ZINC000537422504 1047214321 /nfs/dbraw/zinc/21/43/21/1047214321.db2.gz MGIZGPHTOLXTFB-YLJYHZDGSA-N 2 1 342.527 4.317 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2ccc(Cl)nc21 ZINC000788527565 1047228876 /nfs/dbraw/zinc/22/88/76/1047228876.db2.gz NKJQLBFDEFMYLO-SFHVURJKSA-N 2 1 343.902 4.352 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCOc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000556064371 1047430495 /nfs/dbraw/zinc/43/04/95/1047430495.db2.gz YGHRFHZNBKXKRS-UYAOXDASSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCOc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000556064371 1047430499 /nfs/dbraw/zinc/43/04/99/1047430499.db2.gz YGHRFHZNBKXKRS-UYAOXDASSA-N 2 1 344.886 4.144 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)o1 ZINC000556092716 1047443999 /nfs/dbraw/zinc/44/39/99/1047443999.db2.gz BZTLYFMANGBODN-LRQRDZAKSA-N 2 1 326.484 4.334 20 0 EIADMP Cc1ccc(CC[C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)o1 ZINC000556092716 1047444007 /nfs/dbraw/zinc/44/40/07/1047444007.db2.gz BZTLYFMANGBODN-LRQRDZAKSA-N 2 1 326.484 4.334 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)Oc1cccc(F)c1 ZINC000556093680 1047444795 /nfs/dbraw/zinc/44/47/95/1047444795.db2.gz KEXDFFUYKWEUIC-OZOXKJRCSA-N 2 1 342.458 4.018 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)Oc1cccc(F)c1 ZINC000556093680 1047444802 /nfs/dbraw/zinc/44/48/02/1047444802.db2.gz KEXDFFUYKWEUIC-OZOXKJRCSA-N 2 1 342.458 4.018 20 0 EIADMP COc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556103677 1047454231 /nfs/dbraw/zinc/45/42/31/1047454231.db2.gz ULFRTTDSRNYXDU-QMMLZNLJSA-N 2 1 336.479 4.108 20 0 EIADMP COc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556103677 1047454239 /nfs/dbraw/zinc/45/42/39/1047454239.db2.gz ULFRTTDSRNYXDU-QMMLZNLJSA-N 2 1 336.479 4.108 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC[N@H+]2C2CC2)cc1 ZINC000897746547 1047481415 /nfs/dbraw/zinc/48/14/15/1047481415.db2.gz NLWSJCUAKIKCQL-BLXFWRLFSA-N 2 1 342.552 4.371 20 0 EIADMP c1ccc([C@@H]2C[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC[N@@H+]2C2CC2)cc1 ZINC000897746547 1047481419 /nfs/dbraw/zinc/48/14/19/1047481419.db2.gz NLWSJCUAKIKCQL-BLXFWRLFSA-N 2 1 342.552 4.371 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)CCS1 ZINC000897788144 1047482799 /nfs/dbraw/zinc/48/27/99/1047482799.db2.gz CCRSPCXHWVEFCA-HAGHYFMRSA-N 2 1 344.568 4.303 20 0 EIADMP Cc1cccnc1C(C)(C)C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556195252 1047553628 /nfs/dbraw/zinc/55/36/28/1047553628.db2.gz UGFIPPFCMRIORP-WOJBJXKFSA-N 2 1 337.511 4.093 20 0 EIADMP Cc1cccnc1C(C)(C)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556195252 1047553637 /nfs/dbraw/zinc/55/36/37/1047553637.db2.gz UGFIPPFCMRIORP-WOJBJXKFSA-N 2 1 337.511 4.093 20 0 EIADMP COc1cccc(C[N@H+]2CCC3(C2)CC[NH+]([C@@H]2CC[C@H](C)C2)CC3)c1 ZINC001170136345 1047591176 /nfs/dbraw/zinc/59/11/76/1047591176.db2.gz JUMFUVWXXICUSI-AZUAARDMSA-N 2 1 342.527 4.172 20 0 EIADMP FC(F)(F)Sc1ccccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000898281724 1047609122 /nfs/dbraw/zinc/60/91/22/1047609122.db2.gz PCSYIWSHVAUGNL-ZIAGYGMSSA-N 2 1 330.419 4.015 20 0 EIADMP FC(F)(F)Sc1ccccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000898281724 1047609130 /nfs/dbraw/zinc/60/91/30/1047609130.db2.gz PCSYIWSHVAUGNL-ZIAGYGMSSA-N 2 1 330.419 4.015 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000550606176 1047746367 /nfs/dbraw/zinc/74/63/67/1047746367.db2.gz FNEDSKRBVSTLST-IFMALSPDSA-N 2 1 338.495 4.399 20 0 EIADMP CC(C)Oc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000550606179 1047747628 /nfs/dbraw/zinc/74/76/28/1047747628.db2.gz FNEDSKRBVSTLST-UNMCSNQZSA-N 2 1 338.495 4.399 20 0 EIADMP CC(C)c1cnc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)o1 ZINC000763434218 1047764719 /nfs/dbraw/zinc/76/47/19/1047764719.db2.gz RVQJXULJAVSADL-QGZVFWFLSA-N 2 1 333.520 4.275 20 0 EIADMP CC(C)c1cnc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)o1 ZINC000763434218 1047764734 /nfs/dbraw/zinc/76/47/34/1047764734.db2.gz RVQJXULJAVSADL-QGZVFWFLSA-N 2 1 333.520 4.275 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@@H]2CC2(Cl)Cl)CC1 ZINC000763435103 1047804746 /nfs/dbraw/zinc/80/47/46/1047804746.db2.gz YZZGPKOSEOTUKB-ZBFHGGJFSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556609730 1047839992 /nfs/dbraw/zinc/83/99/92/1047839992.db2.gz ACGYCMVZISSDPG-XNJGSVPQSA-N 2 1 349.931 4.282 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556609730 1047839994 /nfs/dbraw/zinc/83/99/94/1047839994.db2.gz ACGYCMVZISSDPG-XNJGSVPQSA-N 2 1 349.931 4.282 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc3cc(Cl)cnc3o2)cc1 ZINC000824383505 1047864188 /nfs/dbraw/zinc/86/41/88/1047864188.db2.gz OIURGONGMMIDPH-UHFFFAOYSA-N 2 1 343.858 4.175 20 0 EIADMP CC[C@H]1C[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCO1 ZINC000824427274 1047867204 /nfs/dbraw/zinc/86/72/04/1047867204.db2.gz IBKWJSGEUFDBAW-FAEIBLRNSA-N 2 1 342.527 4.119 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCO[C@H]3CCCC[C@@H]3C)C2)CC1 ZINC000498881058 1047896958 /nfs/dbraw/zinc/89/69/58/1047896958.db2.gz QYBNAQFZDAAKKN-HBMCJLEFSA-N 2 1 336.564 4.026 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCO[C@H]3CCCC[C@@H]3C)C2)CC1 ZINC000498881058 1047896965 /nfs/dbraw/zinc/89/69/65/1047896965.db2.gz QYBNAQFZDAAKKN-HBMCJLEFSA-N 2 1 336.564 4.026 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCO[C@H]3CCCC[C@H]3C)C2)CC1 ZINC000498881061 1047897688 /nfs/dbraw/zinc/89/76/88/1047897688.db2.gz QYBNAQFZDAAKKN-NJYVYQBISA-N 2 1 336.564 4.026 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCO[C@H]3CCCC[C@H]3C)C2)CC1 ZINC000498881061 1047897692 /nfs/dbraw/zinc/89/76/92/1047897692.db2.gz QYBNAQFZDAAKKN-NJYVYQBISA-N 2 1 336.564 4.026 20 0 EIADMP CC(C)Oc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000498909321 1047933750 /nfs/dbraw/zinc/93/37/50/1047933750.db2.gz HQLQNKOHUGFERH-NRFANRHFSA-N 2 1 344.543 4.418 20 0 EIADMP CC(C)Oc1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000498909321 1047933788 /nfs/dbraw/zinc/93/37/88/1047933788.db2.gz HQLQNKOHUGFERH-NRFANRHFSA-N 2 1 344.543 4.418 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@]2(C)CC2(Cl)Cl)CC[N@H+]1Cc1ccccc1 ZINC000824775051 1047933654 /nfs/dbraw/zinc/93/36/54/1047933654.db2.gz XRDHYLLTENEGDE-HYVNUMGLSA-N 2 1 341.326 4.213 20 0 EIADMP Cc1ccc2c(C[NH+]3CCCC[C@@H]3C[C@@H]3CCC[N@@H+]3C)c[nH]c2c1 ZINC001136974963 1048007353 /nfs/dbraw/zinc/00/73/53/1048007353.db2.gz UODJLYRFOATTPF-RBUKOAKNSA-N 2 1 325.500 4.315 20 0 EIADMP Cc1ccc2c(C[N@H+]3CCCC[C@@H]3C[C@@H]3CCC[NH+]3C)c[nH]c2c1 ZINC001136974963 1048007367 /nfs/dbraw/zinc/00/73/67/1048007367.db2.gz UODJLYRFOATTPF-RBUKOAKNSA-N 2 1 325.500 4.315 20 0 EIADMP Cc1ccc2c(C[N@@H+]3CCCC[C@@H]3C[C@@H]3CCC[NH+]3C)c[nH]c2c1 ZINC001136974963 1048007384 /nfs/dbraw/zinc/00/73/84/1048007384.db2.gz UODJLYRFOATTPF-RBUKOAKNSA-N 2 1 325.500 4.315 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171112197 1048234914 /nfs/dbraw/zinc/23/49/14/1048234914.db2.gz TYGUIMSJPQVZNQ-VAMGGRTRSA-N 2 1 332.919 4.179 20 0 EIADMP Fc1ccc(CN[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c(F)c1 ZINC000499147322 1048350094 /nfs/dbraw/zinc/35/00/94/1048350094.db2.gz PALLXCNVDKDQCY-OWZKRDHZSA-N 2 1 342.433 4.250 20 0 EIADMP Fc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(F)c1 ZINC000499147322 1048350111 /nfs/dbraw/zinc/35/01/11/1048350111.db2.gz PALLXCNVDKDQCY-OWZKRDHZSA-N 2 1 342.433 4.250 20 0 EIADMP Fc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c(F)c1 ZINC000499147322 1048350129 /nfs/dbraw/zinc/35/01/29/1048350129.db2.gz PALLXCNVDKDQCY-OWZKRDHZSA-N 2 1 342.433 4.250 20 0 EIADMP CN(C)c1cccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000499154462 1048362203 /nfs/dbraw/zinc/36/22/03/1048362203.db2.gz UOSYCBJDBFUDCR-UADZTWIMSA-N 2 1 349.522 4.038 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(-n3cccc3)cc2)CC1 ZINC001144250827 1048542924 /nfs/dbraw/zinc/54/29/24/1048542924.db2.gz BADLYJLEIMRORP-UHFFFAOYSA-N 2 1 325.500 4.174 20 0 EIADMP CC[NH+]1CCC([N@H+](C)[C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171162226 1048597726 /nfs/dbraw/zinc/59/77/26/1048597726.db2.gz IXFZSFIYNGZAEW-INIZCTEOSA-N 2 1 341.326 4.267 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)[C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171162226 1048597738 /nfs/dbraw/zinc/59/77/38/1048597738.db2.gz IXFZSFIYNGZAEW-INIZCTEOSA-N 2 1 341.326 4.267 20 0 EIADMP CCc1cccc(CN2CCC([N@@H+](C)Cc3cccc(F)c3)CC2)c1 ZINC001144326477 1048599510 /nfs/dbraw/zinc/59/95/10/1048599510.db2.gz BKRMUNRDHQXRTK-UHFFFAOYSA-N 2 1 340.486 4.485 20 0 EIADMP CCc1cccc(C[NH+]2CCC(N(C)Cc3cccc(F)c3)CC2)c1 ZINC001144326477 1048599524 /nfs/dbraw/zinc/59/95/24/1048599524.db2.gz BKRMUNRDHQXRTK-UHFFFAOYSA-N 2 1 340.486 4.485 20 0 EIADMP c1cc2cccc(C[NH+]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]4C3)c2[nH]1 ZINC001144718327 1048818799 /nfs/dbraw/zinc/81/87/99/1048818799.db2.gz HQZRWDQUAYKAET-IFMALSPDSA-N 2 1 345.490 4.122 20 0 EIADMP c1cc2cccc(C[N@H+]3CC[C@@H]4C[NH+](Cc5ccccc5)C[C@H]4C3)c2[nH]1 ZINC001144718327 1048818800 /nfs/dbraw/zinc/81/88/00/1048818800.db2.gz HQZRWDQUAYKAET-IFMALSPDSA-N 2 1 345.490 4.122 20 0 EIADMP CC(C)Cc1ccc([C@@H]([NH2+][C@@H](C)C2C[NH2+]C2)c2cccs2)cc1 ZINC000817897342 1049053741 /nfs/dbraw/zinc/05/37/41/1049053741.db2.gz LFQGHAAVVMAQJQ-MGPUTAFESA-N 2 1 328.525 4.234 20 0 EIADMP Cc1[nH+]c2ccc(-n3c(CC[NH3+])cc4ccccc43)cc2n1C(C)C ZINC001171304268 1049149764 /nfs/dbraw/zinc/14/97/64/1049149764.db2.gz FTWUOBJDZCRPPU-UHFFFAOYSA-N 2 1 332.451 4.371 20 0 EIADMP CCO[C@@H]1C[C@@H]([N@H+](C)CCCCn2cc[nH+]c2C)C12CCCCC2 ZINC000348185200 1049476621 /nfs/dbraw/zinc/47/66/21/1049476621.db2.gz ASLRHUHTGCOARH-RTBURBONSA-N 2 1 333.520 4.031 20 0 EIADMP CCO[C@@H]1C[C@@H]([N@@H+](C)CCCCn2cc[nH+]c2C)C12CCCCC2 ZINC000348185200 1049476628 /nfs/dbraw/zinc/47/66/28/1049476628.db2.gz ASLRHUHTGCOARH-RTBURBONSA-N 2 1 333.520 4.031 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](CCSc2ccc(F)cc2)CC1 ZINC000195667381 1049488301 /nfs/dbraw/zinc/48/83/01/1049488301.db2.gz MBVBDOJUAYCTDZ-UHFFFAOYSA-N 2 1 338.536 4.362 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](Cc1ccccc1C)c1ccco1 ZINC000820810614 1049553879 /nfs/dbraw/zinc/55/38/79/1049553879.db2.gz AIGGGYGHVCYPJN-FQEVSTJZSA-N 2 1 337.467 4.447 20 0 EIADMP C[N@H+]1CCC[C@@H](CN[C@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809857 1049554798 /nfs/dbraw/zinc/55/47/98/1049554798.db2.gz JKVFQGSTGJAMRY-HNAYVOBHSA-N 2 1 332.875 4.148 20 0 EIADMP CN1CCC[C@@H](C[NH2+][C@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809857 1049554812 /nfs/dbraw/zinc/55/48/12/1049554812.db2.gz JKVFQGSTGJAMRY-HNAYVOBHSA-N 2 1 332.875 4.148 20 0 EIADMP C[N@@H+]1CCC[C@@H](C[NH2+][C@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809857 1049554824 /nfs/dbraw/zinc/55/48/24/1049554824.db2.gz JKVFQGSTGJAMRY-HNAYVOBHSA-N 2 1 332.875 4.148 20 0 EIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H](Cc2ccccc2Cl)c2ccoc2)C1 ZINC000820809857 1049554836 /nfs/dbraw/zinc/55/48/36/1049554836.db2.gz JKVFQGSTGJAMRY-HNAYVOBHSA-N 2 1 332.875 4.148 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)[C@H]2CCc3c(F)cccc3C2)CC1 ZINC001171414182 1049645706 /nfs/dbraw/zinc/64/57/06/1049645706.db2.gz OGBPCZBZGAZSPS-UFYCRDLUSA-N 2 1 344.518 4.445 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)[C@@H](C)C1 ZINC000245426608 1049719783 /nfs/dbraw/zinc/71/97/83/1049719783.db2.gz LMOVSLVEFVKZSF-KBXCAEBGSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c3cccnc23)[C@@H](C)C1 ZINC000245426608 1049719794 /nfs/dbraw/zinc/71/97/94/1049719794.db2.gz LMOVSLVEFVKZSF-KBXCAEBGSA-N 2 1 331.891 4.050 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c3cccnc23)[C@@H](C)C1 ZINC000245426608 1049719807 /nfs/dbraw/zinc/71/98/07/1049719807.db2.gz LMOVSLVEFVKZSF-KBXCAEBGSA-N 2 1 331.891 4.050 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+]C1(C)CC[NH+](Cc3ccccc3)CC1)C2 ZINC001171564266 1049756727 /nfs/dbraw/zinc/75/67/27/1049756727.db2.gz WVDVBAHARANKTA-QFIPXVFZSA-N 2 1 348.534 4.497 20 0 EIADMP Cc1cccc2c1CC[C@@H]([NH2+]C1(C)CC[NH+](Cc3ccccc3)CC1)C2 ZINC001171564265 1049756994 /nfs/dbraw/zinc/75/69/94/1049756994.db2.gz WVDVBAHARANKTA-JOCHJYFZSA-N 2 1 348.534 4.497 20 0 EIADMP Cl/C=C(/Cl)C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000813370966 1049760720 /nfs/dbraw/zinc/76/07/20/1049760720.db2.gz MFDFGEDBHXPBFE-SFQUDFHCSA-N 2 1 339.310 4.294 20 0 EIADMP Cl/C=C(/Cl)C[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000813370966 1049760726 /nfs/dbraw/zinc/76/07/26/1049760726.db2.gz MFDFGEDBHXPBFE-SFQUDFHCSA-N 2 1 339.310 4.294 20 0 EIADMP Cl/C=C(\Cl)C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000813370965 1049761007 /nfs/dbraw/zinc/76/10/07/1049761007.db2.gz MFDFGEDBHXPBFE-ATVHPVEESA-N 2 1 339.310 4.294 20 0 EIADMP Cl/C=C(\Cl)C[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000813370965 1049761015 /nfs/dbraw/zinc/76/10/15/1049761015.db2.gz MFDFGEDBHXPBFE-ATVHPVEESA-N 2 1 339.310 4.294 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2cccc(OC(F)(F)F)c2)CC1(C)C ZINC001171618777 1049766693 /nfs/dbraw/zinc/76/66/93/1049766693.db2.gz BUMRNVMZBPETSZ-UHFFFAOYSA-N 2 1 344.421 4.326 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2cccc(C(F)(F)F)c2)CC1(C)C ZINC001171617072 1049766938 /nfs/dbraw/zinc/76/69/38/1049766938.db2.gz FZHDINDPOUHRPQ-UHFFFAOYSA-N 2 1 328.422 4.446 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@H](CCO)c2ccc(Cl)cc2)CC1(C)C ZINC001171621884 1049767077 /nfs/dbraw/zinc/76/70/77/1049767077.db2.gz RKPCBBFMPOQGNL-QGZVFWFLSA-N 2 1 338.923 4.005 20 0 EIADMP C[C@H]([NH3+])c1ccc2c(ccn2[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC001171726745 1049785343 /nfs/dbraw/zinc/78/53/43/1049785343.db2.gz HYUKEBSYGJXHJT-LLGFUMIMSA-N 2 1 333.479 4.497 20 0 EIADMP CC1(C)C[C@@H]([NH2+]CCOc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001171961610 1049824177 /nfs/dbraw/zinc/82/41/77/1049824177.db2.gz ASPAXBUQGQVMHU-FQEVSTJZSA-N 2 1 338.495 4.098 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2ccnc(Cl)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171963747 1049825053 /nfs/dbraw/zinc/82/50/53/1049825053.db2.gz JBCDUSGJKQGUGK-GOSISDBHSA-N 2 1 343.902 4.268 20 0 EIADMP CC1(C)C[C@H]([NH2+]Cc2ccnc(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC001171963747 1049825054 /nfs/dbraw/zinc/82/50/54/1049825054.db2.gz JBCDUSGJKQGUGK-GOSISDBHSA-N 2 1 343.902 4.268 20 0 EIADMP CC1(C)C[C@@H](n2ccc3cc(C[NH3+])cnc32)CC[N@H+]1Cc1ccccc1 ZINC001171971362 1049834805 /nfs/dbraw/zinc/83/48/05/1049834805.db2.gz HCLIRKYLQIUHLV-FQEVSTJZSA-N 2 1 348.494 4.111 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccc(O)cc1 ZINC001171971539 1049835049 /nfs/dbraw/zinc/83/50/49/1049835049.db2.gz JDRIVNBEWDAMGT-PXNSSMCTSA-N 2 1 338.495 4.486 20 0 EIADMP CC1(C)C[C@H](n2nc(C[NH3+])c3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC001171973398 1049835659 /nfs/dbraw/zinc/83/56/59/1049835659.db2.gz YMRCMNORKMWCGW-GOSISDBHSA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@H](n2c(C[NH3+])cc3ccncc32)CC[N@H+]1Cc1ccccc1 ZINC001171974577 1049835768 /nfs/dbraw/zinc/83/57/68/1049835768.db2.gz HSSYHOBXOXGMRZ-LJQANCHMSA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@H](n2cnc3cccc(C[NH3+])c32)CC[N@H+]1Cc1ccccc1 ZINC001171973879 1049836255 /nfs/dbraw/zinc/83/62/55/1049836255.db2.gz AEEBRLCQZHCHPF-LJQANCHMSA-N 2 1 348.494 4.111 20 0 EIADMP c1cc2c(o1)CCC[C@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245725363 1049838790 /nfs/dbraw/zinc/83/87/90/1049838790.db2.gz PIOQHRLTOHCOBX-RCLSDMTESA-N 2 1 336.479 4.442 20 0 EIADMP c1cc2c(o1)CCC[C@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245725363 1049838792 /nfs/dbraw/zinc/83/87/92/1049838792.db2.gz PIOQHRLTOHCOBX-RCLSDMTESA-N 2 1 336.479 4.442 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CC[C@@]3(C2)CCCCO3)CC[N@H+]1Cc1ccccc1 ZINC001171981733 1049838828 /nfs/dbraw/zinc/83/88/28/1049838828.db2.gz NGCUDPYJFMHABE-RBBKRZOGSA-N 2 1 342.527 4.075 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CC[C@@]3(C2)CCCCO3)CC[NH+]1Cc1ccccc1 ZINC001171981733 1049838829 /nfs/dbraw/zinc/83/88/29/1049838829.db2.gz NGCUDPYJFMHABE-RBBKRZOGSA-N 2 1 342.527 4.075 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CC[C@@]3(C2)CCCCO3)CC[NH+]1Cc1ccccc1 ZINC001171981733 1049838834 /nfs/dbraw/zinc/83/88/34/1049838834.db2.gz NGCUDPYJFMHABE-RBBKRZOGSA-N 2 1 342.527 4.075 20 0 EIADMP CC1(C)C[C@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CCO1 ZINC001171978676 1049839407 /nfs/dbraw/zinc/83/94/07/1049839407.db2.gz IJPMVEBTECYQFG-WOJBJXKFSA-N 2 1 344.543 4.224 20 0 EIADMP CCCN(CCC[NH+](C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987395 1049840097 /nfs/dbraw/zinc/84/00/97/1049840097.db2.gz USAPMTIVLRHNHE-OAQYLSRUSA-N 2 1 345.575 4.093 20 0 EIADMP C[NH2+]Cc1cccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171986267 1049840703 /nfs/dbraw/zinc/84/07/03/1049840703.db2.gz GJNIZFLXRAPSQO-OAQYLSRUSA-N 2 1 337.511 4.261 20 0 EIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCc2cccc(F)c2C1 ZINC001171014368 1049841590 /nfs/dbraw/zinc/84/15/90/1049841590.db2.gz YYMBIIVXFTWQNB-FQEVSTJZSA-N 2 1 344.518 4.412 20 0 EIADMP F[C@H]1CCCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070339 1049842959 /nfs/dbraw/zinc/84/29/59/1049842959.db2.gz ZFSNHYUYEKLLCT-UWHLTILDSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070339 1049842960 /nfs/dbraw/zinc/84/29/60/1049842960.db2.gz ZFSNHYUYEKLLCT-UWHLTILDSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070339 1049842962 /nfs/dbraw/zinc/84/29/62/1049842962.db2.gz ZFSNHYUYEKLLCT-UWHLTILDSA-N 2 1 330.491 4.396 20 0 EIADMP F[C@H]1CCCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070339 1049842966 /nfs/dbraw/zinc/84/29/66/1049842966.db2.gz ZFSNHYUYEKLLCT-UWHLTILDSA-N 2 1 330.491 4.396 20 0 EIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@@H]2CCc4cccnc42)C3)cc1 ZINC001172073580 1049844403 /nfs/dbraw/zinc/84/44/03/1049844403.db2.gz RZEDLHUXKUKJCE-YUMYIRISSA-N 2 1 347.506 4.244 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@@H]2CCc4cccnc42)C3)cc1 ZINC001172073580 1049844409 /nfs/dbraw/zinc/84/44/09/1049844409.db2.gz RZEDLHUXKUKJCE-YUMYIRISSA-N 2 1 347.506 4.244 20 0 EIADMP CC[N@H+](C1CCOCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172073876 1049844482 /nfs/dbraw/zinc/84/44/82/1049844482.db2.gz DRAPAZPAALLZJG-ZBYYUNFXSA-N 2 1 342.527 4.073 20 0 EIADMP CC[N@@H+](C1CCOCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172073876 1049844485 /nfs/dbraw/zinc/84/44/85/1049844485.db2.gz DRAPAZPAALLZJG-ZBYYUNFXSA-N 2 1 342.527 4.073 20 0 EIADMP CC[NH+](C1CCOCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172073876 1049844486 /nfs/dbraw/zinc/84/44/86/1049844486.db2.gz DRAPAZPAALLZJG-ZBYYUNFXSA-N 2 1 342.527 4.073 20 0 EIADMP CC[NH+](C1CCOCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172073876 1049844491 /nfs/dbraw/zinc/84/44/91/1049844491.db2.gz DRAPAZPAALLZJG-ZBYYUNFXSA-N 2 1 342.527 4.073 20 0 EIADMP [NH3+]CCc1cccc(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001172065171 1049850964 /nfs/dbraw/zinc/85/09/64/1049850964.db2.gz IONNYFPKDPKCCU-NUNAXRQHSA-N 2 1 349.522 4.185 20 0 EIADMP C[C@]1(CF)CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070258 1049853360 /nfs/dbraw/zinc/85/33/60/1049853360.db2.gz XRPCYOGEKCQSTN-PLACYPQZSA-N 2 1 330.491 4.254 20 0 EIADMP C[C@]1(CF)CC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172070258 1049853361 /nfs/dbraw/zinc/85/33/61/1049853361.db2.gz XRPCYOGEKCQSTN-PLACYPQZSA-N 2 1 330.491 4.254 20 0 EIADMP C[C@]1(CF)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172070258 1049853363 /nfs/dbraw/zinc/85/33/63/1049853363.db2.gz XRPCYOGEKCQSTN-PLACYPQZSA-N 2 1 330.491 4.254 20 0 EIADMP C[C@]1(CF)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172070258 1049853367 /nfs/dbraw/zinc/85/33/67/1049853367.db2.gz XRPCYOGEKCQSTN-PLACYPQZSA-N 2 1 330.491 4.254 20 0 EIADMP CO[C@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172070026 1049853518 /nfs/dbraw/zinc/85/35/18/1049853518.db2.gz IXJKXAMNDOMHJC-HRMJIJJXSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127448 1049853744 /nfs/dbraw/zinc/85/37/44/1049853744.db2.gz JNVRSPZBGINYGU-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP C[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127448 1049853745 /nfs/dbraw/zinc/85/37/45/1049853745.db2.gz JNVRSPZBGINYGU-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172127448 1049853748 /nfs/dbraw/zinc/85/37/48/1049853748.db2.gz JNVRSPZBGINYGU-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP C[NH+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172127448 1049853749 /nfs/dbraw/zinc/85/37/49/1049853749.db2.gz JNVRSPZBGINYGU-BJWYYQGGSA-N 2 1 326.406 4.153 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1Cl)C2 ZINC001172103756 1049856454 /nfs/dbraw/zinc/85/64/54/1049856454.db2.gz XKQKCSIXMZCRRB-QDMKHBRRSA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1Cl)C2 ZINC001172103756 1049856458 /nfs/dbraw/zinc/85/64/58/1049856458.db2.gz XKQKCSIXMZCRRB-QDMKHBRRSA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCCc1cccc(C(F)(F)F)c1)C2 ZINC001172104247 1049856738 /nfs/dbraw/zinc/85/67/38/1049856738.db2.gz BHIRKRBYNMGKED-BCDXTJNWSA-N 2 1 340.433 4.243 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1cc(Cl)cc(Cl)c1)C2 ZINC001172107669 1049856749 /nfs/dbraw/zinc/85/67/49/1049856749.db2.gz GIQSJZYWJQHGGW-BJWYYQGGSA-N 2 1 327.299 4.141 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(C(F)(F)F)c(Cl)c1)C2 ZINC001172105060 1049857107 /nfs/dbraw/zinc/85/71/07/1049857107.db2.gz FSXNUWOIJKQUEQ-ZSOGYDGISA-N 2 1 346.824 4.464 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(Cc3ccccc3F)CCC1)C2 ZINC001172110605 1049857252 /nfs/dbraw/zinc/85/72/52/1049857252.db2.gz KVFJPFQXNVTHGN-REPLKXPHSA-N 2 1 330.491 4.143 20 0 EIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172104246 1049857576 /nfs/dbraw/zinc/85/75/76/1049857576.db2.gz DPOHXJWNGOOLIQ-QDMKHBRRSA-N 2 1 327.299 4.407 20 0 EIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172104246 1049857577 /nfs/dbraw/zinc/85/75/77/1049857577.db2.gz DPOHXJWNGOOLIQ-QDMKHBRRSA-N 2 1 327.299 4.407 20 0 EIADMP COCCC[NH+]1CCC([N@@H+]2CCCC[C@H]2c2ccc(C)c(C)c2)CC1 ZINC001172254254 1049871968 /nfs/dbraw/zinc/87/19/68/1049871968.db2.gz JIAWOJXAXCQCFK-QFIPXVFZSA-N 2 1 344.543 4.331 20 0 EIADMP COCCC[NH+]1CCC([N@H+]2CCCC[C@H]2c2ccc(C)c(C)c2)CC1 ZINC001172254254 1049871970 /nfs/dbraw/zinc/87/19/70/1049871970.db2.gz JIAWOJXAXCQCFK-QFIPXVFZSA-N 2 1 344.543 4.331 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC001172319423 1049877195 /nfs/dbraw/zinc/87/71/95/1049877195.db2.gz QUNPRFHXWOVOBT-QHGDMDKLSA-N 2 1 344.543 4.080 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172326879 1049879877 /nfs/dbraw/zinc/87/98/77/1049879877.db2.gz BSOGAMSJXQTCEL-IRFCIJBXSA-N 2 1 346.559 4.470 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172326879 1049879881 /nfs/dbraw/zinc/87/98/81/1049879881.db2.gz BSOGAMSJXQTCEL-IRFCIJBXSA-N 2 1 346.559 4.470 20 0 EIADMP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C[C@H]1C ZINC001172379936 1049885996 /nfs/dbraw/zinc/88/59/96/1049885996.db2.gz UJZIVSXLMXZTKI-QWFCFKBJSA-N 2 1 330.516 4.392 20 0 EIADMP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC([NH3+])(c2cccc(Cl)c2)CC1 ZINC001172340934 1049889238 /nfs/dbraw/zinc/88/92/38/1049889238.db2.gz YAYCFRPGNUFRJJ-CVEARBPZSA-N 2 1 338.923 4.184 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001172339791 1049889285 /nfs/dbraw/zinc/88/92/85/1049889285.db2.gz QQODUWZMEHHNIH-OALUTQOASA-N 2 1 348.531 4.161 20 0 EIADMP CC[C@@H](C)OCC[C@@H](C)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001172352506 1049892079 /nfs/dbraw/zinc/89/20/79/1049892079.db2.gz RMBMFKDIESEKDC-RTBURBONSA-N 2 1 332.532 4.224 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C ZINC001172353459 1049893204 /nfs/dbraw/zinc/89/32/04/1049893204.db2.gz XAHPKWRBVBHRPK-AQCRLBJHSA-N 2 1 346.559 4.328 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001172355742 1049894662 /nfs/dbraw/zinc/89/46/62/1049894662.db2.gz VVIGZIMKPNJNIS-ZJOUEHCJSA-N 2 1 332.532 4.034 20 0 EIADMP CC[C@H](C)OCC[C@H](C)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001172355742 1049894663 /nfs/dbraw/zinc/89/46/63/1049894663.db2.gz VVIGZIMKPNJNIS-ZJOUEHCJSA-N 2 1 332.532 4.034 20 0 EIADMP CC[C@@H](CC(C)C)[NH+]1CCC2(C[C@H]([N@@H+](C)Cc3ccco3)CO2)CC1 ZINC001172402921 1049898809 /nfs/dbraw/zinc/89/88/09/1049898809.db2.gz PSRIQKLDUMVNBS-OALUTQOASA-N 2 1 348.531 4.160 20 0 EIADMP c1ccc(-c2cccc(C[N@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)c2)nc1 ZINC000246098467 1049908552 /nfs/dbraw/zinc/90/85/52/1049908552.db2.gz JCHQEAJKRRBCGZ-REWPJTCUSA-N 2 1 347.506 4.197 20 0 EIADMP CC(C)OCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172436701 1049912142 /nfs/dbraw/zinc/91/21/42/1049912142.db2.gz HHVGBJKSTISEAM-AZUAARDMSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)OCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172436701 1049912146 /nfs/dbraw/zinc/91/21/46/1049912146.db2.gz HHVGBJKSTISEAM-AZUAARDMSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)COCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172455589 1049915770 /nfs/dbraw/zinc/91/57/70/1049915770.db2.gz UJBSFTWZEPADIM-PSWRPDDJSA-N 2 1 344.543 4.223 20 0 EIADMP CC(C)COCC[C@@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172466209 1049918300 /nfs/dbraw/zinc/91/83/00/1049918300.db2.gz BMDIBOJMYIDAFV-CTNGQTDRSA-N 2 1 346.559 4.328 20 0 EIADMP CC(C)COCC[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172466209 1049918309 /nfs/dbraw/zinc/91/83/09/1049918309.db2.gz BMDIBOJMYIDAFV-CTNGQTDRSA-N 2 1 346.559 4.328 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172721644 1049964749 /nfs/dbraw/zinc/96/47/49/1049964749.db2.gz IIPPCFCULXSBKH-SLFFLAALSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172721644 1049964753 /nfs/dbraw/zinc/96/47/53/1049964753.db2.gz IIPPCFCULXSBKH-SLFFLAALSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172721644 1049964758 /nfs/dbraw/zinc/96/47/58/1049964758.db2.gz IIPPCFCULXSBKH-SLFFLAALSA-N 2 1 332.919 4.146 20 0 EIADMP Cc1nccn1CCCC[N@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000246381289 1049965408 /nfs/dbraw/zinc/96/54/08/1049965408.db2.gz ZPMBSVJLYIKFJS-DNVCBOLYSA-N 2 1 327.472 4.353 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000246381289 1049965421 /nfs/dbraw/zinc/96/54/21/1049965421.db2.gz ZPMBSVJLYIKFJS-DNVCBOLYSA-N 2 1 327.472 4.353 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000246381289 1049965423 /nfs/dbraw/zinc/96/54/23/1049965423.db2.gz ZPMBSVJLYIKFJS-DNVCBOLYSA-N 2 1 327.472 4.353 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2C[C@H](c3ccccc3)C2(C)C)cn1 ZINC000181012213 1049977883 /nfs/dbraw/zinc/97/78/83/1049977883.db2.gz ONYHJGJCUAZPLE-WOJBJXKFSA-N 2 1 346.478 4.248 20 0 EIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1OC ZINC000246813397 1050002295 /nfs/dbraw/zinc/00/22/95/1050002295.db2.gz AUDKQPLJWRNLTN-LNLFQRSKSA-N 2 1 348.531 4.398 20 0 EIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000246813397 1050002299 /nfs/dbraw/zinc/00/22/99/1050002299.db2.gz AUDKQPLJWRNLTN-LNLFQRSKSA-N 2 1 348.531 4.398 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2cccc(Br)c21 ZINC000247003827 1050008861 /nfs/dbraw/zinc/00/88/61/1050008861.db2.gz KVIRHUJTDJHUEY-PBFPGSCMSA-N 2 1 349.316 4.071 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc2c(c1)OCCCO2 ZINC000247007955 1050010296 /nfs/dbraw/zinc/01/02/96/1050010296.db2.gz LBPMRJVUTZSQRU-QZTJIDSGSA-N 2 1 346.515 4.153 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248388798 1050052214 /nfs/dbraw/zinc/05/22/14/1050052214.db2.gz ADVYFYJMIYLWDU-SQNIBIBYSA-N 2 1 330.516 4.307 20 0 EIADMP COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248388798 1050052223 /nfs/dbraw/zinc/05/22/23/1050052223.db2.gz ADVYFYJMIYLWDU-SQNIBIBYSA-N 2 1 330.516 4.307 20 0 EIADMP COc1ccc(OC)c([C@H](C)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000248404240 1050054015 /nfs/dbraw/zinc/05/40/15/1050054015.db2.gz PUEJKYUGASWYOP-IKGGRYGDSA-N 2 1 346.515 4.007 20 0 EIADMP COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000248404240 1050054016 /nfs/dbraw/zinc/05/40/16/1050054016.db2.gz PUEJKYUGASWYOP-IKGGRYGDSA-N 2 1 346.515 4.007 20 0 EIADMP COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000248404240 1050054019 /nfs/dbraw/zinc/05/40/19/1050054019.db2.gz PUEJKYUGASWYOP-IKGGRYGDSA-N 2 1 346.515 4.007 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCC2Cc3ccccc3C2)C[C@@H]1c1ccccc1 ZINC000520621181 1050057846 /nfs/dbraw/zinc/05/78/46/1050057846.db2.gz WZTJYPLDYPZZAF-XZOQPEGZSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCC2Cc3ccccc3C2)C[C@@H]1c1ccccc1 ZINC000520621181 1050057855 /nfs/dbraw/zinc/05/78/55/1050057855.db2.gz WZTJYPLDYPZZAF-XZOQPEGZSA-N 2 1 334.507 4.217 20 0 EIADMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2csc(Cl)c2)[C@@H](C)C1 ZINC000248732228 1050075388 /nfs/dbraw/zinc/07/53/88/1050075388.db2.gz WEHKHECIYLKJHY-LZWOXQAQSA-N 2 1 344.952 4.189 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2csc(Cl)c2)[C@@H](C)C1 ZINC000248732228 1050075393 /nfs/dbraw/zinc/07/53/93/1050075393.db2.gz WEHKHECIYLKJHY-LZWOXQAQSA-N 2 1 344.952 4.189 20 0 EIADMP 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 1050092879 /nfs/dbraw/zinc/09/28/79/1050092879.db2.gz SEHWPXBTUMHCPE-XJIUQZFPSA-N 2 1 328.422 4.127 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000249188533 1050094219 /nfs/dbraw/zinc/09/42/19/1050094219.db2.gz MGBXCGXGFDUUGO-ZJIFWQFVSA-N 2 1 332.454 4.350 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](CC)c2cccc(F)c2)[C@H](C)C1 ZINC000249214412 1050095373 /nfs/dbraw/zinc/09/53/73/1050095373.db2.gz ZJIIEAWNBLZGIC-AHRSYUTCSA-N 2 1 336.495 4.003 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](CCc3ccccc3)CC1)CC2 ZINC001172833635 1050168279 /nfs/dbraw/zinc/16/82/79/1050168279.db2.gz AFGYWHOHZIIRCK-DEOSSOPVSA-N 2 1 348.534 4.149 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2cccs2)cc1 ZINC001177231317 1050168616 /nfs/dbraw/zinc/16/86/16/1050168616.db2.gz LGIBVDFJNFZMIN-OAHLLOKOSA-N 2 1 325.481 4.346 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(Br)c1 ZINC000251335482 1050168854 /nfs/dbraw/zinc/16/88/54/1050168854.db2.gz YTXFOVKGNLZJLO-ULQDDVLXSA-N 2 1 337.305 4.117 20 0 EIADMP CCOc1cccc(F)c1C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177290060 1050178553 /nfs/dbraw/zinc/17/85/53/1050178553.db2.gz LQDNFICWAQTSCP-CALCHBBNSA-N 2 1 336.495 4.072 20 0 EIADMP CC(C)c1nc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c2ccccn21 ZINC001177299493 1050179575 /nfs/dbraw/zinc/17/95/75/1050179575.db2.gz SIKJLBATCCSDFS-SFHVURJKSA-N 2 1 342.531 4.202 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cccc(F)c1OC(F)F ZINC001177299554 1050181085 /nfs/dbraw/zinc/18/10/85/1050181085.db2.gz VJZFILAIVUSLGC-AWEZNQCLSA-N 2 1 344.421 4.171 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C)CC2 ZINC001172843746 1050182772 /nfs/dbraw/zinc/18/27/72/1050182772.db2.gz OKODCFULFVWSGI-BDTNDASRSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C)CC2 ZINC001172843746 1050182775 /nfs/dbraw/zinc/18/27/75/1050182775.db2.gz OKODCFULFVWSGI-BDTNDASRSA-N 2 1 326.528 4.191 20 0 EIADMP Cc1ccc2c(c1)C[C@@H]([N@@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C)CC2 ZINC001172843746 1050182777 /nfs/dbraw/zinc/18/27/77/1050182777.db2.gz OKODCFULFVWSGI-BDTNDASRSA-N 2 1 326.528 4.191 20 0 EIADMP CC(C)[N@@H+]([C@H](C)Cc1ccc(F)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172855882 1050192748 /nfs/dbraw/zinc/19/27/48/1050192748.db2.gz APZXMFPLDSWOSX-KBRIMQKVSA-N 2 1 326.887 4.390 20 0 EIADMP C[C@@H](C[NH2+]Cc1ccc(-c2ccc(Cl)cc2)o1)C[NH+]1CCCC1 ZINC001177328984 1050193913 /nfs/dbraw/zinc/19/39/13/1050193913.db2.gz YOAWJBAFXBYHRI-HNNXBMFYSA-N 2 1 332.875 4.422 20 0 EIADMP C[C@@H](Cc1ccc(F)cc1Cl)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001172860342 1050198659 /nfs/dbraw/zinc/19/86/59/1050198659.db2.gz CMWHILMRNJKCCY-GJZGRUSLSA-N 2 1 326.887 4.251 20 0 EIADMP C[C@H](CSc1ccc(Cl)cc1)[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001172881687 1050222634 /nfs/dbraw/zinc/22/26/34/1050222634.db2.gz KQYIXKUKCVQNQP-OAHLLOKOSA-N 2 1 338.948 4.238 20 0 EIADMP COc1cc(C)ccc1C[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001177548594 1050250350 /nfs/dbraw/zinc/25/03/50/1050250350.db2.gz KWURWVKNTJYBCT-HXUWFJFHSA-N 2 1 338.495 4.005 20 0 EIADMP COc1cc(C)ccc1C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001177548594 1050250364 /nfs/dbraw/zinc/25/03/64/1050250364.db2.gz KWURWVKNTJYBCT-HXUWFJFHSA-N 2 1 338.495 4.005 20 0 EIADMP COCCCN1CCC([NH2+][C@@H](c2ccccc2F)C2CCCC2)CC1 ZINC000091317650 1050252726 /nfs/dbraw/zinc/25/27/26/1050252726.db2.gz SYABDVFVNZNNJU-OAQYLSRUSA-N 2 1 348.506 4.148 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001173113486 1050310320 /nfs/dbraw/zinc/31/03/20/1050310320.db2.gz QNIPKBWUMCEKAE-HDYDNRTBSA-N 2 1 330.516 4.138 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](C)Cc2cccc3cccnc32)CC1 ZINC001173114430 1050310735 /nfs/dbraw/zinc/31/07/35/1050310735.db2.gz JQIGWZZBMFBJTL-UHFFFAOYSA-N 2 1 325.500 4.320 20 0 EIADMP CC[NH+](CC)C1CCC([N@@H+](Cc2ccccc2)C2CCOCC2)CC1 ZINC001173114345 1050311141 /nfs/dbraw/zinc/31/11/41/1050311141.db2.gz HPLDQAOTVJIBDP-UHFFFAOYSA-N 2 1 344.543 4.321 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)CC1 ZINC001173117469 1050315811 /nfs/dbraw/zinc/31/58/11/1050315811.db2.gz MVJVJSOQYJVSGR-XVAXZDLZSA-N 2 1 332.507 4.486 20 0 EIADMP CCc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@H](C)CC3)CC2)cs1 ZINC001177855425 1050317092 /nfs/dbraw/zinc/31/70/92/1050317092.db2.gz VTPXUUUDOZSMJC-FUHWJXTLSA-N 2 1 349.588 4.476 20 0 EIADMP C[C@H](CC[NH2+]Cc1nccc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC001177962876 1050330912 /nfs/dbraw/zinc/33/09/12/1050330912.db2.gz UZQRYYUOPCASER-GOSISDBHSA-N 2 1 333.479 4.235 20 0 EIADMP C[C@H](CC[NH2+]Cc1nccc2ccccc21)[N@@H+](C)Cc1ccccc1 ZINC001177962876 1050330930 /nfs/dbraw/zinc/33/09/30/1050330930.db2.gz UZQRYYUOPCASER-GOSISDBHSA-N 2 1 333.479 4.235 20 0 EIADMP CC(C)[N@H+]1CC[C@H]([NH2+]C2CCC(Oc3ccccc3)CC2)[C@@H](C)C1 ZINC001173202545 1050345414 /nfs/dbraw/zinc/34/54/14/1050345414.db2.gz UJNSJROBNXYYKF-CZOVOBHWSA-N 2 1 330.516 4.085 20 0 EIADMP CCc1ccc(C[C@@H](C)[NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)cc1 ZINC001173250630 1050377220 /nfs/dbraw/zinc/37/72/20/1050377220.db2.gz SRYHIEGUPMLFBC-QGZVFWFLSA-N 2 1 340.486 4.269 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2cccc(F)c2F)C[N@H+]1Cc1ccccc1 ZINC001178208287 1050403818 /nfs/dbraw/zinc/40/38/18/1050403818.db2.gz KYQLEIDDVKHLAH-FUHWJXTLSA-N 2 1 344.449 4.355 20 0 EIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc(F)cc2F)C[N@H+]1Cc1ccccc1 ZINC001178207952 1050404247 /nfs/dbraw/zinc/40/42/47/1050404247.db2.gz JKLCUJDGELSWEZ-SJLPKXTDSA-N 2 1 344.449 4.355 20 0 EIADMP COC(=O)CCCC[C@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173445649 1050462708 /nfs/dbraw/zinc/46/27/08/1050462708.db2.gz NPEUVRBXFQXUSA-LNLFQRSKSA-N 2 1 338.536 4.013 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC001173545630 1050477896 /nfs/dbraw/zinc/47/78/96/1050477896.db2.gz CBXSTIYOYDDEPT-OGHNNQOOSA-N 2 1 329.315 4.244 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1CC[N@@H+](C)C[C@@H]1C ZINC001173545630 1050477899 /nfs/dbraw/zinc/47/78/99/1050477899.db2.gz CBXSTIYOYDDEPT-OGHNNQOOSA-N 2 1 329.315 4.244 20 0 EIADMP Cc1cc(C[N@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)ccc1Oc1ccccc1 ZINC001206209691 1050535515 /nfs/dbraw/zinc/53/55/15/1050535515.db2.gz IBHJEAWSWLQLRE-RTBURBONSA-N 2 1 328.431 4.049 20 0 EIADMP