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+]1CCCC[C@H]1CC[NH+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548409 1026097173 /nfs/dbraw/zinc/09/71/73/1026097173.db2.gz MXZTZBHSYLMIPB-MSOLQXFVSA-N 2 1 331.460 3.649 20 5 EHBDMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548409 1026097191 /nfs/dbraw/zinc/09/71/91/1026097191.db2.gz MXZTZBHSYLMIPB-MSOLQXFVSA-N 2 1 331.460 3.649 20 5 EHBDMP C[NH+]1CCCC[C@H]1CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548409 1026097203 /nfs/dbraw/zinc/09/72/03/1026097203.db2.gz MXZTZBHSYLMIPB-MSOLQXFVSA-N 2 1 331.460 3.649 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]CCC[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504900471 1029027617 /nfs/dbraw/zinc/02/76/17/1029027617.db2.gz YNRNLMWPUODOBA-INIZCTEOSA-N 2 1 349.475 3.766 20 5 EHBDMP CC(C)c1ccc(C[NH2+]CCC[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000061558274 1034347116 /nfs/dbraw/zinc/34/71/16/1034347116.db2.gz NDKUNOCEONKKRW-UHFFFAOYSA-N 2 1 333.476 3.930 20 5 EHBDMP O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)o2)c1 ZINC000591282633 1037320218 /nfs/dbraw/zinc/32/02/18/1037320218.db2.gz IMLVUKFKPLEQSQ-HNNXBMFYSA-N 2 1 341.411 3.619 20 5 EHBDMP C[C@H](C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000433150155 1040927372 /nfs/dbraw/zinc/92/73/72/1040927372.db2.gz VRRFTATWRBMZSS-RDTXWAMCSA-N 2 1 331.460 3.639 20 5 EHBDMP C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272380199 1121596672 /nfs/dbraw/zinc/59/66/72/1121596672.db2.gz BRNLJXUGSOIIOA-APWZRJJASA-N 2 1 339.439 3.595 20 5 EHBDMP C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272380199 1121596678 /nfs/dbraw/zinc/59/66/78/1121596678.db2.gz BRNLJXUGSOIIOA-APWZRJJASA-N 2 1 339.439 3.595 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](Cc1ccccc1)C[C@@H](C)C[NH3+] ZINC001173220889 1132003960 /nfs/dbraw/zinc/00/39/60/1132003960.db2.gz HSRSGIVLFUZHAS-DLBZAZTESA-N 2 1 341.455 3.623 20 5 EHBDMP CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC[NH2+]CC1 ZINC000414720663 1017155117 /nfs/dbraw/zinc/15/51/17/1017155117.db2.gz ZIZSWXQVIAAIDN-OAHLLOKOSA-N 2 1 343.427 3.819 20 5 EHBDMP C[C@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186636 1020542952 /nfs/dbraw/zinc/54/29/52/1020542952.db2.gz BPFDIQXJBPXMOY-YQQAZPJKSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186636 1020542962 /nfs/dbraw/zinc/54/29/62/1020542962.db2.gz BPFDIQXJBPXMOY-YQQAZPJKSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186636 1020542967 /nfs/dbraw/zinc/54/29/67/1020542967.db2.gz BPFDIQXJBPXMOY-YQQAZPJKSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@@H]1C[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371218 1024856145 /nfs/dbraw/zinc/85/61/45/1024856145.db2.gz LYFSNRFNLKWPGL-VXGBXAGGSA-N 2 1 349.818 3.677 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451552113 1026105258 /nfs/dbraw/zinc/10/52/58/1026105258.db2.gz VQYRHQSTVZTRPE-GOSISDBHSA-N 2 1 342.443 3.760 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451552113 1026105272 /nfs/dbraw/zinc/10/52/72/1026105272.db2.gz VQYRHQSTVZTRPE-GOSISDBHSA-N 2 1 342.443 3.760 20 5 EHBDMP CC1CC[NH+](CCC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000447516942 1030239619 /nfs/dbraw/zinc/23/96/19/1030239619.db2.gz IOTJHWYOQRLQGB-LJQANCHMSA-N 2 1 331.460 3.684 20 5 EHBDMP O=[N+]([O-])c1ccccc1/C=C/CNC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000598992025 1033644517 /nfs/dbraw/zinc/64/45/17/1033644517.db2.gz JQPCZTQHQCRJDA-IWHGQQBYSA-N 2 1 329.444 3.605 20 5 EHBDMP O=[N+]([O-])c1ccccc1/C=C/CNC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000598992025 1033644526 /nfs/dbraw/zinc/64/45/26/1033644526.db2.gz JQPCZTQHQCRJDA-IWHGQQBYSA-N 2 1 329.444 3.605 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417358000 1039719886 /nfs/dbraw/zinc/71/98/86/1039719886.db2.gz HIUQUHHQQKWJLM-BEFAXECRSA-N 2 1 331.460 3.684 20 5 EHBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433115167 1040778555 /nfs/dbraw/zinc/77/85/55/1040778555.db2.gz HVUCDKTWRGWGNW-UGSOOPFHSA-N 2 1 342.443 3.748 20 5 EHBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCCn1cc[nH+]c1C ZINC000344892317 1044657342 /nfs/dbraw/zinc/65/73/42/1044657342.db2.gz XRSFXAJTZFKMDM-QINSGFPZSA-N 2 1 328.416 3.573 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000272722562 1121963871 /nfs/dbraw/zinc/96/38/71/1121963871.db2.gz XSTVDMBNNZSCNK-OWCLPIDISA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000272722562 1121963878 /nfs/dbraw/zinc/96/38/78/1121963878.db2.gz XSTVDMBNNZSCNK-OWCLPIDISA-N 2 1 331.460 3.898 20 5 EHBDMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000152652743 1123727621 /nfs/dbraw/zinc/72/76/21/1123727621.db2.gz MSVNPZWOQGSMKV-CQSZACIVSA-N 2 1 335.448 3.519 20 5 EHBDMP O=[N+]([O-])c1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c(Cl)c1 ZINC000182062895 1125140875 /nfs/dbraw/zinc/14/08/75/1125140875.db2.gz KDZFHAFMMJFUPN-UHFFFAOYSA-N 2 1 337.851 3.556 20 5 EHBDMP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000735493607 1131353648 /nfs/dbraw/zinc/35/36/48/1131353648.db2.gz YRAHKXJKGUYCEQ-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000735493607 1131353655 /nfs/dbraw/zinc/35/36/55/1131353655.db2.gz YRAHKXJKGUYCEQ-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788538975 1134139541 /nfs/dbraw/zinc/13/95/41/1134139541.db2.gz JAJIHOQDKYHSLF-OWCLPIDISA-N 2 1 348.491 3.586 20 5 EHBDMP C[C@@H]1C[C@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000130638800 1138466188 /nfs/dbraw/zinc/46/61/88/1138466188.db2.gz ORYPXUNXPRKABX-RHSMWYFYSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000130638800 1138466191 /nfs/dbraw/zinc/46/61/91/1138466191.db2.gz ORYPXUNXPRKABX-RHSMWYFYSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000130638800 1138466193 /nfs/dbraw/zinc/46/61/93/1138466193.db2.gz ORYPXUNXPRKABX-RHSMWYFYSA-N 2 1 343.427 3.769 20 5 EHBDMP Cc1c(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722997 1140166779 /nfs/dbraw/zinc/16/67/79/1140166779.db2.gz DVMCVPBQPOBQTI-WBVHZDCISA-N 2 1 331.460 3.646 20 5 EHBDMP Cc1c(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722997 1140166780 /nfs/dbraw/zinc/16/67/80/1140166780.db2.gz DVMCVPBQPOBQTI-WBVHZDCISA-N 2 1 331.460 3.646 20 5 EHBDMP C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-n2ccnc2)cs1 ZINC000348674980 1141564757 /nfs/dbraw/zinc/56/47/57/1141564757.db2.gz PDNAATNUNFLCES-UHFFFAOYSA-N 2 1 342.424 3.517 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000153972781 1014720621 /nfs/dbraw/zinc/72/06/21/1014720621.db2.gz RZPMTPUPWPVGFK-CQSZACIVSA-N 2 1 346.431 3.629 20 5 EHBDMP CCCn1ccnc1CCC[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000290331660 1018207798 /nfs/dbraw/zinc/20/77/98/1018207798.db2.gz DUXJSPBPIOTATA-RMKNXTFCSA-N 2 1 342.443 3.779 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000290331660 1018207812 /nfs/dbraw/zinc/20/78/12/1018207812.db2.gz DUXJSPBPIOTATA-RMKNXTFCSA-N 2 1 342.443 3.779 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000290331660 1018207824 /nfs/dbraw/zinc/20/78/24/1018207824.db2.gz DUXJSPBPIOTATA-RMKNXTFCSA-N 2 1 342.443 3.779 20 5 EHBDMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399496 1018584084 /nfs/dbraw/zinc/58/40/84/1018584084.db2.gz JGULALVSRFBCNA-KBXCAEBGSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399496 1018584092 /nfs/dbraw/zinc/58/40/92/1018584092.db2.gz JGULALVSRFBCNA-KBXCAEBGSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399496 1018584100 /nfs/dbraw/zinc/58/41/00/1018584100.db2.gz JGULALVSRFBCNA-KBXCAEBGSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399496 1018584111 /nfs/dbraw/zinc/58/41/11/1018584111.db2.gz JGULALVSRFBCNA-KBXCAEBGSA-N 2 1 343.427 3.627 20 5 EHBDMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000580221184 1018818843 /nfs/dbraw/zinc/81/88/43/1018818843.db2.gz FFDWYDVQLLAHST-UYAOXDASSA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000580221184 1018818850 /nfs/dbraw/zinc/81/88/50/1018818850.db2.gz FFDWYDVQLLAHST-UYAOXDASSA-N 2 1 339.439 3.562 20 5 EHBDMP CCC[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000178255747 1022325899 /nfs/dbraw/zinc/32/58/99/1022325899.db2.gz QRIDFRMGAQRENN-IBGZPJMESA-N 2 1 331.460 3.900 20 5 EHBDMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093694 1034078412 /nfs/dbraw/zinc/07/84/12/1034078412.db2.gz DPIRGJCUGCTNFT-RDJZCZTQSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093694 1034078422 /nfs/dbraw/zinc/07/84/22/1034078422.db2.gz DPIRGJCUGCTNFT-RDJZCZTQSA-N 2 1 331.460 3.676 20 5 EHBDMP O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)o2)c1 ZINC000591282634 1037319583 /nfs/dbraw/zinc/31/95/83/1037319583.db2.gz IMLVUKFKPLEQSQ-OAHLLOKOSA-N 2 1 341.411 3.619 20 5 EHBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000470172459 1038426219 /nfs/dbraw/zinc/42/62/19/1038426219.db2.gz XABKJRCBHAUGGU-VBKFSLOCSA-N 2 1 331.460 3.803 20 5 EHBDMP CC1(C)C[C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170624 1040960372 /nfs/dbraw/zinc/96/03/72/1040960372.db2.gz YGOJIYJMFHWIAY-LBTNJELSSA-N 2 1 329.444 3.534 20 5 EHBDMP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170624 1040960400 /nfs/dbraw/zinc/96/04/00/1040960400.db2.gz YGOJIYJMFHWIAY-LBTNJELSSA-N 2 1 329.444 3.534 20 5 EHBDMP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170624 1040960427 /nfs/dbraw/zinc/96/04/27/1040960427.db2.gz YGOJIYJMFHWIAY-LBTNJELSSA-N 2 1 329.444 3.534 20 5 EHBDMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131945 1123165401 /nfs/dbraw/zinc/16/54/01/1123165401.db2.gz BTHPXNWILXEPAA-AEFFLSMTSA-N 2 1 339.439 3.768 20 5 EHBDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000340592636 1032520618 /nfs/dbraw/zinc/52/06/18/1032520618.db2.gz BXMXEIDAWMVGEV-UHFFFAOYSA-N 2 1 327.428 3.679 20 5 EHBDMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656696 1017107709 /nfs/dbraw/zinc/10/77/09/1017107709.db2.gz IZXJBBZCULKIES-UONOGXRCSA-N 2 1 345.468 3.883 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592491867 1032928312 /nfs/dbraw/zinc/92/83/12/1032928312.db2.gz MQIAAEHXGPLPSC-BBWFWOEESA-N 2 1 331.460 3.676 20 5 EHBDMP C[C@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372448 1024855815 /nfs/dbraw/zinc/85/58/15/1024855815.db2.gz RHEHSJHGXYMHCN-NWDGAFQWSA-N 2 1 349.818 3.677 20 5 EHBDMP C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC[NH2+]CC1 ZINC000435390753 1024874946 /nfs/dbraw/zinc/87/49/46/1024874946.db2.gz TYVKOUSPMVTISK-UHFFFAOYSA-N 2 1 331.441 3.507 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC[NH2+]CC1 ZINC000435390753 1024874954 /nfs/dbraw/zinc/87/49/54/1024874954.db2.gz TYVKOUSPMVTISK-UHFFFAOYSA-N 2 1 331.441 3.507 20 5 EHBDMP C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1[NH3+] ZINC000435395021 1024882349 /nfs/dbraw/zinc/88/23/49/1024882349.db2.gz NUSAJONQPWLZPL-BZNIZROVSA-N 2 1 349.818 3.677 20 5 EHBDMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1[NH3+] ZINC000435395021 1024882362 /nfs/dbraw/zinc/88/23/62/1024882362.db2.gz NUSAJONQPWLZPL-BZNIZROVSA-N 2 1 349.818 3.677 20 5 EHBDMP CCC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1cccc([N+](=O)[O-])c1 ZINC000178702058 1028121999 /nfs/dbraw/zinc/12/19/99/1028121999.db2.gz JZHKCVMIRSYDRO-KBXCAEBGSA-N 2 1 330.432 3.867 20 5 EHBDMP C[C@@H]([NH2+][C@H](CN)C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284197 1028322148 /nfs/dbraw/zinc/32/21/48/1028322148.db2.gz WPNATHNSKKNLCX-BXUZGUMPSA-N 2 1 331.441 3.711 20 5 EHBDMP C[C@@H]([NH2+][C@H](C[NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284197 1028322157 /nfs/dbraw/zinc/32/21/57/1028322157.db2.gz WPNATHNSKKNLCX-BXUZGUMPSA-N 2 1 331.441 3.711 20 5 EHBDMP O=[N+]([O-])c1ccccc1/C=C\CNC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000598992027 1033644858 /nfs/dbraw/zinc/64/48/58/1033644858.db2.gz JQPCZTQHQCRJDA-POZKEBTKSA-N 2 1 329.444 3.605 20 5 EHBDMP O=[N+]([O-])c1ccccc1/C=C\CNC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000598992027 1033644864 /nfs/dbraw/zinc/64/48/64/1033644864.db2.gz JQPCZTQHQCRJDA-POZKEBTKSA-N 2 1 329.444 3.605 20 5 EHBDMP O=[N+]([O-])c1cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cs1 ZINC000122096198 1034355729 /nfs/dbraw/zinc/35/57/29/1034355729.db2.gz AWDPDEZMUOGOON-UHFFFAOYSA-N 2 1 337.489 3.744 20 5 EHBDMP CC(C)[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCCC1 ZINC000480535607 1039655413 /nfs/dbraw/zinc/65/54/13/1039655413.db2.gz KWTUTTHXVYZFLU-QUCCMNQESA-N 2 1 345.487 3.626 20 5 EHBDMP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000236920759 1039765963 /nfs/dbraw/zinc/76/59/63/1039765963.db2.gz FUYGSXWUCGGWTI-UHFFFAOYSA-N 2 1 333.457 3.788 20 5 EHBDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900961 1131884276 /nfs/dbraw/zinc/88/42/76/1131884276.db2.gz HWRZXGJUXDCXJK-VQIMIIECSA-N 2 1 345.487 3.696 20 5 EHBDMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909652 1131916810 /nfs/dbraw/zinc/91/68/10/1131916810.db2.gz UTFRZSUOMSHIGI-MOXGXCLJSA-N 2 1 345.487 3.551 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001173226550 1132006293 /nfs/dbraw/zinc/00/62/93/1132006293.db2.gz KJSGJZPSVPNKMY-HKUYNNGSSA-N 2 1 345.487 3.866 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001173226560 1132007124 /nfs/dbraw/zinc/00/71/24/1132007124.db2.gz KJSGJZPSVPNKMY-PKOBYXMFSA-N 2 1 345.487 3.866 20 5 EHBDMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023197 1137565385 /nfs/dbraw/zinc/56/53/85/1137565385.db2.gz CZRCRVJCVPEKQF-UONOGXRCSA-N 2 1 337.489 3.699 20 5 EHBDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023197 1137565386 /nfs/dbraw/zinc/56/53/86/1137565386.db2.gz CZRCRVJCVPEKQF-UONOGXRCSA-N 2 1 337.489 3.699 20 5 EHBDMP Cc1c(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722980 1140166219 /nfs/dbraw/zinc/16/62/19/1140166219.db2.gz DVMCVPBQPOBQTI-RDJZCZTQSA-N 2 1 331.460 3.646 20 5 EHBDMP Cc1c(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722980 1140166222 /nfs/dbraw/zinc/16/62/22/1140166222.db2.gz DVMCVPBQPOBQTI-RDJZCZTQSA-N 2 1 331.460 3.646 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000414785337 1017198659 /nfs/dbraw/zinc/19/86/59/1017198659.db2.gz SMSWCTHUKXSGKG-DLBZAZTESA-N 2 1 331.460 3.540 20 5 EHBDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]1 ZINC000414944937 1022958108 /nfs/dbraw/zinc/95/81/08/1022958108.db2.gz HRKYYBAYAJVPBA-NEPJUHHUSA-N 2 1 349.818 3.738 20 5 EHBDMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000475335966 1026490088 /nfs/dbraw/zinc/49/00/88/1026490088.db2.gz NNDGMKYYZYGJOB-RYRKJORJSA-N 2 1 333.476 3.626 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC3(CC[NH2+]3)CC2)s1 ZINC000422559699 1027790175 /nfs/dbraw/zinc/79/01/75/1027790175.db2.gz DYUBLTTVPMQXLN-UHFFFAOYSA-N 2 1 343.452 3.651 20 5 EHBDMP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423374184 1028379490 /nfs/dbraw/zinc/37/94/90/1028379490.db2.gz HZADJUBNGGCULX-LMMKCTJWSA-N 2 1 325.412 3.544 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000504926268 1029072035 /nfs/dbraw/zinc/07/20/35/1029072035.db2.gz HEYVYOIKRBTDGY-OWCLPIDISA-N 2 1 349.500 3.682 20 5 EHBDMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000160481529 1030788030 /nfs/dbraw/zinc/78/80/30/1030788030.db2.gz IRSXAKWDBWUFPS-OAHLLOKOSA-N 2 1 331.460 3.961 20 5 EHBDMP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2c1CC[NH2+]C2 ZINC000595890271 1034020783 /nfs/dbraw/zinc/02/07/83/1034020783.db2.gz DSYBUAXYBKZXHV-UHFFFAOYSA-N 2 1 339.439 3.651 20 5 EHBDMP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596096621 1034078074 /nfs/dbraw/zinc/07/80/74/1034078074.db2.gz VMEDWXJMCQELRH-AEFFLSMTSA-N 2 1 345.487 3.628 20 5 EHBDMP