C[N@H+]1CCCC[C@@H]1C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001178701278 1050535751 /nfs/dbraw/zinc/53/57/51/1050535751.db2.gz HOZCDCFYTDHOSK-OAHLLOKOSA-N 2 1 328.481 4.056 20 0 EIADMP [NH3+][C@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC[C@@H]1F ZINC001206212288 1050542268 /nfs/dbraw/zinc/54/22/68/1050542268.db2.gz RKNYPRGXPPFSPW-OALUTQOASA-N 2 1 332.850 4.268 20 0 EIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC[C@@H]1F ZINC001206212288 1050542283 /nfs/dbraw/zinc/54/22/83/1050542283.db2.gz RKNYPRGXPPFSPW-OALUTQOASA-N 2 1 332.850 4.268 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3nc(Cl)ccc3s2)C[C@H]1C ZINC001204236524 1050615900 /nfs/dbraw/zinc/61/59/00/1050615900.db2.gz HVJZJFPMJRXJAF-OLZOCXBDSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc3nc(Cl)ccc3s2)C[C@H]1C ZINC001204236524 1050615901 /nfs/dbraw/zinc/61/59/01/1050615901.db2.gz HVJZJFPMJRXJAF-OLZOCXBDSA-N 2 1 337.920 4.254 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc3nc(Cl)ccc3s2)C[C@H]1C ZINC001204236524 1050615905 /nfs/dbraw/zinc/61/59/05/1050615905.db2.gz HVJZJFPMJRXJAF-OLZOCXBDSA-N 2 1 337.920 4.254 20 0 EIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1C ZINC001179110024 1050635964 /nfs/dbraw/zinc/63/59/64/1050635964.db2.gz FAQOCOTYYBSIBT-REWPJTCUSA-N 2 1 336.523 4.489 20 0 EIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1C ZINC001179110024 1050635968 /nfs/dbraw/zinc/63/59/68/1050635968.db2.gz FAQOCOTYYBSIBT-REWPJTCUSA-N 2 1 336.523 4.489 20 0 EIADMP C[NH+]1CCC(COc2ccc(Nc3cc[nH+]c4ccccc34)cc2)CC1 ZINC001174038897 1050716157 /nfs/dbraw/zinc/71/61/57/1050716157.db2.gz FXPRAUGJMFSKHP-UHFFFAOYSA-N 2 1 347.462 4.121 20 0 EIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](CC4CCSCC4)CC[C@H]32)cc1 ZINC001179918360 1050833871 /nfs/dbraw/zinc/83/38/71/1050833871.db2.gz BOCCNQXXYRCCIC-NHCUHLMSSA-N 2 1 344.568 4.116 20 0 EIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](CC4CCSCC4)CC[C@H]32)cc1 ZINC001179918360 1050833874 /nfs/dbraw/zinc/83/38/74/1050833874.db2.gz BOCCNQXXYRCCIC-NHCUHLMSSA-N 2 1 344.568 4.116 20 0 EIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](CC4CCSCC4)CC[C@H]32)cc1 ZINC001179918360 1050833879 /nfs/dbraw/zinc/83/38/79/1050833879.db2.gz BOCCNQXXYRCCIC-NHCUHLMSSA-N 2 1 344.568 4.116 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cc3ccccc3n2C)C1 ZINC001180031068 1050860154 /nfs/dbraw/zinc/86/01/54/1050860154.db2.gz UHHIJGXJULQVSV-RTBURBONSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cc3ccccc3n2C)C1 ZINC001180031068 1050860157 /nfs/dbraw/zinc/86/01/57/1050860157.db2.gz UHHIJGXJULQVSV-RTBURBONSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cc3ccccc3n2C)C1 ZINC001180031068 1050860161 /nfs/dbraw/zinc/86/01/61/1050860161.db2.gz UHHIJGXJULQVSV-RTBURBONSA-N 2 1 339.527 4.265 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cc3ccccc3n2C)C1 ZINC001180031068 1050860164 /nfs/dbraw/zinc/86/01/64/1050860164.db2.gz UHHIJGXJULQVSV-RTBURBONSA-N 2 1 339.527 4.265 20 0 EIADMP COCC[N@@H+](C)CCCC1CC[NH+](C[C@@H](C)c2ccc(C)cc2)CC1 ZINC001180077804 1050877811 /nfs/dbraw/zinc/87/78/11/1050877811.db2.gz VMKWEUXEBNCHNP-HXUWFJFHSA-N 2 1 346.559 4.169 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H]2CCc3ccccc3C2)CC1 ZINC001180125401 1050892463 /nfs/dbraw/zinc/89/24/63/1050892463.db2.gz YEACTWANRZFUPT-FQEVSTJZSA-N 2 1 328.544 4.235 20 0 EIADMP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001180302566 1050945220 /nfs/dbraw/zinc/94/52/20/1050945220.db2.gz ZLYNMXDPUBINFN-HLRQEUIKSA-N 2 1 326.528 4.455 20 0 EIADMP C[N@@H+]1CCC[C@@H]2C[NH+](CCCc3c(Cl)cccc3Cl)CC[C@H]21 ZINC001204278338 1051066095 /nfs/dbraw/zinc/06/60/95/1051066095.db2.gz BAKKUOSSGRYTBE-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCc3c(Cl)cccc3Cl)CC[C@H]21 ZINC001204278338 1051066110 /nfs/dbraw/zinc/06/61/10/1051066110.db2.gz BAKKUOSSGRYTBE-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCc3c(Cl)cccc3Cl)CC[C@H]21 ZINC001204278338 1051066118 /nfs/dbraw/zinc/06/61/18/1051066118.db2.gz BAKKUOSSGRYTBE-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CCCc3c(Cl)cccc3Cl)CC[C@H]21 ZINC001204278338 1051066126 /nfs/dbraw/zinc/06/61/26/1051066126.db2.gz BAKKUOSSGRYTBE-RDTXWAMCSA-N 2 1 341.326 4.342 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001180793783 1051076868 /nfs/dbraw/zinc/07/68/68/1051076868.db2.gz LSICUFGLZVUXTF-QGZVFWFLSA-N 2 1 328.887 4.391 20 0 EIADMP COc1ccc(SCC[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001180795287 1051079498 /nfs/dbraw/zinc/07/94/98/1051079498.db2.gz UOTZOKJBQUHDPF-DLBZAZTESA-N 2 1 348.556 4.030 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCCc2cc(SC(F)F)ccc21 ZINC000775379228 1051173302 /nfs/dbraw/zinc/17/33/02/1051173302.db2.gz CCRMBJRYQLRXHN-INIZCTEOSA-N 2 1 337.439 4.173 20 0 EIADMP C[C@H]([NH2+]C1(C[NH2+][C@@H](C)C2CCOCC2)CCCC1)c1ccccc1 ZINC000153859403 1051236711 /nfs/dbraw/zinc/23/67/11/1051236711.db2.gz UUVXUARTHPRJJI-ROUUACIJSA-N 2 1 330.516 4.055 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccnc(Cl)c2)cc1 ZINC000183672760 1051245349 /nfs/dbraw/zinc/24/53/49/1051245349.db2.gz XVADMMZSPLWFCD-CYBMUJFWSA-N 2 1 326.831 4.080 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000153989815 1051256099 /nfs/dbraw/zinc/25/60/99/1051256099.db2.gz XJQHXCPXLJSKJB-LJISPDSOSA-N 2 1 328.422 4.270 20 0 EIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000153989815 1051256114 /nfs/dbraw/zinc/25/61/14/1051256114.db2.gz XJQHXCPXLJSKJB-LJISPDSOSA-N 2 1 328.422 4.270 20 0 EIADMP C([C@@H]1CCCC12CCOCC2)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190827426 1051285344 /nfs/dbraw/zinc/28/53/44/1051285344.db2.gz PJTAUJRJEHNSQW-RTWAWAEBSA-N 2 1 348.575 4.171 20 0 EIADMP CO[C@@H](C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccc(F)cc1 ZINC001190826207 1051286632 /nfs/dbraw/zinc/28/66/32/1051286632.db2.gz GEWHQWKAVGQNOG-NQIIRXRSSA-N 2 1 348.506 4.101 20 0 EIADMP CO[C@@H](C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccc(F)cc1 ZINC001190826207 1051286639 /nfs/dbraw/zinc/28/66/39/1051286639.db2.gz GEWHQWKAVGQNOG-NQIIRXRSSA-N 2 1 348.506 4.101 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2sc(-c3ccccc3F)nc2C)C1 ZINC000163230731 1051292185 /nfs/dbraw/zinc/29/21/85/1051292185.db2.gz CWXYCSHDNGMBCU-ZFWWWQNUSA-N 2 1 347.503 4.250 20 0 EIADMP CCOCCC1(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CCCC1 ZINC000151888089 1051324150 /nfs/dbraw/zinc/32/41/50/1051324150.db2.gz QVYWZBTXWUYAEX-UHFFFAOYSA-N 2 1 344.543 4.228 20 0 EIADMP C([C@H]1CC[N@H+](C[C@@H]2CCC3(CCCCCC3)O2)C1)[NH+]1CCCCC1 ZINC001191069966 1051339814 /nfs/dbraw/zinc/33/98/14/1051339814.db2.gz JDXLWRBGTDZLKN-UXHICEINSA-N 2 1 334.548 4.066 20 0 EIADMP COc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000154856433 1051344981 /nfs/dbraw/zinc/34/49/81/1051344981.db2.gz DEXWLNLGMTVGHE-QGZVFWFLSA-N 2 1 326.484 4.386 20 0 EIADMP CCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001191164595 1051371540 /nfs/dbraw/zinc/37/15/40/1051371540.db2.gz GXDZCEVPIBNRIG-SFTDATJTSA-N 2 1 344.543 4.308 20 0 EIADMP Cc1nc(C)c([C@H](C)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000268792345 1051390714 /nfs/dbraw/zinc/39/07/14/1051390714.db2.gz MOOZIEJJXIBASU-QOKNQOGYSA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000268792345 1051390725 /nfs/dbraw/zinc/39/07/25/1051390725.db2.gz MOOZIEJJXIBASU-QOKNQOGYSA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000268792345 1051390740 /nfs/dbraw/zinc/39/07/40/1051390740.db2.gz MOOZIEJJXIBASU-QOKNQOGYSA-N 2 1 343.540 4.321 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000268792345 1051390751 /nfs/dbraw/zinc/39/07/51/1051390751.db2.gz MOOZIEJJXIBASU-QOKNQOGYSA-N 2 1 343.540 4.321 20 0 EIADMP COc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)ccc1SC ZINC000268843482 1051396333 /nfs/dbraw/zinc/39/63/33/1051396333.db2.gz DHNDXJXUWVLVFG-HZPDHXFCSA-N 2 1 336.545 4.188 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@H]1C ZINC001191417134 1051452375 /nfs/dbraw/zinc/45/23/75/1051452375.db2.gz NMPYNGKWAVSPED-RDTXWAMCSA-N 2 1 331.891 4.193 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@H]1C ZINC001191417134 1051452388 /nfs/dbraw/zinc/45/23/88/1051452388.db2.gz NMPYNGKWAVSPED-RDTXWAMCSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@H]1C ZINC001191417134 1051452400 /nfs/dbraw/zinc/45/24/00/1051452400.db2.gz NMPYNGKWAVSPED-RDTXWAMCSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc3ccc(Cl)cc3n2)C[C@H]1C ZINC001191417134 1051452411 /nfs/dbraw/zinc/45/24/11/1051452411.db2.gz NMPYNGKWAVSPED-RDTXWAMCSA-N 2 1 331.891 4.193 20 0 EIADMP C[C@@H]1[C@@H](c2ccccc2)c2ccccc2CC[N@H+]1CCCn1ccnc1 ZINC001192334257 1051691138 /nfs/dbraw/zinc/69/11/38/1051691138.db2.gz GKCQQYDYDSECCJ-XXBNENTESA-N 2 1 345.490 4.352 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(C)c(F)c2)CC1)CC1CC1 ZINC001192501664 1051748318 /nfs/dbraw/zinc/74/83/18/1051748318.db2.gz PKBOKCGBHVYXGX-UHFFFAOYSA-N 2 1 332.507 4.468 20 0 EIADMP Cc1nc(-c2ccccc2)oc1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001192918349 1051831624 /nfs/dbraw/zinc/83/16/24/1051831624.db2.gz LWASVZXTSZJYJR-UHFFFAOYSA-N 2 1 349.478 4.344 20 0 EIADMP C[C@H]1CC[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CC[C@H]1C[NH3+] ZINC001205618043 1051843274 /nfs/dbraw/zinc/84/32/74/1051843274.db2.gz QWIXBGCGQDSBAQ-JSGCOSHPSA-N 2 1 332.435 4.105 20 0 EIADMP CCC1([NH+]2CCCCC2)CC[NH+](Cc2cc(C)c(O)c(C)c2)CC1 ZINC001183532526 1051863683 /nfs/dbraw/zinc/86/36/83/1051863683.db2.gz CQTDRLBYXPFSDW-UHFFFAOYSA-N 2 1 330.516 4.240 20 0 EIADMP C[NH+](C)Cc1ccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)cc1 ZINC000171126838 1052396815 /nfs/dbraw/zinc/39/68/15/1052396815.db2.gz SOLCIVAWHIDBLI-JOCHJYFZSA-N 2 1 331.463 4.022 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000336788965 1052519117 /nfs/dbraw/zinc/51/91/17/1052519117.db2.gz HZZBKVVKAGJIES-QGZVFWFLSA-N 2 1 335.451 4.121 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000339066071 1052551908 /nfs/dbraw/zinc/55/19/08/1052551908.db2.gz FCEQNTHQKQVAJG-KCZVDYSFSA-N 2 1 344.543 4.399 20 0 EIADMP C[C@H](CCc1ccco1)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000379903741 1052565124 /nfs/dbraw/zinc/56/51/24/1052565124.db2.gz IIFFGIZEADSVOW-WSTZPKSXSA-N 2 1 326.484 4.101 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1OCC ZINC000623339359 1052627064 /nfs/dbraw/zinc/62/70/64/1052627064.db2.gz WNGHTURHUOWGAX-DOTOQJQBSA-N 2 1 334.504 4.007 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1OCC ZINC000623339359 1052627066 /nfs/dbraw/zinc/62/70/66/1052627066.db2.gz WNGHTURHUOWGAX-DOTOQJQBSA-N 2 1 334.504 4.007 20 0 EIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3cccc4n[nH]cc43)cc2)C1 ZINC000623357429 1052631993 /nfs/dbraw/zinc/63/19/93/1052631993.db2.gz OKRDFVYEOVMQGM-QGZVFWFLSA-N 2 1 348.494 4.085 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)c(C)c2c1 ZINC000623408063 1052647712 /nfs/dbraw/zinc/64/77/12/1052647712.db2.gz GPCNHOPDADLOEI-LSDHHAIUSA-N 2 1 330.472 4.273 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@@H]3CC[N@@H+](C)C(C)(C)C3)c(C)c2c1 ZINC000623408063 1052647717 /nfs/dbraw/zinc/64/77/17/1052647717.db2.gz GPCNHOPDADLOEI-LSDHHAIUSA-N 2 1 330.472 4.273 20 0 EIADMP C[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Br)cc1F ZINC000623524422 1052671806 /nfs/dbraw/zinc/67/18/06/1052671806.db2.gz SMNNQWURSWOCOW-AAEUAGOBSA-N 2 1 343.284 4.112 20 0 EIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000623526034 1052672356 /nfs/dbraw/zinc/67/23/56/1052672356.db2.gz HTSDRMDCLTWKJB-SJLPKXTDSA-N 2 1 339.483 4.397 20 0 EIADMP CC(C)OCC[NH+]1CCC([NH2+][C@H](C)c2cccc3ccccc32)CC1 ZINC000177485924 1052677794 /nfs/dbraw/zinc/67/77/94/1052677794.db2.gz ARZHOEGWPIYKRJ-GOSISDBHSA-N 2 1 340.511 4.380 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3[nH]c4ccc(Cl)cc4c3C2)CC1(C)C ZINC000623556901 1052680545 /nfs/dbraw/zinc/68/05/45/1052680545.db2.gz CZYOPUPPQZWLNN-CABCVRRESA-N 2 1 345.918 4.141 20 0 EIADMP C[C@H]1C[C@@H](NC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@H+]1C ZINC000178606567 1052710068 /nfs/dbraw/zinc/71/00/68/1052710068.db2.gz BVCFPAQWUIFOCA-LIRRHRJNSA-N 2 1 330.422 4.127 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(-c3ccccc3)n[nH]2)c1 ZINC000178619395 1052710447 /nfs/dbraw/zinc/71/04/47/1052710447.db2.gz HINAUQBELOTSIG-UHFFFAOYSA-N 2 1 348.494 4.207 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000180403051 1052798362 /nfs/dbraw/zinc/79/83/62/1052798362.db2.gz FJTODTVMVUQMEA-QGZVFWFLSA-N 2 1 342.405 4.035 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC1 ZINC000623927977 1052837098 /nfs/dbraw/zinc/83/70/98/1052837098.db2.gz AGABNKNWSRUFHS-SFHVURJKSA-N 2 1 329.875 4.050 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]C[C@H]3CCCC[N@H+](C)C3)c(C)c2c1 ZINC000624121119 1052867280 /nfs/dbraw/zinc/86/72/80/1052867280.db2.gz ONPHRCZXDGMQSN-HZPDHXFCSA-N 2 1 330.472 4.132 20 0 EIADMP COc1ccc2oc([C@@H](C)[NH2+]C[C@H]3CCCC[N@@H+](C)C3)c(C)c2c1 ZINC000624121119 1052867283 /nfs/dbraw/zinc/86/72/83/1052867283.db2.gz ONPHRCZXDGMQSN-HZPDHXFCSA-N 2 1 330.472 4.132 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1OC(F)F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185667281 1053019237 /nfs/dbraw/zinc/01/92/37/1053019237.db2.gz TXDPUTOSPAVHRN-GOEBONIOSA-N 2 1 338.442 4.031 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1OC(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185667281 1053019239 /nfs/dbraw/zinc/01/92/39/1053019239.db2.gz TXDPUTOSPAVHRN-GOEBONIOSA-N 2 1 338.442 4.031 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000381151229 1053055751 /nfs/dbraw/zinc/05/57/51/1053055751.db2.gz ANTBRZLMBZOJLU-MJGOQNOKSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000381151229 1053055753 /nfs/dbraw/zinc/05/57/53/1053055753.db2.gz ANTBRZLMBZOJLU-MJGOQNOKSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc2c(c1)CCCO2 ZINC000850457048 1053234948 /nfs/dbraw/zinc/23/49/48/1053234948.db2.gz FPPOJNVWOYMCJC-ZWOKBUDYSA-N 2 1 342.527 4.315 20 0 EIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000764829325 1053320118 /nfs/dbraw/zinc/32/01/18/1053320118.db2.gz WEPLCKDGNPTICB-AWEZNQCLSA-N 2 1 328.422 4.476 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCC2SCCS2)cc1 ZINC000850570855 1053323859 /nfs/dbraw/zinc/32/38/59/1053323859.db2.gz MYPSIKMFFZQTEH-ZDUSSCGKSA-N 2 1 333.526 4.028 20 0 EIADMP COc1ccc(CC[C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000764963358 1053398700 /nfs/dbraw/zinc/39/87/00/1053398700.db2.gz NRHJYGAQVXGWIT-OALUTQOASA-N 2 1 332.532 4.261 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cnn(-c2ccccc2)c1 ZINC000764965137 1053403248 /nfs/dbraw/zinc/40/32/48/1053403248.db2.gz URPKBSGTXBHZTN-OALUTQOASA-N 2 1 340.515 4.178 20 0 EIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCC[C@]1(C)Cc1cccc(Cl)c1 ZINC001195756641 1053471815 /nfs/dbraw/zinc/47/18/15/1053471815.db2.gz HTRWWFFGYPSDDE-LJQANCHMSA-N 2 1 331.891 4.103 20 0 EIADMP Cn1c[nH+]cc1CCC[N@H+]1CCC[C@]1(C)Cc1cccc(Cl)c1 ZINC001195756641 1053471826 /nfs/dbraw/zinc/47/18/26/1053471826.db2.gz HTRWWFFGYPSDDE-LJQANCHMSA-N 2 1 331.891 4.103 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1cccc(F)c1 ZINC000765361055 1053516269 /nfs/dbraw/zinc/51/62/69/1053516269.db2.gz VDLWRZFSXBFLNH-HMFYCAOWSA-N 2 1 340.486 4.429 20 0 EIADMP CCOc1cccc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000385805308 1053551054 /nfs/dbraw/zinc/55/10/54/1053551054.db2.gz NHLNJVUOKPDENL-RXVVDRJESA-N 2 1 338.495 4.086 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccnc(Cl)c1 ZINC000765451613 1053555660 /nfs/dbraw/zinc/55/56/60/1053555660.db2.gz ALNWACYVLHLWDN-OAHLLOKOSA-N 2 1 335.923 4.430 20 0 EIADMP Clc1nc2ccccc2cc1C[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000852754086 1053610772 /nfs/dbraw/zinc/61/07/72/1053610772.db2.gz ONSJDEYCIBUDEF-QGZVFWFLSA-N 2 1 343.902 4.100 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CCc2cccnc2)c1 ZINC000866245830 1053662957 /nfs/dbraw/zinc/66/29/57/1053662957.db2.gz BZVOZIGAEMGIFF-SFHVURJKSA-N 2 1 325.500 4.033 20 0 EIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866250231 1053665685 /nfs/dbraw/zinc/66/56/85/1053665685.db2.gz WZLFIKXHXNSQOB-ZDUSSCGKSA-N 2 1 335.879 4.396 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)CCc1cncc2ccccc21 ZINC000866272773 1053673411 /nfs/dbraw/zinc/67/34/11/1053673411.db2.gz UBYDMFNJMPDNRE-QGZVFWFLSA-N 2 1 336.483 4.131 20 0 EIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000386441156 1053728883 /nfs/dbraw/zinc/72/88/83/1053728883.db2.gz PULPQTXNCZANRX-DENIHFKCSA-N 2 1 338.495 4.258 20 0 EIADMP C[C@]12C[NH+](Cc3ccccc3)C[C@]1(C)C[NH+](CC1CCCCC1)C2 ZINC001196962255 1053814727 /nfs/dbraw/zinc/81/47/27/1053814727.db2.gz PZWZQYNMLPJBRQ-FGZHOGPDSA-N 2 1 326.528 4.411 20 0 EIADMP C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866705974 1053817923 /nfs/dbraw/zinc/81/79/23/1053817923.db2.gz DIKSJQPYWGWZOK-FOIQADDNSA-N 2 1 327.472 4.100 20 0 EIADMP C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866705974 1053817930 /nfs/dbraw/zinc/81/79/30/1053817930.db2.gz DIKSJQPYWGWZOK-FOIQADDNSA-N 2 1 327.472 4.100 20 0 EIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2c(Cl)n[nH]c2C2CC2)c1 ZINC000921607212 1053910483 /nfs/dbraw/zinc/91/04/83/1053910483.db2.gz NGYDYQKRIULKOW-UHFFFAOYSA-N 2 1 346.906 4.071 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2c(Cl)n[nH]c2C2CC2)c1 ZINC000921607212 1053910500 /nfs/dbraw/zinc/91/05/00/1053910500.db2.gz NGYDYQKRIULKOW-UHFFFAOYSA-N 2 1 346.906 4.071 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)cc1F ZINC000872027072 1054343616 /nfs/dbraw/zinc/34/36/16/1054343616.db2.gz JOCNCEXFWSOZAN-VQIMIIECSA-N 2 1 345.462 4.003 20 0 EIADMP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)CCO1 ZINC001199275047 1054371742 /nfs/dbraw/zinc/37/17/42/1054371742.db2.gz CGUXRPGAJZDKRD-COPCDDAFSA-N 2 1 344.543 4.354 20 0 EIADMP CC(C)[C@@H](C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1)[NH+]1CCC(C)CC1 ZINC001199258528 1054373977 /nfs/dbraw/zinc/37/39/77/1054373977.db2.gz KQJBEPYYQMWXRJ-ILWGZMRPSA-N 2 1 343.559 4.454 20 0 EIADMP COc1cccc2c1CCC[C@H]([NH2+]C[C@@]1([NH+](C)C)CCC[C@@H](C)C1)C2 ZINC001199638613 1054437774 /nfs/dbraw/zinc/43/77/74/1054437774.db2.gz FCYCDUPTSRFTDT-ZWCUEREDSA-N 2 1 344.543 4.043 20 0 EIADMP CC[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)c1cc(C)ccc1C ZINC000858353471 1054471126 /nfs/dbraw/zinc/47/11/26/1054471126.db2.gz HZVYDEYRZXOEHO-HXUWFJFHSA-N 2 1 334.467 4.433 20 0 EIADMP CCOc1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)o1 ZINC001199897126 1054483952 /nfs/dbraw/zinc/48/39/52/1054483952.db2.gz TUHGJGBJWLTCLW-UHFFFAOYSA-N 2 1 342.483 4.344 20 0 EIADMP [NH3+][C@@H](C[C@H]1CCC[N@@H+](Cc2cnc(C3CC3)s2)C1)C1CCCC1 ZINC000873232527 1054509121 /nfs/dbraw/zinc/50/91/21/1054509121.db2.gz SDZZWXWQRPDLKB-KDOFPFPSSA-N 2 1 333.545 4.140 20 0 EIADMP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@H](C)c1ccc(C(F)(F)F)nc1 ZINC000873297501 1054526388 /nfs/dbraw/zinc/52/63/88/1054526388.db2.gz XSGMZSVDXOPNFI-UMVBOHGHSA-N 2 1 329.410 4.062 20 0 EIADMP CC1(C)CC([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)CC(C)(C)[NH2+]1 ZINC000061003149 1054736277 /nfs/dbraw/zinc/73/62/77/1054736277.db2.gz JSUKVFKEVFSDIN-UHFFFAOYSA-N 2 1 330.447 4.485 20 0 EIADMP CC(C)=CCC[C@H](C)C[N@@H+]1CCn2c(C[NH+](C)C(C)C)cnc2[C@H]1C ZINC001201488106 1054816854 /nfs/dbraw/zinc/81/68/54/1054816854.db2.gz VPFUOXLCCUMVRD-RBUKOAKNSA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@H](C)C[N@H+]1CCn2c(C[NH+](C)C(C)C)cnc2[C@H]1C ZINC001201488106 1054816864 /nfs/dbraw/zinc/81/68/64/1054816864.db2.gz VPFUOXLCCUMVRD-RBUKOAKNSA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@H](C)C[NH+]1CCn2c(C[N@H+](C)C(C)C)cnc2[C@H]1C ZINC001201488106 1054816866 /nfs/dbraw/zinc/81/68/66/1054816866.db2.gz VPFUOXLCCUMVRD-RBUKOAKNSA-N 2 1 346.563 4.482 20 0 EIADMP CC(C)=CCC[C@H](C)C[NH+]1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@H]1C ZINC001201488106 1054816876 /nfs/dbraw/zinc/81/68/76/1054816876.db2.gz VPFUOXLCCUMVRD-RBUKOAKNSA-N 2 1 346.563 4.482 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2cc(F)ccc2F)C[N@H+]1Cc1ccccc1 ZINC001201492024 1054818382 /nfs/dbraw/zinc/81/83/82/1054818382.db2.gz PANQHTNAIMUPLH-FUHWJXTLSA-N 2 1 344.449 4.355 20 0 EIADMP CCCCOc1ccc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)cc1 ZINC001203970266 1054838154 /nfs/dbraw/zinc/83/81/54/1054838154.db2.gz KNTBMNOUCVUUEB-UHFFFAOYSA-N 2 1 332.532 4.418 20 0 EIADMP c1csc(C[N@@H+]2CCC3(C2)CC[NH+](CCc2ccccc2)CC3)c1 ZINC001201596320 1054847151 /nfs/dbraw/zinc/84/71/51/1054847151.db2.gz DPLYJZUGOLDTQM-UHFFFAOYSA-N 2 1 340.536 4.279 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCC2(CCC[N@@H+]2Cc2ccn(C)n2)CC1 ZINC001201566412 1054850103 /nfs/dbraw/zinc/85/01/03/1054850103.db2.gz TWHVXGFFACADJS-IBGZPJMESA-N 2 1 346.563 4.067 20 0 EIADMP CCCC[C@H](CC)C[NH+]1CCC2(CCC[N@H+]2Cc2ccn(C)n2)CC1 ZINC001201566412 1054850111 /nfs/dbraw/zinc/85/01/11/1054850111.db2.gz TWHVXGFFACADJS-IBGZPJMESA-N 2 1 346.563 4.067 20 0 EIADMP CSCCC[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3cccs3)[C@@H]2C1 ZINC001201680822 1054874257 /nfs/dbraw/zinc/87/42/57/1054874257.db2.gz ODLXIDZCYDFOOY-JQHSSLGASA-N 2 1 338.586 4.034 20 0 EIADMP CSCCC[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201680822 1054874263 /nfs/dbraw/zinc/87/42/63/1054874263.db2.gz ODLXIDZCYDFOOY-JQHSSLGASA-N 2 1 338.586 4.034 20 0 EIADMP CSCCC[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201680822 1054874268 /nfs/dbraw/zinc/87/42/68/1054874268.db2.gz ODLXIDZCYDFOOY-JQHSSLGASA-N 2 1 338.586 4.034 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[NH+](CCC(C)(C)C)C[C@@H]21 ZINC001202079163 1055018298 /nfs/dbraw/zinc/01/82/98/1055018298.db2.gz XUYMFHPOHPYNLZ-YSIASYRMSA-N 2 1 329.532 4.050 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[NH+](CCC(C)(C)C)C[C@@H]21 ZINC001202079163 1055018312 /nfs/dbraw/zinc/01/83/12/1055018312.db2.gz XUYMFHPOHPYNLZ-YSIASYRMSA-N 2 1 329.532 4.050 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[N@H+](CCC(C)(C)C)C[C@@H]21 ZINC001202079163 1055018329 /nfs/dbraw/zinc/01/83/29/1055018329.db2.gz XUYMFHPOHPYNLZ-YSIASYRMSA-N 2 1 329.532 4.050 20 0 EIADMP C[NH+](Cc1ccccn1)[C@@H]1CCC[C@H]2C[N@@H+](CCC(C)(C)C)C[C@@H]21 ZINC001202079163 1055018345 /nfs/dbraw/zinc/01/83/45/1055018345.db2.gz XUYMFHPOHPYNLZ-YSIASYRMSA-N 2 1 329.532 4.050 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](CCCC(F)(F)F)CC2 ZINC001202395586 1055170352 /nfs/dbraw/zinc/17/03/52/1055170352.db2.gz NQIVOYYEHSQCMP-INIZCTEOSA-N 2 1 344.421 4.299 20 0 EIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC(C)(C)c1ccccn1 ZINC001202465686 1055181658 /nfs/dbraw/zinc/18/16/58/1055181658.db2.gz GSUOEUDQCWXBGA-UHFFFAOYSA-N 2 1 339.527 4.107 20 0 EIADMP C[C@H](NCc1cc(C(F)(F)F)co1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000878411521 1055295338 /nfs/dbraw/zinc/29/53/38/1055295338.db2.gz LHUJNKKRVBAIKM-QWHCGFSZSA-N 2 1 330.394 4.041 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CC[C@@H](c2ccccc2)O1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000878412322 1055300300 /nfs/dbraw/zinc/30/03/00/1055300300.db2.gz VTUBIBLKFRGRRY-UDDWMFPDSA-N 2 1 342.527 4.149 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC000878511831 1055329115 /nfs/dbraw/zinc/32/91/15/1055329115.db2.gz HHQDEDACAKLCPU-VQTJNVASSA-N 2 1 341.499 4.078 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC000878511831 1055329135 /nfs/dbraw/zinc/32/91/35/1055329135.db2.gz HHQDEDACAKLCPU-VQTJNVASSA-N 2 1 341.499 4.078 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000474710955 1055997644 /nfs/dbraw/zinc/99/76/44/1055997644.db2.gz JZUPHWQZICZLLK-JUVOFCAFSA-N 2 1 334.470 4.454 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1 ZINC000515315598 1056676158 /nfs/dbraw/zinc/67/61/58/1056676158.db2.gz HWVDPVVKKRVIOB-RTBURBONSA-N 2 1 344.886 4.274 20 0 EIADMP FC(F)Sc1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000743851443 1059152613 /nfs/dbraw/zinc/15/26/13/1059152613.db2.gz HWFVTFQHJGIZQP-MRXNPFEDSA-N 2 1 340.483 4.309 20 0 EIADMP FC(F)Sc1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000743851443 1059152631 /nfs/dbraw/zinc/15/26/31/1059152631.db2.gz HWFVTFQHJGIZQP-MRXNPFEDSA-N 2 1 340.483 4.309 20 0 EIADMP c1cc2cnccc2c(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000183252237 1059962113 /nfs/dbraw/zinc/96/21/13/1059962113.db2.gz ZFRZTBFKYPXKPJ-LJQANCHMSA-N 2 1 337.511 4.323 20 0 EIADMP CC(C)[NH+](CCC[NH2+]Cc1ccccc1N1CCCCC1)C(C)C ZINC000746054137 1059992752 /nfs/dbraw/zinc/99/27/52/1059992752.db2.gz YEJPBNXRARTVHI-UHFFFAOYSA-N 2 1 331.548 4.275 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3cnccc3c2)CC[N@@H+]1Cc1ccccc1 ZINC000379619226 1060132233 /nfs/dbraw/zinc/13/22/33/1060132233.db2.gz BFNASELXOMSVQN-JPYJTQIMSA-N 2 1 345.490 4.378 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3cnccc3c2)CC[N@H+]1Cc1ccccc1 ZINC000379619226 1060132279 /nfs/dbraw/zinc/13/22/79/1060132279.db2.gz BFNASELXOMSVQN-JPYJTQIMSA-N 2 1 345.490 4.378 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000379737957 1060257719 /nfs/dbraw/zinc/25/77/19/1060257719.db2.gz CRMVDNLARQSITM-YWZLYKJASA-N 2 1 343.540 4.323 20 0 EIADMP C[C@H]([NH2+]Cc1ccc2cnccc2c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000388982823 1060281790 /nfs/dbraw/zinc/28/17/90/1060281790.db2.gz RCJPPVGROIXVEJ-FDDCHVKYSA-N 2 1 345.490 4.235 20 0 EIADMP COc1ccc([C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000392742272 1060308904 /nfs/dbraw/zinc/30/89/04/1060308904.db2.gz SWMYUUHESBRBFL-JAXLGGSGSA-N 2 1 336.479 4.001 20 0 EIADMP COc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000392742272 1060308926 /nfs/dbraw/zinc/30/89/26/1060308926.db2.gz SWMYUUHESBRBFL-JAXLGGSGSA-N 2 1 336.479 4.001 20 0 EIADMP CC(C)C[C@@H](Cc1ccccc1)[NH+]1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001169071044 1060628782 /nfs/dbraw/zinc/62/87/82/1060628782.db2.gz UCQVXYPOOQFBRT-NRFANRHFSA-N 2 1 326.528 4.062 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)cc1C(F)(F)F)C2 ZINC001169097535 1060634470 /nfs/dbraw/zinc/63/44/70/1060634470.db2.gz BBUYHALNPABCDP-ZSOGYDGISA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)cc1C(F)(F)F)C2 ZINC001169097535 1060634474 /nfs/dbraw/zinc/63/44/74/1060634474.db2.gz BBUYHALNPABCDP-ZSOGYDGISA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)c1cccc(C(F)(F)F)c1)C2 ZINC001169101582 1060635367 /nfs/dbraw/zinc/63/53/67/1060635367.db2.gz UJPMLCZMELOBPD-MUJYYYPQSA-N 2 1 326.406 4.155 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)C2 ZINC001169099427 1060637926 /nfs/dbraw/zinc/63/79/26/1060637926.db2.gz RLAWXEYOWGXSOI-QDMKHBRRSA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)C2 ZINC001169099427 1060637930 /nfs/dbraw/zinc/63/79/30/1060637930.db2.gz RLAWXEYOWGXSOI-QDMKHBRRSA-N 2 1 332.797 4.074 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CCCc3ccc(Br)cc31)C2 ZINC001169082344 1060641788 /nfs/dbraw/zinc/64/17/88/1060641788.db2.gz YRWLNMBMBHGLDI-DFGXFYAUSA-N 2 1 349.316 4.041 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc3nc(-c4ccccc4)oc3c1)C2 ZINC001169118104 1060646422 /nfs/dbraw/zinc/64/64/22/1060646422.db2.gz DQJOGEGAMXSKRF-REPLKXPHSA-N 2 1 347.462 4.210 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc3nc(-c4ccccc4)oc3c1)C2 ZINC001169118104 1060646434 /nfs/dbraw/zinc/64/64/34/1060646434.db2.gz DQJOGEGAMXSKRF-REPLKXPHSA-N 2 1 347.462 4.210 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)Cc1cccc(C(F)(F)F)c1)C2 ZINC001169117087 1060647668 /nfs/dbraw/zinc/64/76/68/1060647668.db2.gz VQNPHJXISQCSPG-OSYLJGHBSA-N 2 1 340.433 4.241 20 0 EIADMP Cc1cc(C(F)(F)F)cc(N[C@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)[nH+]1 ZINC001169137301 1060653647 /nfs/dbraw/zinc/65/36/47/1060653647.db2.gz KRQXWCGWKZLIAA-BBRMVZONSA-N 2 1 329.410 4.364 20 0 EIADMP Cc1ccc(Cl)c(O[C@@H]2CCC[NH+]([C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4C)C2)c1 ZINC001169142745 1060663637 /nfs/dbraw/zinc/66/36/37/1060663637.db2.gz VEGFRBAJIJUTDW-VSZNYVQBSA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@@H]2CCC[NH+]([C@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4C)C2)c1 ZINC001169142745 1060663642 /nfs/dbraw/zinc/66/36/42/1060663642.db2.gz VEGFRBAJIJUTDW-VSZNYVQBSA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@@H]2CCC[N@@H+]([C@H]3C[C@H]4CC[C@@H](C3)[NH+]4C)C2)c1 ZINC001169142745 1060663649 /nfs/dbraw/zinc/66/36/49/1060663649.db2.gz VEGFRBAJIJUTDW-VSZNYVQBSA-N 2 1 348.918 4.117 20 0 EIADMP Cc1ccc(Cl)c(O[C@@H]2CCC[N@H+]([C@H]3C[C@H]4CC[C@@H](C3)[NH+]4C)C2)c1 ZINC001169142745 1060663656 /nfs/dbraw/zinc/66/36/56/1060663656.db2.gz VEGFRBAJIJUTDW-VSZNYVQBSA-N 2 1 348.918 4.117 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1[C@@H]3Cc4ccccc4[C@@]1(C)c1ccccc13)C2 ZINC001169155255 1060670977 /nfs/dbraw/zinc/67/09/77/1060670977.db2.gz LSVGZMBRQYCCKN-QSHYCUDZSA-N 2 1 344.502 4.488 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1[C@@H]3Cc4ccccc4[C@@]1(C)c1ccccc13)C2 ZINC001169155255 1060670983 /nfs/dbraw/zinc/67/09/83/1060670983.db2.gz LSVGZMBRQYCCKN-QSHYCUDZSA-N 2 1 344.502 4.488 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1[C@@H]3Cc4ccccc4[C@@]1(C)c1ccccc13)C2 ZINC001169155255 1060670990 /nfs/dbraw/zinc/67/09/90/1060670990.db2.gz LSVGZMBRQYCCKN-QSHYCUDZSA-N 2 1 344.502 4.488 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1[C@@H]3Cc4ccccc4[C@@]1(C)c1ccccc13)C2 ZINC001169155255 1060670998 /nfs/dbraw/zinc/67/09/98/1060670998.db2.gz LSVGZMBRQYCCKN-QSHYCUDZSA-N 2 1 344.502 4.488 20 0 EIADMP 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 1060673438 /nfs/dbraw/zinc/67/34/38/1060673438.db2.gz FBUZOQODHKRDRY-YSTOQKLRSA-N 2 1 342.527 4.278 20 0 EIADMP C[C@H]1C[N@@H+](Cc2sccc2Oc2ccccc2)CCC[C@H]1C[NH3+] ZINC001206003735 1060686855 /nfs/dbraw/zinc/68/68/55/1060686855.db2.gz LYSYUHUFUGITRA-HOTGVXAUSA-N 2 1 330.497 4.347 20 0 EIADMP CC[NH+]1CCC(N2c3sc(C)cc3C(=[NH2+])Nc3ccccc32)CC1 ZINC001169225662 1060701370 /nfs/dbraw/zinc/70/13/70/1060701370.db2.gz XWDPWEBHQVJVAK-UHFFFAOYSA-N 2 1 340.496 4.029 20 0 EIADMP CC[NH+]1CCC([N@H+](C[C@@H](O)c2ccc3ccccc3c2)C(C)C)CC1 ZINC001169261937 1060710235 /nfs/dbraw/zinc/71/02/35/1060710235.db2.gz RQCYIPIHYOSWBP-JOCHJYFZSA-N 2 1 340.511 4.068 20 0 EIADMP CC[NH+]1CCC([N@@H+](C[C@@H](O)c2ccc3ccccc3c2)C(C)C)CC1 ZINC001169261937 1060710258 /nfs/dbraw/zinc/71/02/58/1060710258.db2.gz RQCYIPIHYOSWBP-JOCHJYFZSA-N 2 1 340.511 4.068 20 0 EIADMP CC[NH+]1CCC([N@@H+]2CCSC[C@@H]2c2cccc3ccccc32)CC1 ZINC001169265439 1060714636 /nfs/dbraw/zinc/71/46/36/1060714636.db2.gz WXYVSDYYNHCIKG-OAQYLSRUSA-N 2 1 340.536 4.414 20 0 EIADMP CC[NH+]1CCC([N@H+]2CCSC[C@@H]2c2cccc3ccccc32)CC1 ZINC001169265439 1060714651 /nfs/dbraw/zinc/71/46/51/1060714651.db2.gz WXYVSDYYNHCIKG-OAQYLSRUSA-N 2 1 340.536 4.414 20 0 EIADMP CC[NH+]1CCC([NH2+]C2(c3ccccc3C(F)(F)F)CCC2)CC1 ZINC001169241330 1060716862 /nfs/dbraw/zinc/71/68/62/1060716862.db2.gz UYOQUXYDLDWESI-UHFFFAOYSA-N 2 1 326.406 4.159 20 0 EIADMP CC[NH+]1CCC([NH+]2CCC(c3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC001169254293 1060725584 /nfs/dbraw/zinc/72/55/84/1060725584.db2.gz BSEBVBOMDPSIBP-UHFFFAOYSA-N 2 1 340.433 4.369 20 0 EIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cccc(C(C)(C)C)c2)[C@H](C)C1 ZINC001169555162 1060856266 /nfs/dbraw/zinc/85/62/66/1060856266.db2.gz NQRBEKGDIJDOAC-WIYYLYMNSA-N 2 1 346.559 4.211 20 0 EIADMP Cc1cc[nH+]c(C)c1-n1cc(CC[NH3+])c2ccc(OC(F)(F)F)cc21 ZINC001169609212 1060868870 /nfs/dbraw/zinc/86/88/70/1060868870.db2.gz QZXWFBYYFKXNJY-UHFFFAOYSA-N 2 1 349.356 4.042 20 0 EIADMP C[C@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(Br)s1 ZINC000038001940 213186173 /nfs/dbraw/zinc/18/61/73/213186173.db2.gz UWYGIRYRHLRJKZ-LBPRGKRZSA-N 2 1 331.323 4.037 20 0 EIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3ccc4ccccc4n3)CC2)C1 ZINC000532205408 1032073929 /nfs/dbraw/zinc/07/39/29/1032073929.db2.gz SFMXWUSOJOLCMB-DYESRHJHSA-N 2 1 337.511 4.368 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188301 1032077389 /nfs/dbraw/zinc/07/73/89/1032077389.db2.gz CTDPQNUXXFUXKW-GCJKJVERSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188301 1032077403 /nfs/dbraw/zinc/07/74/03/1032077403.db2.gz CTDPQNUXXFUXKW-GCJKJVERSA-N 2 1 347.506 4.211 20 0 EIADMP C[NH+]1CCC([NH2+][C@@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1 ZINC000532200174 1032085735 /nfs/dbraw/zinc/08/57/35/1032085735.db2.gz ZMUULQDDNPBAEC-FQEVSTJZSA-N 2 1 328.887 4.308 20 0 EIADMP c1ccc(C(CC[NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000459372855 1032087145 /nfs/dbraw/zinc/08/71/45/1032087145.db2.gz HVZCJTLEKVNKRN-UHFFFAOYSA-N 2 1 334.507 4.425 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(F)cc1 ZINC000532213619 1032094465 /nfs/dbraw/zinc/09/44/65/1032094465.db2.gz LBCAWQNVVCOLAV-FGSXEWAUSA-N 2 1 340.486 4.429 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(F)cc1 ZINC000532213619 1032094479 /nfs/dbraw/zinc/09/44/79/1032094479.db2.gz LBCAWQNVVCOLAV-FGSXEWAUSA-N 2 1 340.486 4.429 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cccc(OCc2ccccc2)c1 ZINC000532225077 1032103792 /nfs/dbraw/zinc/10/37/92/1032103792.db2.gz KFTFQOYVURGCFD-UYAOXDASSA-N 2 1 338.495 4.258 20 0 EIADMP CC1(C)CC([NH2+]Cc2ccc(F)c(C(F)(F)F)c2)CC(C)(C)[NH2+]1 ZINC000322098953 1032182153 /nfs/dbraw/zinc/18/21/53/1032182153.db2.gz RYISJIJWMXTLNI-UHFFFAOYSA-N 2 1 332.385 4.243 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1OC ZINC000173364512 1032359100 /nfs/dbraw/zinc/35/91/00/1032359100.db2.gz OKFLHRNAXBSNIS-INIZCTEOSA-N 2 1 346.515 4.009 20 0 EIADMP CSC1(C[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000514697401 1032410601 /nfs/dbraw/zinc/41/06/01/1032410601.db2.gz OOOXJCLXFBHTAQ-IEBWSBKVSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000514697401 1032410605 /nfs/dbraw/zinc/41/06/05/1032410605.db2.gz OOOXJCLXFBHTAQ-IEBWSBKVSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000514697401 1032410611 /nfs/dbraw/zinc/41/06/11/1032410611.db2.gz OOOXJCLXFBHTAQ-IEBWSBKVSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000514697401 1032410615 /nfs/dbraw/zinc/41/06/15/1032410615.db2.gz OOOXJCLXFBHTAQ-IEBWSBKVSA-N 2 1 332.557 4.257 20 0 EIADMP CSC1(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000514697401 1032410621 /nfs/dbraw/zinc/41/06/21/1032410621.db2.gz OOOXJCLXFBHTAQ-IEBWSBKVSA-N 2 1 332.557 4.257 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529543741 1032434245 /nfs/dbraw/zinc/43/42/45/1032434245.db2.gz NDWNDUSWBSNAGA-SOLBZPMBSA-N 2 1 336.470 4.311 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000760156859 1032464412 /nfs/dbraw/zinc/46/44/12/1032464412.db2.gz AJQRKSVLTSBYLV-GFCCVEGCSA-N 2 1 330.303 4.102 20 0 EIADMP CC(C)c1nc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cs1 ZINC000533098974 1032483983 /nfs/dbraw/zinc/48/39/83/1032483983.db2.gz YILXGVPMQOCNEA-UHFFFAOYSA-N 2 1 335.561 4.355 20 0 EIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)CC1 ZINC000245843438 1032509140 /nfs/dbraw/zinc/50/91/40/1032509140.db2.gz DYFJUGFOXTUDQY-UMSONDCASA-N 2 1 342.527 4.005 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1 ZINC000450470708 1032517230 /nfs/dbraw/zinc/51/72/30/1032517230.db2.gz UVNPPVXDKTVPNW-CQSZACIVSA-N 2 1 328.422 4.269 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1 ZINC000450470708 1032517243 /nfs/dbraw/zinc/51/72/43/1032517243.db2.gz UVNPPVXDKTVPNW-CQSZACIVSA-N 2 1 328.422 4.269 20 0 EIADMP CC[N@@H+](C)C[C@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475823 1032520505 /nfs/dbraw/zinc/52/05/05/1032520505.db2.gz ZYOYMCQNFCPKTR-GOEBONIOSA-N 2 1 328.422 4.126 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475823 1032520511 /nfs/dbraw/zinc/52/05/11/1032520511.db2.gz ZYOYMCQNFCPKTR-GOEBONIOSA-N 2 1 328.422 4.126 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475823 1032520524 /nfs/dbraw/zinc/52/05/24/1032520524.db2.gz ZYOYMCQNFCPKTR-GOEBONIOSA-N 2 1 328.422 4.126 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475823 1032520532 /nfs/dbraw/zinc/52/05/32/1032520532.db2.gz ZYOYMCQNFCPKTR-GOEBONIOSA-N 2 1 328.422 4.126 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475823 1032520544 /nfs/dbraw/zinc/52/05/44/1032520544.db2.gz ZYOYMCQNFCPKTR-GOEBONIOSA-N 2 1 328.422 4.126 20 0 EIADMP c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000178294513 1032526972 /nfs/dbraw/zinc/52/69/72/1032526972.db2.gz PWVZAIJTWNGJOY-FQEVSTJZSA-N 2 1 340.511 4.430 20 0 EIADMP CC(C)C1CCC([NH+]2CCN(C[C@@H]3CCCC[N@H+]3C(C)C)CC2)CC1 ZINC000450485703 1032527923 /nfs/dbraw/zinc/52/79/23/1032527923.db2.gz KAPCNXWYAVYFAG-HRTMPFAESA-N 2 1 349.607 4.082 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(CSC(F)F)o1 ZINC000120620218 1019897969 /nfs/dbraw/zinc/89/79/69/1019897969.db2.gz CGAZTZKONSVHGM-AWEZNQCLSA-N 2 1 346.487 4.480 20 0 EIADMP CC[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(Br)c1 ZINC000037318621 1020021008 /nfs/dbraw/zinc/02/10/08/1020021008.db2.gz NZJICACZFJIRCM-QGZVFWFLSA-N 2 1 337.305 4.117 20 0 EIADMP Cc1nc2c(s1)[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)CCC2 ZINC000154869919 1020078750 /nfs/dbraw/zinc/07/87/50/1020078750.db2.gz DYPQZCLJUYDUAH-SFHVURJKSA-N 2 1 343.540 4.459 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCc3ccc(F)cc32)cc1F ZINC000153716904 1020385419 /nfs/dbraw/zinc/38/54/19/1020385419.db2.gz ZYODISGBCLQQKE-LJQANCHMSA-N 2 1 339.389 4.236 20 0 EIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)c3cccnc23)CC1 ZINC000109788200 1020415822 /nfs/dbraw/zinc/41/58/22/1020415822.db2.gz MIVGXUUIVQFIAN-UHFFFAOYSA-N 2 1 331.891 4.194 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](COC)c2cccc(Cl)c2)c1 ZINC000579891510 1020490217 /nfs/dbraw/zinc/49/02/17/1020490217.db2.gz VGLVKKGHXZRKOS-FQEVSTJZSA-N 2 1 346.902 4.269 20 0 EIADMP CC(C)C1CC(Nc2ccc([NH+]3CCC(C[NH+](C)C)CC3)cc2)C1 ZINC000754102111 1020500602 /nfs/dbraw/zinc/50/06/02/1020500602.db2.gz QKWUGOSSZOWYJV-UHFFFAOYSA-N 2 1 329.532 4.311 20 0 EIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2csc(C3CC3)n2)CC1 ZINC000340194051 1020606822 /nfs/dbraw/zinc/60/68/22/1020606822.db2.gz HTACRSLOEGPJBH-INIZCTEOSA-N 2 1 347.572 4.497 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2csc(C3CC3)n2)CC1 ZINC000340194051 1020606839 /nfs/dbraw/zinc/60/68/39/1020606839.db2.gz HTACRSLOEGPJBH-INIZCTEOSA-N 2 1 347.572 4.497 20 0 EIADMP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547831562 1020779227 /nfs/dbraw/zinc/77/92/27/1020779227.db2.gz ACPRCCVYUZNZTO-QESAQDPVSA-N 2 1 344.543 4.080 20 0 EIADMP CSc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000237386693 1020781147 /nfs/dbraw/zinc/78/11/47/1020781147.db2.gz NWKYTVSAUHDROX-UHFFFAOYSA-N 2 1 340.536 4.205 20 0 EIADMP COCCCC1(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)CCC1 ZINC001204496334 1020977185 /nfs/dbraw/zinc/97/71/85/1020977185.db2.gz FWDKMAUAYGNQNF-HXUWFJFHSA-N 2 1 336.564 4.027 20 0 EIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1CCCCO1 ZINC000655850675 1021015918 /nfs/dbraw/zinc/01/59/18/1021015918.db2.gz YJJVKOVFKAMJNS-LILSUDLASA-N 2 1 342.527 4.119 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CCC3(CCCO3)CC2)[C@H]1c1cccs1 ZINC000570449148 1021452894 /nfs/dbraw/zinc/45/28/94/1021452894.db2.gz XZLPTMWQEDEMKH-PYXOFJJQSA-N 2 1 348.556 4.212 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+]C2CCC3(CCCO3)CC2)[C@H]1c1cccs1 ZINC000570449148 1021452911 /nfs/dbraw/zinc/45/29/11/1021452911.db2.gz XZLPTMWQEDEMKH-PYXOFJJQSA-N 2 1 348.556 4.212 20 0 EIADMP Cc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)s1 ZINC000376165586 1021639160 /nfs/dbraw/zinc/63/91/60/1021639160.db2.gz ZQUICPWTRUDVGG-DOPJRALCSA-N 2 1 329.513 4.104 20 0 EIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000580225599 1021778796 /nfs/dbraw/zinc/77/87/96/1021778796.db2.gz UTMDEGDQYQEHMI-MJGOQNOKSA-N 2 1 332.536 4.133 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(-c3ncco3)cc2F)CC1 ZINC000580286717 1021821590 /nfs/dbraw/zinc/82/15/90/1021821590.db2.gz PLJCRELBVRSAPU-UHFFFAOYSA-N 2 1 345.462 4.033 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000177969287 1021834949 /nfs/dbraw/zinc/83/49/49/1021834949.db2.gz NHZSCGVEQDWZIR-QGZVFWFLSA-N 2 1 334.573 4.203 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000398019224 1021898001 /nfs/dbraw/zinc/89/80/01/1021898001.db2.gz JDWYDUWUNOQQJA-MGPUTAFESA-N 2 1 346.877 4.479 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000398019224 1021898002 /nfs/dbraw/zinc/89/80/02/1021898002.db2.gz JDWYDUWUNOQQJA-MGPUTAFESA-N 2 1 346.877 4.479 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1csc(-c2ccccc2)n1 ZINC000414131394 1021903014 /nfs/dbraw/zinc/90/30/14/1021903014.db2.gz XRFIYNOJICDSLX-HNNXBMFYSA-N 2 1 340.496 4.446 20 0 EIADMP C[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cncc(F)c1 ZINC000414148612 1021976576 /nfs/dbraw/zinc/97/65/76/1021976576.db2.gz RYMPYPDTYWCBKA-KQLYMOGASA-N 2 1 339.458 4.067 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cncc(F)c1 ZINC000414148612 1021976634 /nfs/dbraw/zinc/97/66/34/1021976634.db2.gz RYMPYPDTYWCBKA-KQLYMOGASA-N 2 1 339.458 4.067 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H](NCc2noc4ccccc24)C3)cc1 ZINC000580465626 1022054896 /nfs/dbraw/zinc/05/48/96/1022054896.db2.gz PUBDOXUXIGWSPG-LDLYASANSA-N 2 1 347.462 4.113 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](NCc2noc4ccccc24)C3)cc1 ZINC000580465627 1022055822 /nfs/dbraw/zinc/05/58/22/1022055822.db2.gz PUBDOXUXIGWSPG-REPLKXPHSA-N 2 1 347.462 4.113 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[N@H+](C)C[C@H]1CCn2cc[nH+]c2C1 ZINC000377861678 1022057208 /nfs/dbraw/zinc/05/72/08/1022057208.db2.gz SKJQCZDGKLGLBT-KGLIPLIRSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@H](c1ccccc1C(F)(F)F)[N@@H+](C)C[C@H]1CCn2cc[nH+]c2C1 ZINC000377861678 1022057225 /nfs/dbraw/zinc/05/72/25/1022057225.db2.gz SKJQCZDGKLGLBT-KGLIPLIRSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[N@H+](C)C[C@H]1CCn2cc[nH+]c2C1 ZINC000377861677 1022057899 /nfs/dbraw/zinc/05/78/99/1022057899.db2.gz SKJQCZDGKLGLBT-KBPBESRZSA-N 2 1 337.389 4.157 20 0 EIADMP C[C@@H](c1ccccc1C(F)(F)F)[N@@H+](C)C[C@H]1CCn2cc[nH+]c2C1 ZINC000377861677 1022057914 /nfs/dbraw/zinc/05/79/14/1022057914.db2.gz SKJQCZDGKLGLBT-KBPBESRZSA-N 2 1 337.389 4.157 20 0 EIADMP Cc1cc([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)sc1Br ZINC000414193285 1022085628 /nfs/dbraw/zinc/08/56/28/1022085628.db2.gz SYLISOSGWOFARE-QWHCGFSZSA-N 2 1 345.350 4.202 20 0 EIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1csc(-c2ccccc2F)n1 ZINC000414193956 1022089335 /nfs/dbraw/zinc/08/93/35/1022089335.db2.gz UCIIGDPNIDCMKY-CABCVRRESA-N 2 1 347.503 4.332 20 0 EIADMP Cc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cnc1F ZINC000892572154 1022236389 /nfs/dbraw/zinc/23/63/89/1022236389.db2.gz UKLKAIVBOOMIFV-KRWDZBQOSA-N 2 1 341.474 4.193 20 0 EIADMP CO[C@@](C)([C@H](C)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)C1CC1 ZINC000414235544 1022248031 /nfs/dbraw/zinc/24/80/31/1022248031.db2.gz JXHFFDNDYIKHNP-SIFCLUCFSA-N 2 1 327.472 4.035 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CC[C@@H]2CC2(Cl)Cl)C1 ZINC001167426421 1022325860 /nfs/dbraw/zinc/32/58/60/1022325860.db2.gz WTHVXJBNNBZTRA-BZUAXINKSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CC[C@@H]2CC2(Cl)Cl)C1 ZINC001167426421 1022325880 /nfs/dbraw/zinc/32/58/80/1022325880.db2.gz WTHVXJBNNBZTRA-BZUAXINKSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CC[C@@H]2CC2(Cl)Cl)C1 ZINC001167426421 1022325898 /nfs/dbraw/zinc/32/58/98/1022325898.db2.gz WTHVXJBNNBZTRA-BZUAXINKSA-N 2 1 333.347 4.157 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CC[C@@H]2CC2(Cl)Cl)C1 ZINC001167426421 1022325915 /nfs/dbraw/zinc/32/59/15/1022325915.db2.gz WTHVXJBNNBZTRA-BZUAXINKSA-N 2 1 333.347 4.157 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)CCCc1ccc(C(F)(F)F)cc1 ZINC000136311458 1022718236 /nfs/dbraw/zinc/71/82/36/1022718236.db2.gz ZPTWKKNNMAHMEZ-UHFFFAOYSA-N 2 1 339.405 4.165 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)CCCc1ccc(C(F)(F)F)cc1 ZINC000136311458 1022718251 /nfs/dbraw/zinc/71/82/51/1022718251.db2.gz ZPTWKKNNMAHMEZ-UHFFFAOYSA-N 2 1 339.405 4.165 20 0 EIADMP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)ccc1Br ZINC000378489594 1022843431 /nfs/dbraw/zinc/84/34/31/1022843431.db2.gz CTXBTYNBLSYSPU-IMJJTQAJSA-N 2 1 337.305 4.035 20 0 EIADMP Cn1cc[nH+]c1CC1CC[NH+](Cc2csc3ccccc23)CC1 ZINC000106166698 1022855554 /nfs/dbraw/zinc/85/55/54/1022855554.db2.gz SNFUGWVWLIYLGK-UHFFFAOYSA-N 2 1 325.481 4.090 20 0 EIADMP COc1c(C)cc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cc1C ZINC000065976464 1022873265 /nfs/dbraw/zinc/87/32/65/1022873265.db2.gz ADGPRMZCJZHVLQ-UHFFFAOYSA-N 2 1 340.511 4.442 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000311193167 1022876396 /nfs/dbraw/zinc/87/63/96/1022876396.db2.gz GPZLAMUKBSTGMA-UYAOXDASSA-N 2 1 340.486 4.259 20 0 EIADMP Cc1ccccc1SC[C@H](C)C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC001167457587 1023100107 /nfs/dbraw/zinc/10/01/07/1023100107.db2.gz FXWIEXUNKHSYHR-IEBWSBKVSA-N 2 1 332.557 4.141 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1cncs1 ZINC000156186667 1023116866 /nfs/dbraw/zinc/11/68/66/1023116866.db2.gz SFOQRWXVGBYLHK-HOTGVXAUSA-N 2 1 329.513 4.368 20 0 EIADMP CC[C@H](CC(F)F)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000660167147 1023191413 /nfs/dbraw/zinc/19/14/13/1023191413.db2.gz ZMKBGHLEUACPRT-MRXNPFEDSA-N 2 1 339.474 4.301 20 0 EIADMP C/C(=C\c1ccccc1)C[N@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000376682547 1023254461 /nfs/dbraw/zinc/25/44/61/1023254461.db2.gz UWUJGYWZQDHCMX-UMKIKXNYSA-N 2 1 335.495 4.110 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@H](C)[C@@H]3C[C@H]3c3cccs3)CC2)[nH+]c1 ZINC000417310235 1023255723 /nfs/dbraw/zinc/25/57/23/1023255723.db2.gz JVZSUWXYELHATF-BPQIPLTHSA-N 2 1 341.524 4.202 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCN(c3ccccc3)C2)cc1 ZINC000153856996 1023348430 /nfs/dbraw/zinc/34/84/30/1023348430.db2.gz AURFVGHRHOUMBD-XLIONFOSSA-N 2 1 346.478 4.110 20 0 EIADMP C[C@@H]([NH3+])[C@H](C)[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000415014150 1023395395 /nfs/dbraw/zinc/39/53/95/1023395395.db2.gz LMDKTYVZBLAIPK-MNOVXSKESA-N 2 1 339.302 4.003 20 0 EIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CCOc3cccc4ccccc43)CC[NH2+]2)cc1 ZINC000415093830 1023440434 /nfs/dbraw/zinc/44/04/34/1023440434.db2.gz WEZHASLTYYDVHJ-UNMCSNQZSA-N 2 1 346.474 4.302 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cccc(OC(F)F)c1 ZINC000119865033 1023440617 /nfs/dbraw/zinc/44/06/17/1023440617.db2.gz PDMOGTDOQRVIKY-CYBMUJFWSA-N 2 1 326.431 4.202 20 0 EIADMP C[C@H](C[N@@H+](C)[C@H]1CCN(C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097672 1023499444 /nfs/dbraw/zinc/49/94/44/1023499444.db2.gz MWQQZHXQQMZTDO-KEYYUXOJSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[N@H+](C)[C@H]1CC[NH+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097672 1023499450 /nfs/dbraw/zinc/49/94/50/1023499450.db2.gz MWQQZHXQQMZTDO-KEYYUXOJSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[N@@H+](C)[C@H]1CC[NH+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097672 1023499464 /nfs/dbraw/zinc/49/94/64/1023499464.db2.gz MWQQZHXQQMZTDO-KEYYUXOJSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[NH+](C)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097672 1023499472 /nfs/dbraw/zinc/49/94/72/1023499472.db2.gz MWQQZHXQQMZTDO-KEYYUXOJSA-N 2 1 328.422 4.223 20 0 EIADMP C[C@H](C[NH+](C)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097672 1023499478 /nfs/dbraw/zinc/49/94/78/1023499478.db2.gz MWQQZHXQQMZTDO-KEYYUXOJSA-N 2 1 328.422 4.223 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+]C(C3CCC3)C3CCC3)C2)cc1 ZINC000549237398 1023515760 /nfs/dbraw/zinc/51/57/60/1023515760.db2.gz OMFZOSGKFQEAEF-LJQANCHMSA-N 2 1 326.528 4.109 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CCC[C@@H](C[NH3+])C3)s2)cc1 ZINC000430633895 1023539098 /nfs/dbraw/zinc/53/90/98/1023539098.db2.gz CJLKDBBSGNGMEJ-HNNXBMFYSA-N 2 1 329.513 4.104 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CCC[C@@H](C[NH3+])C3)s2)cc1 ZINC000430633895 1023539103 /nfs/dbraw/zinc/53/91/03/1023539103.db2.gz CJLKDBBSGNGMEJ-HNNXBMFYSA-N 2 1 329.513 4.104 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCNc1ccnc(NC(=O)OC(C)(C)C)c1 ZINC001167753551 1023630580 /nfs/dbraw/zinc/63/05/80/1023630580.db2.gz POHVYVCNSNOTSL-OAHLLOKOSA-N 2 1 348.491 4.105 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1CCCNc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001167753551 1023630584 /nfs/dbraw/zinc/63/05/84/1023630584.db2.gz POHVYVCNSNOTSL-OAHLLOKOSA-N 2 1 348.491 4.105 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCNc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001167753551 1023630590 /nfs/dbraw/zinc/63/05/90/1023630590.db2.gz POHVYVCNSNOTSL-OAHLLOKOSA-N 2 1 348.491 4.105 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCNc1ccc(SC2CC[NH2+]CC2)cc1 ZINC001167755033 1023641161 /nfs/dbraw/zinc/64/11/61/1023641161.db2.gz YZGHKSBOAQRRKD-QGZVFWFLSA-N 2 1 347.572 4.207 20 0 EIADMP CCc1nc2cc(C[NH2+][C@H]3C[C@H]([NH3+])c4ccccc43)ccc2n1C1CC1 ZINC000581800388 1023721995 /nfs/dbraw/zinc/72/19/95/1023721995.db2.gz GNXNFYUHOAQDOJ-OALUTQOASA-N 2 1 346.478 4.168 20 0 EIADMP CC[N@H+]1CCC[C@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000500420902 1023814959 /nfs/dbraw/zinc/81/49/59/1023814959.db2.gz LYNUFAJNEXCBOS-UVQBRAAOSA-N 2 1 340.433 4.430 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000500426891 1023822005 /nfs/dbraw/zinc/82/20/05/1023822005.db2.gz HEAJOVMDEXPFDW-SFHLNBCPSA-N 2 1 329.532 4.065 20 0 EIADMP CCC[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1 ZINC000471780428 1023841223 /nfs/dbraw/zinc/84/12/23/1023841223.db2.gz NAPJVWNRVVDEHK-INIZCTEOSA-N 2 1 326.271 4.400 20 0 EIADMP C[C@H]1C[C@@H](CC[NH2+]C2CCC(F)(F)CC2)C[N@H+]1Cc1ccccc1 ZINC000647196189 1023851075 /nfs/dbraw/zinc/85/10/75/1023851075.db2.gz RSAXFDRKKHQWMB-FUHWJXTLSA-N 2 1 336.470 4.455 20 0 EIADMP COCc1ccccc1/C=C(/C)C[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000511741924 1023854085 /nfs/dbraw/zinc/85/40/85/1023854085.db2.gz XSRDEEXCKRQMCP-NURJGKTBSA-N 2 1 344.543 4.194 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000511741925 1023854362 /nfs/dbraw/zinc/85/43/62/1023854362.db2.gz XSRDEEXCKRQMCP-QDDTUJKSSA-N 2 1 344.543 4.194 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)o1 ZINC000581948651 1023923984 /nfs/dbraw/zinc/92/39/84/1023923984.db2.gz VHXHHOFUDNIDJS-IFXJQAMLSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@@H]2C)o1 ZINC000581948651 1023923987 /nfs/dbraw/zinc/92/39/87/1023923987.db2.gz VHXHHOFUDNIDJS-IFXJQAMLSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)o1 ZINC000581948651 1023923995 /nfs/dbraw/zinc/92/39/95/1023923995.db2.gz VHXHHOFUDNIDJS-IFXJQAMLSA-N 2 1 330.447 4.166 20 0 EIADMP Cc1c(F)cccc1-c1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)o1 ZINC000581948651 1023924000 /nfs/dbraw/zinc/92/40/00/1023924000.db2.gz VHXHHOFUDNIDJS-IFXJQAMLSA-N 2 1 330.447 4.166 20 0 EIADMP c1coc(C2CC[NH+](CCC[NH+]3CCC(c4ccco4)CC3)CC2)c1 ZINC000661161315 1024287111 /nfs/dbraw/zinc/28/71/11/1024287111.db2.gz PRCRKCDSKGYFKC-UHFFFAOYSA-N 2 1 342.483 4.322 20 0 EIADMP FCCC[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000510723888 1024317004 /nfs/dbraw/zinc/31/70/04/1024317004.db2.gz UQRFZZRGLWNUCT-FPOVZHCZSA-N 2 1 332.507 4.202 20 0 EIADMP FC1(F)CCC[C@H]1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000647215542 1024330929 /nfs/dbraw/zinc/33/09/29/1024330929.db2.gz YDTAYZGSDFLOFI-ROUUACIJSA-N 2 1 334.454 4.209 20 0 EIADMP FC1(F)CCC[C@H]1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000647215542 1024330938 /nfs/dbraw/zinc/33/09/38/1024330938.db2.gz YDTAYZGSDFLOFI-ROUUACIJSA-N 2 1 334.454 4.209 20 0 EIADMP Cc1cccc([C@H]([NH2+][C@@H]2CCN(C)[C@H](C)C2)c2cccc(F)c2)c1 ZINC000510736765 1024380090 /nfs/dbraw/zinc/38/00/90/1024380090.db2.gz RFGWTPIKFYZAIN-HBGVWJBISA-N 2 1 326.459 4.296 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cccc3ccsc32)[C@H](C)C1 ZINC000652219679 1024389591 /nfs/dbraw/zinc/38/95/91/1024389591.db2.gz IJVSXDVMIVFHGP-APWZRJJASA-N 2 1 346.540 4.128 20 0 EIADMP CCC[NH+]1CCC([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000652330034 1024616557 /nfs/dbraw/zinc/61/65/57/1024616557.db2.gz RSOPXLJHFDGMLN-UHFFFAOYSA-N 2 1 326.406 4.159 20 0 EIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652348184 1024686476 /nfs/dbraw/zinc/68/64/76/1024686476.db2.gz WRFQCAVUBLBMSA-XRULBBBTSA-N 2 1 344.543 4.263 20 0 EIADMP CC(C)c1ccc([C@H](C)[N@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)cc1 ZINC000652350437 1024703484 /nfs/dbraw/zinc/70/34/84/1024703484.db2.gz YMHSDDVBIKOYEF-FIRPJDEBSA-N 2 1 330.516 4.089 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000164635627 1024740840 /nfs/dbraw/zinc/74/08/40/1024740840.db2.gz FMDKUABYVNPJCB-MRXNPFEDSA-N 2 1 335.904 4.452 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC000164650241 1024766550 /nfs/dbraw/zinc/76/65/50/1024766550.db2.gz RAFQCVBRJUYXOM-ZDUSSCGKSA-N 2 1 325.378 4.341 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cc[nH+]c3c(O)cccc23)C1 ZINC000684575023 1024827537 /nfs/dbraw/zinc/82/75/37/1024827537.db2.gz IZRMWAWKYAIKLM-SJORKVTESA-N 2 1 339.483 4.031 20 0 EIADMP CS[C@H](C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000548486106 1024836693 /nfs/dbraw/zinc/83/66/93/1024836693.db2.gz NUSRTGGYACPLJY-NZSAHSFTSA-N 2 1 334.573 4.264 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)CCc1cccc(C(F)(F)F)c1 ZINC000510959077 1024866788 /nfs/dbraw/zinc/86/67/88/1024866788.db2.gz NRPXPWKJWVDKEP-CQSZACIVSA-N 2 1 339.405 4.211 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000341951703 1025007684 /nfs/dbraw/zinc/00/76/84/1025007684.db2.gz ZAIUKAYYYWURPR-UHFFFAOYSA-N 2 1 337.389 4.269 20 0 EIADMP C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295631 1025048196 /nfs/dbraw/zinc/04/81/96/1025048196.db2.gz VYYDMTBTTWHOLV-QFBILLFUSA-N 2 1 339.483 4.114 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccnc3ccccc23)C1 ZINC000535825427 1025072985 /nfs/dbraw/zinc/07/29/85/1025072985.db2.gz DYOWQYBFBGKSDB-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccnc3ccccc23)C1 ZINC000535825427 1025072994 /nfs/dbraw/zinc/07/29/94/1025072994.db2.gz DYOWQYBFBGKSDB-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccnc3ccccc23)C1 ZINC000535825427 1025073004 /nfs/dbraw/zinc/07/30/04/1025073004.db2.gz DYOWQYBFBGKSDB-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccnc3ccccc23)C1 ZINC000535825427 1025073009 /nfs/dbraw/zinc/07/30/09/1025073009.db2.gz DYOWQYBFBGKSDB-MOPGFXCFSA-N 2 1 337.511 4.321 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH2+]CCCc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000684613736 1025087931 /nfs/dbraw/zinc/08/79/31/1025087931.db2.gz KWQZEZWWMMSKHA-CXAGYDPISA-N 2 1 329.315 4.246 20 0 EIADMP Clc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c2ncccc12 ZINC000663346534 1025145563 /nfs/dbraw/zinc/14/55/63/1025145563.db2.gz TWLXQMGPPTVWEF-MRXNPFEDSA-N 2 1 343.902 4.100 20 0 EIADMP c1sc(C2CC2)nc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000162624980 1025156439 /nfs/dbraw/zinc/15/64/39/1025156439.db2.gz OGBYCHRCYJTFQE-UHFFFAOYSA-N 2 1 333.545 4.109 20 0 EIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(F)cc2C(F)(F)F)CC1 ZINC000623853886 1025376312 /nfs/dbraw/zinc/37/63/12/1025376312.db2.gz KPLDEAZYEFUAHO-LBPRGKRZSA-N 2 1 332.385 4.370 20 0 EIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC000663466306 1025391519 /nfs/dbraw/zinc/39/15/19/1025391519.db2.gz QWSPOIUYEAHDQO-HBMCJLEFSA-N 2 1 341.543 4.128 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc2ccncc2s1 ZINC000663463803 1025392888 /nfs/dbraw/zinc/39/28/88/1025392888.db2.gz BRZVAFHGHKPBGD-HOCLYGCPSA-N 2 1 329.513 4.069 20 0 EIADMP c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467854 1025399748 /nfs/dbraw/zinc/39/97/48/1025399748.db2.gz IHXZCJNXTRBZSS-AZUAARDMSA-N 2 1 340.511 4.145 20 0 EIADMP c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467854 1025399751 /nfs/dbraw/zinc/39/97/51/1025399751.db2.gz IHXZCJNXTRBZSS-AZUAARDMSA-N 2 1 340.511 4.145 20 0 EIADMP Cc1cccc(C)c1OC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167965883 1025545696 /nfs/dbraw/zinc/54/56/96/1025545696.db2.gz PFJXIDPOGINIQG-LBFURVHYSA-N 2 1 342.527 4.066 20 0 EIADMP COc1cccc(CCC[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000303939287 1025588985 /nfs/dbraw/zinc/58/89/85/1025588985.db2.gz SIYIDRPZKPZNRG-NRFANRHFSA-N 2 1 344.543 4.072 20 0 EIADMP CC[C@H](CC(F)(F)F)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000546165262 1025597607 /nfs/dbraw/zinc/59/76/07/1025597607.db2.gz BEINYOYJCRZTMT-MRXNPFEDSA-N 2 1 328.422 4.014 20 0 EIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H](Sc2ccncc2)C1 ZINC001167826941 1025629539 /nfs/dbraw/zinc/62/95/39/1025629539.db2.gz SDMRAAGPEFDRGV-MJGOQNOKSA-N 2 1 335.561 4.149 20 0 EIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)cc1 ZINC000925784391 1025657265 /nfs/dbraw/zinc/65/72/65/1025657265.db2.gz RBRQMJJUQXUZRZ-HIFRSBDPSA-N 2 1 328.472 4.083 20 0 EIADMP CCc1ccc(C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cn1 ZINC000512047147 1025842637 /nfs/dbraw/zinc/84/26/37/1025842637.db2.gz XRMRDKQSQYBOHP-ICSRJNTNSA-N 2 1 337.511 4.034 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc(OC(F)F)cc1 ZINC000319773496 1025858525 /nfs/dbraw/zinc/85/85/25/1025858525.db2.gz FKIHICHZNXZGPQ-LSDHHAIUSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc(OC(F)F)cc1 ZINC000319773493 1025859561 /nfs/dbraw/zinc/85/95/61/1025859561.db2.gz FKIHICHZNXZGPQ-HUUCEWRRSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H](c2ccccc2)C2CCCC2)CCCO1 ZINC000432404667 1025871676 /nfs/dbraw/zinc/87/16/76/1025871676.db2.gz FFCPEKVNRQKPJN-NQIIRXRSSA-N 2 1 330.516 4.008 20 0 EIADMP Clc1cccc([C@H]2C[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167968566 1025906083 /nfs/dbraw/zinc/90/60/83/1025906083.db2.gz RNEQODQCZMQXSI-NOSIKRSBSA-N 2 1 330.903 4.191 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000431333173 1025922138 /nfs/dbraw/zinc/92/21/38/1025922138.db2.gz MWJLVVBLPPQEQJ-LAUBAEHRSA-N 2 1 342.527 4.099 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cc3ccncc3s2)C1 ZINC000657313477 1025965540 /nfs/dbraw/zinc/96/55/40/1025965540.db2.gz SEXQQMPDWLDHMV-IYBDPMFKSA-N 2 1 331.529 4.144 20 0 EIADMP CCOc1cccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167971509 1026074325 /nfs/dbraw/zinc/07/43/25/1026074325.db2.gz WSZYWHUJVGWXGI-MIJOPJBOSA-N 2 1 328.500 4.141 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCOc3c(C)cc(Cl)cc32)C1 ZINC000431347650 1026085031 /nfs/dbraw/zinc/08/50/31/1026085031.db2.gz GGIVQORIIKOZFS-QAPCUYQASA-N 2 1 336.907 4.184 20 0 EIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCCOc3c(C)cc(Cl)cc32)C1 ZINC000431347649 1026085464 /nfs/dbraw/zinc/08/54/64/1026085464.db2.gz GGIVQORIIKOZFS-MAUKXSAKSA-N 2 1 336.907 4.184 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000431350090 1026114298 /nfs/dbraw/zinc/11/42/98/1026114298.db2.gz NMLCYCFWEFKRIB-BQFCYCMXSA-N 2 1 334.891 4.079 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000431350090 1026114304 /nfs/dbraw/zinc/11/43/04/1026114304.db2.gz NMLCYCFWEFKRIB-BQFCYCMXSA-N 2 1 334.891 4.079 20 0 EIADMP CC(C)SCC[N@@H+](C)[C@H]1CCC[NH+](CCSC(C)C)CC1 ZINC000514096016 1026134551 /nfs/dbraw/zinc/13/45/51/1026134551.db2.gz RDIIMZRSETXYSV-KRWDZBQOSA-N 2 1 332.623 4.056 20 0 EIADMP CC(C)SCC[NH+](C)[C@H]1CCC[N@H+](CCSC(C)C)CC1 ZINC000514096016 1026134557 /nfs/dbraw/zinc/13/45/57/1026134557.db2.gz RDIIMZRSETXYSV-KRWDZBQOSA-N 2 1 332.623 4.056 20 0 EIADMP CC(C)SCC[NH+](C)[C@H]1CCC[N@@H+](CCSC(C)C)CC1 ZINC000514096016 1026134562 /nfs/dbraw/zinc/13/45/62/1026134562.db2.gz RDIIMZRSETXYSV-KRWDZBQOSA-N 2 1 332.623 4.056 20 0 EIADMP CC(C)c1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167974370 1026174676 /nfs/dbraw/zinc/17/46/76/1026174676.db2.gz YFJMFCGIDVDOPL-FRIKZZABSA-N 2 1 326.528 4.348 20 0 EIADMP CC(C)(C)C[N@H+](C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001167975073 1026222207 /nfs/dbraw/zinc/22/22/07/1026222207.db2.gz GMXDVAWGIHJANC-UKVDTYTHSA-N 2 1 347.591 4.010 20 0 EIADMP CC(C)(C)C[NH+](C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001167975073 1026222215 /nfs/dbraw/zinc/22/22/15/1026222215.db2.gz GMXDVAWGIHJANC-UKVDTYTHSA-N 3 1 347.591 4.010 20 0 EIADMP CC(C)(C)C[NH+](C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001167975073 1026222222 /nfs/dbraw/zinc/22/22/22/1026222222.db2.gz GMXDVAWGIHJANC-UKVDTYTHSA-N 3 1 347.591 4.010 20 0 EIADMP Fc1cccc(CC2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CCC2)c1 ZINC001167975155 1026224161 /nfs/dbraw/zinc/22/41/61/1026224161.db2.gz JIDSWUOEAPDLSN-SEJPIABJSA-N 2 1 342.502 4.286 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC2([C@H](C)CCO)CCC2)cc1 ZINC000344301518 1026227809 /nfs/dbraw/zinc/22/78/09/1026227809.db2.gz JNUMHOOVUSUWAS-IAGOWNOFSA-N 2 1 341.499 4.020 20 0 EIADMP C[N@@H+](Cc1cccc(C(F)F)c1)C1CCN(c2ccccn2)CC1 ZINC000375679352 1026327686 /nfs/dbraw/zinc/32/76/86/1026327686.db2.gz OQKTXMRDCRQUQR-UHFFFAOYSA-N 2 1 331.410 4.120 20 0 EIADMP Fc1ccccc1CC1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CCC1 ZINC001167977876 1026340434 /nfs/dbraw/zinc/34/04/34/1026340434.db2.gz HNNBLDYLSQAWNU-IHWFROFDSA-N 2 1 342.502 4.286 20 0 EIADMP CCC1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CCC(F)(F)CC1 ZINC001167979041 1026348672 /nfs/dbraw/zinc/34/86/72/1026348672.db2.gz STTIZQPKVRKXID-ALOPSCKCSA-N 2 1 326.475 4.340 20 0 EIADMP c1cc2c(cccc2C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)[nH]1 ZINC000279331120 1026379409 /nfs/dbraw/zinc/37/94/09/1026379409.db2.gz DFKNVHOTHVHOLM-UHFFFAOYSA-N 2 1 334.467 4.080 20 0 EIADMP C[N@@H+](Cc1cc2ccnc(Cl)c2s1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000894748168 1026391254 /nfs/dbraw/zinc/39/12/54/1026391254.db2.gz IGLBTSFHNUAABW-PBWFPOADSA-N 2 1 335.904 4.007 20 0 EIADMP C[NH+](Cc1cc2ccnc(Cl)c2s1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000894748168 1026391269 /nfs/dbraw/zinc/39/12/69/1026391269.db2.gz IGLBTSFHNUAABW-PBWFPOADSA-N 2 1 335.904 4.007 20 0 EIADMP C[NH+](Cc1cc2ccnc(Cl)c2s1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000894748168 1026391283 /nfs/dbraw/zinc/39/12/83/1026391283.db2.gz IGLBTSFHNUAABW-PBWFPOADSA-N 2 1 335.904 4.007 20 0 EIADMP COCc1csc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000657389130 1026426529 /nfs/dbraw/zinc/42/65/29/1026426529.db2.gz SBEPBLFPONSVAN-LPHOPBHVSA-N 2 1 344.524 4.037 20 0 EIADMP COCc1csc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000657389130 1026426553 /nfs/dbraw/zinc/42/65/53/1026426553.db2.gz SBEPBLFPONSVAN-LPHOPBHVSA-N 2 1 344.524 4.037 20 0 EIADMP CCCC[N@@H+](C)CC1CC[NH+](C/C=C\c2ccccc2OC)CC1 ZINC000506867956 1026476140 /nfs/dbraw/zinc/47/61/40/1026476140.db2.gz PMOYYSUDJWOAFV-NTMALXAHSA-N 2 1 330.516 4.152 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccc(Br)s1 ZINC000548733895 1026549051 /nfs/dbraw/zinc/54/90/51/1026549051.db2.gz XWPKZRUHKOAVLO-NWDGAFQWSA-N 2 1 331.323 4.036 20 0 EIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(Br)s1 ZINC000548733895 1026549062 /nfs/dbraw/zinc/54/90/62/1026549062.db2.gz XWPKZRUHKOAVLO-NWDGAFQWSA-N 2 1 331.323 4.036 20 0 EIADMP C[C@H]([NH2+]Cc1cc2ccncc2s1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000657430592 1026644312 /nfs/dbraw/zinc/64/43/12/1026644312.db2.gz RSQZTABUPRTFDR-GOEBONIOSA-N 2 1 329.513 4.039 20 0 EIADMP Fc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1-c1cccs1 ZINC000391397338 1026752919 /nfs/dbraw/zinc/75/29/19/1026752919.db2.gz NGACIKXWBJKFLW-HOTGVXAUSA-N 2 1 330.472 4.271 20 0 EIADMP CCc1cccnc1[C@H](C)[NH2+][C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000507506133 1026819567 /nfs/dbraw/zinc/81/95/67/1026819567.db2.gz FGDOEMJZILTWKW-WFXMLNOXSA-N 2 1 337.511 4.348 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCOc2cccc3ccccc32)C[C@H]1C ZINC001167589381 1026859583 /nfs/dbraw/zinc/85/95/83/1026859583.db2.gz DKKYOBPXNIBJDQ-UYAOXDASSA-N 2 1 340.511 4.413 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCOc2cccc3ccccc32)C[C@H]1C ZINC001167589381 1026859585 /nfs/dbraw/zinc/85/95/85/1026859585.db2.gz DKKYOBPXNIBJDQ-UYAOXDASSA-N 2 1 340.511 4.413 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@H]1CCCc2cccnc21 ZINC000684958875 1026895635 /nfs/dbraw/zinc/89/56/35/1026895635.db2.gz YUASGSIJEIGGPV-GKJHBJHPSA-N 2 1 349.522 4.205 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@H]1CCCc2cccnc21 ZINC000684958875 1026895637 /nfs/dbraw/zinc/89/56/37/1026895637.db2.gz YUASGSIJEIGGPV-GKJHBJHPSA-N 2 1 349.522 4.205 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1ccncc1 ZINC000582664258 1026916088 /nfs/dbraw/zinc/91/60/88/1026916088.db2.gz CKYKUFOZCXIROC-SFTDATJTSA-N 2 1 335.495 4.320 20 0 EIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1ccncc1 ZINC000582664258 1026916093 /nfs/dbraw/zinc/91/60/93/1026916093.db2.gz CKYKUFOZCXIROC-SFTDATJTSA-N 2 1 335.495 4.320 20 0 EIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2cccc3C)cn1 ZINC000153077521 1026982672 /nfs/dbraw/zinc/98/26/72/1026982672.db2.gz QNLDTEKJPMDGJQ-BEFAXECRSA-N 2 1 332.451 4.222 20 0 EIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1cccc(F)c1 ZINC000188065881 1027070479 /nfs/dbraw/zinc/07/04/79/1027070479.db2.gz IUKRTPVVIKTDGH-LJQANCHMSA-N 2 1 327.447 4.239 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](CCOC)c2ccc(Cl)c(Cl)c2)CC1 ZINC000342805905 1027072516 /nfs/dbraw/zinc/07/25/16/1027072516.db2.gz LEVUONDNTVULPF-KRWDZBQOSA-N 2 1 345.314 4.145 20 0 EIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(OCCC(C)C)c(OC)c2)CC1 ZINC000061016445 1027085608 /nfs/dbraw/zinc/08/56/08/1027085608.db2.gz IWZFBXKDMGPLAR-UHFFFAOYSA-N 2 1 348.531 4.084 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1)C1CCOCC1 ZINC000474484331 1027119694 /nfs/dbraw/zinc/11/96/94/1027119694.db2.gz HXOKRCNVJMDSJM-OTWHNJEPSA-N 2 1 344.543 4.069 20 0 EIADMP Cc1cccc(N[C@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)n1 ZINC000301892068 1027132645 /nfs/dbraw/zinc/13/26/45/1027132645.db2.gz VMXMZBZOIRSHCR-INIZCTEOSA-N 2 1 335.373 4.095 20 0 EIADMP CC1CC[NH+](C[C@H]2CCCN(c3cc[nH+]c4ccsc43)C2)CC1 ZINC000302004585 1027183508 /nfs/dbraw/zinc/18/35/08/1027183508.db2.gz ZIEXMKOEWHLEOJ-MRXNPFEDSA-N 2 1 329.513 4.245 20 0 EIADMP Cc1ccc2[nH+]ccc(N[C@H](C[NH+]3CCOCC3)c3ccccc3)c2c1 ZINC000302155478 1027235223 /nfs/dbraw/zinc/23/52/23/1027235223.db2.gz MLJLARAJTOKRNN-JOCHJYFZSA-N 2 1 347.462 4.029 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CSc3ccccc32)C[C@@H]1c1ccccc1 ZINC000453217930 1027339622 /nfs/dbraw/zinc/33/96/22/1027339622.db2.gz JPMCNZVXWICEMB-WSTZPKSXSA-N 2 1 338.520 4.301 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CSc3ccccc32)C[C@@H]1c1ccccc1 ZINC000453217930 1027339647 /nfs/dbraw/zinc/33/96/47/1027339647.db2.gz JPMCNZVXWICEMB-WSTZPKSXSA-N 2 1 338.520 4.301 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+]C1(c2ccc(Br)cc2)CCC1 ZINC000342862785 1027339891 /nfs/dbraw/zinc/33/98/91/1027339891.db2.gz CYWHVQDGXROOKP-UHFFFAOYSA-N 2 1 348.288 4.013 20 0 EIADMP C[C@@H]1CC([N@H+](C)Cc2cccc(O)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168040508 1027399546 /nfs/dbraw/zinc/39/95/46/1027399546.db2.gz NQYKMRXBJAHTJJ-QZTJIDSGSA-N 2 1 338.495 4.266 20 0 EIADMP C[C@@H]1CC([N@@H+](C)Cc2cccc(O)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168040508 1027399568 /nfs/dbraw/zinc/39/95/68/1027399568.db2.gz NQYKMRXBJAHTJJ-QZTJIDSGSA-N 2 1 338.495 4.266 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cccc(N(C)C)c2)cc1 ZINC000119882161 1027407062 /nfs/dbraw/zinc/40/70/62/1027407062.db2.gz KXTBOHYHJRJKSK-MRXNPFEDSA-N 2 1 334.467 4.098 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474819958 1027544034 /nfs/dbraw/zinc/54/40/34/1027544034.db2.gz XQFLHFBVRWTYHU-ALEMQFKUSA-N 2 1 338.948 4.498 20 0 EIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474819958 1027544046 /nfs/dbraw/zinc/54/40/46/1027544046.db2.gz XQFLHFBVRWTYHU-ALEMQFKUSA-N 2 1 338.948 4.498 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474819959 1027545105 /nfs/dbraw/zinc/54/51/05/1027545105.db2.gz XQFLHFBVRWTYHU-LRMUHYSTSA-N 2 1 338.948 4.498 20 0 EIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474819959 1027545108 /nfs/dbraw/zinc/54/51/08/1027545108.db2.gz XQFLHFBVRWTYHU-LRMUHYSTSA-N 2 1 338.948 4.498 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccccc1OC(C)C ZINC000582873530 1027551397 /nfs/dbraw/zinc/55/13/97/1027551397.db2.gz SDXGJDMJFWAKCN-UHFFFAOYSA-N 2 1 329.488 4.145 20 0 EIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccccc1OC(C)C ZINC000582873530 1027551417 /nfs/dbraw/zinc/55/14/17/1027551417.db2.gz SDXGJDMJFWAKCN-UHFFFAOYSA-N 2 1 329.488 4.145 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000320915259 1027562099 /nfs/dbraw/zinc/56/20/99/1027562099.db2.gz DOOGLPPWFUVPDY-UNEWFSDZSA-N 2 1 326.406 4.230 20 0 EIADMP Cc1cc(N2CCC([NH2+][C@H](C)[C@H](C)C3CCCCC3)CC2)nc(C)[nH+]1 ZINC000474879750 1027711474 /nfs/dbraw/zinc/71/14/74/1027711474.db2.gz ODQWTICHOQYCLA-DLBZAZTESA-N 2 1 344.547 4.257 20 0 EIADMP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000657706271 1027759514 /nfs/dbraw/zinc/75/95/14/1027759514.db2.gz KYOPEPAYXVVQLE-STQMWFEESA-N 2 1 346.359 4.256 20 0 EIADMP Fc1cccc([C@@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167996134 1027847255 /nfs/dbraw/zinc/84/72/55/1027847255.db2.gz XEGOZEJYUMDGKC-JKWVGCSGSA-N 2 1 328.475 4.368 20 0 EIADMP Fc1cccc([C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167996134 1027847262 /nfs/dbraw/zinc/84/72/62/1027847262.db2.gz XEGOZEJYUMDGKC-JKWVGCSGSA-N 2 1 328.475 4.368 20 0 EIADMP Fc1cccc([C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167996134 1027847264 /nfs/dbraw/zinc/84/72/64/1027847264.db2.gz XEGOZEJYUMDGKC-JKWVGCSGSA-N 2 1 328.475 4.368 20 0 EIADMP CC(F)(F)CCC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167648721 1027851085 /nfs/dbraw/zinc/85/10/85/1027851085.db2.gz XLXFZCVLFLCJPK-RBUKOAKNSA-N 2 1 336.470 4.408 20 0 EIADMP CC(F)(F)CCC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001167648721 1027851092 /nfs/dbraw/zinc/85/10/92/1027851092.db2.gz XLXFZCVLFLCJPK-RBUKOAKNSA-N 2 1 336.470 4.408 20 0 EIADMP CC(F)(F)CCC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001167648721 1027851101 /nfs/dbraw/zinc/85/11/01/1027851101.db2.gz XLXFZCVLFLCJPK-RBUKOAKNSA-N 2 1 336.470 4.408 20 0 EIADMP C[N@H+](CCCc1cc(-c2ccccc2)no1)CCC[NH+]1CCCCC1 ZINC000444585170 1027884588 /nfs/dbraw/zinc/88/45/88/1027884588.db2.gz XNSBKGJGMAQFFT-UHFFFAOYSA-N 2 1 341.499 4.082 20 0 EIADMP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)c1 ZINC000280803824 1027894997 /nfs/dbraw/zinc/89/49/97/1027894997.db2.gz LBRWSLUVFNRDMD-VDHUWJSZSA-N 2 1 338.417 4.168 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](CC(F)(F)F)c1ccccc1C ZINC000444777950 1028061299 /nfs/dbraw/zinc/06/12/99/1028061299.db2.gz UKWYKYPKUFYCPJ-MRXNPFEDSA-N 2 1 325.378 4.173 20 0 EIADMP C[C@@H](c1ccncc1)[NH+](C)CCCCC[N@H+](C)[C@@H](C)c1ccncc1 ZINC000091988586 1028146701 /nfs/dbraw/zinc/14/67/01/1028146701.db2.gz IGWFOTRNYNMTDV-OALUTQOASA-N 2 1 340.515 4.333 20 0 EIADMP c1cc2c(s1)C[NH+](CCCCC[N@H+]1CCc3ccsc3C1)CC2 ZINC000536368156 1028178785 /nfs/dbraw/zinc/17/87/85/1028178785.db2.gz GEDCMZMYWKIKNL-UHFFFAOYSA-N 2 1 346.565 4.396 20 0 EIADMP CC1(C)[C@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1(F)F ZINC000657738982 1028185213 /nfs/dbraw/zinc/18/52/13/1028185213.db2.gz PBHUWWVZDZJIRN-IRXDYDNUSA-N 2 1 334.454 4.065 20 0 EIADMP CC1(C)[C@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1(F)F