Cc1c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150541 1037622327 /nfs/dbraw/zinc/62/23/27/1037622327.db2.gz FURLWNZUSZQCEC-IAGOWNOFSA-N 2 1 333.476 3.922 20 5 EHBDMP C[C@H](C[NH+]1CCCCCC1)[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000480660228 1039824592 /nfs/dbraw/zinc/82/45/92/1039824592.db2.gz FJIVVIBNADVIOX-DLBZAZTESA-N 2 1 333.476 3.770 20 5 EHBDMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136451 1123167553 /nfs/dbraw/zinc/16/75/53/1123167553.db2.gz IWCAWLSRKOURNS-WMZOPIPTSA-N 2 1 339.439 3.768 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC[N@H+](CC2CCCCC2)C1 ZINC001173219499 1132003230 /nfs/dbraw/zinc/00/32/30/1132003230.db2.gz COJWEAUVNCFSFX-LPHOPBHVSA-N 2 1 345.487 3.770 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC[N@@H+](CC2CCCCC2)C1 ZINC001173219499 1132003236 /nfs/dbraw/zinc/00/32/36/1132003236.db2.gz COJWEAUVNCFSFX-LPHOPBHVSA-N 2 1 345.487 3.770 20 5 EHBDMP C[C@@H](CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[NH+](C)C ZINC001203270812 1133900060 /nfs/dbraw/zinc/90/00/60/1133900060.db2.gz OZHYQBVAOMWFHJ-ZDUSSCGKSA-N 2 1 333.457 3.753 20 5 EHBDMP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020635 1137565034 /nfs/dbraw/zinc/56/50/34/1137565034.db2.gz JNBMRRLXXUCOMU-ZDUSSCGKSA-N 2 1 331.391 3.646 20 5 EHBDMP Cc1c(CN2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475453 1023246774 /nfs/dbraw/zinc/24/67/74/1023246774.db2.gz XAKNSKZHOLWYIM-FUHWJXTLSA-N 2 1 345.487 3.990 20 5 EHBDMP C[C@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372449 1024857679 /nfs/dbraw/zinc/85/76/79/1024857679.db2.gz RHEHSJHGXYMHCN-RYUDHWBXSA-N 2 1 349.818 3.677 20 5 EHBDMP c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000729684804 1028553319 /nfs/dbraw/zinc/55/33/19/1028553319.db2.gz WWXALVNUZANNJU-WOJBJXKFSA-N 2 1 346.474 3.946 20 5 EHBDMP c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000729684804 1028553328 /nfs/dbraw/zinc/55/33/28/1028553328.db2.gz WWXALVNUZANNJU-WOJBJXKFSA-N 2 1 346.474 3.946 20 5 EHBDMP CC(C)[N@@H+](C)Cc1cccc(CNCc2csc([N+](=O)[O-])c2)c1 ZINC000236666918 1035038395 /nfs/dbraw/zinc/03/83/95/1035038395.db2.gz RREKFKYNVJBVHW-UHFFFAOYSA-N 2 1 333.457 3.786 20 5 EHBDMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)c1 ZINC000236666918 1035038408 /nfs/dbraw/zinc/03/84/08/1035038408.db2.gz RREKFKYNVJBVHW-UHFFFAOYSA-N 2 1 333.457 3.786 20 5 EHBDMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)c1 ZINC000236666918 1035038412 /nfs/dbraw/zinc/03/84/12/1035038412.db2.gz RREKFKYNVJBVHW-UHFFFAOYSA-N 2 1 333.457 3.786 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CCCC2 ZINC000417328257 1039672451 /nfs/dbraw/zinc/67/24/51/1039672451.db2.gz SFFPXTDINIHVMQ-FRQCXROJSA-N 2 1 329.444 3.579 20 5 EHBDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173351 1040994073 /nfs/dbraw/zinc/99/40/73/1040994073.db2.gz GHBAZFJDXQENIC-RDTXWAMCSA-N 2 1 331.460 3.639 20 5 EHBDMP C[N@@H+]1CC=C(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000494987435 1120923865 /nfs/dbraw/zinc/92/38/65/1120923865.db2.gz JGRYGNRJCFJAQX-FQEVSTJZSA-N 2 1 337.423 3.536 20 5 EHBDMP O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000915714994 1121602798 /nfs/dbraw/zinc/60/27/98/1121602798.db2.gz SULGAKDLDLZIMC-UHFFFAOYSA-N 2 1 349.450 3.822 20 5 EHBDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900958 1131884156 /nfs/dbraw/zinc/88/41/56/1131884156.db2.gz HWRZXGJUXDCXJK-APWZRJJASA-N 2 1 345.487 3.696 20 5 EHBDMP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cc[nH+]cc1C ZINC001174540193 1132389445 /nfs/dbraw/zinc/38/94/45/1132389445.db2.gz XMHYGXZKFVNXDQ-UHFFFAOYSA-N 2 1 344.418 3.947 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1[N+](=O)[O-] ZINC000179397948 1139754535 /nfs/dbraw/zinc/75/45/35/1139754535.db2.gz SHNKMKSFWUYOMM-OAHLLOKOSA-N 2 1 349.475 3.765 20 5 EHBDMP CC(C)c1ccc(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697212 1032153901 /nfs/dbraw/zinc/15/39/01/1032153901.db2.gz GIRXXFUBWSKOFA-GOSISDBHSA-N 2 1 345.487 3.882 20 5 EHBDMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000592397468 1032770042 /nfs/dbraw/zinc/77/00/42/1032770042.db2.gz LQKDYFVZYYTCGJ-ZTNFWEORSA-N 2 1 339.439 3.591 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@]4(CC[NH2+]C4)C3)s2)cc1 ZINC000262107567 1019927443 /nfs/dbraw/zinc/92/74/43/1019927443.db2.gz WCNOCIJVANMVRP-SFHVURJKSA-N 2 1 343.452 3.509 20 5 EHBDMP C[NH+]1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000237169137 1028115839 /nfs/dbraw/zinc/11/58/39/1028115839.db2.gz CKZJSMZULFJDFI-UHFFFAOYSA-N 2 1 331.441 3.507 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)cc1[N+](=O)[O-] ZINC000154141318 1029731073 /nfs/dbraw/zinc/73/10/73/1029731073.db2.gz SMTSRYDHQNRPOY-BPUTZDHNSA-N 2 1 335.448 3.517 20 5 EHBDMP COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000595023873 1033615488 /nfs/dbraw/zinc/61/54/88/1033615488.db2.gz ZDYMKGXOENHQBS-HOTGVXAUSA-N 2 1 349.475 3.622 20 5 EHBDMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000599071669 1033712010 /nfs/dbraw/zinc/71/20/10/1033712010.db2.gz SFHPGSYSQCZAHC-AOIWGVFYSA-N 2 1 345.487 3.628 20 5 EHBDMP C[NH+](C)CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C(C)(C)C ZINC000761525444 1037109388 /nfs/dbraw/zinc/10/93/88/1037109388.db2.gz KATZRSDCGYJXIR-HNNXBMFYSA-N 2 1 327.856 3.704 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCCn1cc[nH+]c1C ZINC000344892315 1044658322 /nfs/dbraw/zinc/65/83/22/1044658322.db2.gz XRSFXAJTZFKMDM-NTCAYCPXSA-N 2 1 328.416 3.573 20 5 EHBDMP CC[N@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444201 1130208707 /nfs/dbraw/zinc/20/87/07/1130208707.db2.gz XUPBLFHDHOYJRW-MAUKXSAKSA-N 2 1 349.475 3.544 20 5 EHBDMP C[C@H]1C[C@@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000130639358 1138466163 /nfs/dbraw/zinc/46/61/63/1138466163.db2.gz ORYPXUNXPRKABX-YOEHRIQHSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000130639358 1138466166 /nfs/dbraw/zinc/46/61/66/1138466166.db2.gz ORYPXUNXPRKABX-YOEHRIQHSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000130639358 1138466170 /nfs/dbraw/zinc/46/61/70/1138466170.db2.gz ORYPXUNXPRKABX-YOEHRIQHSA-N 2 1 343.427 3.769 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000191483079 1140466231 /nfs/dbraw/zinc/46/62/31/1140466231.db2.gz ZHUVLNUQVZBHRJ-HNNXBMFYSA-N 2 1 330.432 3.827 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000191483079 1140466234 /nfs/dbraw/zinc/46/62/34/1140466234.db2.gz ZHUVLNUQVZBHRJ-HNNXBMFYSA-N 2 1 330.432 3.827 20 5 EHBDMP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000449233803 1032328574 /nfs/dbraw/zinc/32/85/74/1032328574.db2.gz NEFQQRHDNBOIIQ-NUJGCVRESA-N 2 1 345.487 3.768 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)s1 ZINC000427105299 1023217740 /nfs/dbraw/zinc/21/77/40/1023217740.db2.gz XHNPQKXHRIYAGJ-XJKSGUPXSA-N 2 1 343.452 3.507 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)s1 ZINC000427105299 1023217751 /nfs/dbraw/zinc/21/77/51/1023217751.db2.gz XHNPQKXHRIYAGJ-XJKSGUPXSA-N 2 1 343.452 3.507 20 5 EHBDMP C[C@@H]1C[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371215 1024857596 /nfs/dbraw/zinc/85/75/96/1024857596.db2.gz LYFSNRFNLKWPGL-NEPJUHHUSA-N 2 1 349.818 3.677 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCC[NH+](C)C1 ZINC000508579737 1029873153 /nfs/dbraw/zinc/87/31/53/1029873153.db2.gz PWQOCJQOUNYMAE-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCC[NH+](C)C1 ZINC000508579737 1029873160 /nfs/dbraw/zinc/87/31/60/1029873160.db2.gz PWQOCJQOUNYMAE-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCC[N@H+](C)C1 ZINC000508579737 1029873166 /nfs/dbraw/zinc/87/31/66/1029873166.db2.gz PWQOCJQOUNYMAE-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCC[N@@H+](C)C1 ZINC000508579737 1029873171 /nfs/dbraw/zinc/87/31/71/1029873171.db2.gz PWQOCJQOUNYMAE-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC(C)(C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000447595107 1030334254 /nfs/dbraw/zinc/33/42/54/1030334254.db2.gz LDEUCPOENGMPPT-GOSISDBHSA-N 2 1 331.460 3.684 20 5 EHBDMP Cc1c([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094861 1034079041 /nfs/dbraw/zinc/07/90/41/1034079041.db2.gz NQWOMVHQIHTQEW-NVXWUHKLSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150536 1037623172 /nfs/dbraw/zinc/62/31/72/1037623172.db2.gz FURLWNZUSZQCEC-DLBZAZTESA-N 2 1 333.476 3.922 20 5 EHBDMP CC[NH+](CC)CC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000735491153 1131350068 /nfs/dbraw/zinc/35/00/68/1131350068.db2.gz ASVDIENOEYIEQX-UHFFFAOYSA-N 2 1 339.867 3.802 20 5 EHBDMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903495 1131886014 /nfs/dbraw/zinc/88/60/14/1131886014.db2.gz HBRRSSTVUBMJRE-MSOLQXFVSA-N 2 1 345.487 3.695 20 5 EHBDMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903495 1131886026 /nfs/dbraw/zinc/88/60/26/1131886026.db2.gz HBRRSSTVUBMJRE-MSOLQXFVSA-N 2 1 345.487 3.695 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001173219313 1132003507 /nfs/dbraw/zinc/00/35/07/1132003507.db2.gz ATMIYKWVIVZBGE-DOTOQJQBSA-N 2 1 331.460 3.522 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001173219313 1132003512 /nfs/dbraw/zinc/00/35/12/1132003512.db2.gz ATMIYKWVIVZBGE-DOTOQJQBSA-N 2 1 331.460 3.522 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173220593 1132004472 /nfs/dbraw/zinc/00/44/72/1132004472.db2.gz DCJDBQFOAVTFQD-QGPMSJSTSA-N 2 1 331.460 3.650 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859215044 1137008092 /nfs/dbraw/zinc/00/80/92/1137008092.db2.gz VAQWOEPTCNPZRI-OAHLLOKOSA-N 2 1 327.428 3.849 20 5 EHBDMP Cc1c(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722960 1140166362 /nfs/dbraw/zinc/16/63/62/1140166362.db2.gz DVMCVPBQPOBQTI-NVXWUHKLSA-N 2 1 331.460 3.646 20 5 EHBDMP Cc1c(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722960 1140166364 /nfs/dbraw/zinc/16/63/64/1140166364.db2.gz DVMCVPBQPOBQTI-NVXWUHKLSA-N 2 1 331.460 3.646 20 5 EHBDMP CC(C)c1ccc(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697214 1032154373 /nfs/dbraw/zinc/15/43/73/1032154373.db2.gz GIRXXFUBWSKOFA-SFHVURJKSA-N 2 1 345.487 3.882 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536835051 1032330176 /nfs/dbraw/zinc/33/01/76/1032330176.db2.gz ZGSGKAUHUBYGMZ-IAGOWNOFSA-N 2 1 333.476 3.922 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000536835051 1032330192 /nfs/dbraw/zinc/33/01/92/1032330192.db2.gz ZGSGKAUHUBYGMZ-IAGOWNOFSA-N 2 1 333.476 3.922 20 5 EHBDMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414656208 1017107871 /nfs/dbraw/zinc/10/78/71/1017107871.db2.gz HZWKOUGIYNJYFY-HIFRSBDPSA-N 2 1 345.468 3.883 20 5 EHBDMP C[C@H]([NH3+])[C@H](C)[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000415013061 1017408891 /nfs/dbraw/zinc/40/88/91/1017408891.db2.gz JYXHIEIEDDZFGA-RYUDHWBXSA-N 2 1 349.818 3.866 20 5 EHBDMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399521 1018584754 /nfs/dbraw/zinc/58/47/54/1018584754.db2.gz JGULALVSRFBCNA-KSSFIOAISA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399521 1018584762 /nfs/dbraw/zinc/58/47/62/1018584762.db2.gz JGULALVSRFBCNA-KSSFIOAISA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399521 1018584769 /nfs/dbraw/zinc/58/47/69/1018584769.db2.gz JGULALVSRFBCNA-KSSFIOAISA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399521 1018584775 /nfs/dbraw/zinc/58/47/75/1018584775.db2.gz JGULALVSRFBCNA-KSSFIOAISA-N 2 1 343.427 3.627 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](C2CC2)C2CC[NH2+]CC2)o1 ZINC000592424353 1032812111 /nfs/dbraw/zinc/81/21/11/1032812111.db2.gz KVSGLCQQKUZPFP-UHFFFAOYSA-N 2 1 341.411 3.571 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](C2CC2)C2CC[NH2+]CC2)o1 ZINC000592424353 1032812125 /nfs/dbraw/zinc/81/21/25/1032812125.db2.gz KVSGLCQQKUZPFP-UHFFFAOYSA-N 2 1 341.411 3.571 20 5 EHBDMP CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1[NH3+] ZINC000592427623 1032816799 /nfs/dbraw/zinc/81/67/99/1032816799.db2.gz JFBZSKYVLDHTCJ-CZUORRHYSA-N 2 1 345.468 3.883 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000506851260 1022632212 /nfs/dbraw/zinc/63/22/12/1022632212.db2.gz MYFKNVDAPYAXCU-UHFFFAOYSA-N 2 1 333.476 3.847 20 5 EHBDMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471009 1023232503 /nfs/dbraw/zinc/23/25/03/1023232503.db2.gz OVPOHBGFOKIVKP-HKUYNNGSSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471009 1023232509 /nfs/dbraw/zinc/23/25/09/1023232509.db2.gz OVPOHBGFOKIVKP-HKUYNNGSSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471009 1023232522 /nfs/dbraw/zinc/23/25/22/1023232522.db2.gz OVPOHBGFOKIVKP-HKUYNNGSSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471009 1023232531 /nfs/dbraw/zinc/23/25/31/1023232531.db2.gz OVPOHBGFOKIVKP-HKUYNNGSSA-N 2 1 345.487 3.724 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H]4[NH2+]CC[C@@H]4C3)s2)cc1 ZINC000427128683 1023237009 /nfs/dbraw/zinc/23/70/09/1023237009.db2.gz OQJAOUIRYFJEKE-PBHICJAKSA-N 2 1 343.452 3.507 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4[NH2+]CC[C@@H]4C3)s2)cc1 ZINC000427128683 1023237017 /nfs/dbraw/zinc/23/70/17/1023237017.db2.gz OQJAOUIRYFJEKE-PBHICJAKSA-N 2 1 343.452 3.507 20 5 EHBDMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435371618 1024857849 /nfs/dbraw/zinc/85/78/49/1024857849.db2.gz OABUPUAUYZRSOP-AWEZNQCLSA-N 2 1 345.468 3.755 20 5 EHBDMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435371618 1024857865 /nfs/dbraw/zinc/85/78/65/1024857865.db2.gz OABUPUAUYZRSOP-AWEZNQCLSA-N 2 1 345.468 3.755 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC[NH2+]CC1 ZINC000435383965 1024869215 /nfs/dbraw/zinc/86/92/15/1024869215.db2.gz KSKSPWDTYZYZQG-UHFFFAOYSA-N 2 1 331.441 3.507 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451552123 1026105906 /nfs/dbraw/zinc/10/59/06/1026105906.db2.gz VQYRHQSTVZTRPE-SFHVURJKSA-N 2 1 342.443 3.760 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451552123 1026105911 /nfs/dbraw/zinc/10/59/11/1026105911.db2.gz VQYRHQSTVZTRPE-SFHVURJKSA-N 2 1 342.443 3.760 20 5 EHBDMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000550665497 1033836273 /nfs/dbraw/zinc/83/62/73/1033836273.db2.gz KRUQTVFYVBMCOE-AZUAARDMSA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000550665497 1033836287 /nfs/dbraw/zinc/83/62/87/1033836287.db2.gz KRUQTVFYVBMCOE-AZUAARDMSA-N 2 1 339.439 3.562 20 5 EHBDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc([N+](=O)[O-])c1C ZINC000609029865 1033985003 /nfs/dbraw/zinc/98/50/03/1033985003.db2.gz XSXMMBZOSLHWAQ-UHFFFAOYSA-N 2 1 341.455 3.987 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC3CC3)C1)CCC2 ZINC000596092475 1034077697 /nfs/dbraw/zinc/07/76/97/1034077697.db2.gz ANXVASDKIBDLBR-OXJNMPFZSA-N 2 1 343.471 3.684 20 5 EHBDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309056 1039663685 /nfs/dbraw/zinc/66/36/85/1039663685.db2.gz DFKABBOVOIVWRR-DNVCBOLYSA-N 2 1 331.460 3.684 20 5 EHBDMP C[C@@H](C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[NH+]1CCCC1 ZINC001648832608 1120050859 /nfs/dbraw/zinc/05/08/59/1120050859.db2.gz DBNPBRUVSVROPT-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP Cc1cc(NC[C@H]2CC[N@H+](C(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000326334686 1121648825 /nfs/dbraw/zinc/64/88/25/1121648825.db2.gz IJIYDXWYDQBPOJ-CQSZACIVSA-N 2 1 328.416 3.594 20 5 EHBDMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000152652632 1123727387 /nfs/dbraw/zinc/72/73/87/1123727387.db2.gz MSVNPZWOQGSMKV-AWEZNQCLSA-N 2 1 335.448 3.519 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000245535391 1130233091 /nfs/dbraw/zinc/23/30/91/1130233091.db2.gz WOMHUDFMWBGYAS-IRXDYDNUSA-N 2 1 331.460 3.772 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000245535391 