ZINC000657738982 1028185227 /nfs/dbraw/zinc/18/52/27/1028185227.db2.gz PBHUWWVZDZJIRN-IRXDYDNUSA-N 2 1 334.454 4.065 20 0 EIADMP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)s1 ZINC000162719314 1028304975 /nfs/dbraw/zinc/30/49/75/1028304975.db2.gz JSOMWVUXDSGSDH-HNNXBMFYSA-N 2 1 347.528 4.224 20 0 EIADMP Cc1ccsc1[C@H](C)[NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1 ZINC000162749475 1028328500 /nfs/dbraw/zinc/32/85/00/1028328500.db2.gz OTQWVDPDVXVDGJ-HNNXBMFYSA-N 2 1 347.528 4.224 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](c1cncc(F)c1)C1CC1 ZINC000281095773 1028375109 /nfs/dbraw/zinc/37/51/09/1028375109.db2.gz AXEQVDAVSVKPNN-OAQYLSRUSA-N 2 1 341.474 4.302 20 0 EIADMP Fc1cncc([C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C2CC2)c1 ZINC000281500118 1028655430 /nfs/dbraw/zinc/65/54/30/1028655430.db2.gz GQUBDGKJIQRLJJ-HXUWFJFHSA-N 2 1 331.479 4.059 20 0 EIADMP Clc1ccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1Cl ZINC000281644673 1028822497 /nfs/dbraw/zinc/82/24/97/1028822497.db2.gz PEJBTUTTXLYPJY-VGWMRTNUSA-N 2 1 339.310 4.456 20 0 EIADMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000347001248 1028837929 /nfs/dbraw/zinc/83/79/29/1028837929.db2.gz GVNOGJMJNKQWEU-DZGCQCFKSA-N 2 1 334.410 4.000 20 0 EIADMP C[N@H+](Cc1cc(F)ccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000445806537 1028901784 /nfs/dbraw/zinc/90/17/84/1028901784.db2.gz WYNWZDHMXFNFKV-UHFFFAOYSA-N 2 1 347.865 4.223 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc3ccccc3nc2Cl)CC1 ZINC000728571646 1028980567 /nfs/dbraw/zinc/98/05/67/1028980567.db2.gz IQSPSFGRYJVWEA-UHFFFAOYSA-N 2 1 345.918 4.440 20 0 EIADMP Cc1ccsc1C[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000583660787 1029002958 /nfs/dbraw/zinc/00/29/58/1029002958.db2.gz MFWBSJIYHNLTMC-FQEVSTJZSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1ccsc1C[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000583660787 1029002978 /nfs/dbraw/zinc/00/29/78/1029002978.db2.gz MFWBSJIYHNLTMC-FQEVSTJZSA-N 2 1 326.509 4.155 20 0 EIADMP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1csc(-c2ccccc2)n1 ZINC000650755874 1029183451 /nfs/dbraw/zinc/18/34/51/1029183451.db2.gz OPZHNSDTQRUAAY-OAHLLOKOSA-N 2 1 337.492 4.380 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCOC(C)(C)C ZINC000475335718 1029549904 /nfs/dbraw/zinc/54/99/04/1029549904.db2.gz SEHXHDOTZXENLO-UYAOXDASSA-N 2 1 332.532 4.082 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCOC(C)(C)C ZINC000475335718 1029549915 /nfs/dbraw/zinc/54/99/15/1029549915.db2.gz SEHXHDOTZXENLO-UYAOXDASSA-N 2 1 332.532 4.082 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000446766408 1029566651 /nfs/dbraw/zinc/56/66/51/1029566651.db2.gz HVRKHPVEAOKCTN-QGZVFWFLSA-N 2 1 328.431 4.002 20 0 EIADMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000446766408 1029566661 /nfs/dbraw/zinc/56/66/61/1029566661.db2.gz HVRKHPVEAOKCTN-QGZVFWFLSA-N 2 1 328.431 4.002 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C(C3CCC3)C3CCC3)CC2)cc1 ZINC000325012691 1029585965 /nfs/dbraw/zinc/58/59/65/1029585965.db2.gz CYCBIVXMPQVBSP-UHFFFAOYSA-N 2 1 326.528 4.252 20 0 EIADMP COC[C@@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C1CCCC1 ZINC000446830783 1029595858 /nfs/dbraw/zinc/59/58/58/1029595858.db2.gz WVZNOPDKOOQLOH-DYESRHJHSA-N 2 1 330.516 4.007 20 0 EIADMP CSC1CC[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168063143 1029605519 /nfs/dbraw/zinc/60/55/19/1029605519.db2.gz MEOWZSGNEZHNRL-IZZQQSIFSA-N 2 1 332.557 4.255 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccn1 ZINC000158894060 1029610275 /nfs/dbraw/zinc/61/02/75/1029610275.db2.gz JCPZEZCTUFCBCQ-MJGOQNOKSA-N 2 1 343.540 4.486 20 0 EIADMP CCC[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccn1 ZINC000158894060 1029610283 /nfs/dbraw/zinc/61/02/83/1029610283.db2.gz JCPZEZCTUFCBCQ-MJGOQNOKSA-N 2 1 343.540 4.486 20 0 EIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Br)cc1F ZINC000446938969 1029646109 /nfs/dbraw/zinc/64/61/09/1029646109.db2.gz YSRODOJNOGTRRN-YUTCNCBUSA-N 2 1 343.284 4.112 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@@H+]3CC[C@H]([NH3+])C[C@@H]3C)s2)cc1 ZINC000584180409 1029662341 /nfs/dbraw/zinc/66/23/41/1029662341.db2.gz MJDFJSHPRBEJAO-YOEHRIQHSA-N 2 1 329.513 4.245 20 0 EIADMP CC(C)c1ccc(-c2ncc(C[N@H+]3CC[C@H]([NH3+])C[C@@H]3C)s2)cc1 ZINC000584180409 1029662348 /nfs/dbraw/zinc/66/23/48/1029662348.db2.gz MJDFJSHPRBEJAO-YOEHRIQHSA-N 2 1 329.513 4.245 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)Cc3cccc(F)c3)C2)s1 ZINC000584259148 1029698743 /nfs/dbraw/zinc/69/87/43/1029698743.db2.gz YOSSQWDXGFTCOD-KRWDZBQOSA-N 2 1 332.488 4.150 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)Cc3cccc(F)c3)C2)s1 ZINC000584259148 1029698772 /nfs/dbraw/zinc/69/87/72/1029698772.db2.gz YOSSQWDXGFTCOD-KRWDZBQOSA-N 2 1 332.488 4.150 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)Cc3cccc(F)c3)C2)s1 ZINC000584259148 1029698779 /nfs/dbraw/zinc/69/87/79/1029698779.db2.gz YOSSQWDXGFTCOD-KRWDZBQOSA-N 2 1 332.488 4.150 20 0 EIADMP Clc1ccc2[nH+]ccc(N3CCC[C@H]([NH+]4CCCC4)CC3)c2c1 ZINC000301362331 1029717197 /nfs/dbraw/zinc/71/71/97/1029717197.db2.gz MONZZPICWWWJQV-INIZCTEOSA-N 2 1 329.875 4.343 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838281 1029724660 /nfs/dbraw/zinc/72/46/60/1029724660.db2.gz PYOBGHVSNFTFBW-CABCVRRESA-N 2 1 325.447 4.182 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838284 1029727938 /nfs/dbraw/zinc/72/79/38/1029727938.db2.gz PYOBGHVSNFTFBW-LSDHHAIUSA-N 2 1 325.447 4.182 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(Br)c(Cl)c2)C1 ZINC000657840429 1029747365 /nfs/dbraw/zinc/74/73/65/1029747365.db2.gz GHSFFXIHYYXJAN-RYUDHWBXSA-N 2 1 345.712 4.095 20 0 EIADMP Cc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3nc(C)c(C)o3)CC2)c(C)o1 ZINC000278741230 1029775643 /nfs/dbraw/zinc/77/56/43/1029775643.db2.gz NHTSHQJBWCXIIR-HNNXBMFYSA-N 2 1 345.487 4.064 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000301754466 1029804122 /nfs/dbraw/zinc/80/41/22/1029804122.db2.gz CMYYCTCIDYMQPF-AUUYWEPGSA-N 2 1 341.886 4.341 20 0 EIADMP Clc1ccc2c(c1)[nH+]ccc2N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000301754466 1029804123 /nfs/dbraw/zinc/80/41/23/1029804123.db2.gz CMYYCTCIDYMQPF-AUUYWEPGSA-N 2 1 341.886 4.341 20 0 EIADMP CC(C)[C@H]([NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1)c1cccnc1 ZINC000091310344 1029883466 /nfs/dbraw/zinc/88/34/66/1029883466.db2.gz SZBKJFJSLSFOQK-NRFANRHFSA-N 2 1 325.500 4.409 20 0 EIADMP CCc1cc(CCC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)on1 ZINC000450684687 1029896334 /nfs/dbraw/zinc/89/63/34/1029896334.db2.gz RXRGQJQVKLHEDN-OAHLLOKOSA-N 2 1 338.455 4.015 20 0 EIADMP c1c[nH]c([C@H]2CCC[N@H+](Cc3cccc(OC4CCCC4)c3)C2)n1 ZINC000092071784 1029900146 /nfs/dbraw/zinc/90/01/46/1029900146.db2.gz BCQXMTYGFARYCR-KRWDZBQOSA-N 2 1 325.456 4.111 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@H+](C[C@@H]3CCCCC3(F)F)C1)CCCC2 ZINC000450788099 1029981696 /nfs/dbraw/zinc/98/16/96/1029981696.db2.gz TUOLCUOOIRFOKH-HOTGVXAUSA-N 2 1 337.458 4.143 20 0 EIADMP Cc1[nH+]c2c(n1[C@H]1CC[N@@H+](C[C@@H]3CCCCC3(F)F)C1)CCCC2 ZINC000450788099 1029981722 /nfs/dbraw/zinc/98/17/22/1029981722.db2.gz TUOLCUOOIRFOKH-HOTGVXAUSA-N 2 1 337.458 4.143 20 0 EIADMP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1OC ZINC000183187485 1029990054 /nfs/dbraw/zinc/99/00/54/1029990054.db2.gz UNTAPTLJWLZMII-QKLQHJQFSA-N 2 1 330.516 4.389 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccccc1OC(F)(F)F ZINC000121428120 1030109685 /nfs/dbraw/zinc/10/96/85/1030109685.db2.gz WHQMFAJUNWWGBN-CHWSQXEVSA-N 2 1 341.377 4.077 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]Cc2ccc4c(c2)COC4)C3)cc1 ZINC000447587132 1030187249 /nfs/dbraw/zinc/18/72/49/1030187249.db2.gz OWKTWBABVZFFNF-WBDAEOGXSA-N 2 1 348.490 4.002 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C2(c4ccccc4)CC2)C3)cc1 ZINC000447589013 1030189148 /nfs/dbraw/zinc/18/91/48/1030189148.db2.gz WHKODEOKIONNNL-KOUNCHBCSA-N 2 1 332.491 4.461 20 0 EIADMP Clc1ccc(/C=C/C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000526056935 1030253001 /nfs/dbraw/zinc/25/30/01/1030253001.db2.gz RWZBQOISOJWSHK-BRNBINNCSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C/C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000526056935 1030253015 /nfs/dbraw/zinc/25/30/15/1030253015.db2.gz RWZBQOISOJWSHK-BRNBINNCSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C/C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000526056935 1030253020 /nfs/dbraw/zinc/25/30/20/1030253020.db2.gz RWZBQOISOJWSHK-BRNBINNCSA-N 2 1 330.903 4.302 20 0 EIADMP Clc1ccc(/C=C/C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000526056935 1030253024 /nfs/dbraw/zinc/25/30/24/1030253024.db2.gz RWZBQOISOJWSHK-BRNBINNCSA-N 2 1 330.903 4.302 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc2cnccc21 ZINC000685456721 1030335101 /nfs/dbraw/zinc/33/51/01/1030335101.db2.gz NZINRAIZGRWGDA-UHFFFAOYSA-N 2 1 333.479 4.319 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@H+](Cc3csc(Cl)c3Cl)C2)CC1 ZINC000685462788 1030342352 /nfs/dbraw/zinc/34/23/52/1030342352.db2.gz CIHCJKVSXFXTIC-LBPRGKRZSA-N 2 1 333.328 4.219 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3csc(Cl)c3Cl)C2)CC1 ZINC000685462788 1030342371 /nfs/dbraw/zinc/34/23/71/1030342371.db2.gz CIHCJKVSXFXTIC-LBPRGKRZSA-N 2 1 333.328 4.219 20 0 EIADMP CC[N@H+](CCC[NH+](C)C)Cc1ccc(-c2ccccc2OC)cc1 ZINC000685459922 1030343007 /nfs/dbraw/zinc/34/30/07/1030343007.db2.gz ASCOKQJQEVVMKB-UHFFFAOYSA-N 2 1 326.484 4.136 20 0 EIADMP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(-c2ccccc2OC)cc1 ZINC000685459922 1030343028 /nfs/dbraw/zinc/34/30/28/1030343028.db2.gz ASCOKQJQEVVMKB-UHFFFAOYSA-N 2 1 326.484 4.136 20 0 EIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1 ZINC000447812581 1030353316 /nfs/dbraw/zinc/35/33/16/1030353316.db2.gz MPZJJEGKZASVRN-QZTJIDSGSA-N 2 1 328.525 4.353 20 0 EIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1 ZINC000447812581 1030353331 /nfs/dbraw/zinc/35/33/31/1030353331.db2.gz MPZJJEGKZASVRN-QZTJIDSGSA-N 2 1 328.525 4.353 20 0 EIADMP CC[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Oc2ccccc2)cc1 ZINC000530407316 1030377666 /nfs/dbraw/zinc/37/76/66/1030377666.db2.gz PRWXJBSSSMHNFG-NRFANRHFSA-N 2 1 335.451 4.496 20 0 EIADMP C[C@H](CC[NH2+][C@@H](C)c1cc2cnccc2o1)[N@H+](C)Cc1ccccc1 ZINC000657898545 1030406388 /nfs/dbraw/zinc/40/63/88/1030406388.db2.gz DBMULIXHZUMEJH-SJORKVTESA-N 2 1 337.467 4.389 20 0 EIADMP C[C@H](CC[NH2+][C@@H](C)c1cc2cnccc2o1)[N@@H+](C)Cc1ccccc1 ZINC000657898545 1030406396 /nfs/dbraw/zinc/40/63/96/1030406396.db2.gz DBMULIXHZUMEJH-SJORKVTESA-N 2 1 337.467 4.389 20 0 EIADMP C[C@@H]([NH2+]CCCc1ccccc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000530477276 1030447380 /nfs/dbraw/zinc/44/73/80/1030447380.db2.gz XBPRETQYAMNESR-WIYYLYMNSA-N 2 1 340.486 4.259 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)C[C@@H]1C ZINC000530663223 1030620941 /nfs/dbraw/zinc/62/09/41/1030620941.db2.gz YNSHKOXVEPOUSC-GOEBONIOSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c3cccnc23)C[C@@H]1C ZINC000530663223 1030620955 /nfs/dbraw/zinc/62/09/55/1030620955.db2.gz YNSHKOXVEPOUSC-GOEBONIOSA-N 2 1 331.891 4.193 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c3cccnc23)C[C@@H]1C ZINC000530663223 1030620964 /nfs/dbraw/zinc/62/09/64/1030620964.db2.gz YNSHKOXVEPOUSC-GOEBONIOSA-N 2 1 331.891 4.193 20 0 EIADMP CCOC1CCC([NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000657933747 1030628471 /nfs/dbraw/zinc/62/84/71/1030628471.db2.gz VFCDYNUWTHIUGV-JSFXGIFRSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Br)c(Cl)c1 ZINC000657939433 1030644959 /nfs/dbraw/zinc/64/49/59/1030644959.db2.gz YBZFAGOCFBEEOL-LLVKDONJSA-N 2 1 343.696 4.015 20 0 EIADMP CCOc1ccccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398026962 1030687158 /nfs/dbraw/zinc/68/71/58/1030687158.db2.gz CPJUQOZVXCPTBP-WIYYLYMNSA-N 2 1 338.495 4.086 20 0 EIADMP CCOc1ccccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398026962 1030687170 /nfs/dbraw/zinc/68/71/70/1030687170.db2.gz CPJUQOZVXCPTBP-WIYYLYMNSA-N 2 1 338.495 4.086 20 0 EIADMP CC[N@H+](Cc1cc(F)ccc1F)CC1CCN(c2ccccn2)CC1 ZINC000530757294 1030705534 /nfs/dbraw/zinc/70/55/34/1030705534.db2.gz WTZQUQFMISWZGF-UHFFFAOYSA-N 2 1 345.437 4.098 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000398141016 1030711452 /nfs/dbraw/zinc/71/14/52/1030711452.db2.gz MKDMZWFOSIQGRI-UTKZUKDTSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000398141016 1030711472 /nfs/dbraw/zinc/71/14/72/1030711472.db2.gz MKDMZWFOSIQGRI-UTKZUKDTSA-N 2 1 333.479 4.168 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cc2cnccc2o1 ZINC000657968523 1030713484 /nfs/dbraw/zinc/71/34/84/1030713484.db2.gz AVYDFSDXBNKYKE-JYJNAYRXSA-N 2 1 327.472 4.131 20 0 EIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cc2cnccc2o1 ZINC000657968523 1030713500 /nfs/dbraw/zinc/71/35/00/1030713500.db2.gz AVYDFSDXBNKYKE-JYJNAYRXSA-N 2 1 327.472 4.131 20 0 EIADMP CCOC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000658002439 1030770405 /nfs/dbraw/zinc/77/04/05/1030770405.db2.gz CMWNTDKEHJUUNP-CBNMVNINSA-N 2 1 344.543 4.224 20 0 EIADMP CCOC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000658002439 1030770430 /nfs/dbraw/zinc/77/04/30/1030770430.db2.gz CMWNTDKEHJUUNP-CBNMVNINSA-N 2 1 344.543 4.224 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(CNCc3ccncc3Cl)cc2)C1 ZINC000527639459 1030791382 /nfs/dbraw/zinc/79/13/82/1030791382.db2.gz DQKBMNNYNQAWEP-INIZCTEOSA-N 2 1 343.902 4.257 20 0 EIADMP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccncc3Cl)cc2)C1 ZINC000527639459 1030791402 /nfs/dbraw/zinc/79/14/02/1030791402.db2.gz DQKBMNNYNQAWEP-INIZCTEOSA-N 2 1 343.902 4.257 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]Cc3ccncc3Cl)cc2)C1 ZINC000527639459 1030791423 /nfs/dbraw/zinc/79/14/23/1030791423.db2.gz DQKBMNNYNQAWEP-INIZCTEOSA-N 2 1 343.902 4.257 20 0 EIADMP CC[C@@H](CCc1ccccc1)[NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1 ZINC000527853423 1030875611 /nfs/dbraw/zinc/87/56/11/1030875611.db2.gz UKIORBXCPOYYIJ-FQEVSTJZSA-N 2 1 334.467 4.077 20 0 EIADMP COCc1csc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)c1 ZINC000658208474 1030882229 /nfs/dbraw/zinc/88/22/29/1030882229.db2.gz IBZNNJAEQOUMNM-BEFAXECRSA-N 2 1 336.545 4.027 20 0 EIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCc3ccc(O)cc32)CC1 ZINC000658242564 1030900683 /nfs/dbraw/zinc/90/06/83/1030900683.db2.gz ZXVSECYLLURXMR-NQERJWCQSA-N 2 1 328.500 4.012 20 0 EIADMP COc1cccc(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000531188851 1030953325 /nfs/dbraw/zinc/95/33/25/1030953325.db2.gz NHTAQWYUPAQRTH-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000531188851 1030953347 /nfs/dbraw/zinc/95/33/47/1030953347.db2.gz NHTAQWYUPAQRTH-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000531188851 1030953363 /nfs/dbraw/zinc/95/33/63/1030953363.db2.gz NHTAQWYUPAQRTH-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP COc1cccc(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000531188851 1030953378 /nfs/dbraw/zinc/95/33/78/1030953378.db2.gz NHTAQWYUPAQRTH-RXVVDRJESA-N 2 1 338.495 4.180 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cncs1 ZINC000658319532 1030978847 /nfs/dbraw/zinc/97/88/47/1030978847.db2.gz FYEQZJAXPOQXRL-SJLPKXTDSA-N 2 1 341.524 4.096 20 0 EIADMP c1ccc(C[N@@H+]2C[C@@H](C[NH2+][C@@H]3CCCSCC3)C3(CCC3)C2)cc1 ZINC000658318857 1030979147 /nfs/dbraw/zinc/97/91/47/1030979147.db2.gz SYJIGFXSIYEVLD-WOJBJXKFSA-N 2 1 344.568 4.164 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc3cccnc32)C[C@H]1c1ccccc1 ZINC000340213240 1031189313 /nfs/dbraw/zinc/18/93/13/1031189313.db2.gz VDTBZFZNZFNWFT-SFTDATJTSA-N 2 1 331.463 4.160 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cccc3cccnc32)C[C@H]1c1ccccc1 ZINC000340213240 1031189335 /nfs/dbraw/zinc/18/93/35/1031189335.db2.gz VDTBZFZNZFNWFT-SFTDATJTSA-N 2 1 331.463 4.160 20 0 EIADMP COc1cccc(C[N@@H+](C2CCC(C)CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001168205432 1031271680 /nfs/dbraw/zinc/27/16/80/1031271680.db2.gz BNQAZPOQRQPFBB-YAEFEIELSA-N 2 1 330.516 4.346 20 0 EIADMP COc1cc(C[NH+]2CCC(Cc3[nH+]ccn3C)CC2)cc2ccccc21 ZINC000449030913 1031367522 /nfs/dbraw/zinc/36/75/22/1031367522.db2.gz VVFFYHAAZIWAQF-UHFFFAOYSA-N 2 1 349.478 4.037 20 0 EIADMP Clc1ccc(C2=CC[C@H]([NH2+]C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000449071777 1031425431 /nfs/dbraw/zinc/42/54/31/1031425431.db2.gz ONRBCPMEJHMDPU-SFHVURJKSA-N 2 1 330.903 4.492 20 0 EIADMP CCCC[NH+]1CCC([NH2+]Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000449098328 1031441544 /nfs/dbraw/zinc/44/15/44/1031441544.db2.gz ISYLVBPAQINMEZ-UHFFFAOYSA-N 2 1 347.503 4.303 20 0 EIADMP CCC[C@H]([NH2+]CC1CC[NH+](Cc2nc(C)c(C)o2)CC1)C1CCCC1 ZINC000449128845 1031465697 /nfs/dbraw/zinc/46/56/97/1031465697.db2.gz YNTXYUQRMKBXFN-FQEVSTJZSA-N 2 1 347.547 4.452 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+](C)C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000531677321 1031469094 /nfs/dbraw/zinc/46/90/94/1031469094.db2.gz OQWSYAMYYOCVRO-MRXNPFEDSA-N 2 1 330.447 4.007 20 0 EIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)C1CCOCC1 ZINC000531682127 1031474858 /nfs/dbraw/zinc/47/48/58/1031474858.db2.gz HNOMNZUCSCQWCA-AVRDEDQJSA-N 2 1 344.543 4.356 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3ccc(C)cc32)c1 ZINC000123946043 1031496486 /nfs/dbraw/zinc/49/64/86/1031496486.db2.gz CXZWFBYNEISKJW-OAQYLSRUSA-N 2 1 338.495 4.450 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000531715397 1031501592 /nfs/dbraw/zinc/50/15/92/1031501592.db2.gz ZOOLAGCFLCYWSC-GDBMZVCRSA-N 2 1 326.937 4.142 20 0 EIADMP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000453053220 1031544468 /nfs/dbraw/zinc/54/44/68/1031544468.db2.gz FLVNAEBVDANNMJ-LJQANCHMSA-N 2 1 337.511 4.047 20 0 EIADMP COCC1CCC([NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000449216236 1031549544 /nfs/dbraw/zinc/54/95/44/1031549544.db2.gz QQJAFAMENNRVIF-YOLZPYMBSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1[nH]c2ccccc2c1C1CC[NH+](CC[C@H]2CCC[N@@H+]2C)CC1 ZINC000124972030 1031563788 /nfs/dbraw/zinc/56/37/88/1031563788.db2.gz LOCHTFBFMMFGRK-GOSISDBHSA-N 2 1 325.500 4.140 20 0 EIADMP CN(Cc1ccccn1)[C@H]1CCC[N@@H+](Cc2cccc3ccoc32)CC1 ZINC000449264332 1031602703 /nfs/dbraw/zinc/60/27/03/1031602703.db2.gz LNMOAVNTUHBVED-NRFANRHFSA-N 2 1 349.478 4.314 20 0 EIADMP C[N@H+](Cc1ccccn1)[C@H]1CCC[NH+](Cc2cccc3ccoc32)CC1 ZINC000449264332 1031602714 /nfs/dbraw/zinc/60/27/14/1031602714.db2.gz LNMOAVNTUHBVED-NRFANRHFSA-N 2 1 349.478 4.314 20 0 EIADMP C[N@@H+](Cc1ccccn1)[C@H]1CCC[NH+](Cc2cccc3ccoc32)CC1 ZINC000449264332 1031602722 /nfs/dbraw/zinc/60/27/22/1031602722.db2.gz LNMOAVNTUHBVED-NRFANRHFSA-N 2 1 349.478 4.314 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@H+](Cc2cccc3ccoc32)CC1 ZINC000449264332 1031602728 /nfs/dbraw/zinc/60/27/28/1031602728.db2.gz LNMOAVNTUHBVED-NRFANRHFSA-N 2 1 349.478 4.314 20 0 EIADMP C[NH+](Cc1ccccn1)[C@H]1CCC[N@@H+](Cc2cccc3ccoc32)CC1 ZINC000449264332 1031602739 /nfs/dbraw/zinc/60/27/39/1031602739.db2.gz LNMOAVNTUHBVED-NRFANRHFSA-N 2 1 349.478 4.314 20 0 EIADMP COCC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000449307339 1031613512 /nfs/dbraw/zinc/61/35/12/1031613512.db2.gz OVWKZTLCBXVKBG-CBNMVNINSA-N 2 1 344.543 4.082 20 0 EIADMP COCC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000449307339 1031613533 /nfs/dbraw/zinc/61/35/33/1031613533.db2.gz OVWKZTLCBXVKBG-CBNMVNINSA-N 2 1 344.543 4.082 20 0 EIADMP CC[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000453234217 1031754868 /nfs/dbraw/zinc/75/48/68/1031754868.db2.gz ZQBOSQKDUWOVQR-NHCUHLMSSA-N 2 1 337.511 4.423 20 0 EIADMP CC[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000453234217 1031754903 /nfs/dbraw/zinc/75/49/03/1031754903.db2.gz ZQBOSQKDUWOVQR-NHCUHLMSSA-N 2 1 337.511 4.423 20 0 EIADMP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453256132 1031780534 /nfs/dbraw/zinc/78/05/34/1031780534.db2.gz QQBARDLRMJOYEQ-RBBKRZOGSA-N 2 1 337.511 4.425 20 0 EIADMP CSCC1CCC([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000453268484 1031794113 /nfs/dbraw/zinc/79/41/13/1031794113.db2.gz KJOZAAPVMYVJLJ-DXBWTPJFSA-N 2 1 332.557 4.333 20 0 EIADMP CSCC1CCC([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000453268484 1031794118 /nfs/dbraw/zinc/79/41/18/1031794118.db2.gz KJOZAAPVMYVJLJ-DXBWTPJFSA-N 2 1 332.557 4.333 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCO[C@H](C(C)C)C2)cc1 ZINC000449494200 1031803261 /nfs/dbraw/zinc/80/32/61/1031803261.db2.gz MYYCQYRZLNEFBW-MDKPJZGXSA-N 2 1 341.499 4.283 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cccc(COc2ccccc2)c1 ZINC000531939388 1031851216 /nfs/dbraw/zinc/85/12/16/1031851216.db2.gz DMTRBAVYMWBLFY-KGVIQGDOSA-N 2 1 338.495 4.084 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(NC2CC[NH+](C3CC3)CC2)cc1 ZINC000459344582 1031863124 /nfs/dbraw/zinc/86/31/24/1031863124.db2.gz NXZKXOZBZHKYNV-KRWDZBQOSA-N 2 1 327.516 4.100 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000453346493 1031872707 /nfs/dbraw/zinc/87/27/07/1031872707.db2.gz KJUNJEBNFSURMU-MMNRESRNSA-N 2 1 334.891 4.077 20 0 EIADMP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453346493 1031872710 /nfs/dbraw/zinc/87/27/10/1031872710.db2.gz KJUNJEBNFSURMU-MMNRESRNSA-N 2 1 334.891 4.077 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCn1cc[nH+]c1C ZINC000531964861 1031883642 /nfs/dbraw/zinc/88/36/42/1031883642.db2.gz ZTVCVBLWTUSSMQ-CQSZACIVSA-N 2 1 340.496 4.283 20 0 EIADMP CCC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531972395 1031910699 /nfs/dbraw/zinc/91/06/99/1031910699.db2.gz OBLIUZGOOVTXOM-YOEHRIQHSA-N 2 1 328.422 4.478 20 0 EIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(OC(F)(F)F)cc1 ZINC000453375540 1031923319 /nfs/dbraw/zinc/92/33/19/1031923319.db2.gz XWAYQRWTFORZLG-UCMJJCQDSA-N 2 1 342.405 4.251 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000531980845 1031924325 /nfs/dbraw/zinc/92/43/25/1031924325.db2.gz WOLAVFKONUKRRB-IPYPFGDCSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000531980845 1031924338 /nfs/dbraw/zinc/92/43/38/1031924338.db2.gz WOLAVFKONUKRRB-IPYPFGDCSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000531980845 1031924353 /nfs/dbraw/zinc/92/43/53/1031924353.db2.gz WOLAVFKONUKRRB-IPYPFGDCSA-N 2 1 347.503 4.391 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000531980845 1031924362 /nfs/dbraw/zinc/92/43/62/1031924362.db2.gz WOLAVFKONUKRRB-IPYPFGDCSA-N 2 1 347.503 4.391 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cccc(OC(F)(F)F)c1 ZINC000453399170 1031934224 /nfs/dbraw/zinc/93/42/24/1031934224.db2.gz KZQLVTCRNSHBBP-CYBMUJFWSA-N 2 1 330.394 4.110 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)[C@H](C)c1nc2ccccc2s1 ZINC000453417580 1031951165 /nfs/dbraw/zinc/95/11/65/1031951165.db2.gz XVEGFGIYBKHQFZ-GJZGRUSLSA-N 2 1 331.529 4.252 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccccc1OC(F)(F)F ZINC000453418665 1031952040 /nfs/dbraw/zinc/95/20/40/1031952040.db2.gz YPYJMNSLYIUWPI-CYBMUJFWSA-N 2 1 330.394 4.110 20 0 EIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000453393767 1031961350 /nfs/dbraw/zinc/96/13/50/1031961350.db2.gz GHAMIVATZACCES-VHDGCEQUSA-N 2 1 326.937 4.358 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+]C[C@@H]3C(C)=CCC[C@H]3C)CC2)oc1C ZINC000134186314 1031995277 /nfs/dbraw/zinc/99/52/77/1031995277.db2.gz RDOAYLQZCNPGCZ-OXQOHEQNSA-N 2 1 345.531 4.085 20 0 EIADMP Cc1ccc(-c2nc(C[NH2+]CCCC[N@H+](C)C3CC3)cs2)cc1 ZINC000453590204 1032037454 /nfs/dbraw/zinc/03/74/54/1032037454.db2.gz AZDLBQBNKMVQIM-UHFFFAOYSA-N 2 1 329.513 4.083 20 0 EIADMP Clc1ccc2cccnc2c1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000512768574 1033892810 /nfs/dbraw/zinc/89/28/10/1033892810.db2.gz FDBRAISRDJILLP-INIZCTEOSA-N 2 1 343.902 4.196 20 0 EIADMP Clc1ccc2cccnc2c1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000512768574 1033892819 /nfs/dbraw/zinc/89/28/19/1033892819.db2.gz FDBRAISRDJILLP-INIZCTEOSA-N 2 1 343.902 4.196 20 0 EIADMP C[C@H](C[NH2+]Cc1c(OC(F)F)ccc2ccccc21)C[NH+]1CCCC1 ZINC000513068415 1034480046 /nfs/dbraw/zinc/48/00/46/1034480046.db2.gz GRZYDKLXKNZIEI-OAHLLOKOSA-N 2 1 348.437 4.263 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc3c2NCCC3)c1 ZINC000894205677 1034704356 /nfs/dbraw/zinc/70/43/56/1034704356.db2.gz ALIKIZIQCOYCIT-UHFFFAOYSA-N 2 1 337.511 4.175 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000513216686 1034833531 /nfs/dbraw/zinc/83/35/31/1034833531.db2.gz GWTBOYIXNDELRX-BTHPGYMESA-N 2 1 332.557 4.303 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000513216686 1034833533 /nfs/dbraw/zinc/83/35/33/1034833533.db2.gz GWTBOYIXNDELRX-BTHPGYMESA-N 2 1 332.557 4.303 20 0 EIADMP COCc1ccccc1/C=C(\C)C[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000509921695 1034850301 /nfs/dbraw/zinc/85/03/01/1034850301.db2.gz BBCLHUXFOWCZPX-BQUCVHFLSA-N 2 1 344.543 4.481 20 0 EIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000414170132 1035055618 /nfs/dbraw/zinc/05/56/18/1035055618.db2.gz BRWLMMLYWXWXTK-GJZGRUSLSA-N 2 1 342.499 4.426 20 0 EIADMP c1cc(CCC[N@@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cs1 ZINC000420301648 1035502764 /nfs/dbraw/zinc/50/27/64/1035502764.db2.gz ARBIWFLXENFELI-GOSISDBHSA-N 2 1 346.565 4.387 20 0 EIADMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2nc(-c3ccccc3Cl)cs2)C1 ZINC000420303716 1035504431 /nfs/dbraw/zinc/50/44/31/1035504431.db2.gz DAJVVVUVSDZXSM-ZDUSSCGKSA-N 2 1 335.904 4.024 20 0 EIADMP Cc1nc([C@H](C)[N@H+]2CCC[C@@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420319111 1035514307 /nfs/dbraw/zinc/51/43/07/1035514307.db2.gz XDBOUXCEDPHRDM-GJZGRUSLSA-N 2 1 347.890 4.425 20 0 EIADMP c1sc(C2CCCCC2)nc1C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000420332629 1035530095 /nfs/dbraw/zinc/53/00/95/1035530095.db2.gz GQLAVDBCOGZGLC-GOSISDBHSA-N 2 1 333.545 4.155 20 0 EIADMP CSCC1(CC[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000595064446 1035544241 /nfs/dbraw/zinc/54/42/41/1035544241.db2.gz BBSPGTWTCAAAJT-OAHLLOKOSA-N 2 1 329.513 4.365 20 0 EIADMP C[C@@H](C[N@H+]1CCC[C@H]([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501951056 1035752636 /nfs/dbraw/zinc/75/26/36/1035752636.db2.gz OBQYKHKYSRXORP-YOEHRIQHSA-N 2 1 328.422 4.225 20 0 EIADMP Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000571380350 1036034851 /nfs/dbraw/zinc/03/48/51/1036034851.db2.gz IPAXKICDKUKXEN-MDNUFGMLSA-N 2 1 349.522 4.170 20 0 EIADMP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)C1 ZINC000571700905 1036130173 /nfs/dbraw/zinc/13/01/73/1036130173.db2.gz BOEPSEZGMPATGM-OAGGEKHMSA-N 2 1 345.487 4.186 20 0 EIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)s1 ZINC000414505842 1036188091 /nfs/dbraw/zinc/18/80/91/1036188091.db2.gz VLOXQWUEKYYQFG-GOEBONIOSA-N 2 1 349.931 4.284 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+]CC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000588177469 1036285524 /nfs/dbraw/zinc/28/55/24/1036285524.db2.gz URZSMQFYERNVGD-UHFFFAOYSA-N 2 1 343.298 4.089 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+]CC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000588177469 1036285531 /nfs/dbraw/zinc/28/55/31/1036285531.db2.gz URZSMQFYERNVGD-UHFFFAOYSA-N 2 1 343.298 4.089 20 0 EIADMP CC[N@H+](CCC1CC[NH+](Cc2nc3c(o2)CCCC3)CC1)CC(C)C ZINC001168413086 1036576840 /nfs/dbraw/zinc/57/68/40/1036576840.db2.gz FXBCAUFSYAOQFE-UHFFFAOYSA-N 2 1 347.547 4.133 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2nc3c(o2)CCCC3)CC1)CC(C)C ZINC001168413086 1036576854 /nfs/dbraw/zinc/57/68/54/1036576854.db2.gz FXBCAUFSYAOQFE-UHFFFAOYSA-N 2 1 347.547 4.133 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2cccc(COC)c2)CC1)CC(C)C ZINC001168413945 1036796222 /nfs/dbraw/zinc/79/62/22/1036796222.db2.gz MJOYWDOGAILFAA-UHFFFAOYSA-N 2 1 346.559 4.413 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cc3ccc(F)cc3[nH]2)C1 ZINC000486689703 1036816618 /nfs/dbraw/zinc/81/66/18/1036816618.db2.gz PGAPNTYSZYXKNU-IYBDPMFKSA-N 2 1 331.479 4.155 20 0 EIADMP Cc1ccccc1C[N@@H+]1CCCN(c2cc[nH+]c3cc(F)ccc32)CC1 ZINC000603493208 1036866804 /nfs/dbraw/zinc/86/68/04/1036866804.db2.gz NELHRSSRVODUAM-UHFFFAOYSA-N 2 1 349.453 4.395 20 0 EIADMP Cc1ccccc1C[N@H+]1CCCN(c2cc[nH+]c3cc(F)ccc32)CC1 ZINC000603493208 1036866810 /nfs/dbraw/zinc/86/68/10/1036866810.db2.gz NELHRSSRVODUAM-UHFFFAOYSA-N 2 1 349.453 4.395 20 0 EIADMP CCCC[N@@H+](CCCN1CC[NH+](C(C)C)CC1)[C@@H](C)c1ccc(C)o1 ZINC000669688942 1036891783 /nfs/dbraw/zinc/89/17/83/1036891783.db2.gz GGASWIXUOBEAFH-FQEVSTJZSA-N 2 1 349.563 4.167 20 0 EIADMP CC[N@H+](Cc1nc2ccccc2s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999657 1036918802 /nfs/dbraw/zinc/91/88/02/1036918802.db2.gz QNXDDHJKYZNFSY-UHFFFAOYSA-N 2 1 339.508 4.380 20 0 EIADMP CC[N@@H+](Cc1nc2ccccc2s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999657 1036918825 /nfs/dbraw/zinc/91/88/25/1036918825.db2.gz QNXDDHJKYZNFSY-UHFFFAOYSA-N 2 1 339.508 4.380 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000271737666 1036999538 /nfs/dbraw/zinc/99/95/38/1036999538.db2.gz PRZQLSUXAKLTQQ-LLVKDONJSA-N 2 1 330.303 4.099 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000271742246 1037003299 /nfs/dbraw/zinc/00/32/99/1037003299.db2.gz QLBLMUSTWUUYTN-QWRGUYRKSA-N 2 1 341.286 4.067 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)oc1C ZINC000669699103 1037017701 /nfs/dbraw/zinc/01/77/01/1037017701.db2.gz HKBRCQWTEDSGDM-XLIONFOSSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000669699103 1037017719 /nfs/dbraw/zinc/01/77/19/1037017719.db2.gz HKBRCQWTEDSGDM-XLIONFOSSA-N 2 1 326.484 4.459 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271902762 1037047535 /nfs/dbraw/zinc/04/75/35/1037047535.db2.gz VXFQGOVNUZZHKS-ZDUSSCGKSA-N 2 1 345.487 4.170 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2coc(-c3ccc(F)cc3)n2)CC1 ZINC000590786286 1037167213 /nfs/dbraw/zinc/16/72/13/1037167213.db2.gz NBSYGRNBVRNTDL-UHFFFAOYSA-N 2 1 345.462 4.033 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCCOc2cccc(Cl)c2)CC1 ZINC000590786378 1037167748 /nfs/dbraw/zinc/16/77/48/1037167748.db2.gz UOMSATUSYNSQJA-UHFFFAOYSA-N 2 1 338.923 4.161 20 0 EIADMP Cc1ccc(C)c(OCCC[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1 ZINC000590818876 1037185431 /nfs/dbraw/zinc/18/54/31/1037185431.db2.gz FERRTRJLZVWAKG-UHFFFAOYSA-N 2 1 332.532 4.125 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)s1 ZINC000573018197 1037230416 /nfs/dbraw/zinc/23/04/16/1037230416.db2.gz DJVINNMBEMOSKJ-FQEVSTJZSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)s1 ZINC000573018197 1037230441 /nfs/dbraw/zinc/23/04/41/1037230441.db2.gz DJVINNMBEMOSKJ-FQEVSTJZSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)s1 ZINC000573018197 1037230478 /nfs/dbraw/zinc/23/04/78/1037230478.db2.gz DJVINNMBEMOSKJ-FQEVSTJZSA-N 2 1 326.509 4.155 20 0 EIADMP Cc1ccc2cc[nH+]c(NCC3CC[NH+](Cc4ccncc4)CC3)c2c1 ZINC000664284409 1037312100 /nfs/dbraw/zinc/31/21/00/1037312100.db2.gz QOPBEFMWQCSJLS-UHFFFAOYSA-N 2 1 346.478 4.262 20 0 EIADMP Cc1ccc(-c2ncc(C[NH2+]CCC[NH+]3CCC(C)CC3)s2)cc1 ZINC000604414664 1037382537 /nfs/dbraw/zinc/38/25/37/1037382537.db2.gz JPPLUTLEHUGCMW-UHFFFAOYSA-N 2 1 343.540 4.330 20 0 EIADMP Cc1csc([C@H](C)C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000273470315 1037474123 /nfs/dbraw/zinc/47/41/23/1037474123.db2.gz RXDDCUHYKATPNV-JTDSTZFVSA-N 2 1 343.540 4.055 20 0 EIADMP CC(C)(C)[C@H]1C[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC000488423320 1037578243 /nfs/dbraw/zinc/57/82/43/1037578243.db2.gz WMNRYTSGQLCEHA-RTBURBONSA-N 2 1 332.557 4.161 20 0 EIADMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2cc(-c3ccccc3C)ccc2OC)C1 ZINC000414656147 1037692985 /nfs/dbraw/zinc/69/29/85/1037692985.db2.gz MNCQLCOINRZZCL-SFHVURJKSA-N 2 1 338.495 4.102 20 0 EIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cc(-c3ccccc3C)ccc2OC)C1 ZINC000414656147 1037692992 /nfs/dbraw/zinc/69/29/92/1037692992.db2.gz MNCQLCOINRZZCL-SFHVURJKSA-N 2 1 338.495 4.102 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCSc2ccccc2)C1 ZINC000605151022 1037693181 /nfs/dbraw/zinc/69/31/81/1037693181.db2.gz ZBNXNYDZWXHKGP-MOPGFXCFSA-N 2 1 332.557 4.365 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCSc2ccccc2)C1 ZINC000605151022 1037693193 /nfs/dbraw/zinc/69/31/93/1037693193.db2.gz ZBNXNYDZWXHKGP-MOPGFXCFSA-N 2 1 332.557 4.365 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCSc2ccccc2)C1 ZINC000605151022 1037693203 /nfs/dbraw/zinc/69/32/03/1037693203.db2.gz ZBNXNYDZWXHKGP-MOPGFXCFSA-N 2 1 332.557 4.365 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCSc2ccccc2)C1 ZINC000605151022 1037693211 /nfs/dbraw/zinc/69/32/11/1037693211.db2.gz ZBNXNYDZWXHKGP-MOPGFXCFSA-N 2 1 332.557 4.365 20 0 EIADMP CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)cc1OCC ZINC000422751100 1037825845 /nfs/dbraw/zinc/82/58/45/1037825845.db2.gz FDKWSUWNPMNXGM-KYNGSXCRSA-N 2 1 340.467 4.279 20 0 EIADMP COc1cccc([C@H]([NH2+][C@@H](C)C[C@H](C)[NH3+])c2ccccc2Cl)c1 ZINC000422783218 1037833072 /nfs/dbraw/zinc/83/30/72/1037833072.db2.gz NTIHPEXMOXJJGU-NJSLBKSFSA-N 2 1 332.875 4.153 20 0 EIADMP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000422801909 1037835807 /nfs/dbraw/zinc/83/58/07/1037835807.db2.gz COECIXQKVGXKCO-MNOVXSKESA-N 2 1 343.418 4.044 20 0 EIADMP Cc1nc(-c2ccc([C@@H](C)[NH2+][C@H](C)c3c[nH+]ccc3N)cc2)cs1 ZINC000422810746 1037837983 /nfs/dbraw/zinc/83/79/83/1037837983.db2.gz UTOPXWJYMIIFMM-CHWSQXEVSA-N 2 1 338.480 4.338 20 0 EIADMP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(OC(F)(F)F)cc1 ZINC000422813897 1037839459 /nfs/dbraw/zinc/83/94/59/1037839459.db2.gz YXAPRZZAIYTMPI-GOPGUHFVSA-N 2 1 336.357 4.381 20 0 EIADMP CC[N@@H+](Cc1ccc(-c2ccccc2OC)cc1)[C@@H]1CCC[NH2+]CC1 ZINC000414712456 1037911725 /nfs/dbraw/zinc/91/17/25/1037911725.db2.gz IXUMQCMFGMCKFO-HXUWFJFHSA-N 2 1 338.495 4.326 20 0 EIADMP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]C1CC(c2ccc(F)c(Cl)c2)C1 ZINC000423094862 1037954008 /nfs/dbraw/zinc/95/40/08/1037954008.db2.gz CXCWWUBUCLDGQJ-DSRYFRGISA-N 2 1 346.877 4.273 20 0 EIADMP [NH3+][C@@H]1CCC[C@H]1[NH2+]C[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423125921 1037977560 /nfs/dbraw/zinc/97/75/60/1037977560.db2.gz IMMHZPPTEPZQCR-VAMGGRTRSA-N 2 1 344.886 4.067 20 0 EIADMP CC[N@@H+](Cc1ccc(Oc2cccnc2)c(C)c1)[C@@H]1CCC[NH2+]CC1 ZINC000414720189 1038002105 /nfs/dbraw/zinc/00/21/05/1038002105.db2.gz XLLXKIFZYSJGIF-LJQANCHMSA-N 2 1 339.483 4.146 20 0 EIADMP C[C@H]([NH2+]CC1CCC(F)(F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000503906430 1038007595 /nfs/dbraw/zinc/00/75/95/1038007595.db2.gz ZKOOACSSMHPGAJ-LPHOPBHVSA-N 2 1 336.470 4.312 20 0 EIADMP CC[C@H](C[NH2+][C@@H](c1ccc(OC)cc1)[C@@H]1CCC[NH2+]1)CC(F)(F)F ZINC000423174914 1038031712 /nfs/dbraw/zinc/03/17/12/1038031712.db2.gz DAPCRHYZNUFUFU-JQFCIGGWSA-N 2 1 344.421 4.057 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000503951588 1038042812 /nfs/dbraw/zinc/04/28/12/1038042812.db2.gz FXNFZTUSRCLBFV-PGRDOPGGSA-N 2 1 347.506 4.211 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cccc2[nH]ccc21 ZINC000503951588 1038042830 /nfs/dbraw/zinc/04/28/30/1038042830.db2.gz FXNFZTUSRCLBFV-PGRDOPGGSA-N 2 1 347.506 4.211 20 0 EIADMP CC(C)[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423193276 1038050578 /nfs/dbraw/zinc/05/05/78/1038050578.db2.gz WVIROEBVLKWGRJ-LJQANCHMSA-N 2 1 331.891 4.202 20 0 EIADMP C[C@H]([NH2+]C[C@H]([NH3+])C1CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000423311350 1038106382 /nfs/dbraw/zinc/10/63/82/1038106382.db2.gz BWKODGGMDFRMSG-SDBXPKJASA-N 2 1 340.311 4.112 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000423356671 