1130233096 /nfs/dbraw/zinc/23/30/96/1130233096.db2.gz WOMHUDFMWBGYAS-IRXDYDNUSA-N 2 1 331.460 3.772 20 5 EHBDMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168998118 1132627372 /nfs/dbraw/zinc/62/73/72/1132627372.db2.gz ILULUGZIBZHFQP-VJANTYMQSA-N 2 1 337.508 3.584 20 5 EHBDMP C[C@H]1C[C@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000130639010 1138466311 /nfs/dbraw/zinc/46/63/11/1138466311.db2.gz ORYPXUNXPRKABX-WMLDXEAASA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000130639010 1138466312 /nfs/dbraw/zinc/46/63/12/1138466312.db2.gz ORYPXUNXPRKABX-WMLDXEAASA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000130639010 1138466314 /nfs/dbraw/zinc/46/63/14/1138466314.db2.gz ORYPXUNXPRKABX-WMLDXEAASA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000592397467 1032769811 /nfs/dbraw/zinc/76/98/11/1032769811.db2.gz LQKDYFVZYYTCGJ-CVAIRZPRSA-N 2 1 339.439 3.591 20 5 EHBDMP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414942848 1022928834 /nfs/dbraw/zinc/92/88/34/1022928834.db2.gz NCOKEUMGQYQKJU-BDJLRTHQSA-N 2 1 349.818 3.596 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000420311166 1027455625 /nfs/dbraw/zinc/45/56/25/1027455625.db2.gz GYRRKUNYFUJASP-MDYRTPRTSA-N 2 1 339.439 3.639 20 5 EHBDMP [NH3+]CC[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000904405542 1032020766 /nfs/dbraw/zinc/02/07/66/1032020766.db2.gz NJMVCYVNBAVRTE-LBPRGKRZSA-N 2 1 349.818 3.679 20 5 EHBDMP CN(Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076109833 1037322913 /nfs/dbraw/zinc/32/29/13/1037322913.db2.gz WRKRLLLLXQNTMD-IBGZPJMESA-N 2 1 339.439 3.549 20 5 EHBDMP C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109833 1037322930 /nfs/dbraw/zinc/32/29/30/1037322930.db2.gz WRKRLLLLXQNTMD-IBGZPJMESA-N 2 1 339.439 3.549 20 5 EHBDMP C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109833 1037322951 /nfs/dbraw/zinc/32/29/51/1037322951.db2.gz WRKRLLLLXQNTMD-IBGZPJMESA-N 2 1 339.439 3.549 20 5 EHBDMP C[NH+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076109833 1037322968 /nfs/dbraw/zinc/32/29/68/1037322968.db2.gz WRKRLLLLXQNTMD-IBGZPJMESA-N 2 1 339.439 3.549 20 5 EHBDMP C[NH+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076109833 1037322987 /nfs/dbraw/zinc/32/29/87/1037322987.db2.gz WRKRLLLLXQNTMD-IBGZPJMESA-N 2 1 339.439 3.549 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCCC2 ZINC000417325525 1039682939 /nfs/dbraw/zinc/68/29/39/1039682939.db2.gz QUPYHZKXGOECOY-IBGZPJMESA-N 2 1 329.444 3.579 20 5 EHBDMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990958 1040022389 /nfs/dbraw/zinc/02/23/89/1040022389.db2.gz HEUIXBDWCXXSOL-BQFCYCMXSA-N 2 1 333.476 3.624 20 5 EHBDMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990958 1040022392 /nfs/dbraw/zinc/02/23/92/1040022392.db2.gz HEUIXBDWCXXSOL-BQFCYCMXSA-N 2 1 333.476 3.624 20 5 EHBDMP C[C@@H](C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000433150147 1040928179 /nfs/dbraw/zinc/92/81/79/1040928179.db2.gz VRRFTATWRBMZSS-KBXCAEBGSA-N 2 1 331.460 3.639 20 5 EHBDMP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CC[NH+](C)CC1 ZINC000132211350 1129882386 /nfs/dbraw/zinc/88/23/86/1129882386.db2.gz LLZPQGIBUYZCSQ-UHFFFAOYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](C)CCCC1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000767004850 1132928108 /nfs/dbraw/zinc/92/81/08/1132928108.db2.gz UUPXBDSSIUSUDN-UHFFFAOYSA-N 2 1 339.867 3.802 20 5 EHBDMP O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000817906659 1136845296 /nfs/dbraw/zinc/84/52/96/1136845296.db2.gz AQHNUWHMHALHJT-DJIMGWMZSA-N 2 1 337.851 3.649 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000872079459 1137570228 /nfs/dbraw/zinc/57/02/28/1137570228.db2.gz MYLGMJGGZDZBCE-KGLIPLIRSA-N 2 1 337.489 3.699 20 5 EHBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000271131121 1141312400 /nfs/dbraw/zinc/31/24/00/1141312400.db2.gz LVWKBPFAOWCOTK-AWEZNQCLSA-N 2 1 349.500 3.682 20 5 EHBDMP CC(C)c1ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000246876436 1014812859 /nfs/dbraw/zinc/81/28/59/1014812859.db2.gz SWPGCFRYHJZMBF-FUHWJXTLSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1[N+](=O)[O-] ZINC000246876436 1014812873 /nfs/dbraw/zinc/81/28/73/1014812873.db2.gz SWPGCFRYHJZMBF-FUHWJXTLSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1[N+](=O)[O-] ZINC000246876436 1014812888 /nfs/dbraw/zinc/81/28/88/1014812888.db2.gz SWPGCFRYHJZMBF-FUHWJXTLSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1[N+](=O)[O-] ZINC000246876436 1014812903 /nfs/dbraw/zinc/81/29/03/1014812903.db2.gz SWPGCFRYHJZMBF-FUHWJXTLSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000246876436 1014812916 /nfs/dbraw/zinc/81/29/16/1014812916.db2.gz SWPGCFRYHJZMBF-FUHWJXTLSA-N 2 1 331.460 3.634 20 5 EHBDMP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946165 1024904925 /nfs/dbraw/zinc/90/49/25/1024904925.db2.gz BYSGAORBLGWFDM-RYUDHWBXSA-N 2 1 349.818 3.820 20 5 EHBDMP C[C@H]1C[C@@H]([NH3+])CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946165 1024904934 /nfs/dbraw/zinc/90/49/34/1024904934.db2.gz BYSGAORBLGWFDM-RYUDHWBXSA-N 2 1 349.818 3.820 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1[N+](=O)[O-] ZINC000152630267 1026470845 /nfs/dbraw/zinc/47/08/45/1026470845.db2.gz NDVIXQUIKWNNEE-ZDUSSCGKSA-N 2 1 349.475 3.953 20 5 EHBDMP CCC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1cccc([N+](=O)[O-])c1 ZINC000178702039 1028121758 /nfs/dbraw/zinc/12/17/58/1028121758.db2.gz JZHKCVMIRSYDRO-RDTXWAMCSA-N 2 1 330.432 3.867 20 5 EHBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000572887070 1028196890 /nfs/dbraw/zinc/19/68/90/1028196890.db2.gz JIYGWDOIXGOULX-UIRWJGRMSA-N 2 1 343.471 3.662 20 5 EHBDMP CC(C)(C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000447595108 1030333800 /nfs/dbraw/zinc/33/38/00/1030333800.db2.gz LDEUCPOENGMPPT-SFHVURJKSA-N 2 1 331.460 3.684 20 5 EHBDMP CC[N@@H+](CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1)CC1CC1 ZINC000536142398 1030919801 /nfs/dbraw/zinc/91/98/01/1030919801.db2.gz WBXQAKPHLCORIL-UHFFFAOYSA-N 2 1 345.487 3.929 20 5 EHBDMP O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000163320426 1034145999 /nfs/dbraw/zinc/14/59/99/1034145999.db2.gz NMYKLKNGIFNWKS-UHFFFAOYSA-N 2 1 337.851 3.556 20 5 EHBDMP CC(C)c1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1[N+](=O)[O-] ZINC000092043388 1129531612 /nfs/dbraw/zinc/53/16/12/1129531612.db2.gz SWPGCFRYHJZMBF-AEFFLSMTSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1[N+](=O)[O-] ZINC000092043388 1129531615 /nfs/dbraw/zinc/53/16/15/1129531615.db2.gz SWPGCFRYHJZMBF-AEFFLSMTSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1[N+](=O)[O-] ZINC000092043388 1129531617 /nfs/dbraw/zinc/53/16/17/1129531617.db2.gz SWPGCFRYHJZMBF-AEFFLSMTSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000092043388 1129531621 /nfs/dbraw/zinc/53/16/21/1129531621.db2.gz SWPGCFRYHJZMBF-AEFFLSMTSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)[NH+](CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)C ZINC001172896659 1131901357 /nfs/dbraw/zinc/90/13/57/1131901357.db2.gz QLQWZNACYQPRQC-SFHVURJKSA-N 2 1 333.476 3.551 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173226147 1132006779 /nfs/dbraw/zinc/00/67/79/1132006779.db2.gz VBIXJVSMUJPJNL-ZTFGCOKTSA-N 2 1 331.460 3.508 20 5 EHBDMP COc1ccc(C[C@@H](C)[N@@H+](C(C)C)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001170322374 1134747787 /nfs/dbraw/zinc/74/77/87/1134747787.db2.gz FHTKAAKEZQGDQD-DJIMGWMZSA-N 2 1 349.475 3.515 20 5 EHBDMP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000580345453 1019120582 /nfs/dbraw/zinc/12/05/82/1019120582.db2.gz JHKWGCYYRXHJTR-GOSISDBHSA-N 2 1 329.444 3.579 20 5 EHBDMP CC(C)c1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000513641966 1019897930 /nfs/dbraw/zinc/89/79/30/1019897930.db2.gz CDTJHQQRWAMGLU-INIZCTEOSA-N 2 1 333.476 3.930 20 5 EHBDMP C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183186666 1020542550 /nfs/dbraw/zinc/54/25/50/1020542550.db2.gz BPFDIQXJBPXMOY-ZMSDIMECSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183186666 1020542558 /nfs/dbraw/zinc/54/25/58/1020542558.db2.gz BPFDIQXJBPXMOY-ZMSDIMECSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183186666 1020542563 /nfs/dbraw/zinc/54/25/63/1020542563.db2.gz BPFDIQXJBPXMOY-ZMSDIMECSA-N 2 1 331.460 3.898 20 5 EHBDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587022 1030321504 /nfs/dbraw/zinc/32/15/04/1030321504.db2.gz PWWBJURSHFAEKY-JXFKEZNVSA-N 2 1 345.487 3.930 20 5 EHBDMP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946163 1031258461 /nfs/dbraw/zinc/25/84/61/1031258461.db2.gz BYSGAORBLGWFDM-NEPJUHHUSA-N 2 1 349.818 3.820 20 5 EHBDMP C[C@@H]1C[C@@H]([NH3+])CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946163 1031258476 /nfs/dbraw/zinc/25/84/76/1031258476.db2.gz BYSGAORBLGWFDM-NEPJUHHUSA-N 2 1 349.818 3.820 20 5 EHBDMP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000598994320 1033648041 /nfs/dbraw/zinc/64/80/41/1033648041.db2.gz JUNTYYGIAQVNRF-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000598994320 1033648047 /nfs/dbraw/zinc/64/80/47/1033648047.db2.gz JUNTYYGIAQVNRF-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278966363 1043099080 /nfs/dbraw/zinc/09/90/80/1043099080.db2.gz BSTAOPNNOCHXCX-SFHVURJKSA-N 2 1 342.443 3.892 20 5 EHBDMP CC1(C)C[C@@H]([NH2+]C2CC[NH+](C3CCC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279003348 1043165723 /nfs/dbraw/zinc/16/57/23/1043165723.db2.gz GASXFJKXRMYIPJ-LJQANCHMSA-N 2 1 343.471 3.924 20 5 EHBDMP [NH3+]CCC[N@@H+](C1CCCCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899942 1131883845 /nfs/dbraw/zinc/88/38/45/1131883845.db2.gz QESPRYUDPBOKSC-LJQANCHMSA-N 2 1 345.487 3.826 20 5 EHBDMP [NH3+]CCC[C@@H]1CCCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172904907 1131885980 /nfs/dbraw/zinc/88/59/80/1131885980.db2.gz GUDRRTXDURNVHV-LPHOPBHVSA-N 2 1 345.487 3.683 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001198818849 1135859759 /nfs/dbraw/zinc/85/97/59/1135859759.db2.gz BRJRALKJMCHOJR-FFZOFVMBSA-N 2 1 343.471 3.772 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001198818849 1135859762 /nfs/dbraw/zinc/85/97/62/1135859762.db2.gz BRJRALKJMCHOJR-FFZOFVMBSA-N 2 1 343.471 3.772 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1C[C@@]23C[N@H+](C)C[C@]2(C1)CCCC3 ZINC001198818849 1135859765 /nfs/dbraw/zinc/85/97/65/1135859765.db2.gz BRJRALKJMCHOJR-FFZOFVMBSA-N 2 1 343.471 3.772 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1C[C@@]23C[N@@H+](C)C[C@]2(C1)CCCC3 ZINC001198818849 1135859767 /nfs/dbraw/zinc/85/97/67/1135859767.db2.gz BRJRALKJMCHOJR-FFZOFVMBSA-N 2 1 343.471 3.772 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134922593 1138713475 /nfs/dbraw/zinc/71/34/75/1138713475.db2.gz UGWKHLIUPLNLSS-IDHHARJASA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134922593 1138713477 /nfs/dbraw/zinc/71/34/77/1138713477.db2.gz UGWKHLIUPLNLSS-IDHHARJASA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134922593 1138713480 /nfs/dbraw/zinc/71/34/80/1138713480.db2.gz UGWKHLIUPLNLSS-IDHHARJASA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134922593 1138713485 /nfs/dbraw/zinc/71/34/85/1138713485.db2.gz UGWKHLIUPLNLSS-IDHHARJASA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000269672669 1141134142 /nfs/dbraw/zinc/13/41/42/1141134142.db2.gz RKPNDQBAFOYLGJ-VKJFTORMSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000269672669 1141134144 /nfs/dbraw/zinc/13/41/44/1141134144.db2.gz RKPNDQBAFOYLGJ-VKJFTORMSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000269672669 1141134146 /nfs/dbraw/zinc/13/41/46/1141134146.db2.gz RKPNDQBAFOYLGJ-VKJFTORMSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000269672669 1141134147 /nfs/dbraw/zinc/13/41/47/1141134147.db2.gz RKPNDQBAFOYLGJ-VKJFTORMSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000269672669 1141134149 /nfs/dbraw/zinc/13/41/49/1141134149.db2.gz RKPNDQBAFOYLGJ-VKJFTORMSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000269672669 1141134152 /nfs/dbraw/zinc/13/41/52/1141134152.db2.gz RKPNDQBAFOYLGJ-VKJFTORMSA-N 2 1 329.444 3.605 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000271131124 1141311998 /nfs/dbraw/zinc/31/19/98/1141311998.db2.gz LVWKBPFAOWCOTK-CQSZACIVSA-N 2 1 349.500 3.682 20 5 EHBDMP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000449233804 1032329222 /nfs/dbraw/zinc/32/92/22/1032329222.db2.gz NEFQQRHDNBOIIQ-RYRKJORJSA-N 2 1 345.487 3.768 20 5 EHBDMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]1 ZINC000414944943 1017345820 /nfs/dbraw/zinc/34/58/20/1017345820.db2.gz HRKYYBAYAJVPBA-VXGBXAGGSA-N 2 1 349.818 3.738 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000052210063 1018869368 /nfs/dbraw/zinc/86/93/68/1018869368.db2.gz NWHRBBXVSSQNDU-UHFFFAOYSA-N 2 1 349.475 3.547 20 5 EHBDMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000261918143 1019717043 /nfs/dbraw/zinc/71/70/43/1019717043.db2.gz YIXNMTQWACCGRF-KRWDZBQOSA-N 2 1 349.818 3.679 20 5 EHBDMP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435375544 1024841060 /nfs/dbraw/zinc/84/10/60/1024841060.db2.gz NBAATNSQDUWYJW-LBPRGKRZSA-N 2 1 349.818 3.550 20 5 EHBDMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435375544 1024841080 /nfs/dbraw/zinc/84/10/80/1024841080.db2.gz NBAATNSQDUWYJW-LBPRGKRZSA-N 2 1 349.818 3.550 20 5 EHBDMP CC[NH+]1CCC([NH2+]Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000271937524 1029238669 /nfs/dbraw/zinc/23/86/69/1029238669.db2.gz YCBWNXYTOYLCCZ-UHFFFAOYSA-N 2 1 336.435 3.520 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC[NH+]2CCC2)s1 ZINC000594499180 1033401127 /nfs/dbraw/zinc/40/11/27/1033401127.db2.gz DQWIBXGLIQAVJJ-UHFFFAOYSA-N 2 1 331.441 3.509 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595900214 1034026802 /nfs/dbraw/zinc/02/68/02/1034026802.db2.gz BERHXONURATMNX-WBVHZDCISA-N 2 1 331.460 3.676 20 5 EHBDMP [NH3+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000576227074 1041365779 /nfs/dbraw/zinc/36/57/79/1041365779.db2.gz GSCNENRNBSEPOP-GFCCVEGCSA-N 2 1 349.818 3.679 20 5 EHBDMP CC1(C)C[C@H]([NH2+]C2CC[NH+](C3CCC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279003346 1043165879 /nfs/dbraw/zinc/16/58/79/1043165879.db2.gz GASXFJKXRMYIPJ-IBGZPJMESA-N 2 1 343.471 3.924 20 5 EHBDMP C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272200551 1120561494 /nfs/dbraw/zinc/56/14/94/1120561494.db2.gz OLHZXCQAFXQZPP-QFBILLFUSA-N 2 1 339.439 3.595 20 5 EHBDMP C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272380209 1121596195 /nfs/dbraw/zinc/59/61/95/1121596195.db2.gz BRNLJXUGSOIIOA-VQIMIIECSA-N 2 1 339.439 3.595 20 5 EHBDMP C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272380209 1121596202 /nfs/dbraw/zinc/59/62/02/1121596202.db2.gz BRNLJXUGSOIIOA-VQIMIIECSA-N 2 1 339.439 3.595 20 5 EHBDMP CCCC[NH+]1CCC([N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173238744 1132027242 /nfs/dbraw/zinc/02/72/42/1132027242.db2.gz XFENHIRWJCVSFV-INIZCTEOSA-N 2 1 333.476 3.722 20 5 EHBDMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001181880410 1133545553 /nfs/dbraw/zinc/54/55/53/1133545553.db2.gz VKIGIWXCYRYBES-GOSISDBHSA-N 2 1 331.460 3.506 20 5 EHBDMP Cc1c(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC001197194479 1135657846 /nfs/dbraw/zinc/65/78/46/1135657846.db2.gz NBGYLADKVGWCHG-UHFFFAOYSA-N 2 1 333.476 3.703 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000872079461 1137570174 /nfs/dbraw/zinc/57/01/74/1137570174.db2.gz MYLGMJGGZDZBCE-ZIAGYGMSSA-N 2 1 337.489 3.699 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000269672667 1141134337 /nfs/dbraw/zinc/13/43/37/1141134337.db2.gz RKPNDQBAFOYLGJ-RVKKMQEKSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000269672667 1141134340 /nfs/dbraw/zinc/13/43/40/1141134340.db2.gz RKPNDQBAFOYLGJ-RVKKMQEKSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000269672667 1141134344 /nfs/dbraw/zinc/13/43/44/1141134344.db2.gz RKPNDQBAFOYLGJ-RVKKMQEKSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000269672667 1141134346 /nfs/dbraw/zinc/13/43/46/1141134346.db2.gz RKPNDQBAFOYLGJ-RVKKMQEKSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000269672667 1141134351 /nfs/dbraw/zinc/13/43/51/1141134351.db2.gz RKPNDQBAFOYLGJ-RVKKMQEKSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000269672667 1141134355 /nfs/dbraw/zinc/13/43/55/1141134355.db2.gz RKPNDQBAFOYLGJ-RVKKMQEKSA-N 2 1 329.444 3.605 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000182803343 1019747943 /nfs/dbraw/zinc/74/79/43/1019747943.db2.gz DFVPQKYQLNKJSS-SJORKVTESA-N 2 1 331.460 3.915 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000182803343 1019747957 /nfs/dbraw/zinc/74/79/57/1019747957.db2.gz DFVPQKYQLNKJSS-SJORKVTESA-N 2 1 331.460 3.915 20 5 EHBDMP CCC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1cccc([N+](=O)[O-])c1 ZINC000178702047 1028121930 /nfs/dbraw/zinc/12/19/30/1028121930.db2.gz JZHKCVMIRSYDRO-KSSFIOAISA-N 2 1 330.432 3.867 20 5 EHBDMP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423374183 1028378079 /nfs/dbraw/zinc/37/80/79/1028378079.db2.gz HZADJUBNGGCULX-AOIWGVFYSA-N 2 1 325.412 3.544 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCC[NH2+]CC1 ZINC000414749165 1028495878 /nfs/dbraw/zinc/49/58/78/1028495878.db2.gz JYCTVCOWNKMGRM-OAHLLOKOSA-N 2 1 345.468 3.897 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000504926266 1029072488 /nfs/dbraw/zinc/07/24/88/1029072488.db2.gz HEYVYOIKRBTDGY-OAGGEKHMSA-N 2 1 349.500 3.682 20 5 EHBDMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509101 1030256746 /nfs/dbraw/zinc/25/67/46/1030256746.db2.gz LUISUPNLAKOLBL-DNVCBOLYSA-N 2 1 331.460 3.826 20 5 EHBDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509101 1030256769 /nfs/dbraw/zinc/25/67/69/1030256769.db2.gz LUISUPNLAKOLBL-DNVCBOLYSA-N 2 1 331.460 3.826 20 5 EHBDMP [NH3+]CC[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000904405541 1032020447 /nfs/dbraw/zinc/02/04/47/1032020447.db2.gz NJMVCYVNBAVRTE-GFCCVEGCSA-N 2 1 349.818 3.679 20 5 EHBDMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192831026 1040047343 /nfs/dbraw/zinc/04/73/43/1040047343.db2.gz UERRIUXWVZNHJE-HNAYVOBHSA-N 2 1 331.460 3.682 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000490037574 1040301170 /nfs/dbraw/zinc/30/11/70/1040301170.db2.gz IBUOPEXCVKJFDK-NVXWUHKLSA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000490037574 1040301178 /nfs/dbraw/zinc/30/11/78/1040301178.db2.gz IBUOPEXCVKJFDK-NVXWUHKLSA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000490037574 1040301188 /nfs/dbraw/zinc/30/11/88/1040301188.db2.gz IBUOPEXCVKJFDK-NVXWUHKLSA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000490037574 1040301194 /nfs/dbraw/zinc/30/11/94/1040301194.db2.gz IBUOPEXCVKJFDK-NVXWUHKLSA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433115164 1040778234 /nfs/dbraw/zinc/77/82/34/1040778234.db2.gz HVUCDKTWRGWGNW-SCLBCKFNSA-N 2 1 342.443 3.748 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000543418036 1129474779 /nfs/dbraw/zinc/47/47/79/1129474779.db2.gz MFRPFGRKJBZBSX-CVEARBPZSA-N 2 1 349.475 3.909 20 5 EHBDMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173228373 1132007847 /nfs/dbraw/zinc/00/78/47/1132007847.db2.gz VRWHKWQQZQSOAG-INIZCTEOSA-N 2 1 333.476 3.578 20 5 EHBDMP Cc1ccc(C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001168997178 1132627411 /nfs/dbraw/zinc/62/74/11/1132627411.db2.gz BVQVQDKQMNEPSY-UAFMIMERSA-N 2 1 345.487 3.512 20 5 EHBDMP CC[NH+](CC)CC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000768540715 1133153243 /nfs/dbraw/zinc/15/32/43/1133153243.db2.gz CGWOTIVVLBPYSR-UHFFFAOYSA-N 2 1 339.867 3.802 20 5 EHBDMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000102423192 1135550676 /nfs/dbraw/zinc/55/06/76/1135550676.db2.gz CKXRLBMWKZJGNO-AWEZNQCLSA-N 2 1 345.468 3.755 20 5 EHBDMP Cc1[nH]c(C2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)[nH+]c1C ZINC000886665541 1138111378 /nfs/dbraw/zinc/11/13/78/1138111378.db2.gz AOTVICFYYZIKLV-AWEZNQCLSA-N 2 1 328.416 3.875 20 5 EHBDMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000125466771 1138309569 /nfs/dbraw/zinc/30/95/69/1138309569.db2.gz BTFAVUIDFLIGMK-AWEZNQCLSA-N 2 1 345.468 3.707 20 5 EHBDMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000125466771 1138309571 /nfs/dbraw/zinc/30/95/71/1138309571.db2.gz BTFAVUIDFLIGMK-AWEZNQCLSA-N 2 1 345.468 3.707 20 5 EHBDMP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000449082277 1032173981 /nfs/dbraw/zinc/17/39/81/1032173981.db2.gz MDCYZVZSRODXPK-IAGOWNOFSA-N 2 1 333.476 3.628 20 5 EHBDMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000459727988 1032433334 /nfs/dbraw/zinc/43/33/34/1032433334.db2.gz HWNZNTORTDNIQH-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000580221181 1018819321 /nfs/dbraw/zinc/81/93/21/1018819321.db2.gz FFDWYDVQLLAHST-AZUAARDMSA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000580221181 1018819337 /nfs/dbraw/zinc/81/93/37/1018819337.db2.gz FFDWYDVQLLAHST-AZUAARDMSA-N 2 1 339.439 3.562 20 5 EHBDMP C[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379637260 1019011761 /nfs/dbraw/zinc/01/17/61/1019011761.db2.gz SHBRLPZFBRZXLD-QFBILLFUSA-N 2 1 339.439 3.738 20 5 EHBDMP C[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000379637260 1019011774 /nfs/dbraw/zinc/01/17/74/1019011774.db2.gz SHBRLPZFBRZXLD-QFBILLFUSA-N 2 1 339.439 3.738 20 5 EHBDMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471013 1023232740 /nfs/dbraw/zinc/23/27/40/1023232740.db2.gz OVPOHBGFOKIVKP-MJGOQNOKSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471013 1023232744 /nfs/dbraw/zinc/23/27/44/1023232744.db2.gz OVPOHBGFOKIVKP-MJGOQNOKSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471013 1023232750 /nfs/dbraw/zinc/23/27/50/1023232750.db2.gz OVPOHBGFOKIVKP-MJGOQNOKSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471013 1023232755 /nfs/dbraw/zinc/23/27/55/1023232755.db2.gz OVPOHBGFOKIVKP-MJGOQNOKSA-N 2 1 345.487 3.724 20 5 EHBDMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000263785661 1025665755 /nfs/dbraw/zinc/66/57/55/1025665755.db2.gz GLBWJQBLIZRNQY-UHFFFAOYSA-N 2 1 340.383 3.540 20 5 EHBDMP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000531430330 1026902510 /nfs/dbraw/zinc/90/25/10/1026902510.db2.gz WIDHFSHWPBAXQF-SJORKVTESA-N 2 1 349.475 3.594 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCC[NH2+]CC1 ZINC000414749164 1028495887 /nfs/dbraw/zinc/49/58/87/1028495887.db2.gz JYCTVCOWNKMGRM-HNNXBMFYSA-N 2 1 345.468 3.897 20 5 EHBDMP CCOc1ccc([C@@H](C)NCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504894987 1029040778 /nfs/dbraw/zinc/04/07/78/1029040778.db2.gz PXPUHKBCKIBBHX-JKSUJKDBSA-N 2 1 349.475 3.909 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504894987 1029040794 /nfs/dbraw/zinc/04/07/94/1029040794.db2.gz PXPUHKBCKIBBHX-JKSUJKDBSA-N 2 1 349.475 3.909 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504894987 1029040806 /nfs/dbraw/zinc/04/08/06/1029040806.db2.gz PXPUHKBCKIBBHX-JKSUJKDBSA-N 2 1 349.475 3.909 20 5 EHBDMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@@H+]1C ZINC000525709363 1030047016 /nfs/dbraw/zinc/04/70/16/1030047016.db2.gz VNFCZCWSPMQWII-UKRRQHHQSA-N 2 1 345.468 3.896 20 5 EHBDMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@H+]1C ZINC000525709363 1030047034 /nfs/dbraw/zinc/04/70/34/1030047034.db2.gz VNFCZCWSPMQWII-UKRRQHHQSA-N 2 1 345.468 3.896 20 5 EHBDMP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000595003512 1033629039 /nfs/dbraw/zinc/62/90/39/1033629039.db2.gz IDXREQFHGLQZFN-LBPRGKRZSA-N 2 1 335.448 3.563 20 5 EHBDMP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000598993954 1033646765 /nfs/dbraw/zinc/64/67/65/1033646765.db2.gz FKTKLCFMKZGMSC-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000598993954 1033646768 /nfs/dbraw/zinc/64/67/68/1033646768.db2.gz FKTKLCFMKZGMSC-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596096624 1034077961 /nfs/dbraw/zinc/07/79/61/1034077961.db2.gz VMEDWXJMCQELRH-WMZOPIPTSA-N 2 1 345.487 3.628 20 5 EHBDMP CC(C)(NCc1ccc(-n2ccnc2)cc1)c1ccccc1[N+](=O)[O-] ZINC000492001610 1037853604 /nfs/dbraw/zinc/85/36/04/1037853604.db2.gz QOCBIHZWNMFPLS-UHFFFAOYSA-N 2 1 336.395 3.805 20 5 EHBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314608 1039669929 /nfs/dbraw/zinc/66/99/29/1039669929.db2.gz RMKMAWOBCIGZOC-LIRRHRJNSA-N 2 1 342.443 3.793 20 5 EHBDMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000576227075 1041365815 /nfs/dbraw/zinc/36/58/15/1041365815.db2.gz GSCNENRNBSEPOP-LBPRGKRZSA-N 2 1 349.818 3.679 20 5 EHBDMP C[C@H](NCc1csc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272245305 1121133299 /nfs/dbraw/zinc/13/32/99/1121133299.db2.gz XDIIOAJLVWRAAS-YOEHRIQHSA-N 2 1 345.468 3.657 20 5 EHBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC001199336662 1135896044 /nfs/dbraw/zinc/89/60/44/1135896044.db2.gz UVWHQIQTQPTJJA-MRXNPFEDSA-N 2 1 333.476 3.956 20 5 EHBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC001199336661 1135896118 /nfs/dbraw/zinc/89/61/18/1135896118.db2.gz UVWHQIQTQPTJJA-INIZCTEOSA-N 2 1 333.476 3.956 20 5 EHBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000873069949 1137589430 /nfs/dbraw/zinc/58/94/30/1137589430.db2.gz SWHNPAOEKAMZOP-UHFFFAOYSA-N 2 1 331.460 3.708 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)CCC2 ZINC000192932061 1140556382 /nfs/dbraw/zinc/55/63/82/1140556382.db2.gz RSJZRXZNEMUOLK-HXUWFJFHSA-N 2 1 343.471 3.969 20 5 EHBDMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000348961136 1141615387 /nfs/dbraw/zinc/61/53/87/1141615387.db2.gz DEKKKYYUNIHZFR-UHFFFAOYSA-N 2 1 345.418 3.818 20 5 EHBDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000348961136 1141615389 /nfs/dbraw/zinc/61/53/89/1141615389.db2.gz DEKKKYYUNIHZFR-UHFFFAOYSA-N 2 1 345.418 3.818 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536835038 1032330236 /nfs/dbraw/zinc/33/02/36/1032330236.db2.gz ZGSGKAUHUBYGMZ-DLBZAZTESA-N 2 1 333.476 3.922 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000536835038 1032330249 /nfs/dbraw/zinc/33/02/49/1032330249.db2.gz ZGSGKAUHUBYGMZ-DLBZAZTESA-N 2 1 333.476 3.922 20 5 EHBDMP CC(C)c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057905 1017469362 /nfs/dbraw/zinc/46/93/62/1017469362.db2.gz VFAHMMGSIDBCSU-FUHWJXTLSA-N 2 1 331.460 3.682 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057905 1017469368 /nfs/dbraw/zinc/46/93/68/1017469368.db2.gz VFAHMMGSIDBCSU-FUHWJXTLSA-N 2 1 331.460 3.682 20 5 EHBDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479918888 1026884495 /nfs/dbraw/zinc/88/44/95/1026884495.db2.gz WICPTAHVWFSSIU-VQIMIIECSA-N 2 1 345.487 3.770 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000160481160 1030787449 /nfs/dbraw/zinc/78/74/49/1030787449.db2.gz UHZQRHRWSUUHOS-HNNXBMFYSA-N 2 1 331.460 3.961 20 5 EHBDMP C[N@H+]1CCCC[C@@H](C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068690 1033709286 /nfs/dbraw/zinc/70/92/86/1033709286.db2.gz CJHMXCIVKJMZTQ-KBXCAEBGSA-N 2 1 331.460 3.639 20 5 EHBDMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000599071670 1033711873 /nfs/dbraw/zinc/71/18/73/1033711873.db2.gz SFHPGSYSQCZAHC-LMMKCTJWSA-N 2 1 345.487 3.628 20 5 EHBDMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000550665499 1033835823 /nfs/dbraw/zinc/83/58/23/1033835823.db2.gz KRUQTVFYVBMCOE-QUCCMNQESA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000550665499 1033835835 /nfs/dbraw/zinc/83/58/35/1033835835.db2.gz KRUQTVFYVBMCOE-QUCCMNQESA-N 2 1 339.439 3.562 20 5 EHBDMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496856 1037764422 /nfs/dbraw/zinc/76/44/22/1037764422.db2.gz OYDIBCMOXGJYFE-KSSFIOAISA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496856 1037764438 /nfs/dbraw/zinc/76/44/38/1037764438.db2.gz OYDIBCMOXGJYFE-KSSFIOAISA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496856 1037764456 /nfs/dbraw/zinc/76/44/56/1037764456.db2.gz OYDIBCMOXGJYFE-KSSFIOAISA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496856 1037764474 /nfs/dbraw/zinc/76/44/74/1037764474.db2.gz OYDIBCMOXGJYFE-KSSFIOAISA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496852 1037780550 /nfs/dbraw/zinc/78/05/50/1037780550.db2.gz OYDIBCMOXGJYFE-KBXCAEBGSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496852 1037780560 /nfs/dbraw/zinc/78/05/60/1037780560.db2.gz OYDIBCMOXGJYFE-KBXCAEBGSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496852 1037780577 /nfs/dbraw/zinc/78/05/77/1037780577.db2.gz OYDIBCMOXGJYFE-KBXCAEBGSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496852 1037780588 /nfs/dbraw/zinc/78/05/88/1037780588.db2.gz OYDIBCMOXGJYFE-KBXCAEBGSA-N 2 1 343.427 3.627 20 5 EHBDMP CC1(C)C[C@H](N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170623 1040961983 /nfs/dbraw/zinc/96/19/83/1040961983.db2.gz YGOJIYJMFHWIAY-IYOUNJFTSA-N 2 1 329.444 3.534 20 5 EHBDMP CC1(C)C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170623 1040962010 /nfs/dbraw/zinc/96/20/10/1040962010.db2.gz YGOJIYJMFHWIAY-IYOUNJFTSA-N 2 1 329.444 3.534 20 5 EHBDMP CC1(C)C[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170623 1040962035 /nfs/dbraw/zinc/96/20/35/1040962035.db2.gz YGOJIYJMFHWIAY-IYOUNJFTSA-N 2 1 329.444 3.534 20 5 EHBDMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173349 1040991020 /nfs/dbraw/zinc/99/10/20/1040991020.db2.gz GHBAZFJDXQENIC-KDOFPFPSSA-N 2 1 331.460 3.639 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607043 1139143623 /nfs/dbraw/zinc/14/36/23/1139143623.db2.gz YQPOBXYELWYWTR-CVEARBPZSA-N 2 1 349.475 3.765 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607043 1139143627 /nfs/dbraw/zinc/14/36/27/1139143627.db2.gz YQPOBXYELWYWTR-CVEARBPZSA-N 2 1 349.475 3.765 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CCC[NH2+]C3)o2)c(Cl)c1 ZINC000414828374 1017229887 /nfs/dbraw/zinc/22/98/87/1017229887.db2.gz MESHZMXOINGJFD-GFCCVEGCSA-N 2 1 349.818 3.597 20 5 EHBDMP C[C@@H]([NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)[C@H](C)[NH3+] ZINC000415013054 1017409195 /nfs/dbraw/zinc/40/91/95/1017409195.db2.gz JYXHIEIEDDZFGA-NWDGAFQWSA-N 2 1 349.818 3.866 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000468629503 1018530623 /nfs/dbraw/zinc/53/06/23/1018530623.db2.gz FDXSLNZJHGEFJZ-GANRHZMWSA-N 2 1 331.460 3.708 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188760 1020546349 /nfs/dbraw/zinc/54/63/49/1020546349.db2.gz DKNFGLYDYGIMST-HLLBOEOZSA-N 2 1 331.460 3.898 20 5 EHBDMP CC[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000178038995 1021026750 /nfs/dbraw/zinc/02/67/50/1021026750.db2.gz LOUPBUDTVBBJBF-FCEWJHQRSA-N 2 1 349.475 3.525 20 5 EHBDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000507123226 1023141582 /nfs/dbraw/zinc/14/15/82/1023141582.db2.gz XPNXBRFISFVFMN-UHFFFAOYSA-N 2 1 327.428 3.679 20 5 EHBDMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435372023 1024856604 /nfs/dbraw/zinc/85/66/04/1024856604.db2.gz QEOLQUWUJLBKJC-AWEZNQCLSA-N 2 1 345.468 3.755 20 5 EHBDMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000531430329 1026902814 /nfs/dbraw/zinc/90/28/14/1026902814.db2.gz WIDHFSHWPBAXQF-IRXDYDNUSA-N 2 1 349.475 3.594 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000125638206 1027103751 /nfs/dbraw/zinc/10/37/51/1027103751.db2.gz