1038172527 /nfs/dbraw/zinc/17/25/27/1038172527.db2.gz RBSSQOBAVIGSIL-NLSFWIRASA-N 2 1 349.522 4.146 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000423356671 1038172555 /nfs/dbraw/zinc/17/25/55/1038172555.db2.gz RBSSQOBAVIGSIL-NLSFWIRASA-N 2 1 349.522 4.146 20 0 EIADMP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(F)cc1Br ZINC000423375795 1038204852 /nfs/dbraw/zinc/20/48/52/1038204852.db2.gz IWKJHMKIYTVBPC-LLVKDONJSA-N 2 1 349.247 4.042 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000490070172 1038330194 /nfs/dbraw/zinc/33/01/94/1038330194.db2.gz WRCXGXISGHLADO-IAGOWNOFSA-N 2 1 347.572 4.076 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000490070172 1038330215 /nfs/dbraw/zinc/33/02/15/1038330215.db2.gz WRCXGXISGHLADO-IAGOWNOFSA-N 2 1 347.572 4.076 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000490070172 1038330228 /nfs/dbraw/zinc/33/02/28/1038330228.db2.gz WRCXGXISGHLADO-IAGOWNOFSA-N 2 1 347.572 4.076 20 0 EIADMP C[C@@H](c1ccccc1Br)[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000490296176 1038448895 /nfs/dbraw/zinc/44/88/95/1038448895.db2.gz DAIDTGWHCNMIOH-QWHCGFSZSA-N 2 1 334.261 4.113 20 0 EIADMP C[N@@H+](Cc1ccccc1)[C@@H]1CCN(c2cc[nH+]c3cc(F)ccc32)C1 ZINC000608092838 1038603322 /nfs/dbraw/zinc/60/33/22/1038603322.db2.gz PUQXSJKEBGMKHF-GOSISDBHSA-N 2 1 335.426 4.085 20 0 EIADMP CC[N@@H+](CCC1CC[NH+]([C@H](C)c2ccc(F)nc2)CC1)CC1CC1 ZINC001168423921 1038610628 /nfs/dbraw/zinc/61/06/28/1038610628.db2.gz RWADSDUYNXPVRS-MRXNPFEDSA-N 2 1 333.495 4.116 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1Cl ZINC000539052650 1038800186 /nfs/dbraw/zinc/80/01/86/1038800186.db2.gz NXEMFGUBIGTKKJ-JKSUJKDBSA-N 2 1 338.923 4.367 20 0 EIADMP C[C@@H]([NH2+]CCCN(C)Cc1ccccc1)c1nccc2ccccc21 ZINC000554997529 1038821062 /nfs/dbraw/zinc/82/10/62/1038821062.db2.gz MTNMRKOSCXTKIO-GOSISDBHSA-N 2 1 333.479 4.408 20 0 EIADMP C[C@@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1nccc2ccccc21 ZINC000554997529 1038821063 /nfs/dbraw/zinc/82/10/63/1038821063.db2.gz MTNMRKOSCXTKIO-GOSISDBHSA-N 2 1 333.479 4.408 20 0 EIADMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1nccc2ccccc21 ZINC000554997529 1038821064 /nfs/dbraw/zinc/82/10/64/1038821064.db2.gz MTNMRKOSCXTKIO-GOSISDBHSA-N 2 1 333.479 4.408 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2nc3ccccc3o2)CC1)CC(C)C ZINC000539099133 1038836877 /nfs/dbraw/zinc/83/68/77/1038836877.db2.gz XFESXMMRPJQVSO-UHFFFAOYSA-N 2 1 343.515 4.408 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000504927758 1038857010 /nfs/dbraw/zinc/85/70/10/1038857010.db2.gz UESBNPCWUKTUSI-KGLIPLIRSA-N 2 1 340.433 4.414 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@@H]1C ZINC000537616536 1038889242 /nfs/dbraw/zinc/88/92/42/1038889242.db2.gz PHXBAZPBNWAIHE-GXTWGEPZSA-N 2 1 346.849 4.246 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@@H]1C ZINC000537616536 1038889244 /nfs/dbraw/zinc/88/92/44/1038889244.db2.gz PHXBAZPBNWAIHE-GXTWGEPZSA-N 2 1 346.849 4.246 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@@H]1C ZINC000537616536 1038889247 /nfs/dbraw/zinc/88/92/47/1038889247.db2.gz PHXBAZPBNWAIHE-GXTWGEPZSA-N 2 1 346.849 4.246 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)C[C@@H]1C ZINC000537616536 1038889248 /nfs/dbraw/zinc/88/92/48/1038889248.db2.gz PHXBAZPBNWAIHE-GXTWGEPZSA-N 2 1 346.849 4.246 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000537616144 1038896996 /nfs/dbraw/zinc/89/69/96/1038896996.db2.gz YFTQYIZAJRGKSX-WBMJQRKESA-N 2 1 332.385 4.007 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000537616144 1038897001 /nfs/dbraw/zinc/89/70/01/1038897001.db2.gz YFTQYIZAJRGKSX-WBMJQRKESA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000537616144 1038897003 /nfs/dbraw/zinc/89/70/03/1038897003.db2.gz YFTQYIZAJRGKSX-WBMJQRKESA-N 2 1 332.385 4.007 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(F)cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000537616144 1038897005 /nfs/dbraw/zinc/89/70/05/1038897005.db2.gz YFTQYIZAJRGKSX-WBMJQRKESA-N 2 1 332.385 4.007 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CCc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000462104072 1038909490 /nfs/dbraw/zinc/90/94/90/1038909490.db2.gz JONLIIFIIAHOBE-PTUXOGIPSA-N 2 1 336.523 4.303 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CCc2ccccc2)Cc2ccccc2)CC[N@H+]1C ZINC000462104072 1038909511 /nfs/dbraw/zinc/90/95/11/1038909511.db2.gz JONLIIFIIAHOBE-PTUXOGIPSA-N 2 1 336.523 4.303 20 0 EIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)C1CCC([NH+](C)C)CC1 ZINC001168329551 1038953426 /nfs/dbraw/zinc/95/34/26/1038953426.db2.gz XRKSKHMTLTYQSN-UHFFFAOYSA-N 2 1 328.422 4.400 20 0 EIADMP C[C@@H]([NH2+]CCC[NH+]1CCC(O)CC1)c1ccc(C2CCCCC2)cc1 ZINC000481177800 1039078430 /nfs/dbraw/zinc/07/84/30/1039078430.db2.gz VFWKOPQCCVRFLF-GOSISDBHSA-N 2 1 344.543 4.232 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000688 1039293675 /nfs/dbraw/zinc/29/36/75/1039293675.db2.gz IQXGHXSNVQBBMJ-CABCVRRESA-N 2 1 328.422 4.430 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000688 1039293699 /nfs/dbraw/zinc/29/36/99/1039293699.db2.gz IQXGHXSNVQBBMJ-CABCVRRESA-N 2 1 328.422 4.430 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](CCc2ccccc2)Cc2ccccc2)C1 ZINC000481324778 1039296071 /nfs/dbraw/zinc/29/60/71/1039296071.db2.gz RXLGEGRTTKDYGV-XZOQPEGZSA-N 2 1 336.523 4.162 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+]C[C@@H](C)C[NH+]3CCCC3)c(C)c2c1 ZINC000481327464 1039300699 /nfs/dbraw/zinc/30/06/99/1039300699.db2.gz IDNRCQZAEDOSRZ-ZBFHGGJFSA-N 2 1 330.472 4.132 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](CC)c2cccc(C)c2)[C@H](C)C1 ZINC000552244525 1039311253 /nfs/dbraw/zinc/31/12/53/1039311253.db2.gz DEYJCPYKLAQTFD-GIVPXCGWSA-N 2 1 332.532 4.173 20 0 EIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@@H+](CC)C1 ZINC000481339685 1039318779 /nfs/dbraw/zinc/31/87/79/1039318779.db2.gz QZXOQCIGDRZKGU-GDBMZVCRSA-N 2 1 326.937 4.142 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cccc(OC3CCCC3)c2)C[C@H]1C ZINC000537634895 1039340035 /nfs/dbraw/zinc/34/00/35/1039340035.db2.gz YIJWXQGPPRYHIS-IEBWSBKVSA-N 2 1 330.516 4.313 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(OC3CCCC3)c2)C[C@H]1C ZINC000537634895 1039340090 /nfs/dbraw/zinc/34/00/90/1039340090.db2.gz YIJWXQGPPRYHIS-IEBWSBKVSA-N 2 1 330.516 4.313 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(OC3CCCC3)c2)C[C@H]1C ZINC000537634895 1039340106 /nfs/dbraw/zinc/34/01/06/1039340106.db2.gz YIJWXQGPPRYHIS-IEBWSBKVSA-N 2 1 330.516 4.313 20 0 EIADMP c1ccc2c(C[N@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)ccnc2c1 ZINC000534350618 1039341701 /nfs/dbraw/zinc/34/17/01/1039341701.db2.gz SQMUPVTVVXRTJI-LJQANCHMSA-N 2 1 337.511 4.323 20 0 EIADMP c1ccc2c(C[N@@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)ccnc2c1 ZINC000534350618 1039341721 /nfs/dbraw/zinc/34/17/21/1039341721.db2.gz SQMUPVTVVXRTJI-LJQANCHMSA-N 2 1 337.511 4.323 20 0 EIADMP c1ccc2c(C[N@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)ccnc2c1 ZINC000534350617 1039343258 /nfs/dbraw/zinc/34/32/58/1039343258.db2.gz SQMUPVTVVXRTJI-IBGZPJMESA-N 2 1 337.511 4.323 20 0 EIADMP c1ccc2c(C[N@@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)ccnc2c1 ZINC000534350617 1039343275 /nfs/dbraw/zinc/34/32/75/1039343275.db2.gz SQMUPVTVVXRTJI-IBGZPJMESA-N 2 1 337.511 4.323 20 0 EIADMP C[C@@]1(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000555606102 1039433903 /nfs/dbraw/zinc/43/39/03/1039433903.db2.gz FTTLJMLMPLKVGT-GOTSBHOMSA-N 2 1 334.507 4.434 20 0 EIADMP CCOCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000514103470 1039610162 /nfs/dbraw/zinc/61/01/62/1039610162.db2.gz CIONWXYZOWWFHF-BHDDXSALSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@H](CCc1ccccc1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434688795 1039813022 /nfs/dbraw/zinc/81/30/22/1039813022.db2.gz PRYZYUGEAUOGHS-GOSISDBHSA-N 2 1 337.511 4.420 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H](CO)C2CCCCC2)cc1 ZINC000550898344 1039818141 /nfs/dbraw/zinc/81/81/41/1039818141.db2.gz XHPJBKLYMSLUCL-JXFKEZNVSA-N 2 1 341.499 4.020 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H](CO)C2CCCCC2)cc1 ZINC000550898346 1039819559 /nfs/dbraw/zinc/81/95/59/1039819559.db2.gz XHPJBKLYMSLUCL-OXQOHEQNSA-N 2 1 341.499 4.020 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc(F)cc3)CC2)C[C@@H]1c1ccccc1 ZINC000551006693 1039868925 /nfs/dbraw/zinc/86/89/25/1039868925.db2.gz IISIIFPBGRWMBW-NHCUHLMSSA-N 2 1 338.470 4.282 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(c3ccc(F)cc3)CC2)C[C@@H]1c1ccccc1 ZINC000551006693 1039868929 /nfs/dbraw/zinc/86/89/29/1039868929.db2.gz IISIIFPBGRWMBW-NHCUHLMSSA-N 2 1 338.470 4.282 20 0 EIADMP Clc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)o1 ZINC000537658147 1039869139 /nfs/dbraw/zinc/86/91/39/1039869139.db2.gz BPGMJWLEJXYSDI-UHFFFAOYSA-N 2 1 344.886 4.421 20 0 EIADMP Clc1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)o1 ZINC000537658147 1039869143 /nfs/dbraw/zinc/86/91/43/1039869143.db2.gz BPGMJWLEJXYSDI-UHFFFAOYSA-N 2 1 344.886 4.421 20 0 EIADMP Cc1ccc(OCCC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551029566 1039886837 /nfs/dbraw/zinc/88/68/37/1039886837.db2.gz KCUJOOBLRJDYPF-IFMALSPDSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1ccc(OCCC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551029566 1039886838 /nfs/dbraw/zinc/88/68/38/1039886838.db2.gz KCUJOOBLRJDYPF-IFMALSPDSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1ccc(OCCC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551029568 1039887345 /nfs/dbraw/zinc/88/73/45/1039887345.db2.gz KCUJOOBLRJDYPF-RBBKRZOGSA-N 2 1 338.495 4.189 20 0 EIADMP Cc1ccc(OCCC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551029568 1039887348 /nfs/dbraw/zinc/88/73/48/1039887348.db2.gz KCUJOOBLRJDYPF-RBBKRZOGSA-N 2 1 338.495 4.189 20 0 EIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)Cc2ccccc2C(F)(F)F)C1 ZINC000481925960 1039902454 /nfs/dbraw/zinc/90/24/54/1039902454.db2.gz NPJTUSBBKCEGNF-HZPDHXFCSA-N 2 1 342.449 4.346 20 0 EIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc(C(F)(F)F)ccc2F)CC1 ZINC000535083016 1039918854 /nfs/dbraw/zinc/91/88/54/1039918854.db2.gz SDOWXWJVGLRHFX-UHFFFAOYSA-N 2 1 346.412 4.397 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(C(F)(F)F)ccc2F)CC1 ZINC000535083016 1039918879 /nfs/dbraw/zinc/91/88/79/1039918879.db2.gz SDOWXWJVGLRHFX-UHFFFAOYSA-N 2 1 346.412 4.397 20 0 EIADMP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@H](C)CC[NH+](C)C ZINC000481976089 1039925288 /nfs/dbraw/zinc/92/52/88/1039925288.db2.gz XYTFXDCAPHFMIG-CABCVRRESA-N 2 1 331.529 4.033 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCOc2ccccc2Cl)C[C@H]1c1ccccc1 ZINC000551086044 1039969329 /nfs/dbraw/zinc/96/93/29/1039969329.db2.gz MCAMXBXRQNTZNA-MJGOQNOKSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCOc2ccccc2Cl)C[C@H]1c1ccccc1 ZINC000551086044 1039969354 /nfs/dbraw/zinc/96/93/54/1039969354.db2.gz MCAMXBXRQNTZNA-MJGOQNOKSA-N 2 1 344.886 4.144 20 0 EIADMP CC1=CCC[C@H](C)[C@@H]1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000435057811 1040036262 /nfs/dbraw/zinc/03/62/62/1040036262.db2.gz CPBSXWLIWJJWBT-FXAWDEMLSA-N 2 1 327.516 4.391 20 0 EIADMP Fc1ccc(/C=C\C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000435058315 1040037583 /nfs/dbraw/zinc/03/75/83/1040037583.db2.gz MGNXWZQTEJATMT-ARJAWSKDSA-N 2 1 339.458 4.251 20 0 EIADMP c1[nH+]c(C2CC[NH+](C[C@H]3C[C@@H]3c3ccccc3)CC2)n2c1CCCC2 ZINC000435059466 1040039595 /nfs/dbraw/zinc/03/95/95/1040039595.db2.gz PKHKKSPSKQUKKT-TZIWHRDSSA-N 2 1 335.495 4.203 20 0 EIADMP C[C@H]1C[C@@H]1c1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)o1 ZINC000435062036 1040040541 /nfs/dbraw/zinc/04/05/41/1040040541.db2.gz WIPBGNZPCHKIPR-KXBFYZLASA-N 2 1 339.483 4.315 20 0 EIADMP CCOC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCC1 ZINC000551264832 1040123212 /nfs/dbraw/zinc/12/32/12/1040123212.db2.gz OJWSHOUSPXFTFP-WKCHPHFGSA-N 2 1 342.527 4.121 20 0 EIADMP CC(C)N(CC[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(C)C ZINC000551268067 1040129939 /nfs/dbraw/zinc/12/99/39/1040129939.db2.gz YLRBGFFZCJPODF-UHFFFAOYSA-N 2 1 345.575 4.138 20 0 EIADMP CC(C)[NH+](CC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C(C)C ZINC000551268067 1040129955 /nfs/dbraw/zinc/12/99/55/1040129955.db2.gz YLRBGFFZCJPODF-UHFFFAOYSA-N 3 1 345.575 4.138 20 0 EIADMP CC(C)[NH+](CC[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(C)C ZINC000551268067 1040129972 /nfs/dbraw/zinc/12/99/72/1040129972.db2.gz YLRBGFFZCJPODF-UHFFFAOYSA-N 3 1 345.575 4.138 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000551273214 1040140531 /nfs/dbraw/zinc/14/05/31/1040140531.db2.gz VFVYEWZFCSNSIK-QQUTXWOLSA-N 2 1 334.507 4.290 20 0 EIADMP CCOC[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(C)C ZINC000551279886 1040142385 /nfs/dbraw/zinc/14/23/85/1040142385.db2.gz KRNHUUYWOOFYCP-XVAXZDLZSA-N 2 1 332.532 4.080 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000482336223 1040185980 /nfs/dbraw/zinc/18/59/80/1040185980.db2.gz RVECHZWGPGIUIM-GJZGRUSLSA-N 2 1 328.422 4.476 20 0 EIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)C1 ZINC000482355198 1040197113 /nfs/dbraw/zinc/19/71/13/1040197113.db2.gz FKRXCVUQOCIMEU-GJZGRUSLSA-N 2 1 344.421 4.356 20 0 EIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc3ccccc3)C1)CC2 ZINC000482436778 1040244310 /nfs/dbraw/zinc/24/43/10/1040244310.db2.gz JKFZVVXQHNJRHN-REWPJTCUSA-N 2 1 334.507 4.137 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc(F)c1 ZINC000482442762 1040250289 /nfs/dbraw/zinc/25/02/89/1040250289.db2.gz XCIACAPNNAVCIN-IEBWSBKVSA-N 2 1 326.459 4.041 20 0 EIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+][C@@H](Cc3ccccc3)C3CC3)C2)cc1 ZINC000482452130 1040263580 /nfs/dbraw/zinc/26/35/80/1040263580.db2.gz ABHIMGHYFMWALQ-VWNXMTODSA-N 2 1 348.534 4.162 20 0 EIADMP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCc2c1cc(Br)cc2Cl ZINC000535509422 1040312865 /nfs/dbraw/zinc/31/28/65/1040312865.db2.gz ZRVGIZTWZSSSTH-BMIGLBTASA-N 2 1 345.712 4.020 20 0 EIADMP Cc1ccccc1[C@@H](CC(C)C)[NH2+]CC1([NH+]2CCCC2)CCOCC1 ZINC000482562187 1040352046 /nfs/dbraw/zinc/35/20/46/1040352046.db2.gz TWCVJIHKKUYZLX-OAQYLSRUSA-N 2 1 344.543 4.317 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCCSCc2ccccc2)CC1 ZINC000535584100 1040386282 /nfs/dbraw/zinc/38/62/82/1040386282.db2.gz BYKKIYBXIKXVAS-UHFFFAOYSA-N 2 1 334.573 4.362 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1 ZINC000479468654 1040393093 /nfs/dbraw/zinc/39/30/93/1040393093.db2.gz ZFMWULRPQZTNRE-ZBFHGGJFSA-N 2 1 348.412 4.277 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)c(F)c(F)c1 ZINC000479468654 1040393105 /nfs/dbraw/zinc/39/31/05/1040393105.db2.gz ZFMWULRPQZTNRE-ZBFHGGJFSA-N 2 1 348.412 4.277 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000551533796 1040392915 /nfs/dbraw/zinc/39/29/15/1040392915.db2.gz QOCIATXHKCPLEQ-PILAGYSTSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC[N@H+]1C ZINC000551533796 1040392925 /nfs/dbraw/zinc/39/29/25/1040392925.db2.gz QOCIATXHKCPLEQ-PILAGYSTSA-N 2 1 340.433 4.414 20 0 EIADMP CC[N@H+]1CC[C@H](NCc2cnc(-c3ccc(Cl)cc3)s2)[C@H](C)C1 ZINC000551537064 1040396516 /nfs/dbraw/zinc/39/65/16/1040396516.db2.gz ZTASCQSZKNNQHE-DYVFJYSZSA-N 2 1 349.931 4.283 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)[C@H](C)C1 ZINC000551537064 1040396532 /nfs/dbraw/zinc/39/65/32/1040396532.db2.gz ZTASCQSZKNNQHE-DYVFJYSZSA-N 2 1 349.931 4.283 20 0 EIADMP CC(C)COc1ccc(C(C)(C)C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000482643064 1040405045 /nfs/dbraw/zinc/40/50/45/1040405045.db2.gz ODJBWYZZBYIQOU-PKOBYXMFSA-N 2 1 332.532 4.071 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(C)cc(C)c2)[C@H](C)C1 ZINC000482647706 1040406748 /nfs/dbraw/zinc/40/67/48/1040406748.db2.gz BMAQCEUHBIJGKV-DYXWJJEUSA-N 2 1 332.532 4.091 20 0 EIADMP C[C@@H]([NH2+]C1CC(N2CCCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000479542055 1040446353 /nfs/dbraw/zinc/44/63/53/1040446353.db2.gz NRKOROVTXPASJD-NVPAJSRCSA-N 2 1 326.406 4.373 20 0 EIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000479542055 1040446363 /nfs/dbraw/zinc/44/63/63/1040446363.db2.gz NRKOROVTXPASJD-NVPAJSRCSA-N 2 1 326.406 4.373 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccccc1F ZINC000479561981 1040472211 /nfs/dbraw/zinc/47/22/11/1040472211.db2.gz WIVNWVIFVDGKTB-XMSQKQJNSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccccc1F ZINC000479561981 1040472221 /nfs/dbraw/zinc/47/22/21/1040472221.db2.gz WIVNWVIFVDGKTB-XMSQKQJNSA-N 2 1 340.486 4.259 20 0 EIADMP CCO[C@@H]1C[C@@H]([NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)C1(C)C ZINC000539497147 1040486158 /nfs/dbraw/zinc/48/61/58/1040486158.db2.gz XQJDQAJIWZGALS-PWIZWCRZSA-N 2 1 330.516 4.005 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000482808297 1040502579 /nfs/dbraw/zinc/50/25/79/1040502579.db2.gz CKHONPKHYUHQHQ-HOCLYGCPSA-N 2 1 336.907 4.091 20 0 EIADMP COc1cc(Cl)ccc1C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000482808297 1040502598 /nfs/dbraw/zinc/50/25/98/1040502598.db2.gz CKHONPKHYUHQHQ-HOCLYGCPSA-N 2 1 336.907 4.091 20 0 EIADMP C([NH2+]C1CCC2(CCCC2)CC1)C1([NH+]2CCCCC2)CCOCC1 ZINC000515257038 1040612597 /nfs/dbraw/zinc/61/25/97/1040612597.db2.gz QCUSQQBUFHICIZ-UHFFFAOYSA-N 2 1 334.548 4.114 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)CCCc1c[nH+]cn1C ZINC000568168912 1040635844 /nfs/dbraw/zinc/63/58/44/1040635844.db2.gz VZWQXWANJWABMB-ZDUSSCGKSA-N 2 1 325.378 4.065 20 0 EIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CCCc1c[nH+]cn1C ZINC000568168912 1040635854 /nfs/dbraw/zinc/63/58/54/1040635854.db2.gz VZWQXWANJWABMB-ZDUSSCGKSA-N 2 1 325.378 4.065 20 0 EIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](CC(c2ccccc2)c2ccccc2)C1 ZINC000508857198 1040654019 /nfs/dbraw/zinc/65/40/19/1040654019.db2.gz CSQKTYYSKXYIST-NRFANRHFSA-N 2 1 348.534 4.482 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC000508857198 1040654035 /nfs/dbraw/zinc/65/40/35/1040654035.db2.gz CSQKTYYSKXYIST-NRFANRHFSA-N 2 1 348.534 4.482 20 0 EIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC000508857198 1040654052 /nfs/dbraw/zinc/65/40/52/1040654052.db2.gz CSQKTYYSKXYIST-NRFANRHFSA-N 2 1 348.534 4.482 20 0 EIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cc3ccncc3s2)C1 ZINC000667560866 1040679167 /nfs/dbraw/zinc/67/91/67/1040679167.db2.gz DTBMXQMJEWIRCQ-DLBZAZTESA-N 2 1 343.540 4.383 20 0 EIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cc3ccncc3s2)C1 ZINC000667560866 1040679188 /nfs/dbraw/zinc/67/91/88/1040679188.db2.gz DTBMXQMJEWIRCQ-DLBZAZTESA-N 2 1 343.540 4.383 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cc3ccncc3s2)C1 ZINC000667560866 1040679201 /nfs/dbraw/zinc/67/92/01/1040679201.db2.gz DTBMXQMJEWIRCQ-DLBZAZTESA-N 2 1 343.540 4.383 20 0 EIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cc3ccncc3s2)C1 ZINC000667560866 1040679234 /nfs/dbraw/zinc/67/92/34/1040679234.db2.gz DTBMXQMJEWIRCQ-DLBZAZTESA-N 2 1 343.540 4.383 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000483179000 1040745118 /nfs/dbraw/zinc/74/51/18/1040745118.db2.gz AXSOMXGPNVMJSA-FFGOWVMKSA-N 2 1 332.557 4.161 20 0 EIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000483179000 1040745134 /nfs/dbraw/zinc/74/51/34/1040745134.db2.gz AXSOMXGPNVMJSA-FFGOWVMKSA-N 2 1 332.557 4.161 20 0 EIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@H]1C ZINC000539820934 1040816641 /nfs/dbraw/zinc/81/66/41/1040816641.db2.gz MABFMRKCGFJNEY-MJGOQNOKSA-N 2 1 348.531 4.035 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@H]1C ZINC000539820934 1040816648 /nfs/dbraw/zinc/81/66/48/1040816648.db2.gz MABFMRKCGFJNEY-MJGOQNOKSA-N 2 1 348.531 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@H]1C ZINC000539820934 1040816652 /nfs/dbraw/zinc/81/66/52/1040816652.db2.gz MABFMRKCGFJNEY-MJGOQNOKSA-N 2 1 348.531 4.035 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(OC)c(OCC(C)C)c2)C[C@H]1C ZINC000539820934 1040816658 /nfs/dbraw/zinc/81/66/58/1040816658.db2.gz MABFMRKCGFJNEY-MJGOQNOKSA-N 2 1 348.531 4.035 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@H]1C ZINC000539838135 1040819064 /nfs/dbraw/zinc/81/90/64/1040819064.db2.gz LAWFABGJPQUATP-WBVHZDCISA-N 2 1 340.458 4.209 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@H]1C ZINC000539838135 1040819069 /nfs/dbraw/zinc/81/90/69/1040819069.db2.gz LAWFABGJPQUATP-WBVHZDCISA-N 2 1 340.458 4.209 20 0 EIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@H]1C ZINC000539838135 1040819075 /nfs/dbraw/zinc/81/90/75/1040819075.db2.gz LAWFABGJPQUATP-WBVHZDCISA-N 2 1 340.458 4.209 20 0 EIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cnc(-c3ccc(C)cc3)s2)[C@@H](C)C1 ZINC000539835705 1040829203 /nfs/dbraw/zinc/82/92/03/1040829203.db2.gz PAMZFRRVIUKVTQ-QFBILLFUSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cnc(-c3ccc(C)cc3)s2)[C@@H](C)C1 ZINC000539835705 1040829219 /nfs/dbraw/zinc/82/92/19/1040829219.db2.gz PAMZFRRVIUKVTQ-QFBILLFUSA-N 2 1 343.540 4.281 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cnc(-c3ccc(C)cc3)s2)[C@@H](C)C1 ZINC000539835705 1040829221 /nfs/dbraw/zinc/82/92/21/1040829221.db2.gz PAMZFRRVIUKVTQ-QFBILLFUSA-N 2 1 343.540 4.281 20 0 EIADMP C[C@H]1CCCC[N@H+]1CCCNCc1ccc(CSC(F)F)o1 ZINC000237505876 1040847584 /nfs/dbraw/zinc/84/75/84/1040847584.db2.gz CYMNLTHZUBYKHR-ZDUSSCGKSA-N 2 1 332.460 4.090 20 0 EIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCCc4c(O)cccc43)CC2)C1 ZINC000483430728 1040852922 /nfs/dbraw/zinc/85/29/22/1040852922.db2.gz XGORLEZUZHZQCL-PLMTUMEDSA-N 2 1 342.527 4.402 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000483472229 1040869383 /nfs/dbraw/zinc/86/93/83/1040869383.db2.gz JXRLRQRQQOEODL-UNEWFSDZSA-N 2 1 342.405 4.062 20 0 EIADMP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000483472229 1040869387 /nfs/dbraw/zinc/86/93/87/1040869387.db2.gz JXRLRQRQQOEODL-UNEWFSDZSA-N 2 1 342.405 4.062 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000483483453 1040873265 /nfs/dbraw/zinc/87/32/65/1040873265.db2.gz NNFKUGPRECHSNE-UNEWFSDZSA-N 2 1 326.406 4.183 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000483483453 1040873275 /nfs/dbraw/zinc/87/32/75/1040873275.db2.gz NNFKUGPRECHSNE-UNEWFSDZSA-N 2 1 326.406 4.183 20 0 EIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000483483453 1040873277 /nfs/dbraw/zinc/87/32/77/1040873277.db2.gz NNFKUGPRECHSNE-UNEWFSDZSA-N 2 1 326.406 4.183 20 0 EIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(OC)cc2)CC1)CC1CC1 ZINC000539957228 1040944265 /nfs/dbraw/zinc/94/42/65/1040944265.db2.gz ICWLSNGNSQADQI-UHFFFAOYSA-N 2 1 330.516 4.029 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000483725998 1040977678 /nfs/dbraw/zinc/97/76/78/1040977678.db2.gz IZQQMJQWVLASAP-YDHLFZDLSA-N 2 1 346.462 4.474 20 0 EIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000483725998 1040977709 /nfs/dbraw/zinc/97/77/09/1040977709.db2.gz IZQQMJQWVLASAP-YDHLFZDLSA-N 2 1 346.462 4.474 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]CC2(CCOC)CCCCC2)c1 ZINC000436234924 1041003834 /nfs/dbraw/zinc/00/38/34/1041003834.db2.gz ZOPNRHUCGNMSMO-UHFFFAOYSA-N 2 1 332.532 4.215 20 0 EIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCOC1CCCCC1 ZINC000480161057 1041017189 /nfs/dbraw/zinc/01/71/89/1041017189.db2.gz QQCCWXVBJBAORJ-UGKGYDQZSA-N 2 1 344.543 4.226 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCOC1CCCCC1 ZINC000480161057 1041017194 /nfs/dbraw/zinc/01/71/94/1041017194.db2.gz QQCCWXVBJBAORJ-UGKGYDQZSA-N 2 1 344.543 4.226 20 0 EIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436282147 1041027694 /nfs/dbraw/zinc/02/76/94/1041027694.db2.gz QJNZACHVZSAAFW-LBPRGKRZSA-N 2 1 334.813 4.180 20 0 EIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000436282147 1041027700 /nfs/dbraw/zinc/02/77/00/1041027700.db2.gz QJNZACHVZSAAFW-LBPRGKRZSA-N 2 1 334.813 4.180 20 0 EIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1cnn(Cc2ccccc2)c1)C(C)C ZINC000483859250 1041045558 /nfs/dbraw/zinc/04/55/58/1041045558.db2.gz XOKFAKMZWIMXMP-LJQANCHMSA-N 2 1 342.531 4.091 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1cccnc1 ZINC000538116497 1041049490 /nfs/dbraw/zinc/04/94/90/1041049490.db2.gz LBVMBCFTTNZXOD-COPCDDAFSA-N 2 1 337.511 4.421 20 0 EIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1cccnc1 ZINC000538116497 1041049503 /nfs/dbraw/zinc/04/95/03/1041049503.db2.gz LBVMBCFTTNZXOD-COPCDDAFSA-N 2 1 337.511 4.421 20 0 EIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)C1 ZINC000462889310 1041050255 /nfs/dbraw/zinc/05/02/55/1041050255.db2.gz SJINKFOZHFMYAK-IRXDYDNUSA-N 2 1 327.516 4.156 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CC[C@@H]2CCCC[N@@H+]2C)ccc1OC(C)C ZINC000538154817 1041098699 /nfs/dbraw/zinc/09/86/99/1041098699.db2.gz MTNAIKQHBRTUQQ-AEFFLSMTSA-N 2 1 334.504 4.007 20 0 EIADMP COc1cc([C@@H](C)[NH2+]CC[C@@H]2CCCC[N@H+]2C)ccc1OC(C)C ZINC000538154817 1041098719 /nfs/dbraw/zinc/09/87/19/1041098719.db2.gz MTNAIKQHBRTUQQ-AEFFLSMTSA-N 2 1 334.504 4.007 20 0 EIADMP CC(C)CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000480268467 1041137973 /nfs/dbraw/zinc/13/79/73/1041137973.db2.gz UTCQMNMGZMUQID-QGZVFWFLSA-N 2 1 330.516 4.389 20 0 EIADMP C[C@H]1C[C@@H]([NH2+]CCc2ccc(Oc3ccc(F)cc3)cc2)CC[N@H+]1C ZINC000540140579 1041160792 /nfs/dbraw/zinc/16/07/92/1041160792.db2.gz PCYQAEVBTZYWLR-LPHOPBHVSA-N 2 1 342.458 4.233 20 0 EIADMP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)CCC2 ZINC000540148315 1041162440 /nfs/dbraw/zinc/16/24/40/1041162440.db2.gz YVPQNKRDNLQWPH-UTKZUKDTSA-N 2 1 330.516 4.030 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1sccc1Br ZINC000540167468 1041209601 /nfs/dbraw/zinc/20/96/01/1041209601.db2.gz ZHHBAWZBPUKNSX-MNOVXSKESA-N 2 1 342.306 4.002 20 0 EIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]C[C@@H](c2ccccc2)C(C)C)[C@H](C)C1 ZINC000480331505 1041218016 /nfs/dbraw/zinc/21/80/16/1041218016.db2.gz HBIHUOZWCJGSGI-FCEUIQTBSA-N 2 1 346.559 4.153 20 0 EIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCC1 ZINC000540163761 1041227110 /nfs/dbraw/zinc/22/71/10/1041227110.db2.gz JQNRLHHFLQVDPH-CXAGYDPISA-N 2 1 341.326 4.345 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000667663587 1041229081 /nfs/dbraw/zinc/22/90/81/1041229081.db2.gz QSOQHEPXODHSDN-SFHVURJKSA-N 2 1 341.524 4.036 20 0 EIADMP COC1(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CCCCC1 ZINC000480342633 1041231046 /nfs/dbraw/zinc/23/10/46/1041231046.db2.gz HYWCDTXUWUOHPM-AEFFLSMTSA-N 2 1 336.545 4.070 20 0 EIADMP COC1(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CCCCC1 ZINC000480342633 1041231056 /nfs/dbraw/zinc/23/10/56/1041231056.db2.gz HYWCDTXUWUOHPM-AEFFLSMTSA-N 2 1 336.545 4.070 20 0 EIADMP C[C@@H]([NH2+]C1(C[NH2+][C@H]2CCC23CCOCC3)CCCC1)c1ccccc1 ZINC000554559548 1041244614 /nfs/dbraw/zinc/24/46/14/1041244614.db2.gz DFEYIPKKNDJOLT-QUCCMNQESA-N 2 1 342.527 4.199 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000667667650 1041251528 /nfs/dbraw/zinc/25/15/28/1041251528.db2.gz SEFBPYKHSRADQA-KSSFIOAISA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000667667650 1041251542 /nfs/dbraw/zinc/25/15/42/1041251542.db2.gz SEFBPYKHSRADQA-KSSFIOAISA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000667667650 1041251558 /nfs/dbraw/zinc/25/15/58/1041251558.db2.gz SEFBPYKHSRADQA-KSSFIOAISA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ncsc1-c1ccc(C[N@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000667667650 1041251575 /nfs/dbraw/zinc/25/15/75/1041251575.db2.gz SEFBPYKHSRADQA-KSSFIOAISA-N 2 1 329.513 4.033 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)o1 ZINC000484496302 1041302704 /nfs/dbraw/zinc/30/27/04/1041302704.db2.gz HGGIDRGDQFUQRD-AWQBJMPUSA-N 2 1 326.484 4.395 20 0 EIADMP Cc1ccc([C@@H](C)[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)o1 ZINC000484496302 1041302723 /nfs/dbraw/zinc/30/27/23/1041302723.db2.gz HGGIDRGDQFUQRD-AWQBJMPUSA-N 2 1 326.484 4.395 20 0 EIADMP Cc1cccc(OCC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463072628 1041319127 /nfs/dbraw/zinc/31/91/27/1041319127.db2.gz RAKDZKVTZMFKDX-FPOVZHCZSA-N 2 1 338.495 4.017 20 0 EIADMP Cc1cccc(OCC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463072628 1041319140 /nfs/dbraw/zinc/31/91/40/1041319140.db2.gz RAKDZKVTZMFKDX-FPOVZHCZSA-N 2 1 338.495 4.017 20 0 EIADMP C[N@@H+]1CC=C(C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000538408255 1041325347 /nfs/dbraw/zinc/32/53/47/1041325347.db2.gz DDYMHXRTPVSPTJ-KRWDZBQOSA-N 2 1 325.283 4.296 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC2(CCC[N@@H+]2C)CC1 ZINC000540298654 1041350365 /nfs/dbraw/zinc/35/03/65/1041350365.db2.gz UOFVTFZOGHHENI-AWEZNQCLSA-N 2 1 342.405 4.206 20 0 EIADMP C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC000540298654 1041350372 /nfs/dbraw/zinc/35/03/72/1041350372.db2.gz UOFVTFZOGHHENI-AWEZNQCLSA-N 2 1 342.405 4.206 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)Oc1ccccc1 ZINC000463117280 1041357904 /nfs/dbraw/zinc/35/79/04/1041357904.db2.gz GRKOXHYCYUAQKA-SFHLNBCPSA-N 2 1 338.495 4.097 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)Oc1ccccc1 ZINC000463117280 1041357917 /nfs/dbraw/zinc/35/79/17/1041357917.db2.gz GRKOXHYCYUAQKA-SFHLNBCPSA-N 2 1 338.495 4.097 20 0 EIADMP Cc1ccc([C@H](C)C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000463133094 1041369431 /nfs/dbraw/zinc/36/94/31/1041369431.db2.gz WTHQCLIYECUCHO-HXUWFJFHSA-N 2 1 336.523 4.395 20 0 EIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000463162023 1041378146 /nfs/dbraw/zinc/37/81/46/1041378146.db2.gz JZSOVVDYWQIKTR-FGZHOGPDSA-N 2 1 335.495 4.176 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000463164548 1041380148 /nfs/dbraw/zinc/38/01/48/1041380148.db2.gz UKGLMQYTQAYZIB-COPCDDAFSA-N 2 1 334.507 4.359 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000463164548 1041380152 /nfs/dbraw/zinc/38/01/52/1041380152.db2.gz UKGLMQYTQAYZIB-COPCDDAFSA-N 2 1 334.507 4.359 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]2Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000463190113 1041406957 /nfs/dbraw/zinc/40/69/57/1041406957.db2.gz IADGPQJUGRINTR-YJSIEXFISA-N 2 1 334.507 4.260 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]2Cc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000463190113 1041406966 /nfs/dbraw/zinc/40/69/66/1041406966.db2.gz IADGPQJUGRINTR-YJSIEXFISA-N 2 1 334.507 4.260 20 0 EIADMP C[C@@H]1C[C@H](NC2(c3cccc(F)c3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000538553352 1041417155 /nfs/dbraw/zinc/41/71/55/1041417155.db2.gz DYUMVGSMGUDSCJ-DYESRHJHSA-N 2 1 338.470 4.458 20 0 EIADMP C[C@@H]1C[C@H](NC2(c3cccc(F)c3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000538553352 1041417164 /nfs/dbraw/zinc/41/71/64/1041417164.db2.gz DYUMVGSMGUDSCJ-DYESRHJHSA-N 2 1 338.470 4.458 20 0 EIADMP C[C@@H]1C[C@@H](NC2(c3cccc(F)c3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000538553356 1041417599 /nfs/dbraw/zinc/41/75/99/1041417599.db2.gz DYUMVGSMGUDSCJ-UTKZUKDTSA-N 2 1 338.470 4.458 20 0 EIADMP C[C@@H]1C[C@@H](NC2(c3cccc(F)c3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000538553356 1041417607 /nfs/dbraw/zinc/41/76/07/1041417607.db2.gz DYUMVGSMGUDSCJ-UTKZUKDTSA-N 2 1 338.470 4.458 20 0 EIADMP COc1cc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1OC ZINC000480611629 1041422525 /nfs/dbraw/zinc/42/25/25/1041422525.db2.gz OPJGOJUXXAZOIY-AEFFLSMTSA-N 2 1 348.531 4.175 20 0 EIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(-n2cccn2)cc1 ZINC000480631812 1041445262 /nfs/dbraw/zinc/44/52/62/1041445262.db2.gz QXAXBFPIROSAGF-MOPGFXCFSA-N 2 1 340.515 4.178 20 0 EIADMP CCc1nc2c(s1)[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)CCC2 ZINC000480635083 1041448612 /nfs/dbraw/zinc/44/86/12/1041448612.db2.gz VNQCFUSMPGBVKH-HZPDHXFCSA-N 2 1 335.561 4.327 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1Nc1ccc2c(c1)nc(C(C)(C)C)n2C ZINC000538627233 1041459699 /nfs/dbraw/zinc/45/96/99/1041459699.db2.gz CQXJSYYYIJEEAP-FMKPAKJESA-N 2 1 328.504 4.011 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000538627233 1041459702 /nfs/dbraw/zinc/45/97/02/1041459702.db2.gz CQXJSYYYIJEEAP-FMKPAKJESA-N 2 1 328.504 4.011 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000538627233 1041459704 /nfs/dbraw/zinc/45/97/04/1041459704.db2.gz CQXJSYYYIJEEAP-FMKPAKJESA-N 2 1 328.504 4.011 20 0 EIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000480666439 1041460175 /nfs/dbraw/zinc/46/01/75/1041460175.db2.gz IQYSWQVMNJTJNZ-CQSZACIVSA-N 2 1 334.410 4.046 20 0 EIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000480666439 1041460169 /nfs/dbraw/zinc/46/01/69/1041460169.db2.gz IQYSWQVMNJTJNZ-CQSZACIVSA-N 2 1 334.410 4.046 20 0 EIADMP C[C@H]([NH2+]C1(Cc2ccccc2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000480692504 1041476459 /nfs/dbraw/zinc/47/64/59/1041476459.db2.gz ASDBOOZMTQCQNQ-SIKLNZKXSA-N 2 1 334.507 4.262 20 0 EIADMP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1ccccc1F ZINC000480696120 1041484469 /nfs/dbraw/zinc/48/44/69/1041484469.db2.gz VSTVFWWZTLPGPD-KRWDZBQOSA-N 2 1 344.474 4.397 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)s2)CC[N@@H+]1C ZINC000538717622 1041485872 /nfs/dbraw/zinc/48/58/72/1041485872.db2.gz NWAVJXOHKLSWBX-CABCVRRESA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3F)s2)CC[N@H+]1C ZINC000538717622 1041485880 /nfs/dbraw/zinc/48/58/80/1041485880.db2.gz NWAVJXOHKLSWBX-CABCVRRESA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3F)s2)CC[NH+]1C ZINC000538717622 1041485885 /nfs/dbraw/zinc/48/58/85/1041485885.db2.gz NWAVJXOHKLSWBX-CABCVRRESA-N 2 1 332.488 4.469 20 0 EIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)s2)CC[NH+]1C ZINC000538717622 1041485891 /nfs/dbraw/zinc/48/58/91/1041485891.db2.gz NWAVJXOHKLSWBX-CABCVRRESA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[N@@H+]1C ZINC000538717701 1041487820 /nfs/dbraw/zinc/48/78/20/1041487820.db2.gz SDEGMBKCMYNOGV-HOCLYGCPSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[N@H+]1C ZINC000538717701 1041487825 /nfs/dbraw/zinc/48/78/25/1041487825.db2.gz SDEGMBKCMYNOGV-HOCLYGCPSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[NH+]1C ZINC000538717701 1041487828 /nfs/dbraw/zinc/48/78/28/1041487828.db2.gz SDEGMBKCMYNOGV-HOCLYGCPSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(F)c(-c3cccs3)c2)CC[NH+]1C ZINC000538717701 1041487835 /nfs/dbraw/zinc/48/78/35/1041487835.db2.gz SDEGMBKCMYNOGV-HOCLYGCPSA-N 2 1 332.488 4.469 20 0 EIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1c(F)cccc1F ZINC000402035856 1041513518 /nfs/dbraw/zinc/51/35/18/1041513518.db2.gz CYEQTXKRDYQTRO-HRAATJIYSA-N 2 1 344.449 4.008 20 0 EIADMP COc1ccc2ccccc2c1C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000538749408 1041520518 /nfs/dbraw/zinc/52/05/18/1041520518.db2.gz LLSWZVGXVLBDRP-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc2ccccc2c1C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000538749408 1041520526 /nfs/dbraw/zinc/52/05/26/1041520526.db2.gz LLSWZVGXVLBDRP-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP COc1ccc2ccccc2c1C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000538749408 1041520533 /nfs/dbraw/zinc/52/05/33/1041520533.db2.gz LLSWZVGXVLBDRP-GOSISDBHSA-N 2 1 338.495 4.012 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1Nc1ccc(C[NH+]2CCCC[C@@H]2C)cc1 ZINC000540699939 1041615333 /nfs/dbraw/zinc/61/53/33/1041615333.db2.gz RRMSCPHOFKVVRT-BMQTXXJKSA-N 2 1 329.532 4.202 20 0 EIADMP C[C@@H]1C[NH+](C)[C@H](C)C[C@H]1Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000540699939 1041615335 /nfs/dbraw/zinc/61/53/35/1041615335.db2.gz RRMSCPHOFKVVRT-BMQTXXJKSA-N 2 1 329.532 4.202 20 0 EIADMP