NNGRHKGISXPQDC-UHFFFAOYSA-N 2 1 328.416 3.545 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000125638206 1027103757 /nfs/dbraw/zinc/10/37/57/1027103757.db2.gz NNGRHKGISXPQDC-UHFFFAOYSA-N 2 1 328.416 3.545 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCC[NH+](C)C1 ZINC000508529782 1028792085 /nfs/dbraw/zinc/79/20/85/1028792085.db2.gz TZQFSOFKJNXXLD-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCC[NH+](C)C1 ZINC000508529782 1028792094 /nfs/dbraw/zinc/79/20/94/1028792094.db2.gz TZQFSOFKJNXXLD-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCC[N@H+](C)C1 ZINC000508529782 1028792099 /nfs/dbraw/zinc/79/20/99/1028792099.db2.gz TZQFSOFKJNXXLD-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCC[N@@H+](C)C1 ZINC000508529782 1028792105 /nfs/dbraw/zinc/79/21/05/1028792105.db2.gz TZQFSOFKJNXXLD-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[N@@H+](CCCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000453390729 1030233259 /nfs/dbraw/zinc/23/32/59/1030233259.db2.gz DIKWEKDPCBEZPB-GOSISDBHSA-N 2 1 331.460 3.781 20 5 EHBDMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095283 1034077766 /nfs/dbraw/zinc/07/77/66/1034077766.db2.gz OOSGJCXCQWEPIK-VQIMIIECSA-N 2 1 331.460 3.758 20 5 EHBDMP C[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000592395493 1037938709 /nfs/dbraw/zinc/93/87/09/1037938709.db2.gz CLFCZSMZUUSPLT-CVAIRZPRSA-N 2 1 339.439 3.591 20 5 EHBDMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417358005 1039718203 /nfs/dbraw/zinc/71/82/03/1039718203.db2.gz HIUQUHHQQKWJLM-HNAYVOBHSA-N 2 1 331.460 3.684 20 5 EHBDMP C[C@@]1(CNCc2ccccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000311216154 1040912449 /nfs/dbraw/zinc/91/24/49/1040912449.db2.gz RVNBSEBBQMFLNT-FQEVSTJZSA-N 2 1 339.439 3.597 20 5 EHBDMP C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272200550 1120561517 /nfs/dbraw/zinc/56/15/17/1120561517.db2.gz OLHZXCQAFXQZPP-LPHOPBHVSA-N 2 1 339.439 3.595 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173220594 1132004195 /nfs/dbraw/zinc/00/41/95/1132004195.db2.gz DCJDBQFOAVTFQD-ZVZYQTTQSA-N 2 1 331.460 3.650 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001173232843 1132010887 /nfs/dbraw/zinc/01/08/87/1132010887.db2.gz IFTUMZWMXFCADK-VDGAXYAQSA-N 2 1 345.487 3.865 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001173232843 1132010891 /nfs/dbraw/zinc/01/08/91/1132010891.db2.gz IFTUMZWMXFCADK-VDGAXYAQSA-N 2 1 345.487 3.865 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001173232843 1132010896 /nfs/dbraw/zinc/01/08/96/1132010896.db2.gz IFTUMZWMXFCADK-VDGAXYAQSA-N 2 1 345.487 3.865 20 5 EHBDMP Cc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000747100785 1134843203 /nfs/dbraw/zinc/84/32/03/1134843203.db2.gz UMWVXPAENIOXKC-UHFFFAOYSA-N 2 1 331.460 3.790 20 5 EHBDMP Cc1ccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000809738819 1135883379 /nfs/dbraw/zinc/88/33/79/1135883379.db2.gz LJNKLVUDCWFITO-UHFFFAOYSA-N 2 1 327.428 3.597 20 5 EHBDMP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000449084113 1032139174 /nfs/dbraw/zinc/13/91/74/1032139174.db2.gz WPPJGDBYFZTHER-DLBZAZTESA-N 2 1 333.476 3.770 20 5 EHBDMP CC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]CC1 ZINC000414936312 1017331504 /nfs/dbraw/zinc/33/15/04/1017331504.db2.gz GUTGJIOCQWHRBA-UHFFFAOYSA-N 2 1 349.818 3.740 20 5 EHBDMP CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1[NH3+] ZINC000592427621 1032816530 /nfs/dbraw/zinc/81/65/30/1032816530.db2.gz JFBZSKYVLDHTCJ-BBRMVZONSA-N 2 1 345.468 3.883 20 5 EHBDMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]1 ZINC000414944939 1022958062 /nfs/dbraw/zinc/95/80/62/1022958062.db2.gz HRKYYBAYAJVPBA-NWDGAFQWSA-N 2 1 349.818 3.738 20 5 EHBDMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000108427961 1023125857 /nfs/dbraw/zinc/12/58/57/1023125857.db2.gz NITYVFKZEREGIY-AWEZNQCLSA-N 2 1 345.468 3.755 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]4[NH2+]CC[C@@H]4C3)s2)cc1 ZINC000427128684 1023236703 /nfs/dbraw/zinc/23/67/03/1023236703.db2.gz OQJAOUIRYFJEKE-RHSMWYFYSA-N 2 1 343.452 3.507 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]4[NH2+]CC[C@@H]4C3)s2)cc1 ZINC000427128684 1023236719 /nfs/dbraw/zinc/23/67/19/1023236719.db2.gz OQJAOUIRYFJEKE-RHSMWYFYSA-N 2 1 343.452 3.507 20 5 EHBDMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479918886 1026884390 /nfs/dbraw/zinc/88/43/90/1026884390.db2.gz WICPTAHVWFSSIU-LPHOPBHVSA-N 2 1 345.487 3.770 20 5 EHBDMP C[C@H]([NH2+][C@H](CN)C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284200 1028324099 /nfs/dbraw/zinc/32/40/99/1028324099.db2.gz WPNATHNSKKNLCX-SMDDNHRTSA-N 2 1 331.441 3.711 20 5 EHBDMP C[C@H]([NH2+][C@H](C[NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284200 1028324119 /nfs/dbraw/zinc/32/41/19/1028324119.db2.gz WPNATHNSKKNLCX-SMDDNHRTSA-N 2 1 331.441 3.711 20 5 EHBDMP C[C@@H]([NH2+]CC1([NH3+])CCC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423318226 1028349500 /nfs/dbraw/zinc/34/95/00/1028349500.db2.gz DDRUNAKYKKDRCS-GFCCVEGCSA-N 2 1 331.441 3.855 20 5 EHBDMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000442931118 1036741488 /nfs/dbraw/zinc/74/14/88/1036741488.db2.gz VCOPYSWMYBAUFL-CQSZACIVSA-N 2 1 345.468 3.884 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CCCC2 ZINC000417328266 1039671103 /nfs/dbraw/zinc/67/11/03/1039671103.db2.gz SFFPXTDINIHVMQ-TXPKVOOTSA-N 2 1 329.444 3.579 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CCCC2 ZINC000417323085 1039680653 /nfs/dbraw/zinc/68/06/53/1039680653.db2.gz NXGJLNSJBJVNBL-HXUWFJFHSA-N 2 1 343.471 3.826 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCCC2 ZINC000417325528 1039682390 /nfs/dbraw/zinc/68/23/90/1039682390.db2.gz QUPYHZKXGOECOY-LJQANCHMSA-N 2 1 329.444 3.579 20 5 EHBDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000566474628 1039768820 /nfs/dbraw/zinc/76/88/20/1039768820.db2.gz IDQPXRFVRWWLAH-CRAIPNDOSA-N 2 1 331.460 3.540 20 5 EHBDMP CCCC[N@@H+](C)CCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899945 1131883819 /nfs/dbraw/zinc/88/38/19/1131883819.db2.gz QHZTZQNEJMBRMW-SFHVURJKSA-N 2 1 333.476 3.554 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001173232838 1132010255 /nfs/dbraw/zinc/01/02/55/1132010255.db2.gz IFTUMZWMXFCADK-FFZOFVMBSA-N 2 1 345.487 3.865 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001173232838 1132010262 /nfs/dbraw/zinc/01/02/62/1132010262.db2.gz IFTUMZWMXFCADK-FFZOFVMBSA-N 2 1 345.487 3.865 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001173232838 1132010268 /nfs/dbraw/zinc/01/02/68/1132010268.db2.gz IFTUMZWMXFCADK-FFZOFVMBSA-N 2 1 345.487 3.865 20 5 EHBDMP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746666696 1133986325 /nfs/dbraw/zinc/98/63/25/1133986325.db2.gz PBLPFCQSVRFIDM-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746666696 1133986329 /nfs/dbraw/zinc/98/63/29/1133986329.db2.gz PBLPFCQSVRFIDM-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1CCC[NH3+] ZINC000852759443 1136483968 /nfs/dbraw/zinc/48/39/68/1136483968.db2.gz OXWZESIHGMNFET-MLGOLLRUSA-N 2 1 325.840 3.588 20 5 EHBDMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023195 1137565397 /nfs/dbraw/zinc/56/53/97/1137565397.db2.gz CZRCRVJCVPEKQF-KGLIPLIRSA-N 2 1 337.489 3.699 20 5 EHBDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023195 1137565398 /nfs/dbraw/zinc/56/53/98/1137565398.db2.gz CZRCRVJCVPEKQF-KGLIPLIRSA-N 2 1 337.489 3.699 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000572887068 1028197491 /nfs/dbraw/zinc/19/74/91/1028197491.db2.gz JIYGWDOIXGOULX-BAILOTOSSA-N 2 1 343.471 3.662 20 5 EHBDMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192898178 1030010667 /nfs/dbraw/zinc/01/06/67/1030010667.db2.gz KSSDLKKTMKGZMD-SFHVURJKSA-N 2 1 328.416 3.547 20 5 EHBDMP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509103 1030258229 /nfs/dbraw/zinc/25/82/29/1030258229.db2.gz LUISUPNLAKOLBL-HNAYVOBHSA-N 2 1 331.460 3.826 20 5 EHBDMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509103 1030258244 /nfs/dbraw/zinc/25/82/44/1030258244.db2.gz LUISUPNLAKOLBL-HNAYVOBHSA-N 2 1 331.460 3.826 20 5 EHBDMP Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094862 1034080063 /nfs/dbraw/zinc/08/00/63/1034080063.db2.gz NQWOMVHQIHTQEW-RDJZCZTQSA-N 2 1 331.460 3.676 20 5 EHBDMP C[NH+](C)CCCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000179698831 1034576398 /nfs/dbraw/zinc/57/63/98/1034576398.db2.gz JGDHZUMCCNUFIL-UHFFFAOYSA-N 2 1 339.867 3.802 20 5 EHBDMP C[C@@H](NCc1csc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272245301 1121133454 /nfs/dbraw/zinc/13/34/54/1121133454.db2.gz XDIIOAJLVWRAAS-RHSMWYFYSA-N 2 1 345.468 3.657 20 5 EHBDMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136478 1123167220 /nfs/dbraw/zinc/16/72/20/1123167220.db2.gz IWCAWLSRKOURNS-SJLPKXTDSA-N 2 1 339.439 3.768 20 5 EHBDMP C[NH+](C)CCCC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000123634197 1129444164 /nfs/dbraw/zinc/44/41/64/1129444164.db2.gz WRQATBMMQNCLDN-UHFFFAOYSA-N 2 1 339.867 3.802 20 5 EHBDMP [NH3+]CCC[N@@H+](C1CCCCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899940 1131883390 /nfs/dbraw/zinc/88/33/90/1131883390.db2.gz QESPRYUDPBOKSC-IBGZPJMESA-N 2 1 345.487 3.826 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCCC[N@@H+](C)C1 ZINC000872088544 1137570644 /nfs/dbraw/zinc/57/06/44/1137570644.db2.gz RSJLEVUPXPQVSF-ZIAGYGMSSA-N 2 1 337.489 3.699 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000872088544 1137570645 /nfs/dbraw/zinc/57/06/45/1137570645.db2.gz RSJLEVUPXPQVSF-ZIAGYGMSSA-N 2 1 337.489 3.699 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000872088544 1137570646 /nfs/dbraw/zinc/57/06/46/1137570646.db2.gz RSJLEVUPXPQVSF-ZIAGYGMSSA-N 2 1 337.489 3.699 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000191483096 1140466305 /nfs/dbraw/zinc/46/63/05/1140466305.db2.gz ZHUVLNUQVZBHRJ-OAHLLOKOSA-N 2 1 330.432 3.827 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000191483096 1140466310 /nfs/dbraw/zinc/46/63/10/1140466310.db2.gz ZHUVLNUQVZBHRJ-OAHLLOKOSA-N 2 1 330.432 3.827 20 5 EHBDMP CC[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCC[NH2+]CC1 ZINC000414716273 1017150686 /nfs/dbraw/zinc/15/06/86/1017150686.db2.gz NUZKJBJBJYWORT-INIZCTEOSA-N 2 1 343.427 3.819 20 5 EHBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@H+](C3CC3)C3CC[NH2+]CC3)o2)c1 ZINC000592424343 1032812586 /nfs/dbraw/zinc/81/25/86/1032812586.db2.gz IUISZSDRZLNGHG-UHFFFAOYSA-N 2 1 341.411 3.571 20 5 EHBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+](C3CC3)C3CC[NH2+]CC3)o2)c1 ZINC000592424343 1032812604 /nfs/dbraw/zinc/81/26/04/1032812604.db2.gz IUISZSDRZLNGHG-UHFFFAOYSA-N 2 1 341.411 3.571 20 5 EHBDMP C[C@@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372450 1024857386 /nfs/dbraw/zinc/85/73/86/1024857386.db2.gz RHEHSJHGXYMHCN-VXGBXAGGSA-N 2 1 349.818 3.677 20 5 EHBDMP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435371619 1024857772 /nfs/dbraw/zinc/85/77/72/1024857772.db2.gz OABUPUAUYZRSOP-CQSZACIVSA-N 2 1 345.468 3.755 20 5 EHBDMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435371619 1024857787 /nfs/dbraw/zinc/85/77/87/1024857787.db2.gz OABUPUAUYZRSOP-CQSZACIVSA-N 2 1 345.468 3.755 20 5 EHBDMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548410 1026098317 /nfs/dbraw/zinc/09/83/17/1026098317.db2.gz MXZTZBHSYLMIPB-QZTJIDSGSA-N 2 1 331.460 3.649 20 5 EHBDMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548410 1026098331 /nfs/dbraw/zinc/09/83/31/1026098331.db2.gz MXZTZBHSYLMIPB-QZTJIDSGSA-N 2 1 331.460 3.649 20 5 EHBDMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548410 1026098346 /nfs/dbraw/zinc/09/83/46/1026098346.db2.gz MXZTZBHSYLMIPB-QZTJIDSGSA-N 2 1 331.460 3.649 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)cc1[N+](=O)[O-] ZINC000245508721 1130224188 /nfs/dbraw/zinc/22/41/88/1130224188.db2.gz SMTSRYDHQNRPOY-CWRNSKLLSA-N 2 1 335.448 3.517 20 5 EHBDMP C[C@@H](C[NH3+])C[N@@H+](Cc1ccccc1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220891 1132004212 /nfs/dbraw/zinc/00/42/12/1132004212.db2.gz HSRSGIVLFUZHAS-IRXDYDNUSA-N 2 1 341.455 3.623 20 5 EHBDMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173228374 1132008407 /nfs/dbraw/zinc/00/84/07/1132008407.db2.gz VRWHKWQQZQSOAG-MRXNPFEDSA-N 2 1 333.476 3.578 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001173232839 1132010209 /nfs/dbraw/zinc/01/02/09/1132010209.db2.gz IFTUMZWMXFCADK-LSTHTHJFSA-N 2 1 345.487 3.865 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001173232839 1132010214 /nfs/dbraw/zinc/01/02/14/1132010214.db2.gz IFTUMZWMXFCADK-LSTHTHJFSA-N 2 1 345.487 3.865 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001173232839 1132010218 /nfs/dbraw/zinc/01/02/18/1132010218.db2.gz IFTUMZWMXFCADK-LSTHTHJFSA-N 2 1 345.487 3.865 20 5 EHBDMP CCC[N@H+]1CC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001177483359 1133068885 /nfs/dbraw/zinc/06/88/85/1133068885.db2.gz ONTXXKCKZVKPKE-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001177483359 1133068889 /nfs/dbraw/zinc/06/88/89/1133068889.db2.gz ONTXXKCKZVKPKE-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001177483359 1133068896 /nfs/dbraw/zinc/06/88/96/1133068896.db2.gz ONTXXKCKZVKPKE-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809739123 1135883576 /nfs/dbraw/zinc/88/35/76/1135883576.db2.gz YCZPOVPFWMTUKT-UHFFFAOYSA-N 2 1 347.846 3.942 20 5 EHBDMP O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000078726433 217108876 /nfs/dbraw/zinc/10/88/76/217108876.db2.gz BXRSZSNPJVLACZ-LJQANCHMSA-N 2 1 345.487 3.725 20 5 EHBDMP O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000078726433 217108879 /nfs/dbraw/zinc/10/88/79/217108879.db2.gz BXRSZSNPJVLACZ-LJQANCHMSA-N 2 1 345.487 3.725 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000153972885 1014721156 /nfs/dbraw/zinc/72/11/56/1014721156.db2.gz RZPMTPUPWPVGFK-AWEZNQCLSA-N 2 1 346.431 3.629 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000414785342 1017198251 /nfs/dbraw/zinc/19/82/51/1017198251.db2.gz SMSWCTHUKXSGKG-IRXDYDNUSA-N 2 1 331.460 3.540 20 5 EHBDMP CC[N@@H+](CCC[NH+]1CCCC1)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000579776481 1019857463 /nfs/dbraw/zinc/85/74/63/1019857463.db2.gz OVYWTANSNSQQPX-VKAVYKQESA-N 2 1 331.460 3.806 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183188776 1020546827 /nfs/dbraw/zinc/54/68/27/1020546827.db2.gz DKNFGLYDYGIMST-ZMSDIMECSA-N 2 1 331.460 3.898 20 5 EHBDMP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423374185 1028380160 /nfs/dbraw/zinc/38/01/60/1028380160.db2.gz HZADJUBNGGCULX-ZHALLVOQSA-N 2 1 325.412 3.544 20 5 EHBDMP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946166 1031260139 /nfs/dbraw/zinc/26/01/39/1031260139.db2.gz BYSGAORBLGWFDM-VXGBXAGGSA-N 2 1 349.818 3.820 20 5 EHBDMP C[C@@H]1C[C@H]([NH3+])CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946166 1031260149 /nfs/dbraw/zinc/26/01/49/1031260149.db2.gz BYSGAORBLGWFDM-VXGBXAGGSA-N 2 1 349.818 3.820 20 5 EHBDMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000550665498 1033834983 /nfs/dbraw/zinc/83/49/83/1033834983.db2.gz KRUQTVFYVBMCOE-ICSRJNTNSA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000550665498 1033835001 /nfs/dbraw/zinc/83/50/01/1033835001.db2.gz KRUQTVFYVBMCOE-ICSRJNTNSA-N 2 1 339.439 3.562 20 5 EHBDMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023198 1137565405 /nfs/dbraw/zinc/56/54/05/1137565405.db2.gz CZRCRVJCVPEKQF-ZIAGYGMSSA-N 2 1 337.489 3.699 20 5 EHBDMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023198 1137565406 /nfs/dbraw/zinc/56/54/06/1137565406.db2.gz