C[C@@H]1C[NH+](C)[C@H](C)C[C@H]1Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000540699939 1041615337 /nfs/dbraw/zinc/61/53/37/1041615337.db2.gz RRMSCPHOFKVVRT-BMQTXXJKSA-N 2 1 329.532 4.202 20 0 EIADMP C[C@H]([NH2+]CCc1ccc(F)cc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000516802130 1041763200 /nfs/dbraw/zinc/76/32/00/1041763200.db2.gz LSPNPISOOLLEDR-QFBILLFUSA-N 2 1 344.449 4.008 20 0 EIADMP Cc1nc2ccc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)cc2s1 ZINC000516860357 1041787285 /nfs/dbraw/zinc/78/72/85/1041787285.db2.gz ZCCMAZFQQXPFOS-UHFFFAOYSA-N 2 1 331.529 4.157 20 0 EIADMP CC[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402486993 1041819144 /nfs/dbraw/zinc/81/91/44/1041819144.db2.gz ASRVHNKRKAKRDR-XYJFISCASA-N 2 1 342.449 4.465 20 0 EIADMP C[C@H](CC[NH2+][C@H](C)c1ccccc1OC(F)F)[NH+]1CCCCC1 ZINC000541558865 1042000729 /nfs/dbraw/zinc/00/07/29/1042000729.db2.gz ZLJGBHLFMNIKSL-HUUCEWRRSA-N 2 1 326.431 4.203 20 0 EIADMP C[C@@H](C[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000437982497 1042004160 /nfs/dbraw/zinc/00/41/60/1042004160.db2.gz CNOGXOCTUSXDIB-KRWDZBQOSA-N 2 1 341.474 4.173 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)CC(F)(F)F ZINC000402771433 1042028916 /nfs/dbraw/zinc/02/89/16/1042028916.db2.gz LGRWOEMYMWNVDE-ZOBUZTSGSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)CC(F)(F)F ZINC000402771433 1042028918 /nfs/dbraw/zinc/02/89/18/1042028918.db2.gz LGRWOEMYMWNVDE-ZOBUZTSGSA-N 2 1 328.422 4.218 20 0 EIADMP C[C@H](C[NH2+][C@H](c1ccccc1)c1ccc(OC(F)F)cc1)C[NH+](C)C ZINC000425943697 1042033849 /nfs/dbraw/zinc/03/38/49/1042033849.db2.gz JSMKSYOVDWNTEB-DNVCBOLYSA-N 2 1 348.437 4.165 20 0 EIADMP CC[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccn(C)n1 ZINC000541734500 1042087642 /nfs/dbraw/zinc/08/76/42/1042087642.db2.gz LNYMHALGEZCIAP-HXUWFJFHSA-N 2 1 340.515 4.037 20 0 EIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCCOc2ccc3ccccc3c2)C1 ZINC000464772671 1042166044 /nfs/dbraw/zinc/16/60/44/1042166044.db2.gz FRPFZORGQLQCKB-LJQANCHMSA-N 2 1 340.511 4.272 20 0 EIADMP C[N@@H+](Cc1cccc(Cl)c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464828938 1042185987 /nfs/dbraw/zinc/18/59/87/1042185987.db2.gz FCCBZUYEIBNMHX-IBGZPJMESA-N 2 1 328.887 4.294 20 0 EIADMP C[N@H+](Cc1cccc(Cl)c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464828938 1042185992 /nfs/dbraw/zinc/18/59/92/1042185992.db2.gz FCCBZUYEIBNMHX-IBGZPJMESA-N 2 1 328.887 4.294 20 0 EIADMP C[NH+](Cc1cccc(Cl)c1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464828938 1042185996 /nfs/dbraw/zinc/18/59/96/1042185996.db2.gz FCCBZUYEIBNMHX-IBGZPJMESA-N 2 1 328.887 4.294 20 0 EIADMP C[NH+](Cc1cccc(Cl)c1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464828938 1042186002 /nfs/dbraw/zinc/18/60/02/1042186002.db2.gz FCCBZUYEIBNMHX-IBGZPJMESA-N 2 1 328.887 4.294 20 0 EIADMP C[N@@H+](Cc1cccc(Cl)c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464828942 1042186212 /nfs/dbraw/zinc/18/62/12/1042186212.db2.gz FCCBZUYEIBNMHX-LJQANCHMSA-N 2 1 328.887 4.294 20 0 EIADMP C[N@H+](Cc1cccc(Cl)c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464828942 1042186221 /nfs/dbraw/zinc/18/62/21/1042186221.db2.gz FCCBZUYEIBNMHX-LJQANCHMSA-N 2 1 328.887 4.294 20 0 EIADMP C[NH+](Cc1cccc(Cl)c1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464828942 1042186225 /nfs/dbraw/zinc/18/62/25/1042186225.db2.gz FCCBZUYEIBNMHX-LJQANCHMSA-N 2 1 328.887 4.294 20 0 EIADMP C[NH+](Cc1cccc(Cl)c1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464828942 1042186229 /nfs/dbraw/zinc/18/62/29/1042186229.db2.gz FCCBZUYEIBNMHX-LJQANCHMSA-N 2 1 328.887 4.294 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464847135 1042194949 /nfs/dbraw/zinc/19/49/49/1042194949.db2.gz UTUIURPIHCXRCE-HJNYFJLDSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464847135 1042194954 /nfs/dbraw/zinc/19/49/54/1042194954.db2.gz UTUIURPIHCXRCE-HJNYFJLDSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1CCCC[C@@H]1OCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464847135 1042194956 /nfs/dbraw/zinc/19/49/56/1042194956.db2.gz UTUIURPIHCXRCE-HJNYFJLDSA-N 2 1 344.543 4.036 20 0 EIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H](c2cncc(F)c2)C2CC2)C1 ZINC000467371503 1042213829 /nfs/dbraw/zinc/21/38/29/1042213829.db2.gz WEHNDGLSTYQQIH-YRNRMSPPSA-N 2 1 333.495 4.020 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC2(c3cccc(F)c3F)CCCC2)[C@@H](C)C1 ZINC000426055485 1042237858 /nfs/dbraw/zinc/23/78/58/1042237858.db2.gz RTVYBQCKDDKSGR-YJBOKZPZSA-N 2 1 336.470 4.097 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC000426063599 1042240024 /nfs/dbraw/zinc/24/00/24/1042240024.db2.gz PPOGMKDSJBBIFP-VKJFTORMSA-N 2 1 336.470 4.095 20 0 EIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000506396943 1042381504 /nfs/dbraw/zinc/38/15/04/1042381504.db2.gz SWUYBEPOIHPNGX-UHFFFAOYSA-N 2 1 346.849 4.246 20 0 EIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000506396943 1042381510 /nfs/dbraw/zinc/38/15/10/1042381510.db2.gz SWUYBEPOIHPNGX-UHFFFAOYSA-N 2 1 346.849 4.246 20 0 EIADMP C[C@@H](c1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1)C(F)(F)F ZINC000295283234 1042457067 /nfs/dbraw/zinc/45/70/67/1042457067.db2.gz KTOATUIMXKWCFM-BXEVVDMOSA-N 2 1 340.433 4.409 20 0 EIADMP C[C@@H](c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1)C(F)(F)F ZINC000295283234 1042457070 /nfs/dbraw/zinc/45/70/70/1042457070.db2.gz KTOATUIMXKWCFM-BXEVVDMOSA-N 2 1 340.433 4.409 20 0 EIADMP C[C@@H](c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1)C(F)(F)F ZINC000295283234 1042457076 /nfs/dbraw/zinc/45/70/76/1042457076.db2.gz KTOATUIMXKWCFM-BXEVVDMOSA-N 2 1 340.433 4.409 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC[N@@H+]1C ZINC000439145997 1042519256 /nfs/dbraw/zinc/51/92/56/1042519256.db2.gz KQMAMDAXGJDFIX-IXPVHAAZSA-N 2 1 343.334 4.034 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC[N@H+]1C ZINC000439145997 1042519259 /nfs/dbraw/zinc/51/92/59/1042519259.db2.gz KQMAMDAXGJDFIX-IXPVHAAZSA-N 2 1 343.334 4.034 20 0 EIADMP c1c2ccccc2sc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167964036 1042548936 /nfs/dbraw/zinc/54/89/36/1042548936.db2.gz LMDSBXQUZUJEIC-AYHJJNSGSA-N 2 1 326.509 4.396 20 0 EIADMP C[C@H]([NH2+]CCCc1cccc(F)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492326082 1042614098 /nfs/dbraw/zinc/61/40/98/1042614098.db2.gz BBAFCNLNSXYOKN-GHTZIAJQSA-N 2 1 340.486 4.259 20 0 EIADMP C[C@H]([NH2+]CCCc1cccc(F)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492326084 1042614299 /nfs/dbraw/zinc/61/42/99/1042614299.db2.gz BBAFCNLNSXYOKN-RXVVDRJESA-N 2 1 340.486 4.259 20 0 EIADMP C[C@@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000492427281 1042649105 /nfs/dbraw/zinc/64/91/05/1042649105.db2.gz YRWKSXRUOHNWSJ-CZAYHTPWSA-N 2 1 344.543 4.082 20 0 EIADMP Cc1nc2ccc(C[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2s1 ZINC000426416021 1042680035 /nfs/dbraw/zinc/68/00/35/1042680035.db2.gz GENOXXYBPPVXIJ-VQIMIIECSA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[N@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2s1 ZINC000426416021 1042680042 /nfs/dbraw/zinc/68/00/42/1042680042.db2.gz GENOXXYBPPVXIJ-VQIMIIECSA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[NH+]3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc2s1 ZINC000426416021 1042680043 /nfs/dbraw/zinc/68/00/43/1042680043.db2.gz GENOXXYBPPVXIJ-VQIMIIECSA-N 2 1 341.524 4.053 20 0 EIADMP Cc1nc2ccc(C[NH+]3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc2s1 ZINC000426416021 1042680050 /nfs/dbraw/zinc/68/00/50/1042680050.db2.gz GENOXXYBPPVXIJ-VQIMIIECSA-N 2 1 341.524 4.053 20 0 EIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000506646525 1042729600 /nfs/dbraw/zinc/72/96/00/1042729600.db2.gz PMGOXYKNJRATPS-UHFFFAOYSA-N 2 1 332.488 4.470 20 0 EIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000506646525 1042729612 /nfs/dbraw/zinc/72/96/12/1042729612.db2.gz PMGOXYKNJRATPS-UHFFFAOYSA-N 2 1 332.488 4.470 20 0 EIADMP Fc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000309704199 1042818644 /nfs/dbraw/zinc/81/86/44/1042818644.db2.gz HDIAEZCQFSHNHD-MRXNPFEDSA-N 2 1 332.850 4.091 20 0 EIADMP Fc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000309704199 1042818650 /nfs/dbraw/zinc/81/86/50/1042818650.db2.gz HDIAEZCQFSHNHD-MRXNPFEDSA-N 2 1 332.850 4.091 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309752650 1042820245 /nfs/dbraw/zinc/82/02/45/1042820245.db2.gz ALUPFKUHCUTAGG-QFBILLFUSA-N 2 1 328.887 4.340 20 0 EIADMP C[C@H]([NH2+]Cc1ccccc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309752650 1042820246 /nfs/dbraw/zinc/82/02/46/1042820246.db2.gz ALUPFKUHCUTAGG-QFBILLFUSA-N 2 1 328.887 4.340 20 0 EIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@@H](C)c1ccc(C)cc1C ZINC000542465032 1042831252 /nfs/dbraw/zinc/83/12/52/1042831252.db2.gz ZQAZKIFKFATBCZ-SFHVURJKSA-N 2 1 334.467 4.386 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000177271277 1042832928 /nfs/dbraw/zinc/83/29/28/1042832928.db2.gz BCQKTQWZGYLIGF-SJORKVTESA-N 2 1 344.524 4.320 20 0 EIADMP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000177271277 1042832929 /nfs/dbraw/zinc/83/29/29/1042832929.db2.gz BCQKTQWZGYLIGF-SJORKVTESA-N 2 1 344.524 4.320 20 0 EIADMP Cc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC000310522228 1042839149 /nfs/dbraw/zinc/83/91/49/1042839149.db2.gz NVJWGIYVOVMALP-PXNSSMCTSA-N 2 1 326.459 4.134 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000311236766 1042854997 /nfs/dbraw/zinc/85/49/97/1042854997.db2.gz UILJTIOHHLKWFH-PKOBYXMFSA-N 2 1 341.474 4.174 20 0 EIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000311236766 1042855000 /nfs/dbraw/zinc/85/50/00/1042855000.db2.gz UILJTIOHHLKWFH-PKOBYXMFSA-N 2 1 341.474 4.174 20 0 EIADMP CC[C@H](NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccc(F)cn1 ZINC000493278728 1042891633 /nfs/dbraw/zinc/89/16/33/1042891633.db2.gz VKLLLNWGLQMDIF-ALKREAHSSA-N 2 1 347.503 4.406 20 0 EIADMP CC[C@H]([NH2+]C[C@H]1CCCN(C)[C@@H]1c1cccs1)c1ccc(F)cn1 ZINC000493278728 1042891638 /nfs/dbraw/zinc/89/16/38/1042891638.db2.gz VKLLLNWGLQMDIF-ALKREAHSSA-N 2 1 347.503 4.406 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(Cc2ccc(F)c(F)c2)CC1 ZINC000346036863 1042952379 /nfs/dbraw/zinc/95/23/79/1042952379.db2.gz HYBNXQLQCXEJCN-UHFFFAOYSA-N 2 1 347.453 4.205 20 0 EIADMP CCCC[N@@H+](CC)CCN[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168008113 1043032113 /nfs/dbraw/zinc/03/21/13/1043032113.db2.gz CNYGBKDWAUXVMB-VTYHHJSWSA-N 2 1 345.575 4.140 20 0 EIADMP CCCC[NH+](CC)CCN[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168008113 1043032117 /nfs/dbraw/zinc/03/21/17/1043032117.db2.gz CNYGBKDWAUXVMB-VTYHHJSWSA-N 2 1 345.575 4.140 20 0 EIADMP CCCC[NH+](CC)CCN[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168008113 1043032126 /nfs/dbraw/zinc/03/21/26/1043032126.db2.gz CNYGBKDWAUXVMB-VTYHHJSWSA-N 2 1 345.575 4.140 20 0 EIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(Oc3ccccc3)o2)C[C@@H]1C ZINC000507809882 1043042600 /nfs/dbraw/zinc/04/26/00/1043042600.db2.gz AMADFQBSMHULST-IRXDYDNUSA-N 2 1 328.456 4.377 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]C[C@@H](C)C[NH+]3CCCCC3)oc21 ZINC000391917580 1043076367 /nfs/dbraw/zinc/07/63/67/1043076367.db2.gz DHJNADBIUBIOKJ-CVEARBPZSA-N 2 1 330.472 4.214 20 0 EIADMP Cc1cncc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000184278819 1043087245 /nfs/dbraw/zinc/08/72/45/1043087245.db2.gz UWRVKOANJQPJJY-HKUYNNGSSA-N 2 1 337.511 4.473 20 0 EIADMP FC(F)(F)C1CCC(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)CC1 ZINC000185515734 1043193591 /nfs/dbraw/zinc/19/35/91/1043193591.db2.gz JDCMIQWOELRJOT-OFLPRAFFSA-N 2 1 332.454 4.305 20 0 EIADMP c1cc2c(cccc2C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)[nH]1 ZINC000311054127 1043212839 /nfs/dbraw/zinc/21/28/39/1043212839.db2.gz VKYYOCJQGKBXOZ-LJQANCHMSA-N 2 1 333.479 4.170 20 0 EIADMP Clc1ccc(CCC[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(Cl)c1 ZINC000166760821 1043312616 /nfs/dbraw/zinc/31/26/16/1043312616.db2.gz OKKRLZUSIDPCHE-HZPDHXFCSA-N 2 1 327.299 4.142 20 0 EIADMP FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000625678447 1043335763 /nfs/dbraw/zinc/33/57/63/1043335763.db2.gz CMQKFRMDLZCJSC-KDURUIRLSA-N 2 1 334.454 4.435 20 0 EIADMP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000674045619 1043346045 /nfs/dbraw/zinc/34/60/45/1043346045.db2.gz JALTULAHXGPJLL-VDGAXYAQSA-N 2 1 347.522 4.024 20 0 EIADMP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000674045619 1043346057 /nfs/dbraw/zinc/34/60/57/1043346057.db2.gz JALTULAHXGPJLL-VDGAXYAQSA-N 2 1 347.522 4.024 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1cccnc1 ZINC000520811141 1043386638 /nfs/dbraw/zinc/38/66/38/1043386638.db2.gz ASLKTBLXNZDLOL-NRFANRHFSA-N 2 1 349.522 4.146 20 0 EIADMP CC(C)(C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1cccnc1 ZINC000520811141 1043386649 /nfs/dbraw/zinc/38/66/49/1043386649.db2.gz ASLKTBLXNZDLOL-NRFANRHFSA-N 2 1 349.522 4.146 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000174992617 1043426402 /nfs/dbraw/zinc/42/64/02/1043426402.db2.gz RXWVFEUKJYKOPX-NRFANRHFSA-N 2 1 326.459 4.443 20 0 EIADMP CC(C)[N@H+](C)CCC[NH2+]Cc1c(OC(F)F)ccc2ccccc21 ZINC000520954261 1043457310 /nfs/dbraw/zinc/45/73/10/1043457310.db2.gz QIEIFIKCKSYGQL-UHFFFAOYSA-N 2 1 336.426 4.261 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1c(OC(F)F)ccc2ccccc21 ZINC000520954261 1043457314 /nfs/dbraw/zinc/45/73/14/1043457314.db2.gz QIEIFIKCKSYGQL-UHFFFAOYSA-N 2 1 336.426 4.261 20 0 EIADMP CCCCc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC000765972579 1043605078 /nfs/dbraw/zinc/60/50/78/1043605078.db2.gz BCXNEPZXYKOBRM-GCJKJVERSA-N 2 1 344.543 4.323 20 0 EIADMP CC(C)O[C@H](C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000428251059 1043695954 /nfs/dbraw/zinc/69/59/54/1043695954.db2.gz YALIBPCCQYJKHA-LEWJYISDSA-N 2 1 330.516 4.103 20 0 EIADMP COc1cccc2cc([C@H](C)[NH2+]CC[C@H](C)[NH+]3CCCCC3)oc21 ZINC000542486726 1043722847 /nfs/dbraw/zinc/72/28/47/1043722847.db2.gz LIVBICOCDLPYNU-HOTGVXAUSA-N 2 1 330.472 4.357 20 0 EIADMP Cc1c([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cnn1C(C)C ZINC000191325116 1043808917 /nfs/dbraw/zinc/80/89/17/1043808917.db2.gz OOSJFIPDGVCXJN-ROUUACIJSA-N 2 1 342.531 4.334 20 0 EIADMP Cc1c([C@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)cnn1C(C)C ZINC000191325116 1043808920 /nfs/dbraw/zinc/80/89/20/1043808920.db2.gz OOSJFIPDGVCXJN-ROUUACIJSA-N 2 1 342.531 4.334 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000442705869 1043812677 /nfs/dbraw/zinc/81/26/77/1043812677.db2.gz CEWCTJQGZHYVAP-KYJSFNMBSA-N 2 1 340.433 4.273 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000442705865 1043813302 /nfs/dbraw/zinc/81/33/02/1043813302.db2.gz CEWCTJQGZHYVAP-HFTRVMKXSA-N 2 1 340.433 4.273 20 0 EIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000442705871 1043813535 /nfs/dbraw/zinc/81/35/35/1043813535.db2.gz CEWCTJQGZHYVAP-QGPMSJSTSA-N 2 1 340.433 4.273 20 0 EIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)c2ccc(C(F)(F)F)cc2)CC[N@H+]1C ZINC000191548929 1043825723 /nfs/dbraw/zinc/82/57/23/1043825723.db2.gz MDHZUEBSKVIIJX-XJKSGUPXSA-N 2 1 328.422 4.055 20 0 EIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442773382 1043830307 /nfs/dbraw/zinc/83/03/07/1043830307.db2.gz CLULFFYLKZQREO-WBVHZDCISA-N 2 1 337.389 4.136 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@@H+]1C ZINC000442779550 1043832016 /nfs/dbraw/zinc/83/20/16/1043832016.db2.gz JEARKIFSLQDKBG-HUHSQHJXSA-N 2 1 340.433 4.414 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[N@H+]1C ZINC000442779550 1043832018 /nfs/dbraw/zinc/83/20/18/1043832018.db2.gz JEARKIFSLQDKBG-HUHSQHJXSA-N 2 1 340.433 4.414 20 0 EIADMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000442920469 1043898378 /nfs/dbraw/zinc/89/83/78/1043898378.db2.gz LMARWOSPEHTYQK-AWEZNQCLSA-N 2 1 334.410 4.002 20 0 EIADMP C[N@@H+]1CC[C@@H]2CC[NH+](CCCCc3cccc(C(F)(F)F)c3)[C@@H]2C1 ZINC000192698872 1043949893 /nfs/dbraw/zinc/94/98/93/1043949893.db2.gz PIDNNBGXKSLDQH-SJLPKXTDSA-N 2 1 340.433 4.054 20 0 EIADMP C[N@H+]1CC[C@@H]2CC[NH+](CCCCc3cccc(C(F)(F)F)c3)[C@@H]2C1 ZINC000192698872 1043949920 /nfs/dbraw/zinc/94/99/20/1043949920.db2.gz PIDNNBGXKSLDQH-SJLPKXTDSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@H+](CCCCc3cccc(C(F)(F)F)c3)[C@@H]2C1 ZINC000192698872 1043949932 /nfs/dbraw/zinc/94/99/32/1043949932.db2.gz PIDNNBGXKSLDQH-SJLPKXTDSA-N 2 1 340.433 4.054 20 0 EIADMP C[NH+]1CC[C@@H]2CC[N@@H+](CCCCc3cccc(C(F)(F)F)c3)[C@@H]2C1 ZINC000192698872 1043949947 /nfs/dbraw/zinc/94/99/47/1043949947.db2.gz PIDNNBGXKSLDQH-SJLPKXTDSA-N 2 1 340.433 4.054 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000193083094 1043998266 /nfs/dbraw/zinc/99/82/66/1043998266.db2.gz ONVNUEPEPHLNIJ-INIZCTEOSA-N 2 1 334.916 4.056 20 0 EIADMP Clc1ccsc1C[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000193083094 1043998275 /nfs/dbraw/zinc/99/82/75/1043998275.db2.gz ONVNUEPEPHLNIJ-INIZCTEOSA-N 2 1 334.916 4.056 20 0 EIADMP C[C@@H](CC[NH2+][C@@H](C)c1cc(Br)cs1)[NH+]1CCCCC1 ZINC000494749612 1044019394 /nfs/dbraw/zinc/01/93/94/1044019394.db2.gz RSWJBTNKWBTYHE-STQMWFEESA-N 2 1 345.350 4.426 20 0 EIADMP CC(C)C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195132365 1044025144 /nfs/dbraw/zinc/02/51/44/1044025144.db2.gz ADCNEPBONVTYFK-IFMALSPDSA-N 2 1 337.511 4.281 20 0 EIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCC1CCOCC1 ZINC000521834697 1044025235 /nfs/dbraw/zinc/02/52/35/1044025235.db2.gz LYQNHOJBJRFMFZ-OAQYLSRUSA-N 2 1 344.543 4.084 20 0 EIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCC1CCOCC1 ZINC000521834697 1044025253 /nfs/dbraw/zinc/02/52/53/1044025253.db2.gz LYQNHOJBJRFMFZ-OAQYLSRUSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@]1(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1(F)F ZINC000658223136 1044073510 /nfs/dbraw/zinc/07/35/10/1044073510.db2.gz SPHGYKJKOYLGLR-AKHDSKFASA-N 2 1 334.454 4.207 20 0 EIADMP C1CCC(OC2CCC([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)CC2)C1 ZINC000658229374 1044088128 /nfs/dbraw/zinc/08/81/28/1044088128.db2.gz CFTJNFQUHVYUHK-IDYZSHNDSA-N 2 1 334.548 4.253 20 0 EIADMP C1CCC(OC2CCC([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)CC2)C1 ZINC000658229374 1044088147 /nfs/dbraw/zinc/08/81/47/1044088147.db2.gz CFTJNFQUHVYUHK-IDYZSHNDSA-N 2 1 334.548 4.253 20 0 EIADMP C[NH+](C/C=C/C[N@@H+](C)CCc1cccs1)CCc1cccs1 ZINC000173759467 1044130899 /nfs/dbraw/zinc/13/08/99/1044130899.db2.gz UZKAQPHOBVPZJB-ONEGZZNKSA-N 2 1 334.554 4.015 20 0 EIADMP CC(C)[N@@H+](C)CCC[NH2+]C1CC(c2ccc(Br)cc2)C1 ZINC000226392159 1044179032 /nfs/dbraw/zinc/17/90/32/1044179032.db2.gz SLBYKXKZNPWMRL-UHFFFAOYSA-N 2 1 339.321 4.015 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cc(Br)cs1 ZINC000194025909 1044244798 /nfs/dbraw/zinc/24/47/98/1044244798.db2.gz UAXIMWRROPMYSE-WDEREUQCSA-N 2 1 342.306 4.002 20 0 EIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]CC2CCC(C(F)(F)F)CC2)C1 ZINC000466361380 1044323710 /nfs/dbraw/zinc/32/37/10/1044323710.db2.gz UWKMVHVQYOWYAJ-AQFXKWCLSA-N 2 1 334.470 4.313 20 0 EIADMP Cc1nc(C)c(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)s1 ZINC001168019135 1044339497 /nfs/dbraw/zinc/33/94/97/1044339497.db2.gz GRCVJAQLOIWPGX-HUUCEWRRSA-N 2 1 343.540 4.291 20 0 EIADMP CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000542515433 1044394855 /nfs/dbraw/zinc/39/48/55/1044394855.db2.gz YGUPKMUGHAVJQG-DLBZAZTESA-N 2 1 345.531 4.024 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)c(C)c2c1 ZINC000675752371 1044467237 /nfs/dbraw/zinc/46/72/37/1044467237.db2.gz RZXOLPJXFOKLJW-JYJNAYRXSA-N 2 1 328.456 4.027 20 0 EIADMP COc1ccc2oc([C@H](C)[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)c(C)c2c1 ZINC000675752371 1044467244 /nfs/dbraw/zinc/46/72/44/1044467244.db2.gz RZXOLPJXFOKLJW-JYJNAYRXSA-N 2 1 328.456 4.027 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000443583899 1044494098 /nfs/dbraw/zinc/49/40/98/1044494098.db2.gz QXWJOEDWPLRKMM-UAOJZALGSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000443583899 1044494110 /nfs/dbraw/zinc/49/41/10/1044494110.db2.gz QXWJOEDWPLRKMM-UAOJZALGSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000443583899 1044494125 /nfs/dbraw/zinc/49/41/25/1044494125.db2.gz QXWJOEDWPLRKMM-UAOJZALGSA-N 2 1 330.903 4.276 20 0 EIADMP Clc1cccc2c1CC[C@@H]2[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000443583899 1044494139 /nfs/dbraw/zinc/49/41/39/1044494139.db2.gz QXWJOEDWPLRKMM-UAOJZALGSA-N 2 1 330.903 4.276 20 0 EIADMP c1cncc([C@@H]2CCC[C@H]([NH2+][C@H]3CC[N@@H+](C4CCCCC4)C3)C2)c1 ZINC000657678219 1044519996 /nfs/dbraw/zinc/51/99/96/1044519996.db2.gz NXGDMGVWSFNLIM-HOJAQTOUSA-N 2 1 327.516 4.104 20 0 EIADMP c1cncc([C@@H]2CCC[C@H]([NH2+][C@H]3CC[N@H+](C4CCCCC4)C3)C2)c1 ZINC000657678219 1044520012 /nfs/dbraw/zinc/52/00/12/1044520012.db2.gz NXGDMGVWSFNLIM-HOJAQTOUSA-N 2 1 327.516 4.104 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3ncoc32)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168022570 1044523159 /nfs/dbraw/zinc/52/31/59/1044523159.db2.gz AGTBIRFPCIDJJJ-XEMDLRDOSA-N 2 1 349.478 4.359 20 0 EIADMP CCC[C@H](CCc1ccccc1)[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000675881424 1044551963 /nfs/dbraw/zinc/55/19/63/1044551963.db2.gz LCZQCDJWUIRSJE-IRLDBZIGSA-N 2 1 344.543 4.021 20 0 EIADMP CCC[C@@H](CCc1ccccc1)[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000675881425 1044553928 /nfs/dbraw/zinc/55/39/28/1044553928.db2.gz LCZQCDJWUIRSJE-RBBKRZOGSA-N 2 1 344.543 4.021 20 0 EIADMP C(=C\c1ccncc1)\C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000494963873 1044558602 /nfs/dbraw/zinc/55/86/02/1044558602.db2.gz KGHHNCICSNLYRS-HEBQJAJPSA-N 2 1 347.506 4.083 20 0 EIADMP C(=C\c1ccncc1)\C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000494963873 1044558622 /nfs/dbraw/zinc/55/86/22/1044558622.db2.gz KGHHNCICSNLYRS-HEBQJAJPSA-N 2 1 347.506 4.083 20 0 EIADMP C(=C\c1ccncc1)\C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000494963873 1044558641 /nfs/dbraw/zinc/55/86/41/1044558641.db2.gz KGHHNCICSNLYRS-HEBQJAJPSA-N 2 1 347.506 4.083 20 0 EIADMP C(=C\c1ccncc1)\C[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000494963873 1044558665 /nfs/dbraw/zinc/55/86/65/1044558665.db2.gz KGHHNCICSNLYRS-HEBQJAJPSA-N 2 1 347.506 4.083 20 0 EIADMP C(=C/c1ccncc1)\C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000494963875 1044559602 /nfs/dbraw/zinc/55/96/02/1044559602.db2.gz KGHHNCICSNLYRS-VURDRKPISA-N 2 1 347.506 4.083 20 0 EIADMP C(=C/c1ccncc1)\C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000494963875 1044559618 /nfs/dbraw/zinc/55/96/18/1044559618.db2.gz KGHHNCICSNLYRS-VURDRKPISA-N 2 1 347.506 4.083 20 0 EIADMP C(=C/c1ccncc1)\C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000494963875 1044559636 /nfs/dbraw/zinc/55/96/36/1044559636.db2.gz KGHHNCICSNLYRS-VURDRKPISA-N 2 1 347.506 4.083 20 0 EIADMP C(=C/c1ccncc1)\C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000494963875 1044559654 /nfs/dbraw/zinc/55/96/54/1044559654.db2.gz KGHHNCICSNLYRS-VURDRKPISA-N 2 1 347.506 4.083 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@@H]1C ZINC000443650243 1044620235 /nfs/dbraw/zinc/62/02/35/1044620235.db2.gz CNRDIWCSZUYYLO-WMLDXEAASA-N 2 1 328.422 4.318 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@@H]1C ZINC000443650243 1044620243 /nfs/dbraw/zinc/62/02/43/1044620243.db2.gz CNRDIWCSZUYYLO-WMLDXEAASA-N 2 1 328.422 4.318 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@@H]1C ZINC000443650243 1044620253 /nfs/dbraw/zinc/62/02/53/1044620253.db2.gz CNRDIWCSZUYYLO-WMLDXEAASA-N 2 1 328.422 4.318 20 0 EIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000443658962 1044647493 /nfs/dbraw/zinc/64/74/93/1044647493.db2.gz OMWAELMAUFEAQA-YOEHRIQHSA-N 2 1 328.422 4.176 20 0 EIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000443658962 1044647498 /nfs/dbraw/zinc/64/74/98/1044647498.db2.gz OMWAELMAUFEAQA-YOEHRIQHSA-N 2 1 328.422 4.176 20 0 EIADMP Cc1ccccc1OCCC[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000543461464 1044651094 /nfs/dbraw/zinc/65/10/94/1044651094.db2.gz GYLWTVOGIWUTRG-RBUKOAKNSA-N 2 1 330.516 4.007 20 0 EIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]C3CC(CF)(CF)C3)cc2)C1 ZINC000657836810 1044719935 /nfs/dbraw/zinc/71/99/35/1044719935.db2.gz OVRLTQCEVRJHOS-INIZCTEOSA-N 2 1 336.470 4.096 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C1CC(CF)(CF)C1 ZINC000657838421 1044730248 /nfs/dbraw/zinc/73/02/48/1044730248.db2.gz SYEWLHLVSLTVPF-INIZCTEOSA-N 2 1 336.470 4.238 20 0 EIADMP COc1ccccc1/C=C/C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000237310374 1044824801 /nfs/dbraw/zinc/82/48/01/1044824801.db2.gz PCQCCHIJZIWOLQ-XYOKQWHBSA-N 2 1 338.495 4.338 20 0 EIADMP COCC[NH+]1CCC([NH2+][C@H](C)c2ccc(-c3ccccc3)s2)CC1 ZINC000543591699 1044874260 /nfs/dbraw/zinc/87/42/60/1044874260.db2.gz LBDPVBDKSNPDAG-MRXNPFEDSA-N 2 1 344.524 4.177 20 0 EIADMP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000347913516 1045000286 /nfs/dbraw/zinc/00/02/86/1045000286.db2.gz AEMWYYDXMLOGKU-ZWKOTPCHSA-N 2 1 340.515 4.096 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470885 1045008675 /nfs/dbraw/zinc/00/86/75/1045008675.db2.gz KIZUVPRIQVBXOW-MYZSUADSSA-N 2 1 337.920 4.324 20 0 EIADMP CC[C@H](C[NH2+][C@H](C)[C@@H](C)c1nc2ccccc2s1)[NH+]1CCCC1 ZINC000474478247 1045021032 /nfs/dbraw/zinc/02/10/32/1045021032.db2.gz OQMBEHLGYNNQKJ-BZUAXINKSA-N 2 1 331.529 4.252 20 0 EIADMP CC[C@H](C[NH2+][C@@H](C)[C@@H](C)c1nc2ccccc2s1)[NH+]1CCCC1 ZINC000474478249 1045021895 /nfs/dbraw/zinc/02/18/95/1045021895.db2.gz OQMBEHLGYNNQKJ-OWCLPIDISA-N 2 1 331.529 4.252 20 0 EIADMP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c2ccccc21 ZINC000635005851 1045059226 /nfs/dbraw/zinc/05/92/26/1045059226.db2.gz WZVNPLBIODRIHF-MANSERQUSA-N 2 1 346.833 4.044 20 0 EIADMP COC1(C[C@H](C)[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCC1 ZINC000429432491 1045133447 /nfs/dbraw/zinc/13/34/47/1045133447.db2.gz XHPNMCZOAMYBFU-HOTGVXAUSA-N 2 1 327.472 4.179 20 0 EIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1nc2ccccc2nc1C ZINC000626061811 1045165233 /nfs/dbraw/zinc/16/52/33/1045165233.db2.gz WBFDDGMIZZOEBX-UHFFFAOYSA-N 2 1 348.494 4.022 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168741226 1045230458 /nfs/dbraw/zinc/23/04/58/1045230458.db2.gz XLFIOEUITOUGAD-OKZBNKHCSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168741226 1045230470 /nfs/dbraw/zinc/23/04/70/1045230470.db2.gz XLFIOEUITOUGAD-OKZBNKHCSA-N 2 1 332.919 4.146 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168741226 1045230478 /nfs/dbraw/zinc/23/04/78/1045230478.db2.gz XLFIOEUITOUGAD-OKZBNKHCSA-N 2 1 332.919 4.146 20 0 EIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(F)F)cc2)C[C@@H]1C ZINC000740883932 1045239621 /nfs/dbraw/zinc/23/96/21/1045239621.db2.gz QRXKLPIGKUFONG-DZGCQCFKSA-N 2 1 328.472 4.306 20 0 EIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(F)F)cc2)C[C@@H]1C ZINC000740883932 1045239633 /nfs/dbraw/zinc/23/96/33/1045239633.db2.gz QRXKLPIGKUFONG-DZGCQCFKSA-N 2 1 328.472 4.306 20 0 EIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(SC(F)F)cc2)C[C@@H]1C ZINC000740883932 1045239644 /nfs/dbraw/zinc/23/96/44/1045239644.db2.gz QRXKLPIGKUFONG-DZGCQCFKSA-N 2 1 328.472 4.306 20 0 EIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(SC(F)F)cc2)C[C@@H]1C ZINC000740883932 1045239656 /nfs/dbraw/zinc/23/96/56/1045239656.db2.gz QRXKLPIGKUFONG-DZGCQCFKSA-N 2 1 328.472 4.306 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+][C@H]3CCCc4ccccc43)CC2)cc1 ZINC000236594886 1045360319 /nfs/dbraw/zinc/36/03/19/1045360319.db2.gz XSCMHBKUAQJRLC-QHCPKHFHSA-N 2 1 334.507 4.361 20 0 EIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+]C1CC(c2ccc(Br)cc2)C1 ZINC000312490041 1045364459 /nfs/dbraw/zinc/36/44/59/1045364459.db2.gz CMWOCQOQJSDTFQ-KTAKPFMOSA-N 2 1 339.321 4.013 20 0 EIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+]C1CC(c2ccc(Br)cc2)C1 ZINC000312490041 1045364466 /nfs/dbraw/zinc/36/44/66/1045364466.db2.gz CMWOCQOQJSDTFQ-KTAKPFMOSA-N 2 1 339.321 4.013 20 0 EIADMP CC(C)(C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000236728166 1045365042 /nfs/dbraw/zinc/36/50/42/1045365042.db2.gz MSEHLOOCDMCMLM-UHFFFAOYSA-N 2 1 336.523 4.261 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000237101024 1045374210 /nfs/dbraw/zinc/37/42/10/1045374210.db2.gz UOVPIPUGJVRPSG-RTWAWAEBSA-N 2 1 336.479 4.079 20 0 EIADMP COc1ccccc1-c1ccc(C[NH2+][C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC000237101024 1045374220 /nfs/dbraw/zinc/37/42/20/1045374220.db2.gz UOVPIPUGJVRPSG-RTWAWAEBSA-N 2 1 336.479 4.079 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000237384383 1045383683 /nfs/dbraw/zinc/38/36/83/1045383683.db2.gz RSVPVXQMJGCMDK-SFHVURJKSA-N 2 1 349.478 4.196 20 0 EIADMP Cc1ccccc1C[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000237554545 1045388145 /nfs/dbraw/zinc/38/81/45/1045388145.db2.gz LJCPYTLTZBSWGA-HXUWFJFHSA-N 2 1 336.523 4.223 20 0 EIADMP CC[N@@H+](CCCn1ccnc1C)Cc1ccc(C(F)(F)F)cc1 ZINC000762917560 1045413836 /nfs/dbraw/zinc/41/38/36/1045413836.db2.gz MJMGNLHLDGEXRW-UHFFFAOYSA-N 2 1 325.378 4.123 20 0 EIADMP CC[N@H+](CCCn1cc[nH+]c1C)Cc1ccc(C(F)(F)F)cc1 ZINC000762917560 1045413839 /nfs/dbraw/zinc/41/38/39/1045413839.db2.gz MJMGNLHLDGEXRW-UHFFFAOYSA-N 2 1 325.378 4.123 20 0 EIADMP CC[N@@H+](CCCn1cc[nH+]c1C)Cc1ccc(C(F)(F)F)cc1 ZINC000762917560 1045413842 /nfs/dbraw/zinc/41/38/42/1045413842.db2.gz MJMGNLHLDGEXRW-UHFFFAOYSA-N 2 1 325.378 4.123 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001168498140 1045455396 /nfs/dbraw/zinc/45/53/96/1045455396.db2.gz QTXMWMNPGDULOT-GHTZIAJQSA-N 2 1 340.486 4.211 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001168498140 1045455399 /nfs/dbraw/zinc/45/53/99/1045455399.db2.gz QTXMWMNPGDULOT-GHTZIAJQSA-N 2 1 340.486 4.211 20 0 EIADMP C[C@@H](Cc1cccc(F)c1)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001168498140 1045455403 /nfs/dbraw/zinc/45/54/03/1045455403.db2.gz QTXMWMNPGDULOT-GHTZIAJQSA-N 2 1 340.486 4.211 20 0 EIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874487 1045670122 /nfs/dbraw/zinc/67/01/22/1045670122.db2.gz FUWBUTWZHJRUHT-SJLPKXTDSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874487 1045670137 /nfs/dbraw/zinc/67/01/37/1045670137.db2.gz FUWBUTWZHJRUHT-SJLPKXTDSA-N 2 1 340.433 4.369 20 0 EIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874487 1045670150 /nfs/dbraw/zinc/67/01/50/1045670150.db2.gz FUWBUTWZHJRUHT-SJLPKXTDSA-N 2 1 340.433 4.369 20 0 EIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCC1CCOCC1 ZINC000398044836 1045827139 /nfs/dbraw/zinc/82/71/39/1045827139.db2.gz VARXDJUVWPCKQY-DENIHFKCSA-N 2 1 344.543 4.084 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCC1CCOCC1 ZINC000398044836 1045827140 /nfs/dbraw/zinc/82/71/40/1045827140.db2.gz VARXDJUVWPCKQY-DENIHFKCSA-N 2 1 344.543 4.084 20 0 EIADMP CCn1cc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)cn1 ZINC000246946338 1045835689 /nfs/dbraw/zinc/83/56/89/1045835689.db2.gz HVBCAFDYUAKRLT-MSOLQXFVSA-N 2 1 340.515 4.128 20 0 EIADMP CCn1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)cn1 ZINC000247015376 1045837508 /nfs/dbraw/zinc/83/75/08/1045837508.db2.gz LMFYQAPROZAPJH-QZTJIDSGSA-N 2 1 340.515 4.128 20 0 EIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCC[C@@H]2CCCCO2)C3)cc1 ZINC000248887156 1045887724 /nfs/dbraw/zinc/88/77/24/1045887724.db2.gz MKPOAEWZMZTNDP-LRSLUSHPSA-N 2 1 342.527 4.121 20 0 EIADMP CC[C@@H]1C[C@@H]([N@@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170194964 1045934491 /nfs/dbraw/zinc/93/44/91/1045934491.db2.gz PHMNLCQJQTZKDF-XSDIEEQYSA-N 2 1 330.516 4.025 20 0 EIADMP C[N@@H+](Cc1cncc2ccccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000769403339 1045952236 /nfs/dbraw/zinc/95/22/36/1045952236.db2.gz QPWQICJXPIMIQO-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cncc2ccccc21)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000769403339 1045952262 /nfs/dbraw/zinc/95/22/62/1045952262.db2.gz QPWQICJXPIMIQO-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[N@H+](Cc1cncc2ccccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000769403339 1045952256 /nfs/dbraw/zinc/95/22/56/1045952256.db2.gz QPWQICJXPIMIQO-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cncc2ccccc21)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000769403339 1045952282 /nfs/dbraw/zinc/95/22/82/1045952282.db2.gz QPWQICJXPIMIQO-FQEVSTJZSA-N 2 1 345.490 4.189 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000747095584 1046120164 /nfs/dbraw/zinc/12/01/64/1046120164.db2.gz PPLMRXBSAJOELZ-PMACEKPBSA-N 2 1 330.516 4.362 20 0 EIADMP CCCCCCOc1cccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000747095584 1046120173 /nfs/dbraw/zinc/12/01/73/1046120173.db2.gz PPLMRXBSAJOELZ-PMACEKPBSA-N 2 1 330.516 4.362 20 0 EIADMP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)c2ccsc2)CC1 ZINC000648571125 1046215697 /nfs/dbraw/zinc/21/56/97/1046215697.db2.gz LMGSDXHAXNIPSE-SJORKVTESA-N 2 1 328.525 4.494 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000125520155 1046314766 /nfs/dbraw/zinc/31/47/66/1046314766.db2.gz JPPPRNNWJFTIDO-SFHVURJKSA-N 2 1 349.931 4.415 20 0 EIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000125520155 1046314780 /nfs/dbraw/zinc/31/47/80/1046314780.db2.gz JPPPRNNWJFTIDO-SFHVURJKSA-N 2 1 349.931 4.415 20 0 EIADMP C[C@@H]([NH2+]C[C@@H](C)Cc1cccs1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508692942 1046324980 /nfs/dbraw/zinc/32/49/80/1046324980.db2.gz XMTQOQCIZQMNIP-NLWGTHIKSA-N 2 1 342.552 4.427 20 0 EIADMP COc1cc(C)cc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000508722039 1046422597 /nfs/dbraw/zinc/42/25/97/1046422597.db2.gz QUTGCHMSSXOLLZ-WIYYLYMNSA-N 2 1 338.495 4.004 20 0 EIADMP Cc1nc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC[C@H]3C(C)C)CC2)oc1C ZINC000162745061 1046493735 /nfs/dbraw/zinc/49/37/35/1046493735.db2.gz YOBDTQKQDLFBNS-VQTJNVASSA-N 2 1 347.547 4.308 20 0 EIADMP C[NH+]1C(C)(C)CC(Nc2ccc([C@H]3CCCC[N@@H+]3C)cn2)CC1(C)C ZINC001170450924 1046497557 /nfs/dbraw/zinc/49/75/57/1046497557.db2.gz OBTBFSKBBBBHEN-GOSISDBHSA-N 2 1 344.547 4.302 20 0 EIADMP Cc1[nH+]ccc(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1Cl ZINC000497251756 1046516277 /nfs/dbraw/zinc/51/62/77/1046516277.db2.gz ZWHMYUZBWDUWEV-CXAGYDPISA-N 2 1 335.904 4.022 20 0 EIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(Br)cs2)CC1 ZINC000536652998 1046596797 /nfs/dbraw/zinc/59/67/97/1046596797.db2.gz OEMFKUBEQITZJY-UHFFFAOYSA-N 2 1 345.350 4.063 20 0 EIADMP CC[N@@H+](C[C@H]1C[C@H]1c1ccccc1)CC1CCN(c2ccccn2)CC1 ZINC000536661075 1046626814 /nfs/dbraw/zinc/62/68/14/1046626814.db2.gz WSLWEHBOAXVMTF-YADHBBJMSA-N 2 1 349.522 4.424 20 0 EIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCC[C@H](C(F)(F)F)C3)CC2)[nH+]c1 ZINC000127366312 1046658060 /nfs/dbraw/zinc/65/80/60/1046658060.db2.gz MLRQAQXRRXZQTO-GOEBONIOSA-N 2 1 341.421 4.070 20 0 EIADMP C[C@@H](c1ccc2c(c1)CCC2)[N@@H+]1CC[C@@H](C[NH+](C)Cc2cccnc2)C1 ZINC000459449013 1046679055 /nfs/dbraw/zinc/67/90/55/1046679055.db2.gz WXBOZTZIWBFDGI-ICSRJNTNSA-N 2 1 349.522 4.085 20 0 EIADMP C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@@H](C[NH+](C)Cc2cccnc2)C1 ZINC000459449013 1046679062 /nfs/dbraw/zinc/67/90/62/1046679062.db2.gz WXBOZTZIWBFDGI-ICSRJNTNSA-N 2 1 349.522 4.085 20 0 EIADMP C[C@@H](c1ccc2c(c1)CCC2)[NH+]1CC[C@@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000459449013 1046679075 /nfs/dbraw/zinc/67/90/75/1046679075.db2.gz WXBOZTZIWBFDGI-ICSRJNTNSA-N 2 1 349.522 4.085 20 0 EIADMP C[C@@H](c1ccc2c(c1)CCC2)[NH+]1CC[C@@H](C[N@@H+](C)Cc2cccnc2)C1 ZINC000459449013 1046679085 /nfs/dbraw/zinc/67/90/85/1046679085.db2.gz WXBOZTZIWBFDGI-ICSRJNTNSA-N 