CZRCRVJCVPEKQF-ZIAGYGMSSA-N 2 1 337.489 3.699 20 5 EHBDMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000459726042 1032431637 /nfs/dbraw/zinc/43/16/37/1032431637.db2.gz FZPHFERXFPLMEJ-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP CC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1[NH3+] ZINC000592427640 1032817109 /nfs/dbraw/zinc/81/71/09/1032817109.db2.gz LTBKCWBPURVAGN-SUMWQHHRSA-N 2 1 345.468 3.883 20 5 EHBDMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435372024 1024855915 /nfs/dbraw/zinc/85/59/15/1024855915.db2.gz QEOLQUWUJLBKJC-CQSZACIVSA-N 2 1 345.468 3.755 20 5 EHBDMP C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@H]1[NH3+] ZINC000435395020 1024881544 /nfs/dbraw/zinc/88/15/44/1024881544.db2.gz NUSAJONQPWLZPL-BDJLRTHQSA-N 2 1 349.818 3.677 20 5 EHBDMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@H]1[NH3+] ZINC000435395020 1024881561 /nfs/dbraw/zinc/88/15/61/1024881561.db2.gz NUSAJONQPWLZPL-BDJLRTHQSA-N 2 1 349.818 3.677 20 5 EHBDMP C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1[NH3+] ZINC000435395023 1024882965 /nfs/dbraw/zinc/88/29/65/1024882965.db2.gz NUSAJONQPWLZPL-ZBEGNZNMSA-N 2 1 349.818 3.677 20 5 EHBDMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1[NH3+] ZINC000435395023 1024882977 /nfs/dbraw/zinc/88/29/77/1024882977.db2.gz NUSAJONQPWLZPL-ZBEGNZNMSA-N 2 1 349.818 3.677 20 5 EHBDMP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423374186 1028379549 /nfs/dbraw/zinc/37/95/49/1028379549.db2.gz HZADJUBNGGCULX-ZIFCJYIRSA-N 2 1 325.412 3.544 20 5 EHBDMP C[N@@H+](CCCC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453419353 1030270786 /nfs/dbraw/zinc/27/07/86/1030270786.db2.gz YWJSGGJGSYMFSF-LPHOPBHVSA-N 2 1 345.487 3.770 20 5 EHBDMP O=[N+]([O-])c1cc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)ccc1Cl ZINC000171139422 1034137347 /nfs/dbraw/zinc/13/73/47/1034137347.db2.gz VSYMLIJIEHGBJA-UHFFFAOYSA-N 2 1 337.851 3.556 20 5 EHBDMP C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272135628 1037088355 /nfs/dbraw/zinc/08/83/55/1037088355.db2.gz AJQSHDVZEQQYCE-LPHOPBHVSA-N 2 1 339.439 3.595 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](C3CC3)C3CC[NH2+]CC3)o2)cc1 ZINC000592424765 1037981287 /nfs/dbraw/zinc/98/12/87/1037981287.db2.gz YUPALYQSCIOFSK-UHFFFAOYSA-N 2 1 341.411 3.571 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+](C3CC3)C3CC[NH2+]CC3)o2)cc1 ZINC000592424765 1037981304 /nfs/dbraw/zinc/98/13/04/1037981304.db2.gz YUPALYQSCIOFSK-UHFFFAOYSA-N 2 1 341.411 3.571 20 5 EHBDMP C[N@@H+](CCCC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000417382852 1039752066 /nfs/dbraw/zinc/75/20/66/1039752066.db2.gz WKIRNLFPDQCHEM-IBGZPJMESA-N 2 1 331.460 3.826 20 5 EHBDMP CCC1([NH3+])CC[NH+]([C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000925757187 1042604131 /nfs/dbraw/zinc/60/41/31/1042604131.db2.gz FAPPVARLDJNABB-IBGZPJMESA-N 2 1 339.439 3.888 20 5 EHBDMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131935 1123165335 /nfs/dbraw/zinc/16/53/35/1123165335.db2.gz BTHPXNWILXEPAA-WMZOPIPTSA-N 2 1 339.439 3.768 20 5 EHBDMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900960 1131883496 /nfs/dbraw/zinc/88/34/96/1131883496.db2.gz HWRZXGJUXDCXJK-QFBILLFUSA-N 2 1 345.487 3.696 20 5 EHBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173226133 1132007023 /nfs/dbraw/zinc/00/70/23/1132007023.db2.gz VBIXJVSMUJPJNL-WBAXXEDZSA-N 2 1 331.460 3.508 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607244 1139144383 /nfs/dbraw/zinc/14/43/83/1139144383.db2.gz YQPOBXYELWYWTR-HZPDHXFCSA-N 2 1 349.475 3.765 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607244 1139144385 /nfs/dbraw/zinc/14/43/85/1139144385.db2.gz YQPOBXYELWYWTR-HZPDHXFCSA-N 2 1 349.475 3.765 20 5 EHBDMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000249038865 1032270629 /nfs/dbraw/zinc/27/06/29/1032270629.db2.gz UERRIUXWVZNHJE-KXBFYZLASA-N 2 1 331.460 3.682 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CCC[NH2+]C3)o2)c(Cl)c1 ZINC000414828377 1017230518 /nfs/dbraw/zinc/23/05/18/1017230518.db2.gz MESHZMXOINGJFD-LBPRGKRZSA-N 2 1 349.818 3.597 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)s1 ZINC000261959384 1019770355 /nfs/dbraw/zinc/77/03/55/1019770355.db2.gz HBFHICHXRIAYMB-GOSISDBHSA-N 2 1 343.452 3.509 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@]3(CC[NH2+]C3)C2)s1 ZINC000261959384 1019770371 /nfs/dbraw/zinc/77/03/71/1019770371.db2.gz HBFHICHXRIAYMB-GOSISDBHSA-N 2 1 343.452 3.509 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@]4(CC[NH2+]C4)C3)s2)cc1 ZINC000262107566 1019927263 /nfs/dbraw/zinc/92/72/63/1019927263.db2.gz WCNOCIJVANMVRP-GOSISDBHSA-N 2 1 343.452 3.509 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000516998298 1021933319 /nfs/dbraw/zinc/93/33/19/1021933319.db2.gz SJXRHQPSZYJCHM-UHFFFAOYSA-N 2 1 333.476 3.847 20 5 EHBDMP CC(C)[N@H+](C)CC1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000548625535 1024843185 /nfs/dbraw/zinc/84/31/85/1024843185.db2.gz WOELTTOJIBIOOK-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000548625535 1024843202 /nfs/dbraw/zinc/84/32/02/1024843202.db2.gz WOELTTOJIBIOOK-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000475335964 1026489119 /nfs/dbraw/zinc/48/91/19/1026489119.db2.gz NNDGMKYYZYGJOB-NUJGCVRESA-N 2 1 333.476 3.626 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000504927450 1029071349 /nfs/dbraw/zinc/07/13/49/1029071349.db2.gz PAQMFSIPRGYPME-CVEARBPZSA-N 2 1 349.475 3.766 20 5 EHBDMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509099 1030257305 /nfs/dbraw/zinc/25/73/05/1030257305.db2.gz LUISUPNLAKOLBL-BEFAXECRSA-N 2 1 331.460 3.826 20 5 EHBDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509099 1030257321 /nfs/dbraw/zinc/25/73/21/1030257321.db2.gz LUISUPNLAKOLBL-BEFAXECRSA-N 2 1 331.460 3.826 20 5 EHBDMP COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000595023872 1033616264 /nfs/dbraw/zinc/61/62/64/1033616264.db2.gz ZDYMKGXOENHQBS-CVEARBPZSA-N 2 1 349.475 3.622 20 5 EHBDMP CC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044379 1035274955 /nfs/dbraw/zinc/27/49/55/1035274955.db2.gz NEMGTVITVGNTQT-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044379 1035274959 /nfs/dbraw/zinc/27/49/59/1035274959.db2.gz NEMGTVITVGNTQT-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044379 1035274963 /nfs/dbraw/zinc/27/49/63/1035274963.db2.gz NEMGTVITVGNTQT-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044379 1035274968 /nfs/dbraw/zinc/27/49/68/1035274968.db2.gz NEMGTVITVGNTQT-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044379 1035274970 /nfs/dbraw/zinc/27/49/70/1035274970.db2.gz NEMGTVITVGNTQT-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCC[NH2+]CC3)o2)c(Cl)c1 ZINC000591278472 1035616356 /nfs/dbraw/zinc/61/63/56/1035616356.db2.gz DWDGZDBTNOYNIF-LBPRGKRZSA-N 2 1 349.818 3.740 20 5 EHBDMP Cc1c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150545 1037622925 /nfs/dbraw/zinc/62/29/25/1037622925.db2.gz FURLWNZUSZQCEC-SJORKVTESA-N 2 1 333.476 3.922 20 5 EHBDMP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C[NH+]1CCCCCC1 ZINC000480660233 1039821633 /nfs/dbraw/zinc/82/16/33/1039821633.db2.gz FJIVVIBNADVIOX-SJORKVTESA-N 2 1 333.476 3.770 20 5 EHBDMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990959 1040023282 /nfs/dbraw/zinc/02/32/82/1040023282.db2.gz HEUIXBDWCXXSOL-JZXOWHBKSA-N 2 1 333.476 3.624 20 5 EHBDMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990959 1040023299 /nfs/dbraw/zinc/02/32/99/1040023299.db2.gz HEUIXBDWCXXSOL-JZXOWHBKSA-N 2 1 333.476 3.624 20 5 EHBDMP C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272200549 1120560555 /nfs/dbraw/zinc/56/05/55/1120560555.db2.gz OLHZXCQAFXQZPP-APWZRJJASA-N 2 1 339.439 3.595 20 5 EHBDMP C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272200552 1120563047 /nfs/dbraw/zinc/56/30/47/1120563047.db2.gz OLHZXCQAFXQZPP-VQIMIIECSA-N 2 1 339.439 3.595 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000872037403 1137566741 /nfs/dbraw/zinc/56/67/41/1137566741.db2.gz BIYTXWKRIFTKGV-ZDUSSCGKSA-N 2 1 348.472 3.953 20 5 EHBDMP C[C@H]1C[C@H](N(C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000093644280 1138239127 /nfs/dbraw/zinc/23/91/27/1138239127.db2.gz QVJALBYKUFALHM-LSDHHAIUSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000093644280 1138239128 /nfs/dbraw/zinc/23/91/28/1138239128.db2.gz QVJALBYKUFALHM-LSDHHAIUSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000093644280 1138239129 /nfs/dbraw/zinc/23/91/29/1138239129.db2.gz QVJALBYKUFALHM-LSDHHAIUSA-N 2 1 343.427 3.769 20 5 EHBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000271128440 1141312298 /nfs/dbraw/zinc/31/22/98/1141312298.db2.gz LAIZTEMBCWBCRL-GJZGRUSLSA-N 2 1 349.500 3.539 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000459727991 1032432931 /nfs/dbraw/zinc/43/29/31/1032432931.db2.gz HWNZNTORTDNIQH-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000459727008 1032433220 /nfs/dbraw/zinc/43/32/20/1032433220.db2.gz GXSZLDMAMFNIOA-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656698 1017107047 /nfs/dbraw/zinc/10/70/47/1017107047.db2.gz IZXJBBZCULKIES-ZIAGYGMSSA-N 2 1 345.468 3.883 20 5 EHBDMP CC(C)c1ccc(C[N@@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057907 1017470017 /nfs/dbraw/zinc/47/00/17/1017470017.db2.gz VFAHMMGSIDBCSU-WMZOPIPTSA-N 2 1 331.460 3.682 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057907 1017470022 /nfs/dbraw/zinc/47/00/22/1017470022.db2.gz VFAHMMGSIDBCSU-WMZOPIPTSA-N 2 1 331.460 3.682 20 5 EHBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000236652490 1017633646 /nfs/dbraw/zinc/63/36/46/1017633646.db2.gz PSZRXAYMKUVHHB-CQSZACIVSA-N 2 1 330.432 3.649 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000277247226 1024327272 /nfs/dbraw/zinc/32/72/72/1024327272.db2.gz PYUYPHVJQZWDDH-HNNXBMFYSA-N 2 1 330.432 3.827 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000277247226 1024327283 /nfs/dbraw/zinc/32/72/83/1024327283.db2.gz PYUYPHVJQZWDDH-HNNXBMFYSA-N 2 1 330.432 3.827 20 5 EHBDMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000277436974 1025104746 /nfs/dbraw/zinc/10/47/46/1025104746.db2.gz JXQMWSMQNWVZKQ-INIZCTEOSA-N 2 1 343.427 3.771 20 5 EHBDMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000277436974 1025104752 /nfs/dbraw/zinc/10/47/52/1025104752.db2.gz JXQMWSMQNWVZKQ-INIZCTEOSA-N 2 1 343.427 3.771 20 5 EHBDMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000475335962 1026489394 /nfs/dbraw/zinc/48/93/94/1026489394.db2.gz NNDGMKYYZYGJOB-JFIYKMOQSA-N 2 1 333.476 3.626 20 5 EHBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475576816 1027682337 /nfs/dbraw/zinc/68/23/37/1027682337.db2.gz XZEBNIUHORZWEV-GDNBJRDFSA-N 2 1 329.444 3.605 20 5 EHBDMP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000513784978 1027706420 /nfs/dbraw/zinc/70/64/20/1027706420.db2.gz COOFMJXOOVPDLL-TXJVSEOTSA-N 2 1 343.471 3.522 20 5 EHBDMP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000513784978 1027706431 /nfs/dbraw/zinc/70/64/31/1027706431.db2.gz COOFMJXOOVPDLL-TXJVSEOTSA-N 2 1 343.471 3.522 20 5 EHBDMP C[C@H]([NH2+]C[C@H]([NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423333857 1028369782 /nfs/dbraw/zinc/36/97/82/1028369782.db2.gz WEXDMJSEEMJPAI-FZMZJTMJSA-N 2 1 331.441 3.711 20 5 EHBDMP C[C@@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423333856 1028371070 /nfs/dbraw/zinc/37/10/70/1028371070.db2.gz WEXDMJSEEMJPAI-BXUZGUMPSA-N 2 1 331.441 3.711 20 5 EHBDMP c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000729684800 1028553368 /nfs/dbraw/zinc/55/33/68/1028553368.db2.gz WWXALVNUZANNJU-UXHICEINSA-N 2 1 346.474 3.946 20 5 EHBDMP c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000729684800 1028553377 /nfs/dbraw/zinc/55/33/77/1028553377.db2.gz WWXALVNUZANNJU-UXHICEINSA-N 2 1 346.474 3.946 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000424386626 1029038558 /nfs/dbraw/zinc/03/85/58/1029038558.db2.gz XRVHDSCBUJLLBL-OAHLLOKOSA-N 2 1 331.460 3.682 20 5 EHBDMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192898165 1030010991 /nfs/dbraw/zinc/01/09/91/1030010991.db2.gz KSSDLKKTMKGZMD-GOSISDBHSA-N 2 1 328.416 3.547 20 5 EHBDMP C[N@@H+](CCCC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453419354 1030271743 /nfs/dbraw/zinc/27/17/43/1030271743.db2.gz YWJSGGJGSYMFSF-QFBILLFUSA-N 2 1 345.487 3.770 20 5 EHBDMP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000543852931 1031797972 /nfs/dbraw/zinc/79/79/72/1031797972.db2.gz PRYCWEAWKJGSRW-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000543852931 1031797989 /nfs/dbraw/zinc/79/79/89/1031797989.db2.gz PRYCWEAWKJGSRW-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000414204110 1036052508 /nfs/dbraw/zinc/05/25/08/1036052508.db2.gz ZYPRKYGVNYNYBW-RDTXWAMCSA-N 2 1 331.460 3.639 20 5 EHBDMP C[N@@H+](CCCC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000417382854 1039751545 /nfs/dbraw/zinc/75/15/45/1039751545.db2.gz WKIRNLFPDQCHEM-LJQANCHMSA-N 2 1 331.460 3.826 20 5 EHBDMP C[N@H+]1CCC[C@@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180507371 1124019548 /nfs/dbraw/zinc/01/95/48/1124019548.db2.gz QFCLJLXJDVBIHZ-JXFKEZNVSA-N 2 1 339.439 3.616 20 5 EHBDMP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000768542852 1133153636 /nfs/dbraw/zinc/15/36/36/1133153636.db2.gz ZXJDBPLCTGWFMO-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000768542852 1133153640 /nfs/dbraw/zinc/15/36/40/1133153640.db2.gz ZXJDBPLCTGWFMO-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000872030724 1137566369 /nfs/dbraw/zinc/56/63/69/1137566369.db2.gz BCSVSEVUDWRDDI-OLZOCXBDSA-N 2 1 348.472 3.809 20 5 EHBDMP CCC1([NH+]2CCC2)CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000884716747 1137970863 /nfs/dbraw/zinc/97/08/63/1137970863.db2.gz HYLTUTNJFFSHEN-UHFFFAOYSA-N 2 1 340.427 3.598 20 5 EHBDMP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000449082278 1032173117 /nfs/dbraw/zinc/17/31/17/1032173117.db2.gz MDCYZVZSRODXPK-IRXDYDNUSA-N 2 1 333.476 3.628 20 5 EHBDMP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946164 1024905200 /nfs/dbraw/zinc/90/52/00/1024905200.db2.gz BYSGAORBLGWFDM-NWDGAFQWSA-N 2 1 349.818 3.820 20 5 EHBDMP C[C@H]1C[C@H]([NH3+])CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946164 1024905211 /nfs/dbraw/zinc/90/52/11/1024905211.db2.gz BYSGAORBLGWFDM-NWDGAFQWSA-N 2 1 349.818 3.820 20 5 EHBDMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000277525705 1025677526 /nfs/dbraw/zinc/67/75/26/1025677526.db2.gz PNHNFEHRJNCMCX-INIZCTEOSA-N 2 1 343.427 3.771 20 5 EHBDMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000277525705 1025677535 /nfs/dbraw/zinc/67/75/35/1025677535.db2.gz PNHNFEHRJNCMCX-INIZCTEOSA-N 2 1 343.427 3.771 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1[N+](=O)[O-] ZINC000152630154 1026470622 /nfs/dbraw/zinc/47/06/22/1026470622.db2.gz NDVIXQUIKWNNEE-CYBMUJFWSA-N 2 1 349.475 3.953 20 5 EHBDMP CCC[NH+]1CCC([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433155870 1040938604 /nfs/dbraw/zinc/93/86/04/1040938604.db2.gz ZRXMXAKKYSYUOP-GOSISDBHSA-N 2 1 331.460 3.781 20 5 EHBDMP O=[N+]([O-])c1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000278879972 1042817463 /nfs/dbraw/zinc/81/74/63/1042817463.db2.gz MZOCIBUYPSOLAX-UHFFFAOYSA-N 2 1 340.427 3.507 20 5 EHBDMP O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000116277080 1129348772 /nfs/dbraw/zinc/34/87/72/1129348772.db2.gz WRYPLJKLMVTHHA-UHFFFAOYSA-N 2 1 337.851 3.556 20 5 EHBDMP [NH3+]CCC[C@H]1CCCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172904915 1131886619 /nfs/dbraw/zinc/88/66/19/1131886619.db2.gz