2 1 349.522 4.085 20 0 EIADMP C[N@H+](Cc1csc(-c2ccc(Cl)cc2)n1)CC1CC[NH+](C)CC1 ZINC000536682958 1046683147 /nfs/dbraw/zinc/68/31/47/1046683147.db2.gz CYIAGKSKOVCIDB-UHFFFAOYSA-N 2 1 349.931 4.237 20 0 EIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000536695094 1046688070 /nfs/dbraw/zinc/68/80/70/1046688070.db2.gz LUOZRHBJUTXIFD-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000536695094 1046688083 /nfs/dbraw/zinc/68/80/83/1046688083.db2.gz LUOZRHBJUTXIFD-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000536695094 1046688089 /nfs/dbraw/zinc/68/80/89/1046688089.db2.gz LUOZRHBJUTXIFD-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000536695094 1046688104 /nfs/dbraw/zinc/68/81/04/1046688104.db2.gz LUOZRHBJUTXIFD-OAHLLOKOSA-N 2 1 332.488 4.328 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCOc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379624691 1046715117 /nfs/dbraw/zinc/71/51/17/1046715117.db2.gz JRDUVMUTZSYSOT-CTNGQTDRSA-N 2 1 338.495 4.098 20 0 EIADMP C[C@@H]1C[C@@H]([NH2+]CCCOc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379624691 1046715134 /nfs/dbraw/zinc/71/51/34/1046715134.db2.gz JRDUVMUTZSYSOT-CTNGQTDRSA-N 2 1 338.495 4.098 20 0 EIADMP CC[N@H+](Cc1cccc(OC)c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536711383 1046720717 /nfs/dbraw/zinc/72/07/17/1046720717.db2.gz TZGQVIYUNRGPAH-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1cccc(OC)c1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536711383 1046720730 /nfs/dbraw/zinc/72/07/30/1046720730.db2.gz TZGQVIYUNRGPAH-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP CC[NH+](Cc1cccc(OC)c1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536711383 1046720745 /nfs/dbraw/zinc/72/07/45/1046720745.db2.gz TZGQVIYUNRGPAH-OAQYLSRUSA-N 2 1 338.495 4.039 20 0 EIADMP COc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536836800 1046812079 /nfs/dbraw/zinc/81/20/79/1046812079.db2.gz BPFGVHQPWNFENJ-UWJYYQICSA-N 2 1 330.516 4.030 20 0 EIADMP Fc1ccc(CC[NH+]2CCC([NH2+][C@H]3CCCC(F)(F)C3)CC2)cc1 ZINC000536851136 1046821924 /nfs/dbraw/zinc/82/19/24/1046821924.db2.gz JCSIAHYBUFIMFF-SFHVURJKSA-N 2 1 340.433 4.000 20 0 EIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)cc1 ZINC000536831001 1046824726 /nfs/dbraw/zinc/82/47/26/1046824726.db2.gz DQUGMCSTNDFSMJ-CVAIRZPRSA-N 2 1 341.499 4.425 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1 ZINC000536858195 1046827293 /nfs/dbraw/zinc/82/72/93/1046827293.db2.gz PSWKXBKDNBPPHB-NWDGAFQWSA-N 2 1 326.271 4.485 20 0 EIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(Br)c(F)c2)CC1 ZINC000536866123 1046832321 /nfs/dbraw/zinc/83/23/21/1046832321.db2.gz ZQPXQKGCPKULLH-LBPRGKRZSA-N 2 1 343.284 4.112 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccc(OC)cc3)cc2)[C@@H](C)C1 ZINC000536874168 1046836962 /nfs/dbraw/zinc/83/69/62/1046836962.db2.gz CJHDNVFGNKGAKV-JTSKRJEESA-N 2 1 338.495 4.182 20 0 EIADMP CC[N@H+]1CC[C@H]([NH2+]CC(C)(C)c2c(F)cccc2Cl)[C@H](C)C1 ZINC000536875846 1046839152 /nfs/dbraw/zinc/83/91/52/1046839152.db2.gz JFKJRTMHLMEYDP-CJNGLKHVSA-N 2 1 326.887 4.077 20 0 EIADMP COc1cccc2c1C[C@H]([NH2+][C@@H](C)c1ccc(-n3cc[nH+]c3C)cc1)C2 ZINC000459722638 1046863738 /nfs/dbraw/zinc/86/37/38/1046863738.db2.gz IDSVSYGRCBUHQY-HNAYVOBHSA-N 2 1 347.462 4.007 20 0 EIADMP C[C@@H](C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000459725130 1046865643 /nfs/dbraw/zinc/86/56/43/1046865643.db2.gz BATFYJPYBJRHIE-GJZGRUSLSA-N 2 1 328.422 4.130 20 0 EIADMP COc1ccc(C2CCC([NH2+]CC[C@@H]3CCC[N@@H+](C)C3)CC2)cc1 ZINC000459725080 1046865823 /nfs/dbraw/zinc/86/58/23/1046865823.db2.gz AYOLLYISDSTCGB-ZJRDLVKKSA-N 2 1 330.516 4.043 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000537012673 1046892436 /nfs/dbraw/zinc/89/24/36/1046892436.db2.gz BSTPTBCIEOCUPF-LQWHRVPQSA-N 2 1 337.511 4.348 20 0 EIADMP CCc1cnccc1[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000537012673 1046892442 /nfs/dbraw/zinc/89/24/42/1046892442.db2.gz BSTPTBCIEOCUPF-LQWHRVPQSA-N 2 1 337.511 4.348 20 0 EIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3nc(Cl)ccc32)c1 ZINC000806134324 1047131830 /nfs/dbraw/zinc/13/18/30/1047131830.db2.gz JMDSWACYQSNAKM-SFHVURJKSA-N 2 1 343.902 4.352 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCc2nc(Cl)ccc21)[N@H+](C)Cc1ccccc1 ZINC000806141304 1047167848 /nfs/dbraw/zinc/16/78/48/1047167848.db2.gz IEHKDHURDUODOM-CRAIPNDOSA-N 2 1 343.902 4.223 20 0 EIADMP C[C@H](CC[NH2+][C@@H]1CCc2nc(Cl)ccc21)[N@@H+](C)Cc1ccccc1 ZINC000806141304 1047167853 /nfs/dbraw/zinc/16/78/53/1047167853.db2.gz IEHKDHURDUODOM-CRAIPNDOSA-N 2 1 343.902 4.223 20 0 EIADMP C[NH+](C)CC1CC[NH+](c2ccc(N[C@@H]3CC[C@@H]3C3CC3)cc2)CC1 ZINC000806158298 1047183403 /nfs/dbraw/zinc/18/34/03/1047183403.db2.gz WXYBOPZUGBCVRH-NHCUHLMSSA-N 2 1 327.516 4.065 20 0 EIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1cc[nH]c(=O)c1 ZINC000788525005 1047201726 /nfs/dbraw/zinc/20/17/26/1047201726.db2.gz AEIGLMZUEHZTQM-SJORKVTESA-N 2 1 339.483 4.012 20 0 EIADMP CC[NH+](CC)CCC[N@H+]1CCCCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000788482682 1047214370 /nfs/dbraw/zinc/21/43/70/1047214370.db2.gz QLFJBWRDWADLMA-QZTJIDSGSA-N 2 1 338.561 4.148 20 0 EIADMP CC1=CC[C@H](Nc2ccc([NH+]3CCC(C[NH+](C)C)CC3)cc2)CC1 ZINC000788729474 1047281024 /nfs/dbraw/zinc/28/10/24/1047281024.db2.gz KTXYKPIOVRHFMP-IBGZPJMESA-N 2 1 327.516 4.375 20 0 EIADMP CCC[N@@H+](C)C[C@H]1CCN(Cc2cc(Cl)nc3ccccc23)C1 ZINC000154708090 1047410217 /nfs/dbraw/zinc/41/02/17/1047410217.db2.gz NJZNJUGBZOFXOO-OAHLLOKOSA-N 2 1 331.891 4.052 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]CCOc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000556064369 1047429733 /nfs/dbraw/zinc/42/97/33/1047429733.db2.gz YGHRFHZNBKXKRS-ICSRJNTNSA-N 2 1 344.886 4.144 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]CCOc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000556064369 1047429740 /nfs/dbraw/zinc/42/97/40/1047429740.db2.gz YGHRFHZNBKXKRS-ICSRJNTNSA-N 2 1 344.886 4.144 20 0 EIADMP Cc1cccc2c(CC[NH2+][C@H]3CC[N@@H+](C)[C@H](c4ccccc4)C3)c[nH]c21 ZINC000556094499 1047446647 /nfs/dbraw/zinc/44/66/47/1047446647.db2.gz YIBDYVAFIWUWRI-UNMCSNQZSA-N 2 1 347.506 4.444 20 0 EIADMP Cc1cccc2c(CC[NH2+][C@H]3CC[N@H+](C)[C@H](c4ccccc4)C3)c[nH]c21 ZINC000556094499 1047446650 /nfs/dbraw/zinc/44/66/50/1047446650.db2.gz YIBDYVAFIWUWRI-UNMCSNQZSA-N 2 1 347.506 4.444 20 0 EIADMP CCOc1cccc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000556117630 1047470674 /nfs/dbraw/zinc/47/06/74/1047470674.db2.gz FDVVGCMEOKRENS-UNMCSNQZSA-N 2 1 338.495 4.053 20 0 EIADMP CCOc1cccc(CC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000556117630 1047470677 /nfs/dbraw/zinc/47/06/77/1047470677.db2.gz FDVVGCMEOKRENS-UNMCSNQZSA-N 2 1 338.495 4.053 20 0 EIADMP C[C@H](N[C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1cncs1 ZINC000897931038 1047500132 /nfs/dbraw/zinc/50/01/32/1047500132.db2.gz VABOCWNQNJKYNJ-YXJHDRRASA-N 2 1 327.497 4.162 20 0 EIADMP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000556589890 1047834871 /nfs/dbraw/zinc/83/48/71/1047834871.db2.gz QPMLMMWPJMIJCC-DEPWHIHDSA-N 2 1 330.516 4.041 20 0 EIADMP CC[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCO1 ZINC000824427273 1047867033 /nfs/dbraw/zinc/86/70/33/1047867033.db2.gz IBKWJSGEUFDBAW-BLNMYQONSA-N 2 1 342.527 4.119 20 0 EIADMP CC[C@@H]1C[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCO1 ZINC000824427276 1047867985 /nfs/dbraw/zinc/86/79/85/1047867985.db2.gz IBKWJSGEUFDBAW-SPVGOVNVSA-N 2 1 342.527 4.119 20 0 EIADMP CC(C)Oc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000498909324 1047935245 /nfs/dbraw/zinc/93/52/45/1047935245.db2.gz HQLQNKOHUGFERH-OAQYLSRUSA-N 2 1 344.543 4.418 20 0 EIADMP CC(C)Oc1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000498909324 1047935282 /nfs/dbraw/zinc/93/52/82/1047935282.db2.gz HQLQNKOHUGFERH-OAQYLSRUSA-N 2 1 344.543 4.418 20 0 EIADMP CC1(C)[C@@H]2C[C@H]([N@@H+](Cc3cccc(F)c3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170739311 1047968432 /nfs/dbraw/zinc/96/84/32/1047968432.db2.gz RXTVZKJUPKXCGS-CCQCEHTISA-N 2 1 330.491 4.332 20 0 EIADMP CC1(C)[C@@H]2C[C@@H]([N@@H+](Cc3cccc(F)c3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170739312 1047969441 /nfs/dbraw/zinc/96/94/41/1047969441.db2.gz RXTVZKJUPKXCGS-DHUDUYKCSA-N 2 1 330.491 4.332 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000237538741 1048017853 /nfs/dbraw/zinc/01/78/53/1048017853.db2.gz ZMUKDMGBVPUTBQ-LLVKDONJSA-N 2 1 345.796 4.290 20 0 EIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+]([C@@H]1C[C@@H]3[C@H](C1)C3(C)C)CC2 ZINC001170752381 1048066156 /nfs/dbraw/zinc/06/61/56/1048066156.db2.gz IMINEGUHDLPFIH-RSPOEFSDSA-N 2 1 342.527 4.391 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC(c1ccccc1)c1ccccc1 ZINC000556867774 1048072227 /nfs/dbraw/zinc/07/22/27/1048072227.db2.gz YHTSUEMDFYDMRV-UHFFFAOYSA-N 2 1 333.479 4.346 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)CC(c1ccccc1)c1ccccc1 ZINC000556867774 1048072248 /nfs/dbraw/zinc/07/22/48/1048072248.db2.gz YHTSUEMDFYDMRV-UHFFFAOYSA-N 2 1 333.479 4.346 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000556857802 1048075826 /nfs/dbraw/zinc/07/58/26/1048075826.db2.gz HMYRKBIAFRQBKG-GUYCJALGSA-N 2 1 342.405 4.110 20 0 EIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000556890739 1048132394 /nfs/dbraw/zinc/13/23/94/1048132394.db2.gz RQUCCLGEJLYEIC-BVPBIZIASA-N 2 1 340.433 4.271 20 0 EIADMP Cc1ccc(C(F)(F)F)c(C[NH+]2CCN(c3cc[nH+]cc3C)CC2)c1 ZINC001143683682 1048144520 /nfs/dbraw/zinc/14/45/20/1048144520.db2.gz MKRDSFUECCOBBP-UHFFFAOYSA-N 2 1 349.400 4.039 20 0 EIADMP Cc1c(F)cc(F)cc1C[N@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC001143757576 1048191979 /nfs/dbraw/zinc/19/19/79/1048191979.db2.gz FFGJJMFLNZQQNY-UHFFFAOYSA-N 2 1 344.449 4.370 20 0 EIADMP Fc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1F ZINC000499140735 1048343145 /nfs/dbraw/zinc/34/31/45/1048343145.db2.gz XMKONWYVMFFMKN-REPLKXPHSA-N 2 1 342.433 4.250 20 0 EIADMP Fc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1F ZINC000499140735 1048343162 /nfs/dbraw/zinc/34/31/62/1048343162.db2.gz XMKONWYVMFFMKN-REPLKXPHSA-N 2 1 342.433 4.250 20 0 EIADMP Cc1[nH+]ccn1CCC[NH2+][C@](C)(Cc1ccc(Cl)cc1)C(C)C ZINC001170583014 1048408442 /nfs/dbraw/zinc/40/84/42/1048408442.db2.gz WGKNEJOFYDSAJP-LJQANCHMSA-N 2 1 333.907 4.482 20 0 EIADMP Cc1ccc([C@H]2CCC[C@@H]2[N@@H+](C)Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000809582779 1048424499 /nfs/dbraw/zinc/42/44/99/1048424499.db2.gz DDGNZKREOGBTEL-MOPGFXCFSA-N 2 1 343.540 4.281 20 0 EIADMP Cc1ccc([C@H]2CCC[C@@H]2[N@H+](C)Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000809582779 1048424520 /nfs/dbraw/zinc/42/45/20/1048424520.db2.gz DDGNZKREOGBTEL-MOPGFXCFSA-N 2 1 343.540 4.281 20 0 EIADMP Cc1ccc([C@@H]2CCC[C@H]2[N@@H+](C)Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000809582781 1048424954 /nfs/dbraw/zinc/42/49/54/1048424954.db2.gz DDGNZKREOGBTEL-RBUKOAKNSA-N 2 1 343.540 4.281 20 0 EIADMP Cc1ccc([C@@H]2CCC[C@H]2[N@H+](C)Cc2ncc(C[NH+](C)C)s2)cc1 ZINC000809582781 1048424980 /nfs/dbraw/zinc/42/49/80/1048424980.db2.gz DDGNZKREOGBTEL-RBUKOAKNSA-N 2 1 343.540 4.281 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(F)cc3cccnc32)cc1 ZINC000809738865 1048510101 /nfs/dbraw/zinc/51/01/01/1048510101.db2.gz NFIRKODCCMOSIP-UHFFFAOYSA-N 2 1 337.442 4.068 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cnc(C3CCC3)s2)cc1 ZINC000809738788 1048512987 /nfs/dbraw/zinc/51/29/87/1048512987.db2.gz JVDAEMBHVVCJJE-UHFFFAOYSA-N 2 1 329.513 4.104 20 0 EIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cnc(C3CCC3)s2)cc1 ZINC000809738788 1048512993 /nfs/dbraw/zinc/51/29/93/1048512993.db2.gz JVDAEMBHVVCJJE-UHFFFAOYSA-N 2 1 329.513 4.104 20 0 EIADMP C[C@H](NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1ccccc1SC(C)(C)C ZINC000815576099 1048516892 /nfs/dbraw/zinc/51/68/92/1048516892.db2.gz JIEIFKOYYBCREI-YESZJQIVSA-N 2 1 348.556 4.091 20 0 EIADMP C[C@H]([NH2+]C[C@@H]1CN2CCC[C@H]2CO1)c1ccccc1SC(C)(C)C ZINC000815576099 1048516908 /nfs/dbraw/zinc/51/69/08/1048516908.db2.gz JIEIFKOYYBCREI-YESZJQIVSA-N 2 1 348.556 4.091 20 0 EIADMP CC[NH+](CC)CCC[N@H+](CC)Cc1sc2nc(C)nc(C)c2c1C ZINC000809749776 1048517983 /nfs/dbraw/zinc/51/79/83/1048517983.db2.gz RNRKYUKKFFDIBH-UHFFFAOYSA-N 2 1 348.560 4.170 20 0 EIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1sc2nc(C)nc(C)c2c1C ZINC000809749776 1048517994 /nfs/dbraw/zinc/51/79/94/1048517994.db2.gz RNRKYUKKFFDIBH-UHFFFAOYSA-N 2 1 348.560 4.170 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@]2(C)C[C@@]2(F)Cl)CC[N@@H+]1Cc1ccccc1 ZINC000846030263 1048796844 /nfs/dbraw/zinc/79/68/44/1048796844.db2.gz ABCXSGPOCRZZHF-YSHGAJCASA-N 2 1 338.898 4.334 20 0 EIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@]2(C)C[C@@]2(F)Cl)CC[N@H+]1Cc1ccccc1 ZINC000846030263 1048796862 /nfs/dbraw/zinc/79/68/62/1048796862.db2.gz ABCXSGPOCRZZHF-YSHGAJCASA-N 2 1 338.898 4.334 20 0 EIADMP c1cc2cccc(C[NH+]3CCC([N@@H+]4CCc5ccccc5C4)CC3)c2[nH]1 ZINC001144717276 1048817532 /nfs/dbraw/zinc/81/75/32/1048817532.db2.gz IDDDWDVUGUTCGG-UHFFFAOYSA-N 2 1 345.490 4.191 20 0 EIADMP c1cc2cccc(C[NH+]3CCC([N@H+]4CCc5ccccc5C4)CC3)c2[nH]1 ZINC001144717276 1048817535 /nfs/dbraw/zinc/81/75/35/1048817535.db2.gz IDDDWDVUGUTCGG-UHFFFAOYSA-N 2 1 345.490 4.191 20 0 EIADMP COCc1ccccc1/C=C(/C)C[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000816598702 1048840929 /nfs/dbraw/zinc/84/09/29/1048840929.db2.gz MUNIRBODMVBASH-CYVLTUHYSA-N 2 1 342.527 4.044 20 0 EIADMP COc1ccc([C@@H]([NH2+]C2CC[NH2+]CC2)c2ccc(Cl)cc2)cc1C ZINC000817935982 1049061526 /nfs/dbraw/zinc/06/15/26/1049061526.db2.gz KVAXCVBSAHLTMQ-FQEVSTJZSA-N 2 1 344.886 4.088 20 0 EIADMP COc1ccc([C@H]([NH2+]C2CC[NH2+]CC2)c2ccc(Cl)cc2)cc1C ZINC000817935983 1049062455 /nfs/dbraw/zinc/06/24/55/1049062455.db2.gz KVAXCVBSAHLTMQ-HXUWFJFHSA-N 2 1 344.886 4.088 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C[C@H](O)c1cccc2ccccc21 ZINC000818959516 1049226157 /nfs/dbraw/zinc/22/61/57/1049226157.db2.gz NCSDLOIGDCRBRU-GCJKJVERSA-N 2 1 340.511 4.117 20 0 EIADMP Cc1cc([N@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)ccc1N ZINC001170645415 1049298809 /nfs/dbraw/zinc/29/88/09/1049298809.db2.gz FEDUKZXCTKRVFF-KLXIGZAZSA-N 2 1 335.495 4.210 20 0 EIADMP Cc1cc([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)ccc1N ZINC001170645415 1049298821 /nfs/dbraw/zinc/29/88/21/1049298821.db2.gz FEDUKZXCTKRVFF-KLXIGZAZSA-N 2 1 335.495 4.210 20 0 EIADMP CC1([NH+]2CCCC2)CC[NH+]([C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170941912 1049409507 /nfs/dbraw/zinc/40/95/07/1049409507.db2.gz GWJGJPIVNAGZAP-QGZVFWFLSA-N 2 1 332.919 4.148 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170942978 1049424192 /nfs/dbraw/zinc/42/41/92/1049424192.db2.gz IJJMCQILPDLKFN-SFHVURJKSA-N 2 1 334.935 4.394 20 0 EIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170942977 1049424910 /nfs/dbraw/zinc/42/49/10/1049424910.db2.gz IJJMCQILPDLKFN-GOSISDBHSA-N 2 1 334.935 4.394 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170679991 1049509994 /nfs/dbraw/zinc/50/99/94/1049509994.db2.gz FLRMGJBJUPAUKA-WDSOQIARSA-N 2 1 348.481 4.337 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)[C@@H]2CCc3cccc(F)c3C2)CC1 ZINC001170970684 1049683701 /nfs/dbraw/zinc/68/37/01/1049683701.db2.gz MGNUUCDWRBRMRU-BHIYHBOVSA-N 2 1 330.491 4.198 20 0 EIADMP C[C@@H](C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)CC(F)(F)F ZINC000716680020 1049701533 /nfs/dbraw/zinc/70/15/33/1049701533.db2.gz PKASZECXGJWRAE-SPUZQDLCSA-N 2 1 340.433 4.218 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc3ccccc3)C[C@H]1C)C2 ZINC001171563879 1049756538 /nfs/dbraw/zinc/75/65/38/1049756538.db2.gz OISKXLRSWMYDSS-UCFCWBNQSA-N 2 1 348.534 4.353 20 0 EIADMP Cc1cccc2c1CC[C@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)C[C@H]1C)C2 ZINC001171563879 1049756545 /nfs/dbraw/zinc/75/65/45/1049756545.db2.gz OISKXLRSWMYDSS-UCFCWBNQSA-N 2 1 348.534 4.353 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+][C@H](CO)c2cccc3ccccc32)CC1(C)C ZINC001171629441 1049761947 /nfs/dbraw/zinc/76/19/47/1049761947.db2.gz RFBQIVIYDFVZCC-HXUWFJFHSA-N 2 1 340.511 4.114 20 0 EIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2ccccc2OC(F)(F)F)CC1(C)C ZINC001171612984 1049764679 /nfs/dbraw/zinc/76/46/79/1049764679.db2.gz CFJRPLWONSFFSW-UHFFFAOYSA-N 2 1 344.421 4.326 20 0 EIADMP COc1cc(OC)cc([C@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171623811 1049768051 /nfs/dbraw/zinc/76/80/51/1049768051.db2.gz GWPWVQZDACECFQ-AWEZNQCLSA-N 2 1 334.504 4.006 20 0 EIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706773 1049775493 /nfs/dbraw/zinc/77/54/93/1049775493.db2.gz MACDXJRERGAPMZ-FHWLQOOXSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706773 1049775496 /nfs/dbraw/zinc/77/54/96/1049775496.db2.gz MACDXJRERGAPMZ-FHWLQOOXSA-N 2 1 348.481 4.161 20 0 EIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706773 1049775501 /nfs/dbraw/zinc/77/55/01/1049775501.db2.gz MACDXJRERGAPMZ-FHWLQOOXSA-N 2 1 348.481 4.161 20 0 EIADMP C[C@H]1C[C@@H](n2c3ccccc3c3c2CC[NH2+]C3)C[N@H+]1Cc1ccccc1 ZINC001171758562 1049790299 /nfs/dbraw/zinc/79/02/99/1049790299.db2.gz YFEPCTJRVFZIBL-PKOBYXMFSA-N 2 1 345.490 4.123 20 0 EIADMP COC(C)(C)C[C@@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813788980 1049816766 /nfs/dbraw/zinc/81/67/66/1049816766.db2.gz FHXOQQFDNXUSBB-LBFURVHYSA-N 2 1 344.543 4.365 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+](CC2CCC2)C1 ZINC001171963549 1049824986 /nfs/dbraw/zinc/82/49/86/1049824986.db2.gz IFQYZULHJHIAIP-KDOFPFPSSA-N 2 1 340.433 4.100 20 0 EIADMP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+](CC2CCC2)C1 ZINC001171963549 1049824988 /nfs/dbraw/zinc/82/49/88/1049824988.db2.gz IFQYZULHJHIAIP-KDOFPFPSSA-N 2 1 340.433 4.100 20 0 EIADMP C[C@]1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCS1 ZINC000245686791 1049825671 /nfs/dbraw/zinc/82/56/71/1049825671.db2.gz JQRNVYDRXVKTCH-IYWMVGAKSA-N 2 1 330.541 4.057 20 0 EIADMP CCCC[N@@H+](C)CCCN[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171964540 1049826371 /nfs/dbraw/zinc/82/63/71/1049826371.db2.gz GTLKQKJBUPOLHO-NRFANRHFSA-N 2 1 345.575 4.141 20 0 EIADMP CCCC[NH+](C)CCCN[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964540 1049826372 /nfs/dbraw/zinc/82/63/72/1049826372.db2.gz GTLKQKJBUPOLHO-NRFANRHFSA-N 2 1 345.575 4.141 20 0 EIADMP CCCC[NH+](C)CCCN[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964540 1049826374 /nfs/dbraw/zinc/82/63/74/1049826374.db2.gz GTLKQKJBUPOLHO-NRFANRHFSA-N 2 1 345.575 4.141 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CCC[C@@H](C(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171988793 1049831625 /nfs/dbraw/zinc/83/16/25/1049831625.db2.gz VRFUJMDJBBDNMD-MSOLQXFVSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CCC[C@@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171988793 1049831629 /nfs/dbraw/zinc/83/16/29/1049831629.db2.gz VRFUJMDJBBDNMD-MSOLQXFVSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CCC[C@@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171988793 1049831630 /nfs/dbraw/zinc/83/16/30/1049831630.db2.gz VRFUJMDJBBDNMD-MSOLQXFVSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CCC[C@H](C(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171988795 1049832044 /nfs/dbraw/zinc/83/20/44/1049832044.db2.gz VRFUJMDJBBDNMD-ROUUACIJSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CCC[C@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171988795 1049832045 /nfs/dbraw/zinc/83/20/45/1049832045.db2.gz VRFUJMDJBBDNMD-ROUUACIJSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CCC[C@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171988795 1049832046 /nfs/dbraw/zinc/83/20/46/1049832046.db2.gz VRFUJMDJBBDNMD-ROUUACIJSA-N 2 1 336.470 4.407 20 0 EIADMP CC1(C)C[C@H]([NH2+]CCC2(O)CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001171969752 1049833981 /nfs/dbraw/zinc/83/39/81/1049833981.db2.gz WHPGEHBALYKVJW-HXUWFJFHSA-N 2 1 344.543 4.105 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2CCCc3cccnc32)CC[N@@H+]1Cc1ccccc1 ZINC001171973100 1049836379 /nfs/dbraw/zinc/83/63/79/1049836379.db2.gz VTUCVXONHGCQMR-SFTDATJTSA-N 2 1 349.522 4.492 20 0 EIADMP CC1(C)C[C@@H]([NH2+][C@H]2CCCc3cccnc32)CC[N@H+]1Cc1ccccc1 ZINC001171973100 1049836380 /nfs/dbraw/zinc/83/63/80/1049836380.db2.gz VTUCVXONHGCQMR-SFTDATJTSA-N 2 1 349.522 4.492 20 0 EIADMP CC1(C)C[C@@H]([NH2+]C2(c3ccc(N)cc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171978176 1049837664 /nfs/dbraw/zinc/83/76/64/1049837664.db2.gz WYUAZWLKEFPRPK-NRFANRHFSA-N 2 1 349.522 4.291 20 0 EIADMP CN(Cc1cccc(O)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977941 1049837709 /nfs/dbraw/zinc/83/77/09/1049837709.db2.gz VDCQOBDGOOEIFR-HXUWFJFHSA-N 2 1 338.495 4.267 20 0 EIADMP C[NH+](Cc1cccc(O)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977941 1049837714 /nfs/dbraw/zinc/83/77/14/1049837714.db2.gz VDCQOBDGOOEIFR-HXUWFJFHSA-N 2 1 338.495 4.267 20 0 EIADMP C[NH+](Cc1cccc(O)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977941 1049837715 /nfs/dbraw/zinc/83/77/15/1049837715.db2.gz VDCQOBDGOOEIFR-HXUWFJFHSA-N 2 1 338.495 4.267 20 0 EIADMP CC1(C)C[C@@H]([NH+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171983630 1049838567 /nfs/dbraw/zinc/83/85/67/1049838567.db2.gz ZFXWOYZGPWQWFI-QYZOEREBSA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171983630 1049838570 /nfs/dbraw/zinc/83/85/70/1049838570.db2.gz ZFXWOYZGPWQWFI-QYZOEREBSA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171983630 1049838573 /nfs/dbraw/zinc/83/85/73/1049838573.db2.gz ZFXWOYZGPWQWFI-QYZOEREBSA-N 2 1 348.481 4.407 20 0 EIADMP CC1(C)C[C@@H](n2cnc3ccc(C[NH3+])cc32)CC[N@H+]1Cc1ccccc1 ZINC001171984369 1049840789 /nfs/dbraw/zinc/84/07/89/1049840789.db2.gz VDWURTKYANVWHT-IBGZPJMESA-N 2 1 348.494 4.111 20 0 EIADMP CC1(C)C[C@@H]([NH+]2CC[C@@H](C(F)(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171987848 1049840966 /nfs/dbraw/zinc/84/09/66/1049840966.db2.gz KOOYREGVYRUNKH-SJORKVTESA-N 2 1 340.433 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@@H+]2CC[C@@H](C(F)(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171987848 1049840970 /nfs/dbraw/zinc/84/09/70/1049840970.db2.gz KOOYREGVYRUNKH-SJORKVTESA-N 2 1 340.433 4.314 20 0 EIADMP CC1(C)C[C@@H]([N@H+]2CC[C@@H](C(F)(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001171987848 1049840972 /nfs/dbraw/zinc/84/09/72/1049840972.db2.gz KOOYREGVYRUNKH-SJORKVTESA-N 2 1 340.433 4.314 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cn1 ZINC001172061315 1049842199 /nfs/dbraw/zinc/84/21/99/1049842199.db2.gz GAZHKSJMZBEVGU-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cn1 ZINC001172061315 1049842200 /nfs/dbraw/zinc/84/22/00/1049842200.db2.gz GAZHKSJMZBEVGU-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP CC(C)([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccn1 ZINC001172077995 1049845961 /nfs/dbraw/zinc/84/59/61/1049845961.db2.gz WIUHHMMCHSGEAY-WKCHPHFGSA-N 2 1 349.522 4.492 20 0 EIADMP CC(C)([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccccn1 ZINC001172077995 1049845965 /nfs/dbraw/zinc/84/59/65/1049845965.db2.gz WIUHHMMCHSGEAY-WKCHPHFGSA-N 2 1 349.522 4.492 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC(c1ccccc1)c1ccccc1)C2 ZINC001172101360 1049849521 /nfs/dbraw/zinc/84/95/21/1049849521.db2.gz ZHQAVWTVTQJPKF-DKUWSORSSA-N 2 1 334.507 4.423 20 0 EIADMP F[C@@H]1CCC[C@H]1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067763 1049851045 /nfs/dbraw/zinc/85/10/45/1049851045.db2.gz NRWYAYXCTPVMCF-ALGQRKQJSA-N 2 1 330.491 4.300 20 0 EIADMP FC1(F)CC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172068230 1049851442 /nfs/dbraw/zinc/85/14/42/1049851442.db2.gz PSESVDKMJHPNCN-AKHDSKFASA-N 2 1 334.454 4.350 20 0 EIADMP Cc1cccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC001172067245 1049851957 /nfs/dbraw/zinc/85/19/57/1049851957.db2.gz LZCSYIZDDUVFCC-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP Cc1cccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)n1 ZINC001172067245 1049851959 /nfs/dbraw/zinc/85/19/59/1049851959.db2.gz LZCSYIZDDUVFCC-DKUWSORSSA-N 2 1 335.495 4.065 20 0 EIADMP FC1CCC([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172069822 1049852356 /nfs/dbraw/zinc/85/23/56/1049852356.db2.gz XVPIOUWFWIHORO-ZHLPAPNQSA-N 2 1 330.491 4.442 20 0 EIADMP CCCCOCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069171 1049853346 /nfs/dbraw/zinc/85/33/46/1049853346.db2.gz HEJHANVYWJWKLN-DKUWSORSSA-N 2 1 344.543 4.369 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Cc3ccc(F)cc3F)CC1)C2 ZINC001172127939 1049853837 /nfs/dbraw/zinc/85/38/37/1049853837.db2.gz MAMSKLAJBBSDPH-ACDBMABISA-N 2 1 348.481 4.235 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(Cc3ccc(F)cc3F)CC1)C2 ZINC001172127939 1049853839 /nfs/dbraw/zinc/85/38/39/1049853839.db2.gz MAMSKLAJBBSDPH-ACDBMABISA-N 2 1 348.481 4.235 20 0 EIADMP C[N@@H+](Cc1cccc(OC(F)(F)F)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172133276 1049854289 /nfs/dbraw/zinc/85/42/89/1049854289.db2.gz QWSRSCYICAQJPO-ZSHCYNCHSA-N 2 1 342.405 4.032 20 0 EIADMP C[NH+](Cc1cccc(OC(F)(F)F)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172133276 1049854292 /nfs/dbraw/zinc/85/42/92/1049854292.db2.gz QWSRSCYICAQJPO-ZSHCYNCHSA-N 2 1 342.405 4.032 20 0 EIADMP C[NH+](Cc1cccc(OC(F)(F)F)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172133276 1049854294 /nfs/dbraw/zinc/85/42/94/1049854294.db2.gz QWSRSCYICAQJPO-ZSHCYNCHSA-N 2 1 342.405 4.032 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CC[C@@H](OCc3ccccc3)CC1)C2 ZINC001172110374 1049857744 /nfs/dbraw/zinc/85/77/44/1049857744.db2.gz LRLYPNARXJVHFH-YPHBOWRQSA-N 2 1 342.527 4.119 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CC[C@@H](OCc3ccccc3)CC1)C2 ZINC001172110374 1049857745 /nfs/dbraw/zinc/85/77/45/1049857745.db2.gz LRLYPNARXJVHFH-YPHBOWRQSA-N 2 1 342.527 4.119 20 0 EIADMP CC(C)C[C@@H]([NH3+])c1nc2ccccc2n1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172118826 1049858187 /nfs/dbraw/zinc/85/81/87/1049858187.db2.gz TVWVLNATGRGVMY-XMTFNYHQSA-N 2 1 340.515 4.270 20 0 EIADMP Cc1ccc2c(C[C@@H](C)[NH3+])cn([C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)c2c1 ZINC001172113281 1049858521 /nfs/dbraw/zinc/85/85/21/1049858521.db2.gz BTLIXCVKTDMHAZ-OQIJWPOYSA-N 2 1 325.500 4.027 20 0 EIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(CC3CC3)CCC(F)(F)CC1)C2 ZINC001172111249 1049858552 /nfs/dbraw/zinc/85/85/52/1049858552.db2.gz OQQAVVWEMQMAEE-OSYLJGHBSA-N 2 1 326.475 4.340 20 0 EIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(CC3CC3)CCC(F)(F)CC1)C2 ZINC001172111249 1049858553 /nfs/dbraw/zinc/85/85/53/1049858553.db2.gz OQQAVVWEMQMAEE-OSYLJGHBSA-N 2 1 326.475 4.340 20 0 EIADMP c1ccc2c(c1)C[C@@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CS2 ZINC001172203696 1049863581 /nfs/dbraw/zinc/86/35/81/1049863581.db2.gz VDCHGTQUHDFXGG-RTBURBONSA-N 2 1 330.541 4.044 20 0 EIADMP CC(C)OCC[C@H](C)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172444486 1049913383 /nfs/dbraw/zinc/91/33/83/1049913383.db2.gz LEXHEBVHWJASHY-VDGAXYAQSA-N 2 1 336.495 4.101 20 0 EIADMP CC(C)COCC[C@@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001172466217 1049918087 /nfs/dbraw/zinc/91/80/87/1049918087.db2.gz BMDIBOJMYIDAFV-TZIWHRDSSA-N 2 1 346.559 4.328 20 0 EIADMP CC(C)COCC[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001172466217 1049918093 /nfs/dbraw/zinc/91/80/93/1049918093.db2.gz BMDIBOJMYIDAFV-TZIWHRDSSA-N 2 1 346.559 4.328 20 0 EIADMP CC(C)COCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172465282 1049918664 /nfs/dbraw/zinc/91/86/64/1049918664.db2.gz UJBSFTWZEPADIM-JKLQHZFJSA-N 2 1 344.543 4.223 20 0 EIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccn2)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172555940 1049931553 /nfs/dbraw/zinc/93/15/53/1049931553.db2.gz KNQQUBWPGKXMBJ-OHUMZHCVSA-N 2 1 349.522 4.490 20 0 EIADMP CC[C@H]1CC[C@H](C2CCC(N3CC[NH+](CCCC[NH3+])CC3)CC2)CC1 ZINC001172587474 1049952823 /nfs/dbraw/zinc/95/28/23/1049952823.db2.gz LYQXFBFLTRAMQI-IJDVVPKISA-N 2 1 349.607 4.118 20 0 EIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C1CC(C)(C)OC(C)(C)C1 ZINC001172658885 1049958270 /nfs/dbraw/zinc/95/82/70/1049958270.db2.gz GKZXFLJVAXQIBF-IBGZPJMESA-N 2 1 344.543 4.177 20 0 EIADMP C[C@@H](N[C@@H](C)c1cc(F)c(F)c(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248401595 1050054539 /nfs/dbraw/zinc/05/45/39/1050054539.db2.gz LYKCUHYJZVJLPS-RDBSUJKOSA-N 2 1 340.433 4.408 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248401595 1050054546 /nfs/dbraw/zinc/05/45/46/1050054546.db2.gz LYKCUHYJZVJLPS-RDBSUJKOSA-N 2 1 340.433 4.408 20 0 EIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248401595 1050054552 /nfs/dbraw/zinc/05/45/52/1050054552.db2.gz LYKCUHYJZVJLPS-RDBSUJKOSA-N 2 1 340.433 4.408 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]CCC2Cc3ccccc3C2)C[C@H]1c1ccccc1 ZINC000520621180 1050057450 /nfs/dbraw/zinc/05/74/50/1050057450.db2.gz WZTJYPLDYPZZAF-PKTZIBPZSA-N 2 1 334.507 4.217 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]CCC2Cc3ccccc3C2)C[C@H]1c1ccccc1 ZINC000520621180 1050057453 /nfs/dbraw/zinc/05/74/53/1050057453.db2.gz WZTJYPLDYPZZAF-PKTZIBPZSA-N 2 1 334.507 4.217 20 0 EIADMP Cc1cncc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000248754482 1050076637 /nfs/dbraw/zinc/07/66/37/1050076637.db2.gz UWRVKOANJQPJJY-MJGOQNOKSA-N 2 1 337.511 4.473 20 0 EIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3occc32)[C@H]1c1cccs1 ZINC000248879330 1050081785 /nfs/dbraw/zinc/08/17/85/1050081785.db2.gz KHYZQUPVYKTBOW-OGWOLHLISA-N 2 1 330.497 4.391 20 0 EIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3occc32)[C@H]1c1cccs1 ZINC000248879330 1050081789 /nfs/dbraw/zinc/08/17/89/1050081789.db2.gz KHYZQUPVYKTBOW-OGWOLHLISA-N 2 1 330.497 4.391 20 0 EIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cccc(OC(F)(F)F)c1 ZINC000089513053 1050120818 /nfs/dbraw/zinc/12/08/18/1050120818.db2.gz JRASQKAWYHOMAD-ZDUSSCGKSA-N 2 1 344.421 4.499 20 0 EIADMP c1ccc(CC[NH+]2CCC([NH2+]C3CCc4ccccc4CC3)CC2)cc1 ZINC001177186282 1050166401 /nfs/dbraw/zinc/16/64/01/1050166401.db2.gz LTPPAILZVDLQRU-UHFFFAOYSA-N 2 1 348.534 4.231 20 0 EIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1c(F)ccc(F)c1Cl ZINC001177299325 1050181007 /nfs/dbraw/zinc/18/10/07/1050181007.db2.gz OWVYYCLFNDFUKD-CYBMUJFWSA-N 2 1 330.850 4.362 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C/C=C/c1cccc(F)c1 ZINC001177277633 1050185649 /nfs/dbraw/zinc/18/56/49/1050185649.db2.gz MMMMAQVIWXRCNU-VQHVLOKHSA-N 2 1 326.459 4.469 20 0 EIADMP C[C@@H](Cc1c(F)cccc1Cl)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001172847822 1050186154 /nfs/dbraw/zinc/18/61/54/1050186154.db2.gz NCXMEPVOGOVRHV-AWEZNQCLSA-N 2 1 338.898 4.394 20 0 EIADMP CCc1nc2c(s1)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)CCC2 ZINC000090586928 1050188083 /nfs/dbraw/zinc/18/80/83/1050188083.db2.gz RQXDKKINSMBAAX-HOTGVXAUSA-N 2 1 335.561 4.041 20 0 EIADMP CO[C@@H]1CCC[C@@H]([N@@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172927988 1050237996 /nfs/dbraw/zinc/23/79/96/1050237996.db2.gz IETBPSYETATTOD-XRXFAXGQSA-N 2 1 330.516 4.025 20 0 EIADMP COc1ccccc1[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000091284474 1050247286 /nfs/dbraw/zinc/24/72/86/1050247286.db2.gz BSYNNMADZKSCCJ-KKSFZXQISA-N 2 1 328.500 4.000 20 0 EIADMP CC[C@H](C[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC001177668757 1050272787 /nfs/dbraw/zinc/27/27/87/1050272787.db2.gz CNHNQGRCNOUQAM-FGZHOGPDSA-N 2 1 336.523 4.334 20 0 EIADMP CCCOC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC001173096508 1050288496 /nfs/dbraw/zinc/28/84/96/1050288496.db2.gz QAOCHVRUGAUAAI-QBKZBJQZSA-N 2 1 344.543 4.224 20 0 EIADMP CCCOC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC001173096508 1050288512 /nfs/dbraw/zinc/28/85/12/1050288512.db2.gz QAOCHVRUGAUAAI-QBKZBJQZSA-N 2 1 344.543 4.224 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@@H](c3ccccc3OC)C2)CC1 ZINC001173109048 1050307992 /nfs/dbraw/zinc/30/79/92/1050307992.db2.gz VZRIYHKIDAVOMO-LMDPOFIKSA-N 2 1 330.516 4.138 20 0 EIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H](Sc3ccncc3)C2)CC1 ZINC001173114700 1050309096 /nfs/dbraw/zinc/30/90/96/1050309096.db2.gz QMJNCKDAZSINCW-AFMYVXGZSA-N 2 1 347.572 4.291 20 0 EIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Cl)cc2Br)CC1 ZINC001206311596 1050339604 /nfs/dbraw/zinc/33/96/04/1050339604.db2.gz REIWDZMTBZUBTB-HNNXBMFYSA-N 2 1 345.712 4.053 20 0 EIADMP [NH3+]CCC[N@@H+](C1CCCCC1)C1CCC(Oc2ccccc2)CC1 ZINC001173197755 1050342251 /nfs/dbraw/zinc/34/22/51/1050342251.db2.gz JADCWDBZXYKMDG-UHFFFAOYSA-N 2 1 330.516 4.360 20 0 EIADMP Cc1c[nH+]c(CC[NH3+])n1[C@H](C)CC(c1ccccc1)c1ccccc1 ZINC001173206439 1050365244 /nfs/dbraw/zinc/36/52/44/1050365244.db2.gz VICYCZJFNGKQQL-QGZVFWFLSA-N 2 1 333.479 4.476 20 0 EIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2OC)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272787 1050392766 /nfs/dbraw/zinc/39/27/66/1050392766.db2.gz WWCPNVZHRMSPLC-FRYIKTPZSA-N 2 1 330.516 4.346 20 0 EIADMP Fc1ccccc1C[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001178285385 1050428413 /nfs/dbraw/zinc/42/84/13/1050428413.db2.gz QAXIYOGTYUTDBU-TUNNFDKTSA-N 2 1 338.470 4.216 20 0 EIADMP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173343033 1050431965 /nfs/dbraw/zinc/43/19/65/1050431965.db2.gz GKYKFAJMGBBABW-LEWJYISDSA-N 2 1 348.575 4.455 20 0 EIADMP C[N@@H+](C1CCOCC1)C1CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173344313 1050434754 /nfs/dbraw/zinc/43/47/54/1050434754.db2.gz VAVLZDUYYSAVCA-OAQYLSRUSA-N 2 1 348.575 4.455 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)n1cc[nH+]c1CCC[NH3+] ZINC001173547439 1050481339 /nfs/dbraw/zinc/48/13/39/1050481339.db2.gz PWRCITOVIPTEPF-LBPRGKRZSA-N 2 1 326.271 4.275 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001173553723 1050481357 /nfs/dbraw/zinc/48/13/57/1050481357.db2.gz XZAUYNIFUIXASL-IMJJTQAJSA-N 2 1 341.326 4.198 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1C[C@H]2CC[N@H+](C)C[C@H]2C1 ZINC001173553723 1050481360 /nfs/dbraw/zinc/48/13/60/1050481360.db2.gz XZAUYNIFUIXASL-IMJJTQAJSA-N 2 1 341.326 4.198 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1C[C@H]2CC[N@@H+](C)C[C@H]2C1 ZINC001173553723 1050481369 /nfs/dbraw/zinc/48/13/69/1050481369.db2.gz XZAUYNIFUIXASL-IMJJTQAJSA-N 2 1 341.326 4.198 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCc2[nH+]ccn2CC1 ZINC001173549539 1050485444 /nfs/dbraw/zinc/48/54/44/1050485444.db2.gz HLNXUJHDFQJGLM-ZDUSSCGKSA-N 2 1 338.282 4.069 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CCc2[nH+]ccn2CC1 ZINC001173549539 1050485448 /nfs/dbraw/zinc/48/54/48/1050485448.db2.gz HLNXUJHDFQJGLM-ZDUSSCGKSA-N 2 1 338.282 4.069 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CCC([NH+]2CCC2)CC1 ZINC001173549016 1050486195 /nfs/dbraw/zinc/48/61/95/1050486195.db2.gz FYMUYMCFUNQZPP-CQSZACIVSA-N 2 1 341.326 4.485 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001173548493 1050486407 /nfs/dbraw/zinc/48/64/07/1050486407.db2.gz CGMKKNLJRZBNCQ-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CC[C@]2(CC[N@H+](C)C2)C1 ZINC001173548493 1050486415 /nfs/dbraw/zinc/48/64/15/1050486415.db2.gz CGMKKNLJRZBNCQ-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC001173548493 1050486442 /nfs/dbraw/zinc/48/64/42/1050486442.db2.gz CGMKKNLJRZBNCQ-KSSFIOAISA-N 2 1 341.326 4.342 20 0 EIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@@H]2CCCN(C)[C@@H]2C1 ZINC001173551664 1050487095 /nfs/dbraw/zinc/48/70/95/1050487095.db2.gz UQGOASXYAXMGKB-QIIPPGSGSA-N 2 1 341.326 4.341 20 0 EIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000093770398 1050691798 /nfs/dbraw/zinc/69/17/98/1050691798.db2.gz JYMSEXIYFVGQBO-LJQANCHMSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000093770398 1050691801 /nfs/dbraw/zinc/69/18/01/1050691801.db2.gz JYMSEXIYFVGQBO-LJQANCHMSA-N 2 1 338.495 4.136 20 0 EIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000093770398 1050691802 /nfs/dbraw/zinc/69/18/02/1050691802.db2.gz JYMSEXIYFVGQBO-LJQANCHMSA-N 2 1 338.495 4.136 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1N(C)C ZINC000093946460 1050726751 /nfs/dbraw/zinc/72/67/51/1050726751.db2.gz CUYBRDVHVHKPSK-QGZVFWFLSA-N 2 1 329.532 4.200 20 0 EIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccccc2N(C)C)c1 ZINC000093944631 1050727044 /nfs/dbraw/zinc/72/70/44/1050727044.db2.gz FNJFWYRTBHWAKF-QGZVFWFLSA-N 2 1 325.500 4.055 20 0 EIADMP Cc1ccc(C[C@H]2CCC[N@H+](Cc3ccnn3-c3cc[nH+]cc3)C2)cc1 ZINC001179858193 1050795764 /nfs/dbraw/zinc/79/57/64/1050795764.db2.gz ARMSFPNMPXAAFQ-HXUWFJFHSA-N 2 1 346.478 4.030 20 0 EIADMP Cc1ccc(C[C@H]2CCC[N@@H+](Cc3ccnn3-c3cc[nH+]cc3)C2)cc1 ZINC001179858193 1050795779 /nfs/dbraw/zinc/79/57/79/1050795779.db2.gz ARMSFPNMPXAAFQ-HXUWFJFHSA-N 2 1 346.478 4.030 20 0 EIADMP C[C@@]1(C[N@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCCS1 ZINC001179864193 1050808682 /nfs/dbraw/zinc/80/86/82/1050808682.db2.gz UUAYLZCESMAYMU-SFTDATJTSA-N 2 1 344.568 4.260 20 0 EIADMP C[C@@]1(C[NH+]2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)CCCS1 ZINC001179864193 1050808686 /nfs/dbraw/zinc/80/86/86/1050808686.db2.gz UUAYLZCESMAYMU-SFTDATJTSA-N 2 1 344.568 4.260 20 0 EIADMP C[C@@]1(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CCCS1 ZINC001179864193 1050808689 /nfs/dbraw/zinc/80/86/89/1050808689.db2.gz UUAYLZCESMAYMU-SFTDATJTSA-N 2 1 344.568 4.260 20 0 EIADMP COc1cc2ccccc2cc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001179878254 1050815622 /nfs/dbraw/zinc/81/56/22/1050815622.db2.gz NQYFDFLSFKJNMR-SFHVURJKSA-N 2 1 338.495 4.156 20 0 EIADMP COc1cc2ccccc2cc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001179878254 1050815626 /nfs/dbraw/zinc/81/56/26/1050815626.db2.gz NQYFDFLSFKJNMR-SFHVURJKSA-N 2 1 338.495 4.156 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@H]2CCc3ccccc32)C1 ZINC001180030505 1050860937 /nfs/dbraw/zinc/86/09/37/1050860937.db2.gz NRWHHXKGZPBBNS-SFHLNBCPSA-N 2 1 326.528 4.303 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@H]2CCc3ccccc32)C1 ZINC001180030505 1050860951 /nfs/dbraw/zinc/86/09/51/1050860951.db2.gz NRWHHXKGZPBBNS-SFHLNBCPSA-N 2 1 326.528 4.303 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@H]2CCc3ccccc32)C1 ZINC001180030505 1050860954 /nfs/dbraw/zinc/86/09/54/1050860954.db2.gz NRWHHXKGZPBBNS-SFHLNBCPSA-N 2 1 326.528 4.303 20 0 EIADMP CC[C@H](Cc1ccccc1)[N@@H+](CC)Cc1ccnn1-c1cc[nH+]cc1 ZINC001180057674 1050868663 /nfs/dbraw/zinc/86/86/63/1050868663.db2.gz HMSFQHMRQSFYAL-LJQANCHMSA-N 2 1 334.467 4.111 20 0 EIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000261895230 1050871581 /nfs/dbraw/zinc/87/15/81/1050871581.db2.gz OFRPEUBQQFGASB-KBPBESRZSA-N 2 1 326.406 4.230 20 0 EIADMP Cc1cc(F)ncc1C[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC001180225920 1050921187 /nfs/dbraw/zinc/92/11/87/1050921187.db2.gz XCGUDBPIQJLAAH-KRWDZBQOSA-N 2 1 333.495 4.006 20 0 EIADMP [NH3+][C@H]1CCC12CC[NH+](Cc1c(Cl)ccc(Cl)c1Cl)CC2 ZINC001237357272 1050998154 /nfs/dbraw/zinc/99/81/54/1050998154.db2.gz RLFOBLRQOBCCIC-ZDUSSCGKSA-N 2 1 333.690 4.350 20 0 EIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cnccc2C(C)(C)C)C[C@H]1c1ccccc1 ZINC000414224364 1051179579 /nfs/dbraw/zinc/17/95/79/1051179579.db2.gz HQAQWGWHPLIZSP-FPOVZHCZSA-N 2 1 337.511 4.304 20 0 EIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cnccc2C(C)(C)C)C[C@H]1c1ccccc1 ZINC000414224364 1051179583 /nfs/dbraw/zinc/17/95/83/1051179583.db2.gz HQAQWGWHPLIZSP-FPOVZHCZSA-N 2 1 337.511 4.304 20 0 EIADMP CC[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)CC(F)(F)F ZINC000414248969 1051231196 /nfs/dbraw/zinc/23/11/96/1051231196.db2.gz GEQXSLNNFLOXJL-UAGQMJEPSA-N 2 1 328.422 4.390 20 0 EIADMP CC[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)CC(F)(F)F ZINC000414248969 1051231211 /nfs/dbraw/zinc/23/12/11/1051231211.db2.gz GEQXSLNNFLOXJL-UAGQMJEPSA-N 2 1 328.422 4.390 20 0 EIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CC3([C@H]4CCCCO4)CCC3)C2)CC1 ZINC001190651125 1051244225 /nfs/dbraw/zinc/24/42/25/1051244225.db2.gz JFEXTMCRUHUJDX-LEWJYISDSA-N 2 1 348.575 4.170 20 0 EIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(-c4ccc(F)cc4)o3)C2)CC1 ZINC001181514242 1051245746 /nfs/dbraw/zinc/24/57/46/1051245746.db2.gz BXLBHPKMTJJIQN-SFHVURJKSA-N 2 1 342.458 4.249 20 0 EIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CC3([C@@H]4CCCCO4)CCC3)C2)CC1 ZINC001190651127 1051245961 /nfs/dbraw/zinc/24/59/61/1051245961.db2.gz JFEXTMCRUHUJDX-RTWAWAEBSA-N 2 1 348.575 4.170 20 0 EIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(OC)c1 ZINC000154165194 1051275307 /nfs/dbraw/zinc/27/53/07/1051275307.db2.gz IGTZLDHRXYMJEX-INIZCTEOSA-N 2 1 346.515 4.152 20 0 EIADMP C[C@@H]1CCCC[C@H]1OCC[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190826075 1051285770 /nfs/dbraw/zinc/28/57/70/1051285770.db2.gz FCEIDLAOTIVWPG-NJDAHSKKSA-N 2 1 336.564 4.170 20 0 EIADMP C[C@@H]1CCCC[C@H]1OCC[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190826075 1051285786 /nfs/dbraw/zinc/28/57/86/1051285786.db2.gz FCEIDLAOTIVWPG-NJDAHSKKSA-N 2 1 336.564 4.170 20 0 EIADMP C([C@H]1CCCC12CCOCC2)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190827420 1051286730 /nfs/dbraw/zinc/28/67/30/1051286730.db2.gz PJTAUJRJEHNSQW-LEWJYISDSA-N 2 1 348.575 4.171 20 0 EIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCc2ccccc2Cl)C1 ZINC001191057542 1051335254 /nfs/dbraw/zinc/33/52/54/1051335254.db2.gz KIKZWQCPXVYFGH-MSOLQXFVSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCc2ccccc2Cl)C1 ZINC001191057542 1051335263 /nfs/dbraw/zinc/33/52/63/1051335263.db2.gz KIKZWQCPXVYFGH-MSOLQXFVSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCc2ccccc2Cl)C1 ZINC001191057542 1051335272 /nfs/dbraw/zinc/33/52/72/1051335272.db2.gz KIKZWQCPXVYFGH-MSOLQXFVSA-N 2 1 334.935 4.469 20 0 EIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCc2ccccc2Cl)C1 ZINC001191057542 1051335275 /nfs/dbraw/zinc/33/52/75/1051335275.db2.gz KIKZWQCPXVYFGH-MSOLQXFVSA-N 2 1 334.935 4.469 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccc2c(c1)OCO2 ZINC000154845840 1051342088 /nfs/dbraw/zinc/34/20/88/1051342088.db2.gz WYHFSPUZYREFKQ-INIZCTEOSA-N 2 1 340.467 4.106 20 0 EIADMP COc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000154856311 1051343524 /nfs/dbraw/zinc/34/35/24/1051343524.db2.gz DEXWLNLGMTVGHE-KRWDZBQOSA-N 2 1 326.484 4.386 20 0 EIADMP FC(F)c1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310070910 1051372108 /nfs/dbraw/zinc/37/21/08/1051372108.db2.gz DFNSNYOZLBPBBD-GOSISDBHSA-N 2 1 330.422 4.236 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)c1cncs1 ZINC000268772174 1051390555 /nfs/dbraw/zinc/39/05/55/1051390555.db2.gz MAAHBGUBUBQXNZ-BRWVUGGUSA-N 2 1 343.540 4.472 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1cncs1 ZINC000268805701 1051394493 /nfs/dbraw/zinc/39/44/93/1051394493.db2.gz IUSUXLSPIFRHLC-HZPDHXFCSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1cncs1 ZINC000268805701 1051394503 /nfs/dbraw/zinc/39/45/03/1051394503.db2.gz IUSUXLSPIFRHLC-HZPDHXFCSA-N 2 1 329.513 4.226 20 0 EIADMP C[C@H](CCc1ccccc1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191233029 1051405058 /nfs/dbraw/zinc/40/50/58/1051405058.db2.gz KEEDDUCXBREVGG-OFNKIYASSA-N 2 1 336.523 4.462 20 0 EIADMP C[C@H](CCc1ccccc1)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001191233029 1051405066 /nfs/dbraw/zinc/40/50/66/1051405066.db2.gz KEEDDUCXBREVGG-OFNKIYASSA-N 2 1 336.523 4.462 20 0 EIADMP C[C@H](CCc1ccccc1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001191233029 1051405076 /nfs/dbraw/zinc/40/50/76/1051405076.db2.gz KEEDDUCXBREVGG-OFNKIYASSA-N 2 1 336.523 4.462 20 0 EIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCCOc2cccc3ccccc32)C1 ZINC001191367697 1051444439 /nfs/dbraw/zinc/44/44/39/1051444439.db2.gz TYJIEXNRAVVIMV-IBGZPJMESA-N 2 1 340.511 4.272 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](CCCOc2cccc3ccccc32)C1 ZINC001191367697 1051444450 /nfs/dbraw/zinc/44/44/50/1051444450.db2.gz TYJIEXNRAVVIMV-IBGZPJMESA-N 2 1 340.511 4.272 20 0 EIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](CCCOc2cccc3ccccc32)C1 ZINC001191367697 1051444454 /nfs/dbraw/zinc/44/44/54/1051444454.db2.gz TYJIEXNRAVVIMV-IBGZPJMESA-N 2 1 340.511 4.272 20 0 EIADMP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000774300339 1051545444 /nfs/dbraw/zinc/54/54/44/1051545444.db2.gz DQYCVOBYKMIRFJ-OXQOHEQNSA-N 2 1 329.532 4.454 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1ccc2cc(OC)ccc2c1 ZINC000163255643 1051559520 /nfs/dbraw/zinc/55/95/20/1051559520.db2.gz FLZBKIBHOAJHLJ-KKSFZXQISA-N 2 1 326.484 4.231 20 0 EIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000157003154 1051589842 /nfs/dbraw/zinc/58/98/42/1051589842.db2.gz RGKIAVNNJYRZDK-JKSUJKDBSA-N 2 1 329.488 4.356 20 0 EIADMP c1ccc(C[N@@H+]2CC=C(Nc3ccccc3C[NH+]3CCCC3)CC2)cc1 ZINC001175506243 1051640483 /nfs/dbraw/zinc/64/04/83/1051640483.db2.gz QGUHEEKADQJWRI-UHFFFAOYSA-N 2 1 347.506 4.484 20 0 EIADMP CC(C)C[N@H+](Cc1cc(-c2ccccc2)no1)CC1CC[NH+](C)CC1 ZINC001175601878 1051666991 /nfs/dbraw/zinc/66/69/91/1051666991.db2.gz WJESCJWBKTWTFC-UHFFFAOYSA-N 2 1 341.499 4.141 20 0 EIADMP C[C@H]1[C@@H](c2ccccc2)c2ccccc2CC[N@H+]1CCCn1ccnc1 ZINC001192334056 1051692572 /nfs/dbraw/zinc/69/25/72/1051692572.db2.gz GKCQQYDYDSECCJ-CVDCTZTESA-N 2 1 345.490 4.352 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158098268 1051709589 /nfs/dbraw/zinc/70/95/89/1051709589.db2.gz HVYGODQRFLCXCG-UKRRQHHQSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000158098268 1051709602 /nfs/dbraw/zinc/70/96/02/1051709602.db2.gz HVYGODQRFLCXCG-UKRRQHHQSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000158098711 1051711011 /nfs/dbraw/zinc/71/10/11/1051711011.db2.gz QPGLTDHJYHYLNR-WBVHZDCISA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000158098711 1051711028 /nfs/dbraw/zinc/71/10/28/1051711028.db2.gz QPGLTDHJYHYLNR-WBVHZDCISA-N 2 1 343.540 4.419 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000158121970 1051713960 /nfs/dbraw/zinc/71/39/60/1051713960.db2.gz ILBNBCXINLRJFN-UKRRQHHQSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000158121970 1051713976 /nfs/dbraw/zinc/71/39/76/1051713976.db2.gz ILBNBCXINLRJFN-UKRRQHHQSA-N 2 1 347.503 4.250 20 0 EIADMP Cc1ccc(CC[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@@H+](Cc2ccccc2)C3)cc1C ZINC001182817341 1051718137 /nfs/dbraw/zinc/71/81/37/1051718137.db2.gz SKGSCOPHILUZSF-HJOGWXRNSA-N 2 1 348.534 4.489 20 0 EIADMP C[C@H]1C[N@@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)C(C)(C)C1 ZINC001175758306 1051770834 /nfs/dbraw/zinc/77/08/34/1051770834.db2.gz LYVRIKXKJOFTSK-LJQANCHMSA-N 2 1 328.544 4.452 20 0 EIADMP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@@H+]1Cc1c(Cl)ccc2cccnc21 ZINC001183065558 1051782586 /nfs/dbraw/zinc/78/25/86/1051782586.db2.gz MBDFCQKDQJJFBW-DNVCBOLYSA-N 2 1 345.918 4.440 20 0 EIADMP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1Cc1c(Cl)ccc2cccnc21 ZINC001183065558 1051782596 /nfs/dbraw/zinc/78/25/96/1051782596.db2.gz MBDFCQKDQJJFBW-DNVCBOLYSA-N 2 1 345.918 4.440 20 0 EIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000159208190 1051822847 /nfs/dbraw/zinc/82/28/47/1051822847.db2.gz VROMFGHBCSKRLL-ZDUSSCGKSA-N 2 1 325.378 4.293 20 0 EIADMP Cc1nccn1CCC[N@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000159208190 1051822840 /nfs/dbraw/zinc/82/28/40/1051822840.db2.gz VROMFGHBCSKRLL-ZDUSSCGKSA-N 2 1 325.378 4.293 20 0 EIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000159208190 1051822853 /nfs/dbraw/zinc/82/28/53/1051822853.db2.gz VROMFGHBCSKRLL-ZDUSSCGKSA-N 2 1 325.378 4.293 20 0 EIADMP CC(C)(C)SCCC[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175973080 1051854986 /nfs/dbraw/zinc/85/49/86/1051854986.db2.gz ISJVETGHNNRGLE-PZJWPPBQSA-N 2 1 346.584 4.362 20 0 EIADMP CC(C)(C)SCCC[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175973080 1051854992 /nfs/dbraw/zinc/85/49/92/1051854992.db2.gz ISJVETGHNNRGLE-PZJWPPBQSA-N 2 1 346.584 4.362 20 0 EIADMP CC(C)(C)SCCC[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175973080 1051854994 /nfs/dbraw/zinc/85/49/94/1051854994.db2.gz ISJVETGHNNRGLE-PZJWPPBQSA-N 2 1 346.584 4.362 20 0 EIADMP CCCOc1cccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC001193251616 1051891717 /nfs/dbraw/zinc/89/17/17/1051891717.db2.gz VFFRQDNUKCHGGU-IEBWSBKVSA-N 2 1 330.516 4.218 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)ccc1OC1CCCC1 ZINC000159265028 1051966813 /nfs/dbraw/zinc/96/68/13/1051966813.db2.gz MEDWPNXLJCHCMB-SOLBZPMBSA-N 2 1 346.515 4.150 20 0 EIADMP COc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1OC1CCCC1 ZINC000159265028 1051966828 /nfs/dbraw/zinc/96/68/28/1051966828.db2.gz MEDWPNXLJCHCMB-SOLBZPMBSA-N 2 1 346.515 4.150 20 0 EIADMP CC[NH+](CC)c1ccc(Nc2ccc(OCC[NH+](C)C)cc2)cc1 ZINC001176229750 1051967484 /nfs/dbraw/zinc/96/74/84/1051967484.db2.gz RVBJJPZBDKEICM-UHFFFAOYSA-N 2 1 327.472 4.217 20 0 EIADMP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)ccc1C(F)(F)F ZINC001184301176 1051982641 /nfs/dbraw/zinc/98/26/41/1051982641.db2.gz GARQDWZFRRPWTE-YESZJQIVSA-N 2 1 340.433 4.176 20 0 EIADMP C[C@@H]1CCCC[C@H]1C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263198 1051987214 /nfs/dbraw/zinc/98/72/14/1051987214.db2.gz QYJJLQWTRJERCO-ZDFPQIBNSA-N 2 1 326.528 4.267 20 0 EIADMP C[C@@H]1CCCC[C@H]1C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263198 1051987229 /nfs/dbraw/zinc/98/72/29/1051987229.db2.gz QYJJLQWTRJERCO-ZDFPQIBNSA-N 2 1 326.528 4.267 20 0 EIADMP C[C@@H]1CCCC[C@H]1C[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263198 1051987241 /nfs/dbraw/zinc/98/72/41/1051987241.db2.gz QYJJLQWTRJERCO-ZDFPQIBNSA-N 2 1 326.528 4.267 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cncs1 ZINC000290210177 1052001868 /nfs/dbraw/zinc/00/18/68/1052001868.db2.gz PWFMAINYFBPMJR-AEFFLSMTSA-N 2 1 329.513 4.096 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cncs1 ZINC000290210177 1052001872 /nfs/dbraw/zinc/00/18/72/1052001872.db2.gz PWFMAINYFBPMJR-AEFFLSMTSA-N 2 1 329.513 4.096 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000164626016 1052035262 /nfs/dbraw/zinc/03/52/62/1052035262.db2.gz NWMPXXOEEAOXMY-KRWDZBQOSA-N 2 1 334.467 4.385 20 0 EIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)Cc3ccccc3CF)C2)s1 ZINC001194153712 1052089993 /nfs/dbraw/zinc/08/99/93/1052089993.db2.gz QRCAJGXSCGYJAW-QGZVFWFLSA-N 2 1 346.515 4.480 20 0 EIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)Cc3ccccc3CF)C2)s1 ZINC001194153712 1052090005 /nfs/dbraw/zinc/09/00/05/1052090005.db2.gz QRCAJGXSCGYJAW-QGZVFWFLSA-N 2 1 346.515 4.480 20 0 EIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)Cc3ccccc3CF)C2)s1 ZINC001194153712 1052090014 /nfs/dbraw/zinc/09/00/14/1052090014.db2.gz QRCAJGXSCGYJAW-QGZVFWFLSA-N 2 1 346.515 4.480 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(CN[C@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357195 1052634685 /nfs/dbraw/zinc/63/46/85/1052634685.db2.gz BZJDZANHKHMQGR-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(CN[C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623357195 1052634689 /nfs/dbraw/zinc/63/46/89/1052634689.db2.gz BZJDZANHKHMQGR-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(CN[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623357195 1052634694 /nfs/dbraw/zinc/63/46/94/1052634694.db2.gz BZJDZANHKHMQGR-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357195 1052634695 /nfs/dbraw/zinc/63/46/95/1052634695.db2.gz BZJDZANHKHMQGR-RXVVDRJESA-N 2 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+][C@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357195 1052634699 /nfs/dbraw/zinc/63/46/99/1052634699.db2.gz BZJDZANHKHMQGR-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623357195 1052634700 /nfs/dbraw/zinc/63/47/00/1052634700.db2.gz BZJDZANHKHMQGR-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@H]1CCCC[NH+]1Cc1ccc(C[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623357195 1052634705 /nfs/dbraw/zinc/63/47/05/1052634705.db2.gz BZJDZANHKHMQGR-RXVVDRJESA-N 3 1 343.559 4.023 20 0 EIADMP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623382631 1052640492 /nfs/dbraw/zinc/64/04/92/1052640492.db2.gz NQGYSOUHKZLTGJ-XJKSGUPXSA-N 2 1 328.422 4.099 20 0 EIADMP C[C@H]([NH2+]C1(CN[C@H]2CC[N@@H+](C)C(C)(C)C2)CCCC1)c1ccccc1 ZINC000623427614 1052654885 /nfs/dbraw/zinc/65/48/85/1052654885.db2.gz FTQLKYLPBODQAX-ICSRJNTNSA-N 2 1 343.559 4.112 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2CCc3[nH]c4ccc(Cl)cc4c3C2)CC1(C)C ZINC000623556904 1052679851 /nfs/dbraw/zinc/67/98/51/1052679851.db2.gz CZYOPUPPQZWLNN-LSDHHAIUSA-N 2 1 345.918 4.141 20 0 EIADMP C[N@@H+]1CC[C@@H]([NH2+]C2(c3cccc(OC(F)(F)F)c3)CC2)CC1(C)C ZINC000623561658 1052680029 /nfs/dbraw/zinc/68/00/29/1052680029.db2.gz URURHRAKEOKXIA-CQSZACIVSA-N 2 1 342.405 4.037 20 0 EIADMP C[N@H+]1CC[C@@H]([NH2+]C2(c3cccc(OC(F)(F)F)c3)CC2)CC1(C)C ZINC000623561658 1052680033 /nfs/dbraw/zinc/68/00/33/1052680033.db2.gz URURHRAKEOKXIA-CQSZACIVSA-N 2 1 342.405 4.037 20 0 EIADMP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000623657295 1052698250 /nfs/dbraw/zinc/69/82/50/1052698250.db2.gz MWEOBFASKINHLG-CQSZACIVSA-N 2 1 349.931 4.285 20 0 EIADMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000623657295 1052698253 /nfs/dbraw/zinc/69/82/53/1052698253.db2.gz MWEOBFASKINHLG-CQSZACIVSA-N 2 1 349.931 4.285 20 0 EIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC[N@H+]1C ZINC000623898299 1052832505 /nfs/dbraw/zinc/83/25/05/1052832505.db2.gz FAOWKUYTOFTHMU-RVZJWNSFSA-N 2 1 331.891 4.271 20 0 EIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000623999524 1052849992 /nfs/dbraw/zinc/84/99/92/1052849992.db2.gz SXFVBWIXIZANPC-CHWSQXEVSA-N 2 1 332.385 4.227 20 0 EIADMP COc1ccc2cc([C@H](C)[NH2+]C[C@@H]3CCCC[N@@H+](C)C3)ccc2c1 ZINC000624120026 1052867357 /nfs/dbraw/zinc/86/73/57/1052867357.db2.gz PROHRKJMUXKSMJ-IRXDYDNUSA-N 2 1 326.484 4.231 20 0 EIADMP COc1ccc(C2CCC([NH2+]C[C@@H]3CCCC[N@@H+](C)C3)CC2)cc1 ZINC000624121875 1052867634 /nfs/dbraw/zinc/86/76/34/1052867634.db2.gz FCTUWUIVOPKRLN-ZJRDLVKKSA-N 2 1 330.516 4.043 20 0 EIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c2ccccc12 ZINC000624119589 1052867643 /nfs/dbraw/zinc/86/76/43/1052867643.db2.gz FNMQOZKBFSLDEJ-SJORKVTESA-N 2 1 326.484 4.231 20 0 EIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000624124050 1052868420 /nfs/dbraw/zinc/86/84/20/1052868420.db2.gz VZJICWSWENQDBP-APIJFGDWSA-N 2 1 326.937 4.215 20 0 EIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000624125006 1052868445 /nfs/dbraw/zinc/86/84/45/1052868445.db2.gz QUOXXPWTDWFLTH-OLZOCXBDSA-N 2 1 332.385 4.227 20 0 EIADMP CC[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1nccn1C ZINC000182687054 1052946620 /nfs/dbraw/zinc/94/66/20/1052946620.db2.gz GDFIUTAGKPHJJH-FQEVSTJZSA-N 2 1 340.515 4.037 20 0 EIADMP Cc1cc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c2ccccc2n1 ZINC000185694718 1053020090 /nfs/dbraw/zinc/02/00/90/1053020090.db2.gz MEMZAHOUNBGOPK-QZTJIDSGSA-N 2 1 337.511 4.286 20 0 EIADMP C[C@@H]([NH2+]Cc1cc(Cl)cs1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382062849 1053137838 /nfs/dbraw/zinc/13/78/38/1053137838.db2.gz PYXCHVBJSWHZOZ-GDBMZVCRSA-N 2 1 334.916 4.402 20 0 EIADMP C[C@H]([NH2+]Cc1cnc2ccccc2c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382169298 1053151854 /nfs/dbraw/zinc/15/18/54/1053151854.db2.gz PKKQCTFSXKLHFD-AVRDEDQJSA-N 2 1 345.490 4.235 20 0 EIADMP CO[C@H](C)C[N@H+]1CCCCC[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001194940898 1053192429 /nfs/dbraw/zinc/19/24/29/1053192429.db2.gz CZCUHPVLRNEPBN-KNQAVFIVSA-N 2 1 344.543 4.178 20 0 EIADMP C[N@@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)C1CC(C)(C)C1 ZINC001194994382 1053221420 /nfs/dbraw/zinc/22/14/20/1053221420.db2.gz WGBWSISCEUDVBK-UHFFFAOYSA-N 2 1 328.544 4.452 20 0 EIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000383365056 1053328222 /nfs/dbraw/zinc/32/82/22/1053328222.db2.gz UXUUVOAWPQDXLT-RXVVDRJESA-N 2 1 326.459 4.389 20 0 EIADMP Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000383428559 1053338100 /nfs/dbraw/zinc/33/81/00/1053338100.db2.gz BIUMWIXIEPRFTR-FXAWDEMLSA-N 2 1 326.459 4.134 20 0 EIADMP Cc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1F ZINC000383428565 1053338305 /nfs/dbraw/zinc/33/83/05/1053338305.db2.gz BIUMWIXIEPRFTR-XLIONFOSSA-N 2 1 326.459 4.134 20 0 EIADMP CSc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000383677414 1053373420 /nfs/dbraw/zinc/37/34/20/1053373420.db2.gz NSCKIMJFFTYGOC-YLJYHZDGSA-N 2 1 340.536 4.409 20 0 EIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)CCO2 ZINC000764973527 1053395714 /nfs/dbraw/zinc/39/57/14/1053395714.db2.gz QSHIXLAIBUKJAC-KSZLIROESA-N 2 1 330.516 4.030 20 0 EIADMP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000765450261 1053550953 /nfs/dbraw/zinc/55/09/53/1053550953.db2.gz PBYNWNYEOWEPQC-MJGOQNOKSA-N 2 1 334.573 4.408 20 0 EIADMP C[C@H]([NH2+]Cc1cc2ccccc2o1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386238405 1053644997 /nfs/dbraw/zinc/64/49/97/1053644997.db2.gz BOAPTJQWEWMOHV-PXNSSMCTSA-N 2 1 334.463 4.433 20 0 EIADMP C[C@H]([NH2+]Cc1cc2ccccc2o1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386238405 1053645004 /nfs/dbraw/zinc/64/50/04/1053645004.db2.gz BOAPTJQWEWMOHV-PXNSSMCTSA-N 2 1 334.463 4.433 20 0 EIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](CCc1ccccc1)c1ccccn1 ZINC000866258949 1053667237 /nfs/dbraw/zinc/66/72/37/1053667237.db2.gz DQHDGMBGKDRLAH-XMSQKQJNSA-N 2 1 348.494 4.186 20 0 EIADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000386686417 1053819602 /nfs/dbraw/zinc/81/96/02/1053819602.db2.gz ZCRDBFWRGGDAMF-OPYAIIAOSA-N 2 1 338.495 4.084 20 0 EIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccccc1OCc1ccccc1 ZINC000386686417 1053819606 /nfs/dbraw/zinc/81/96/06/1053819606.db2.gz ZCRDBFWRGGDAMF-OPYAIIAOSA-N 2 1 338.495 4.084 20 0 EIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000386797876 1053829698 /nfs/dbraw/zinc/82/96/98/1053829698.db2.gz MFGQFWZLYGCAFY-LVCYWYKZSA-N 2 1 340.486 4.257 20 0 EIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1CC[C@@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026245 1054058994 /nfs/dbraw/zinc/05/89/94/1054058994.db2.gz BPFQQULXDYHFPO-GJZGRUSLSA-N 2 1 340.433 4.156 20 0 EIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CC[C@@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026245 1054058996 /nfs/dbraw/zinc/05/89/96/1054058996.db2.gz BPFQQULXDYHFPO-GJZGRUSLSA-N 2 1 340.433 4.156 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CC[C@@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026245 1054059009 /nfs/dbraw/zinc/05/90/09/1054059009.db2.gz BPFQQULXDYHFPO-GJZGRUSLSA-N 2 1 340.433 4.156 20 0 EIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CC[C@@H](c2cc(F)c(F)c(F)c2)C1(C)C ZINC001198026245 1054059021 /nfs/dbraw/zinc/05/90/21/1054059021.db2.gz BPFQQULXDYHFPO-GJZGRUSLSA-N 2 1 340.433 4.156 20 0 EIADMP CC(C)[N@@H+](C)Cc1cc(O[C@@H]2CC[NH+](C[C@@H](C)C(C)(C)C)C2)ccn1 ZINC000856558424 1054084134 /nfs/dbraw/zinc/08/41/34/1054084134.db2.gz IGNGOVBHKKLAIH-YLJYHZDGSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@@H]2CC[N@H+](C[C@@H](C)C(C)(C)C)C2)ccn1 ZINC000856558424 1054084139 /nfs/dbraw/zinc/08/41/39/1054084139.db2.gz IGNGOVBHKKLAIH-YLJYHZDGSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)[NH+](C)Cc1cc(O[C@@H]2CC[N@@H+](C[C@@H](C)C(C)(C)C)C2)ccn1 ZINC000856558424 1054084156 /nfs/dbraw/zinc/08/41/56/1054084156.db2.gz IGNGOVBHKKLAIH-YLJYHZDGSA-N 2 1 347.547 4.057 20 0 EIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cccc(O)c1F ZINC000872021966 1054337099 /nfs/dbraw/zinc/33/70/99/1054337099.db2.gz HACLAVIUFWOOAG-OAHLLOKOSA-N 2 1 330.447 4.222 20 0 EIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cccc(O)c1F ZINC000872021966 1054337117 /nfs/dbraw/zinc/33/71/17/1054337117.db2.gz HACLAVIUFWOOAG-OAHLLOKOSA-N 2 1 330.447 4.222 20 0 EIADMP CC[C@@H](CCC(F)(F)F)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000872022676 1054338096 /nfs/dbraw/zinc/33/80/96/1054338096.db2.gz XTAFRMFIXYMURL-KRWDZBQOSA-N 2 1 342.449 4.404 20 0 EIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)CC1 ZINC000872025631 1054341228 /nfs/dbraw/zinc/34/12/28/1054341228.db2.gz QJJOWZGLWOEVQT-RTWAWAEBSA-N 2 1 344.543 4.143 20 0 EIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CCOC3(CCCC3)C2)CC1 ZINC000872036360 1054353159 /nfs/dbraw/zinc/35/31/59/1054353159.db2.gz UJUJHQLUUILIJO-RXVVDRJESA-N 2 1 342.527 4.293 20 0 EIADMP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)C1 ZINC001199265879 1054375936 /nfs/dbraw/zinc/37/59/36/1054375936.db2.gz FANKTOINVGYHLA-YUXAGFNASA-N 2 1 344.543 4.498 20 0 EIADMP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)CC1 ZINC001199265540 1054376059 /nfs/dbraw/zinc/37/60/59/1054376059.db2.gz BJYQTINGSNXSEQ-BVYCBKJFSA-N 2 1 344.543 4.356 20 0 EIADMP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)CC1 ZINC001199265541 1054377252 /nfs/dbraw/zinc/37/72/52/1054377252.db2.gz BJYQTINGSNXSEQ-STZQEDGTSA-N 2 1 344.543 4.356 20 0 EIADMP CC[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2C[C@H](C)C[C@H](C)C2)CCO1 ZINC001199310372 1054387047 /nfs/dbraw/zinc/38/70/47/1054387047.db2.gz TZUJWHJDPWKWHF-GKJHBJHPSA-N 2 1 344.543 4.212 20 0 EIADMP COCC(C)(C)CC[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000872104451 1054389338 /nfs/dbraw/zinc/38/93/38/1054389338.db2.gz FYHBJJCDVKOSIX-UHFFFAOYSA-N 2 1 332.532 4.082 20 0 EIADMP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199321419 1054391934 /nfs/dbraw/zinc/39/19/34/1054391934.db2.gz XXEXTFHVJZQEAW-CALCHBBNSA-N 2 1 348.579 4.103 20 0 EIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(C(F)(F)F)nc1 ZINC000872130650 1054406596 /nfs/dbraw/zinc/40/65/96/1054406596.db2.gz PPDNDUIRIBZDHE-GFCCVEGCSA-N 2 1 329.410 4.014 20 0 EIADMP CCCC[NH+]1CCC([NH2+]Cc2ccc(OC)c(O[C@H](C)CC)c2)CC1 ZINC001199784159 1054471380 /nfs/dbraw/zinc/47/13/80/1054471380.db2.gz PSTHACWOVPFHQL-QGZVFWFLSA-N 2 1 348.531 4.227 20 0 EIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000058060969 1054552216 /nfs/dbraw/zinc/55/22/16/1054552216.db2.gz PJOOXZBTHHVZNZ-NRFANRHFSA-N 2 1 338.495 4.086 20 0 EIADMP CC(C)[NH+](CCC[NH2+]Cc1cccc(C(=O)OC(C)(C)C)c1)C(C)C ZINC001200921477 1054575047 /nfs/dbraw/zinc/57/50/47/1054575047.db2.gz GIURHILPFUBXSQ-UHFFFAOYSA-N 2 1 348.531 4.240 20 0 EIADMP Cc1oc(-c2ccccc2)nc1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859215697 1054645227 /nfs/dbraw/zinc/64/52/27/1054645227.db2.gz OTYQTBCODJRYQN-UHFFFAOYSA-N 2 1 349.478 4.344 20 0 EIADMP Cc1oc(-c2ccccc2)nc1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859215697 1054645235 /nfs/dbraw/zinc/64/52/35/1054645235.db2.gz OTYQTBCODJRYQN-UHFFFAOYSA-N 2 1 349.478 4.344 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000061029070 1054737827 /nfs/dbraw/zinc/73/78/27/1054737827.db2.gz TXDUZUIUWHWESU-KRWDZBQOSA-N 2 1 326.484 4.203 20 0 EIADMP COc1ccc2ccccc2c1C[NH2+]CCC[N@H+]1CCCC[C@@H]1C ZINC000061029070 1054737834 /nfs/dbraw/zinc/73/78/34/1054737834.db2.gz TXDUZUIUWHWESU-KRWDZBQOSA-N 2 1 326.484 4.203 20 0 EIADMP C[N@@H+](CCC[NH2+]Cc1ccccc1C(F)(F)F)Cc1ccccc1 ZINC000061556860 1054761318 /nfs/dbraw/zinc/76/13/18/1054761318.db2.gz WTNXTQJYDIUPKO-UHFFFAOYSA-N 2 1 336.401 4.317 20 0 EIADMP c1csc(C[N@@H+]2CCC3(C2)CC[NH+](C[C@@H]2CC=CCC2)CC3)c1 ZINC001201410362 1054804025 /nfs/dbraw/zinc/80/40/25/1054804025.db2.gz JPGPYHYPAQMQPE-GOSISDBHSA-N 2 1 330.541 4.392 20 0 EIADMP CCC(CC)C[N@@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201528634 1054845821 /nfs/dbraw/zinc/84/58/21/1054845821.db2.gz VFZSXAINRAPSLZ-JBACZVJFSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201528634 1054845826 /nfs/dbraw/zinc/84/58/26/1054845826.db2.gz VFZSXAINRAPSLZ-JBACZVJFSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201528634 1054845828 /nfs/dbraw/zinc/84/58/28/1054845828.db2.gz VFZSXAINRAPSLZ-JBACZVJFSA-N 2 1 329.532 4.050 20 0 EIADMP CCC(CC)C[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201528634 1054845833 /nfs/dbraw/zinc/84/58/33/1054845833.db2.gz VFZSXAINRAPSLZ-JBACZVJFSA-N 2 1 329.532 4.050 20 0 EIADMP CCCC[C@H](CC)C[N@H+]1CC[C@@H]2[C@@H](CCN2Cc2nccs2)C1 ZINC001201566371 1054850783 /nfs/dbraw/zinc/85/07/83/1054850783.db2.gz SPGPANVGVLYGMR-OKZBNKHCSA-N 2 1 335.561 4.256 20 0 EIADMP CCCCCC[N@H+]1CC[C@@]2(C[NH+](CC3CC3)C[C@H]2COCC2CC2)C1 ZINC001201747064 1054894957 /nfs/dbraw/zinc/89/49/57/1054894957.db2.gz TVSDQUVIXNUKTE-VXKWHMMOSA-N 2 1 348.575 4.027 20 0 EIADMP CCCCCC[NH+]1CC[C@]2(C1)C[N@H+](CC1CC1)C[C@H]2COCC1CC1 ZINC001201747064 1054894965 /nfs/dbraw/zinc/89/49/65/1054894965.db2.gz TVSDQUVIXNUKTE-VXKWHMMOSA-N 2 1 348.575 4.027 20 0 EIADMP CCCCCC[NH+]1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCC1CC1 ZINC001201747064 1054894970 /nfs/dbraw/zinc/89/49/70/1054894970.db2.gz TVSDQUVIXNUKTE-VXKWHMMOSA-N 2 1 348.575 4.027 20 0 EIADMP CCCCCC[N@@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201755216 1054898540 /nfs/dbraw/zinc/89/85/40/1054898540.db2.gz UPSUUPRRYPCDPR-JBACZVJFSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3ccccn3)[C@H]2C1 ZINC001201755216 1054898544 /nfs/dbraw/zinc/89/85/44/1054898544.db2.gz UPSUUPRRYPCDPR-JBACZVJFSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201755216 1054898549 /nfs/dbraw/zinc/89/85/49/1054898549.db2.gz UPSUUPRRYPCDPR-JBACZVJFSA-N 2 1 329.532 4.194 20 0 EIADMP CCCCCC[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001201755216 1054898553 /nfs/dbraw/zinc/89/85/53/1054898553.db2.gz UPSUUPRRYPCDPR-JBACZVJFSA-N 2 1 329.532 4.194 20 0 EIADMP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+](CC[C@H](C)CCC=C(C)C)CC1 ZINC001201981661 1054958922 /nfs/dbraw/zinc/95/89/22/1054958922.db2.gz QLDWCFNTVMZDNC-CTNGQTDRSA-N 2 1 336.564 4.334 20 0 EIADMP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+](CC[C@@H](C)CCC=C(C)C)CC1 ZINC001201981663 1054959505 /nfs/dbraw/zinc/95/95/05/1054959505.db2.gz QLDWCFNTVMZDNC-FPOVZHCZSA-N 2 1 336.564 4.334 20 0 EIADMP Cc1c(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)ccnc1F ZINC000862270940 1055041911 /nfs/dbraw/zinc/04/19/11/1055041911.db2.gz AMSVKXUJQVLLHH-MRXNPFEDSA-N 2 1 341.474 4.051 20 0 EIADMP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC000877733351 1055112499 /nfs/dbraw/zinc/11/24/99/1055112499.db2.gz RYCIXAVCMBNNNL-UQNRQAKVSA-N 2 1 344.480 4.096 20 0 EIADMP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1 ZINC000877733351 1055112510 /nfs/dbraw/zinc/11/25/10/1055112510.db2.gz RYCIXAVCMBNNNL-UQNRQAKVSA-N 2 1 344.480 4.096 20 0 EIADMP NC(CCC(F)(F)F)=[NH+]OCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000863491454 1055215267 /nfs/dbraw/zinc/21/52/67/1055215267.db2.gz PAXCQEWPNWJDHV-UHFFFAOYSA-N 2 1 343.393 4.013 20 0 EIADMP C[C@@H]([NH2+]CCCc1cccs1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000542818643 1056119788 /nfs/dbraw/zinc/11/97/88/1056119788.db2.gz XZRXJUXHEZVART-MJGOQNOKSA-N 2 1 328.525 4.181 20 0 EIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000354505720 1056521079 /nfs/dbraw/zinc/52/10/79/1056521079.db2.gz QPZQVKBPDZLCER-IUDNXUCKSA-N 2 1 331.426 4.319 20 0 EIADMP Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000180187121 1058422086 /nfs/dbraw/zinc/42/20/86/1058422086.db2.gz ZOFQLQLXSOWFLR-MRXNPFEDSA-N 2 1 340.515 4.333 20 0 EIADMP FC(F)(F)c1cccc(C2([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000182331403 1059811727 /nfs/dbraw/zinc/81/17/27/1059811727.db2.gz SCHWLBLEPDEOJM-IAGOWNOFSA-N 2 1 338.417 4.301 20 0 EIADMP C[N@H+](Cc1cccc2cnccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000183295007 1059980276 /nfs/dbraw/zinc/98/02/76/1059980276.db2.gz CYYNSBRIAXXUFC-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cccc2cnccc21)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000183295007 1059980309 /nfs/dbraw/zinc/98/03/09/1059980309.db2.gz CYYNSBRIAXXUFC-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[NH+](Cc1cccc2cnccc21)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000183295007 1059980336 /nfs/dbraw/zinc/98/03/36/1059980336.db2.gz CYYNSBRIAXXUFC-HXUWFJFHSA-N 2 1 345.490 4.189 20 0 EIADMP C[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)CCC[C@@H]1C[NH3+] ZINC001205995742 1060512040 /nfs/dbraw/zinc/51/20/40/1060512040.db2.gz PTMFGELENJHKPF-VXGBXAGGSA-N 2 1 334.813 4.166 20 0 EIADMP Cc1ccc(CC[NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC001168993193 1060567715 /nfs/dbraw/zinc/56/77/15/1060567715.db2.gz IRYYHKDZFJPNFV-NPHXMPSESA-N 2 1 336.523 4.284 20 0 EIADMP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]Cc1cc(F)cc(F)c1 ZINC001168991191 1060585857 /nfs/dbraw/zinc/58/58/57/1060585857.db2.gz BBYMRWLMASCFDN-HOTGVXAUSA-N 2 1 344.449 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(Cc3ccccc3)CCC(F)(F)CC1)C2 ZINC001169117139 1060647187 /nfs/dbraw/zinc/64/71/87/1060647187.db2.gz WKNUQGUQEBLWMZ-LDLYASANSA-N 2 1 348.481 4.392 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)Cc1ccc(C(F)(F)F)cc1)C2 ZINC001169118327 1060647359 /nfs/dbraw/zinc/64/73/59/1060647359.db2.gz HNYZGPHUNWKEKH-BJWYYQGGSA-N 2 1 340.433 4.241 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1cccc(Br)c1)C2 ZINC001169147570 1060665783 /nfs/dbraw/zinc/66/57/83/1060665783.db2.gz UYZZPIZTUFZZLE-MLHJIOFPSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1cccc(Br)c1)C2 ZINC001169147570 1060665793 /nfs/dbraw/zinc/66/57/93/1060665793.db2.gz UYZZPIZTUFZZLE-MLHJIOFPSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1cccc(Br)c1)C2 ZINC001169147570 1060665797 /nfs/dbraw/zinc/66/57/97/1060665797.db2.gz UYZZPIZTUFZZLE-MLHJIOFPSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1cccc(Br)c1)C2 ZINC001169147570 1060665810 /nfs/dbraw/zinc/66/58/10/1060665810.db2.gz UYZZPIZTUFZZLE-MLHJIOFPSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1cccc(Br)c1)C2 ZINC001169147577 1060666180 /nfs/dbraw/zinc/66/61/80/1060666180.db2.gz UYZZPIZTUFZZLE-XMTFNYHQSA-N 2 1 349.316 4.211 20 0 EIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1cccc(Br)c1)C2 ZINC001169147577 1060666186 /nfs/dbraw/zinc/66/61/86/1060666186.db2.gz UYZZPIZTUFZZLE-XMTFNYHQSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1cccc(Br)c1)C2 ZINC001169147577 1060666194 /nfs/dbraw/zinc/66/61/94/1060666194.db2.gz UYZZPIZTUFZZLE-XMTFNYHQSA-N 2 1 349.316 4.211 20 0 EIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1cccc(Br)c1)C2 ZINC001169147577 1060666203 /nfs/dbraw/zinc/66/62/03/1060666203.db2.gz UYZZPIZTUFZZLE-XMTFNYHQSA-N 2 1 349.316 4.211 20 0 EIADMP 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 1060674303 /nfs/dbraw/zinc/67/43/03/1060674303.db2.gz FBUZOQODHKRDRY-HAGHYFMRSA-N 2 1 342.527 4.278 20 0 EIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2ccccc2NC(=O)OC(C)(C)C)CC1 ZINC001169230263 1060707158 /nfs/dbraw/zinc/70/71/58/1060707158.db2.gz URTIGADPJVBRNP-HNNXBMFYSA-N 2 1 347.503 4.169 20 0 EIADMP C[C@H]1C[N@@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CCC[C@H]1C[NH3+] ZINC001206011909 1060819038 /nfs/dbraw/zinc/81/90/38/1060819038.db2.gz HANOUXUPGYBENU-AAEUAGOBSA-N 2 1 334.813 4.166 20 0 EIADMP CCC[C@@]1(COC)CCC[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001169780630 1060967864 /nfs/dbraw/zinc/96/78/64/1060967864.db2.gz OKHLTRJELCJOND-QFIPXVFZSA-N 2 1 344.543 4.454 20 0 EIADMP COc1cc(N2CCCC[C@H]2CC[NH+]2CCCC2)[nH+]c2ccccc21 ZINC001165046891 721973495 /nfs/dbraw/zinc/97/34/95/721973495.db2.gz CMFLUUFCJUFKMC-KRWDZBQOSA-N 2 1 339.483 4.088 20 0 EIADMP