GUDRRTXDURNVHV-VQIMIIECSA-N 2 1 345.487 3.683 20 5 EHBDMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044399 1139804340 /nfs/dbraw/zinc/80/43/40/1139804340.db2.gz NEMGTVITVGNTQT-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044399 1139804345 /nfs/dbraw/zinc/80/43/45/1139804345.db2.gz NEMGTVITVGNTQT-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044399 1139804349 /nfs/dbraw/zinc/80/43/49/1139804349.db2.gz NEMGTVITVGNTQT-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044399 1139804355 /nfs/dbraw/zinc/80/43/55/1139804355.db2.gz NEMGTVITVGNTQT-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188795 1140019262 /nfs/dbraw/zinc/01/92/62/1140019262.db2.gz DKNFGLYDYGIMST-BFYDXBDKSA-N 2 1 331.460 3.898 20 5 EHBDMP CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1[NH3+] ZINC000592427638 1032816576 /nfs/dbraw/zinc/81/65/76/1032816576.db2.gz LTBKCWBPURVAGN-DYVFJYSZSA-N 2 1 345.468 3.883 20 5 EHBDMP O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(-n3ccnc3)cc2)C2CC2)c1 ZINC000507169200 1023171827 /nfs/dbraw/zinc/17/18/27/1023171827.db2.gz UMMTZIJTDGDQDA-UHFFFAOYSA-N 2 1 348.406 3.945 20 5 EHBDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479918885 1026884696 /nfs/dbraw/zinc/88/46/96/1026884696.db2.gz WICPTAHVWFSSIU-APWZRJJASA-N 2 1 345.487 3.770 20 5 EHBDMP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000598994321 1033647883 /nfs/dbraw/zinc/64/78/83/1033647883.db2.gz JUNTYYGIAQVNRF-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000598994321 1033647889 /nfs/dbraw/zinc/64/78/89/1033647889.db2.gz JUNTYYGIAQVNRF-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@@H+]1CC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000550704418 1033894654 /nfs/dbraw/zinc/89/46/54/1033894654.db2.gz XKSPOEQZIJADTE-QUCCMNQESA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000550704418 1033894666 /nfs/dbraw/zinc/89/46/66/1033894666.db2.gz XKSPOEQZIJADTE-QUCCMNQESA-N 2 1 339.439 3.562 20 5 EHBDMP CCCC[N@H+](C)CC1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000056495176 1036330024 /nfs/dbraw/zinc/33/00/24/1036330024.db2.gz WSNYYWVDFMCRKF-UHFFFAOYSA-N 2 1 325.478 3.600 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000056495176 1036330044 /nfs/dbraw/zinc/33/00/44/1036330044.db2.gz WSNYYWVDFMCRKF-UHFFFAOYSA-N 2 1 325.478 3.600 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)o1 ZINC000591282897 1037319931 /nfs/dbraw/zinc/31/99/31/1037319931.db2.gz YGURXKOCVBFYOV-CQSZACIVSA-N 2 1 341.411 3.619 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000470172143 1038441018 /nfs/dbraw/zinc/44/10/18/1038441018.db2.gz SIWREDYBYQPSRG-WPNIOXTASA-N 2 1 343.471 3.806 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000470172143 1038441025 /nfs/dbraw/zinc/44/10/25/1038441025.db2.gz SIWREDYBYQPSRG-WPNIOXTASA-N 2 1 343.471 3.806 20 5 EHBDMP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)C[NH+]1CCCCCC1 ZINC000480660230 1039822546 /nfs/dbraw/zinc/82/25/46/1039822546.db2.gz FJIVVIBNADVIOX-IAGOWNOFSA-N 2 1 333.476 3.770 20 5 EHBDMP CC1(C)C[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433154341 1040917823 /nfs/dbraw/zinc/91/78/23/1040917823.db2.gz ZBZKAYMXQWGLPA-LJQANCHMSA-N 2 1 343.471 3.781 20 5 EHBDMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278976860 1043115587 /nfs/dbraw/zinc/11/55/87/1043115587.db2.gz COWMMUBKPKWPAH-QGZVFWFLSA-N 2 1 328.416 3.502 20 5 EHBDMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136470 1123167401 /nfs/dbraw/zinc/16/74/01/1123167401.db2.gz IWCAWLSRKOURNS-FUHWJXTLSA-N 2 1 339.439 3.768 20 5 EHBDMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000125499333 1129696807 /nfs/dbraw/zinc/69/68/07/1129696807.db2.gz QRDCCLOQDHXOBP-AWEZNQCLSA-N 2 1 345.468 3.707 20 5 EHBDMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000125499333 1129696810 /nfs/dbraw/zinc/69/68/10/1129696810.db2.gz QRDCCLOQDHXOBP-AWEZNQCLSA-N 2 1 345.468 3.707 20 5 EHBDMP Cc1ccc(C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001168997175 1132627519 /nfs/dbraw/zinc/62/75/19/1132627519.db2.gz BVQVQDKQMNEPSY-MUGJNUQGSA-N 2 1 345.487 3.512 20 5 EHBDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173387623 1136989532 /nfs/dbraw/zinc/98/95/32/1136989532.db2.gz QLWRXOXFRHMFRA-OAHLLOKOSA-N 2 1 327.428 3.897 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000468609439 1018139779 /nfs/dbraw/zinc/13/97/79/1018139779.db2.gz HCBSFVIUHULGAF-DMVFFGLYSA-N 2 1 345.487 3.956 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)s1 ZINC000427105297 1023217284 /nfs/dbraw/zinc/21/72/84/1023217284.db2.gz XHNPQKXHRIYAGJ-CJNGLKHVSA-N 2 1 343.452 3.507 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)s1 ZINC000427105297 1023217294 /nfs/dbraw/zinc/21/72/94/1023217294.db2.gz XHNPQKXHRIYAGJ-CJNGLKHVSA-N 2 1 343.452 3.507 20 5 EHBDMP CCC[C@@H]([NH2+]C1CCN(CCCOC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000159143136 1026499375 /nfs/dbraw/zinc/49/93/75/1026499375.db2.gz NVXCAUHQZPHVGQ-LJQANCHMSA-N 2 1 349.475 3.527 20 5 EHBDMP COc1ccc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000479592937 1026725138 /nfs/dbraw/zinc/72/51/38/1026725138.db2.gz PKZFUDZMUSXZAB-UHFFFAOYSA-N 2 1 349.475 3.738 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]CCC[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504900472 1029027023 /nfs/dbraw/zinc/02/70/23/1029027023.db2.gz YNRNLMWPUODOBA-MRXNPFEDSA-N 2 1 349.475 3.766 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596097530 1034061692 /nfs/dbraw/zinc/06/16/92/1034061692.db2.gz YSLCWDCUIXHZLA-RDJZCZTQSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596097530 1034061707 /nfs/dbraw/zinc/06/17/07/1034061707.db2.gz YSLCWDCUIXHZLA-RDJZCZTQSA-N 2 1 331.460 3.676 20 5 EHBDMP CN(Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076109668 1037322298 /nfs/dbraw/zinc/32/22/98/1037322298.db2.gz FHPVBXZAUXZMAL-IBGZPJMESA-N 2 1 339.439 3.549 20 5 EHBDMP C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109668 1037322316 /nfs/dbraw/zinc/32/23/16/1037322316.db2.gz FHPVBXZAUXZMAL-IBGZPJMESA-N 2 1 339.439 3.549 20 5 EHBDMP C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109668 1037322333 /nfs/dbraw/zinc/32/23/33/1037322333.db2.gz FHPVBXZAUXZMAL-IBGZPJMESA-N 2 1 339.439 3.549 20 5 EHBDMP C[NH+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076109668 1037322354 /nfs/dbraw/zinc/32/23/54/1037322354.db2.gz FHPVBXZAUXZMAL-IBGZPJMESA-N 2 1 339.439 3.549 20 5 EHBDMP C[NH+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076109668 1037322370 /nfs/dbraw/zinc/32/23/70/1037322370.db2.gz FHPVBXZAUXZMAL-IBGZPJMESA-N 2 1 339.439 3.549 20 5 EHBDMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309055 1039662422 /nfs/dbraw/zinc/66/24/22/1039662422.db2.gz DFKABBOVOIVWRR-BEFAXECRSA-N 2 1 331.460 3.684 20 5 EHBDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309057 1039664322 /nfs/dbraw/zinc/66/43/22/1039664322.db2.gz DFKABBOVOIVWRR-HNAYVOBHSA-N 2 1 331.460 3.684 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000245522029 1130230884 /nfs/dbraw/zinc/23/08/84/1130230884.db2.gz LHMOJWQCRRULKB-FTRWYGJKSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000245522029 1130230886 /nfs/dbraw/zinc/23/08/86/1130230886.db2.gz LHMOJWQCRRULKB-FTRWYGJKSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000245522029 1130230891 /nfs/dbraw/zinc/23/08/91/1130230891.db2.gz LHMOJWQCRRULKB-FTRWYGJKSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000245522029 1130230894 /nfs/dbraw/zinc/23/08/94/1130230894.db2.gz LHMOJWQCRRULKB-FTRWYGJKSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000245522029 1130230897 /nfs/dbraw/zinc/23/08/97/1130230897.db2.gz LHMOJWQCRRULKB-FTRWYGJKSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000245522029 1130230901 /nfs/dbraw/zinc/23/09/01/1130230901.db2.gz LHMOJWQCRRULKB-FTRWYGJKSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000245522029 1130230905 /nfs/dbraw/zinc/23/09/05/1130230905.db2.gz LHMOJWQCRRULKB-FTRWYGJKSA-N 2 1 343.471 3.913 20 5 EHBDMP [NH3+]CCC[C@@H]1CCCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172904911 1131886490 /nfs/dbraw/zinc/88/64/90/1131886490.db2.gz GUDRRTXDURNVHV-QFBILLFUSA-N 2 1 345.487 3.683 20 5 EHBDMP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859215041 1137008259 /nfs/dbraw/zinc/00/82/59/1137008259.db2.gz VAQWOEPTCNPZRI-HNNXBMFYSA-N 2 1 327.428 3.849 20 5 EHBDMP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020634 1137565089 /nfs/dbraw/zinc/56/50/89/1137565089.db2.gz JNBMRRLXXUCOMU-CYBMUJFWSA-N 2 1 331.391 3.646 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000271128442 1141311682 /nfs/dbraw/zinc/31/16/82/1141311682.db2.gz LAIZTEMBCWBCRL-LSDHHAIUSA-N 2 1 349.500 3.539 20 5 EHBDMP CC(C)c1ccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000246876465 1014813714 /nfs/dbraw/zinc/81/37/14/1014813714.db2.gz SWPGCFRYHJZMBF-WMZOPIPTSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cc1[N+](=O)[O-] ZINC000246876465 1014813729 /nfs/dbraw/zinc/81/37/29/1014813729.db2.gz SWPGCFRYHJZMBF-WMZOPIPTSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cc1[N+](=O)[O-] ZINC000246876465 1014813742 /nfs/dbraw/zinc/81/37/42/1014813742.db2.gz SWPGCFRYHJZMBF-WMZOPIPTSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cc1[N+](=O)[O-] ZINC000246876465 1014813746 /nfs/dbraw/zinc/81/37/46/1014813746.db2.gz SWPGCFRYHJZMBF-WMZOPIPTSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000246876465 1014813755 /nfs/dbraw/zinc/81/37/55/1014813755.db2.gz SWPGCFRYHJZMBF-WMZOPIPTSA-N 2 1 331.460 3.634 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246944317 1016193270 /nfs/dbraw/zinc/19/32/70/1016193270.db2.gz UGWKHLIUPLNLSS-OGWOLHLISA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246944317 1016193275 /nfs/dbraw/zinc/19/32/75/1016193275.db2.gz UGWKHLIUPLNLSS-OGWOLHLISA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246944317 1016193278 /nfs/dbraw/zinc/19/32/78/1016193278.db2.gz UGWKHLIUPLNLSS-OGWOLHLISA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246944317 1016193267 /nfs/dbraw/zinc/19/32/67/1016193267.db2.gz UGWKHLIUPLNLSS-OGWOLHLISA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656694 1017108126 /nfs/dbraw/zinc/10/81/26/1017108126.db2.gz IZXJBBZCULKIES-KGLIPLIRSA-N 2 1 345.468 3.883 20 5 EHBDMP CC(C)([NH3+])C[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414807599 1017207804 /nfs/dbraw/zinc/20/78/04/1017207804.db2.gz ROOIOWAUSPKNIN-UHFFFAOYSA-N 2 1 349.818 3.867 20 5 EHBDMP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000580345454 1019120691 /nfs/dbraw/zinc/12/06/91/1019120691.db2.gz JHKWGCYYRXHJTR-SFHVURJKSA-N 2 1 329.444 3.579 20 5 EHBDMP C[C@H]([NH2+]C[C@@H]([NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423333859 1028370828 /nfs/dbraw/zinc/37/08/28/1028370828.db2.gz WEXDMJSEEMJPAI-SMDDNHRTSA-N 2 1 331.441 3.711 20 5 EHBDMP C[N@@H+](CCCC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453419355 1030271348 /nfs/dbraw/zinc/27/13/48/1030271348.db2.gz YWJSGGJGSYMFSF-VQIMIIECSA-N 2 1 345.487 3.770 20 5 EHBDMP CC[NH+]1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000236921124 1039766852 /nfs/dbraw/zinc/76/68/52/1039766852.db2.gz XNGXQSDWGHPNBQ-UHFFFAOYSA-N 2 1 345.468 3.897 20 5 EHBDMP CC[C@@H]1CCC[N@H+]1CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001179863574 1133295430 /nfs/dbraw/zinc/29/54/30/1133295430.db2.gz PKOJNLBHPQUQAO-LJQANCHMSA-N 2 1 345.487 3.724 20 5 EHBDMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000873043912 1137588744 /nfs/dbraw/zinc/58/87/44/1137588744.db2.gz WLSPFXCARDRRLS-UHFFFAOYSA-N 2 1 327.428 3.645 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607350 1139144144 /nfs/dbraw/zinc/14/41/44/1139144144.db2.gz YQPOBXYELWYWTR-JKSUJKDBSA-N 2 1 349.475 3.765 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607350 1139144149 /nfs/dbraw/zinc/14/41/49/1139144149.db2.gz YQPOBXYELWYWTR-JKSUJKDBSA-N 2 1 349.475 3.765 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536835054 1032330856 /nfs/dbraw/zinc/33/08/56/1032330856.db2.gz ZGSGKAUHUBYGMZ-SJORKVTESA-N 2 1 333.476 3.922 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000536835054 1032330873 /nfs/dbraw/zinc/33/08/73/1032330873.db2.gz ZGSGKAUHUBYGMZ-SJORKVTESA-N 2 1 333.476 3.922 20 5 EHBDMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717338 1024493045 /nfs/dbraw/zinc/49/30/45/1024493045.db2.gz UXNFTKTYNVEJRB-QAPCUYQASA-N 2 1 333.476 3.880 20 5 EHBDMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717338 1024493060 /nfs/dbraw/zinc/49/30/60/1024493060.db2.gz UXNFTKTYNVEJRB-QAPCUYQASA-N 2 1 333.476 3.880 20 5 EHBDMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717338 1024493068 /nfs/dbraw/zinc/49/30/68/1024493068.db2.gz UXNFTKTYNVEJRB-QAPCUYQASA-N 2 1 333.476 3.880 20 5 EHBDMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717338 1024493072 /nfs/dbraw/zinc/49/30/72/1024493072.db2.gz UXNFTKTYNVEJRB-QAPCUYQASA-N 2 1 333.476 3.880 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000504920103 1029045748 /nfs/dbraw/zinc/04/57/48/1029045748.db2.gz NDIKXVVYSGJAEK-KFWWJZLASA-N 2 1 337.489 3.538 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000504920103 1029045765 /nfs/dbraw/zinc/04/57/65/1029045765.db2.gz NDIKXVVYSGJAEK-KFWWJZLASA-N 2 1 337.489 3.538 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000160481052 1030787527 /nfs/dbraw/zinc/78/75/27/1030787527.db2.gz UHZQRHRWSUUHOS-OAHLLOKOSA-N 2 1 331.460 3.961 20 5 EHBDMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068691 1033709213 /nfs/dbraw/zinc/70/92/13/1033709213.db2.gz CJHMXCIVKJMZTQ-KDOFPFPSSA-N 2 1 331.460 3.639 20 5 EHBDMP C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272135631 1037087234 /nfs/dbraw/zinc/08/72/34/1037087234.db2.gz AJQSHDVZEQQYCE-VQIMIIECSA-N 2 1 339.439 3.595 20 5 EHBDMP CCC[NH+]1CCC([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433155871 1040938194 /nfs/dbraw/zinc/93/81/94/1040938194.db2.gz ZRXMXAKKYSYUOP-SFHVURJKSA-N 2 1 331.460 3.781 20 5 EHBDMP Cc1c(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722943 1140166767 /nfs/dbraw/zinc/16/67/67/1140166767.db2.gz DVMCVPBQPOBQTI-DOTOQJQBSA-N 2 1 331.460 3.646 20 5 EHBDMP Cc1c(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722943 1140166769 /nfs/dbraw/zinc/16/67/69/1140166769.db2.gz DVMCVPBQPOBQTI-DOTOQJQBSA-N 2 1 331.460 3.646 20 5 EHBDMP C[N@@H+]1CC[C@@H](NCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000340279954 1016848733 /nfs/dbraw/zinc/84/87/33/1016848733.db2.gz RQJIRDKWDPAXNH-MJGOQNOKSA-N 2 1 325.412 3.520 20 5 EHBDMP C[N@H+]1CC[C@@H](NCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000340279954 1016848750 /nfs/dbraw/zinc/84/87/50/1016848750.db2.gz RQJIRDKWDPAXNH-MJGOQNOKSA-N 2 1 325.412 3.520 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000459777276 1032463488 /nfs/dbraw/zinc/46/34/88/1032463488.db2.gz KLXAHJAXQUUYRQ-ZIFCJYIRSA-N 2 1 345.487 3.628 20 5 EHBDMP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000580221182 1018819737 /nfs/dbraw/zinc/81/97/37/1018819737.db2.gz FFDWYDVQLLAHST-ICSRJNTNSA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000580221182 1018819752 /nfs/dbraw/zinc/81/97/52/1018819752.db2.gz FFDWYDVQLLAHST-ICSRJNTNSA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@@H+](CCCC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000602688959 1033068762 /nfs/dbraw/zinc/06/87/62/1033068762.db2.gz UKDKRKKDRPMJRI-UHFFFAOYSA-N 2 1 345.365 3.578 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCC[NH+](C)C1 ZINC000508516250 1028484074 /nfs/dbraw/zinc/48/40/74/1028484074.db2.gz KUVIPTPUAPDCEP-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCC[NH+](C)C1 ZINC000508516250 1028484082 /nfs/dbraw/zinc/48/40/82/1028484082.db2.gz KUVIPTPUAPDCEP-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCC[N@H+](C)C1 ZINC000508516250 1028484085 /nfs/dbraw/zinc/48/40/85/1028484085.db2.gz KUVIPTPUAPDCEP-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000508516250 1028484095 /nfs/dbraw/zinc/48/40/95/1028484095.db2.gz KUVIPTPUAPDCEP-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@@H]1C[N@@H+]2CCC[C@H]2CO1 ZINC000729684802 1028554363 /nfs/dbraw/zinc/55/43/63/1028554363.db2.gz WWXALVNUZANNJU-VQTJNVASSA-N 2 1 346.474 3.946 20 5 EHBDMP c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000729684802 1028554377 /nfs/dbraw/zinc/55/43/77/1028554377.db2.gz WWXALVNUZANNJU-VQTJNVASSA-N 2 1 346.474 3.946 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCC[NH2+]CC1 ZINC000414756659 1028572816 /nfs/dbraw/zinc/57/28/16/1028572816.db2.gz VQXQINJIOAJONV-CQSZACIVSA-N 2 1 345.468 3.897 20 5 EHBDMP CCOc1ccc([C@@H](C)NCCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504894986 1029039268 /nfs/dbraw/zinc/03/92/68/1029039268.db2.gz PXPUHKBCKIBBHX-HZPDHXFCSA-N 2 1 349.475 3.909 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504894986 1029039281 /nfs/dbraw/zinc/03/92/81/1029039281.db2.gz PXPUHKBCKIBBHX-HZPDHXFCSA-N 2 1 349.475 3.909 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504894986 1029039289 /nfs/dbraw/zinc/03/92/89/1029039289.db2.gz PXPUHKBCKIBBHX-HZPDHXFCSA-N 2 1 349.475 3.909 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000052210060 1029356651 /nfs/dbraw/zinc/35/66/51/1029356651.db2.gz VZASYVPYHXWAKR-UHFFFAOYSA-N 2 1 333.476 3.847 20 5 EHBDMP CC1CC[NH+](CCC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000447516939 1030239361 /nfs/dbraw/zinc/23/93/61/1030239361.db2.gz IOTJHWYOQRLQGB-IBGZPJMESA-N 2 1 331.460 3.684 20 5 EHBDMP C[NH+](C)CC1(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCC1 ZINC000447601874 1030354856 /nfs/dbraw/zinc/35/48/56/1030354856.db2.gz ROHATBQVAPKILK-SFHVURJKSA-N 2 1 331.460 3.684 20 5 EHBDMP C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272135630 1037088571 /nfs/dbraw/zinc/08/85/71/1037088571.db2.gz AJQSHDVZEQQYCE-QFBILLFUSA-N 2 1 339.439 3.595 20 5 EHBDMP CC[NH+](CC)CC1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000494177425 1037881569 /nfs/dbraw/zinc/88/15/69/1037881569.db2.gz XBVXNCPSIWACEA-UHFFFAOYSA-N 2 1 339.867 3.802 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000543418037 1129474830 /nfs/dbraw/zinc/47/48/30/1129474830.db2.gz MFRPFGRKJBZBSX-HOTGVXAUSA-N 2 1 349.475 3.909 20 5 EHBDMP C[C@H](C[NH3+])C[N@@H+](Cc1ccccc1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220890 1132004287 /nfs/dbraw/zinc/00/42/87/1132004287.db2.gz HSRSGIVLFUZHAS-IAGOWNOFSA-N 2 1 341.455 3.623 20 5 EHBDMP Cc1c(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cccc1[N+](=O)[O-] ZINC000859214173 1137008265 /nfs/dbraw/zinc/00/82/65/1137008265.db2.gz NMHCZIKHOMAAFL-UHFFFAOYSA-N 2 1 327.428 3.597 20 5 EHBDMP Cc1[nH]c(C2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)[nH+]c1C ZINC000886668146 1138111662 /nfs/dbraw/zinc/11/16/62/1138111662.db2.gz OAALUVTWQLCTHL-UHFFFAOYSA-N 2 1 328.416 3.623 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000191491736 1140466929 /nfs/dbraw/zinc/46/69/29/1140466929.db2.gz KAWVFQXLVKNGHY-UHFFFAOYSA-N 2 1 330.432 3.574 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000191491736 1140466932 /nfs/dbraw/zinc/46/69/32/1140466932.db2.gz KAWVFQXLVKNGHY-UHFFFAOYSA-N 2 1 330.432 3.574 20 5 EHBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCn1cc[nH+]c1C ZINC000271123911 1141310194 /nfs/dbraw/zinc/31/01/94/1141310194.db2.gz KBOULLAXMXXTKZ-HNNXBMFYSA-N 2 1 348.472 3.650 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246944284 1016193492 /nfs/dbraw/zinc/19/34/92/1016193492.db2.gz UGWKHLIUPLNLSS-ALKREAHSSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246944284 1016193498 /nfs/dbraw/zinc/19/34/98/1016193498.db2.gz UGWKHLIUPLNLSS-ALKREAHSSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246944284 1016193501 /nfs/dbraw/zinc/19/35/01/1016193501.db2.gz UGWKHLIUPLNLSS-ALKREAHSSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246944284 1016193509 /nfs/dbraw/zinc/19/35/09/1016193509.db2.gz UGWKHLIUPLNLSS-ALKREAHSSA-N 2 1 329.444 3.605 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CCC2 ZINC000278745108 1032279499 /nfs/dbraw/zinc/27/94/99/1032279499.db2.gz NOEGGZYHTVRXHR-IBGZPJMESA-N 2 1 329.444 3.579 20 5 EHBDMP CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC[NH2+]CC1 ZINC000414720662 1017153930 /nfs/dbraw/zinc/15/39/30/1017153930.db2.gz ZIZSWXQVIAAIDN-HNNXBMFYSA-N 2 1 343.427 3.819 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000414785344 1017198513 /nfs/dbraw/zinc/19/85/13/1017198513.db2.gz SMSWCTHUKXSGKG-SJORKVTESA-N 2 1 331.460 3.540 20 5 EHBDMP C[C@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379637259 1019010578 /nfs/dbraw/zinc/01/05/78/1019010578.db2.gz SHBRLPZFBRZXLD-LPHOPBHVSA-N 2 1 339.439 3.738 20 5 EHBDMP C[C@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000379637259 1019010595 /nfs/dbraw/zinc/01/05/95/1019010595.db2.gz SHBRLPZFBRZXLD-LPHOPBHVSA-N 2 1 339.439 3.738 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000182803361 1019747749 /nfs/dbraw/zinc/74/77/49/1019747749.db2.gz DFVPQKYQLNKJSS-IRXDYDNUSA-N 2 1 331.460 3.915 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000182803361 1019747767 /nfs/dbraw/zinc/74/77/67/1019747767.db2.gz DFVPQKYQLNKJSS-IRXDYDNUSA-N 2 1 331.460 3.915 20 5 EHBDMP CCOc1ccc([C@H](C)NCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504894985 1029040041 /nfs/dbraw/zinc/04/00/41/1029040041.db2.gz PXPUHKBCKIBBHX-HOTGVXAUSA-N 2 1 349.475 3.909 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504894985 1029040057 /nfs/dbraw/zinc/04/00/57/1029040057.db2.gz PXPUHKBCKIBBHX-HOTGVXAUSA-N 2 1 349.475 3.909 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504894985 1029040072 /nfs/dbraw/zinc/04/00/72/1029040072.db2.gz PXPUHKBCKIBBHX-HOTGVXAUSA-N 2 1 349.475 3.909 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595900213 1034025878 /nfs/dbraw/zinc/02/58/78/1034025878.db2.gz BERHXONURATMNX-RDJZCZTQSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596097528 1034061073 /nfs/dbraw/zinc/06/10/73/1034061073.db2.gz YSLCWDCUIXHZLA-DOTOQJQBSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596097528 1034061089 /nfs/dbraw/zinc/06/10/89/1034061089.db2.gz YSLCWDCUIXHZLA-DOTOQJQBSA-N 2 1 331.460 3.676 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]CCC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000179394442 1034278223 /nfs/dbraw/zinc/27/82/23/1034278223.db2.gz YEFFQSSWOCYCOE-OAHLLOKOSA-N 2 1 335.448 3.520 20 5 EHBDMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000236666558 1035037580 /nfs/dbraw/zinc/03/75/80/1035037580.db2.gz AFUUASPJKAXSPT-UHFFFAOYSA-N 2 1 327.428 3.725 20 5 EHBDMP Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150543 1037621728 /nfs/dbraw/zinc/62/17/28/1037621728.db2.gz FURLWNZUSZQCEC-IRXDYDNUSA-N 2 1 333.476 3.922 20 5 EHBDMP C[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000480253207 1039340885 /nfs/dbraw/zinc/34/08/85/1039340885.db2.gz VHPBZYMNWBXPRN-MRXNPFEDSA-N 2 1 339.439 3.694 20 5 EHBDMP C[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000480253207 1039340898 /nfs/dbraw/zinc/34/08/98/1039340898.db2.gz VHPBZYMNWBXPRN-MRXNPFEDSA-N 2 1 339.439 3.694 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000485748438 1039512895 /nfs/dbraw/zinc/51/28/95/1039512895.db2.gz WYZXOGMQDSJFJU-UHFFFAOYSA-N 2 1 349.475 3.547 20 5 EHBDMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417302858 1039643638 /nfs/dbraw/zinc/64/36/38/1039643638.db2.gz BYUSKSAVSDSADJ-SFHVURJKSA-N 2 1 328.416 3.547 20 5 EHBDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309058 1039663178 /nfs/dbraw/zinc/66/31/78/1039663178.db2.gz DFKABBOVOIVWRR-KXBFYZLASA-N 2 1 331.460 3.684 20 5 EHBDMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417311965 1039666108 /nfs/dbraw/zinc/66/61/08/1039666108.db2.gz MUSOAMLXGLQJOV-LJQANCHMSA-N 2 1 342.443 3.937 20 5 EHBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314607 1039669672 /nfs/dbraw/zinc/66/96/72/1039669672.db2.gz RMKMAWOBCIGZOC-KUHUBIRLSA-N 2 1 342.443 3.793 20 5 EHBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433115158 1040781033 /nfs/dbraw/zinc/78/10/33/1040781033.db2.gz HVUCDKTWRGWGNW-ACJLOTCBSA-N 2 1 342.443 3.748 20 5 EHBDMP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192972013 1040926527 /nfs/dbraw/zinc/92/65/27/1040926527.db2.gz JWVRCNUYEUXVPO-SFHVURJKSA-N 2 1 331.460 3.825 20 5 EHBDMP CC(C)[NH+]1CCC([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433284385 1041232730 /nfs/dbraw/zinc/23/27/30/1041232730.db2.gz JURZNFZENCDRJD-GOSISDBHSA-N 2 1 331.460 3.780 20 5 EHBDMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172902932 1131885251 /nfs/dbraw/zinc/88/52/51/1131885251.db2.gz CQTBOVIMYYTDCZ-GUDVDZBRSA-N 2 1 345.487 3.823 20 5 EHBDMP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768209609 1133107734 /nfs/dbraw/zinc/10/77/34/1133107734.db2.gz SFNKWSYRDFLPRO-HNNXBMFYSA-N 2 1 327.428 3.849 20 5 EHBDMP COc1ccc(C[C@H](C)[N@@H+](C(C)C)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001170322375 1134747571 /nfs/dbraw/zinc/74/75/71/1134747571.db2.gz FHTKAAKEZQGDQD-XIRDDKMYSA-N 2 1 349.475 3.515 20 5 EHBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000809736972 1135882388 /nfs/dbraw/zinc/88/23/88/1135882388.db2.gz ACPYJRBNTOEFNV-UHFFFAOYSA-N 2 1 347.846 3.942 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000872079359 1137570211 /nfs/dbraw/zinc/57/02/11/1137570211.db2.gz XVMVBBUPSLMRMV-ZDUSSCGKSA-N 2 1 337.489 3.842 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000269672660 1141133792 /nfs/dbraw/zinc/13/37/92/1141133792.db2.gz RKPNDQBAFOYLGJ-IIDMSEBBSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000269672660 1141133795 /nfs/dbraw/zinc/13/37/95/1141133795.db2.gz RKPNDQBAFOYLGJ-IIDMSEBBSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000269672660 1141133799 /nfs/dbraw/zinc/13/37/99/1141133799.db2.gz RKPNDQBAFOYLGJ-IIDMSEBBSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000269672660 1141133804 /nfs/dbraw/zinc/13/38/04/1141133804.db2.gz RKPNDQBAFOYLGJ-IIDMSEBBSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000269672660 1141133807 /nfs/dbraw/zinc/13/38/07/1141133807.db2.gz RKPNDQBAFOYLGJ-IIDMSEBBSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000269672660 1141133811 /nfs/dbraw/zinc/13/38/11/1141133811.db2.gz RKPNDQBAFOYLGJ-IIDMSEBBSA-N 2 1 329.444 3.605 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCn1cc[nH+]c1C ZINC000271123912 1141310793 /nfs/dbraw/zinc/31/07/93/1141310793.db2.gz KBOULLAXMXXTKZ-OAHLLOKOSA-N 2 1 348.472 3.650 20 5 EHBDMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414656210 1017108221 /nfs/dbraw/zinc/10/82/21/1017108221.db2.gz HZWKOUGIYNJYFY-ZFWWWQNUSA-N 2 1 345.468 3.883 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592491868 1032927653 /nfs/dbraw/zinc/92/76/53/1032927653.db2.gz MQIAAEHXGPLPSC-GVDBMIGSSA-N 2 1 331.460 3.676 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000504920106 1029045582 /nfs/dbraw/zinc/04/55/82/1029045582.db2.gz NDIKXVVYSGJAEK-ZNMIVQPWSA-N 2 1 337.489 3.538 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000504920106 1029045599 /nfs/dbraw/zinc/04/55/99/1029045599.db2.gz NDIKXVVYSGJAEK-ZNMIVQPWSA-N 2 1 337.489 3.538 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000504920104 1029045917 /nfs/dbraw/zinc/04/59/17/1029045917.db2.gz NDIKXVVYSGJAEK-RBSFLKMASA-N 2 1 337.489 3.538 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000504920104 1029045936 /nfs/dbraw/zinc/04/59/36/1029045936.db2.gz NDIKXVVYSGJAEK-RBSFLKMASA-N 2 1 337.489 3.538 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596059047 1034063854 /nfs/dbraw/zinc/06/38/54/1034063854.db2.gz MCWNNXXUFRHRLP-XLCPLWEUSA-N 2 1 343.471 3.710 20 5 EHBDMP CC[N@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000470178706 1038563582 /nfs/dbraw/zinc/56/35/82/1038563582.db2.gz MNWPYSUHUGBYNI-CSXOKHGMSA-N 2 1 331.460 3.803 20 5 EHBDMP CC[NH+]1CC[C@H]([N@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000470178706 1038563589 /nfs/dbraw/zinc/56/35/89/1038563589.db2.gz MNWPYSUHUGBYNI-CSXOKHGMSA-N 2 1 331.460 3.803 20 5 EHBDMP CC[NH+]1CC[C@H]([N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000470178706 1038563596 /nfs/dbraw/zinc/56/35/96/1038563596.db2.gz MNWPYSUHUGBYNI-CSXOKHGMSA-N 2 1 331.460 3.803 20 5 EHBDMP CC1(C)C[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433154340 1040921068 /nfs/dbraw/zinc/92/10/68/1040921068.db2.gz ZBZKAYMXQWGLPA-IBGZPJMESA-N 2 1 343.471 3.781 20 5 EHBDMP C[C@H](C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000433150150 1040928305 /nfs/dbraw/zinc/92/83/05/1040928305.db2.gz VRRFTATWRBMZSS-KDOFPFPSSA-N 2 1 331.460 3.639 20 5 EHBDMP CC(C)[NH+]1CCC([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433284388 1041234607 /nfs/dbraw/zinc/23/46/07/1041234607.db2.gz JURZNFZENCDRJD-SFHVURJKSA-N 2 1 331.460 3.780 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000245522032 1130230407 /nfs/dbraw/zinc/23/04/07/1130230407.db2.gz LHMOJWQCRRULKB-TWOQFEAHSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000245522032 1130230410 /nfs/dbraw/zinc/23/04/10/1130230410.db2.gz LHMOJWQCRRULKB-TWOQFEAHSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000245522032 1130230415 /nfs/dbraw/zinc/23/04/15/1130230415.db2.gz LHMOJWQCRRULKB-TWOQFEAHSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000245522032 1130230419 /nfs/dbraw/zinc/23/04/19/1130230419.db2.gz LHMOJWQCRRULKB-TWOQFEAHSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000245522032 1130230421 /nfs/dbraw/zinc/23/04/21/1130230421.db2.gz LHMOJWQCRRULKB-TWOQFEAHSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000245522032 1130230426 /nfs/dbraw/zinc/23/04/26/1130230426.db2.gz LHMOJWQCRRULKB-TWOQFEAHSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000245522032 1130230431 /nfs/dbraw/zinc/23/04/31/1130230431.db2.gz LHMOJWQCRRULKB-TWOQFEAHSA-N 2 1 343.471 3.913 20 5 EHBDMP O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000817906657 1136845221 /nfs/dbraw/zinc/84/52/21/1136845221.db2.gz AQHNUWHMHALHJT-BHYGNILZSA-N 2 1 337.851 3.649 20 5 EHBDMP O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000817906662 1136845326 /nfs/dbraw/zinc/84/53/26/1136845326.db2.gz AQHNUWHMHALHJT-USXIJHARSA-N 2 1 337.851 3.649 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000271128441 1141311662 /nfs/dbraw/zinc/31/16/62/1141311662.db2.gz LAIZTEMBCWBCRL-HUUCEWRRSA-N 2 1 349.500 3.539 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@H]3CCC[NH2+]3)o2)c(Cl)c1 ZINC000414906906 1017301467 /nfs/dbraw/zinc/30/14/67/1017301467.db2.gz QAFGQNYXZOTSHP-GFCCVEGCSA-N 2 1 349.818 3.740 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000119439966 1024018456 /nfs/dbraw/zinc/01/84/56/1024018456.db2.gz HJWCYBSMHFEIQT-UHFFFAOYSA-N 2 1 330.432 3.791 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000119439966 1024018470 /nfs/dbraw/zinc/01/84/70/1024018470.db2.gz HJWCYBSMHFEIQT-UHFFFAOYSA-N 2 1 330.432 3.791 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000277247228 1024326839 /nfs/dbraw/zinc/32/68/39/1024326839.db2.gz PYUYPHVJQZWDDH-OAHLLOKOSA-N 2 1 330.432 3.827 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000277247228 1024326853 /nfs/dbraw/zinc/32/68/53/1024326853.db2.gz PYUYPHVJQZWDDH-OAHLLOKOSA-N 2 1 330.432 3.827 20 5 EHBDMP C[N@@H+](CCCC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453419352 1030270875 /nfs/dbraw/zinc/27/08/75/1030270875.db2.gz YWJSGGJGSYMFSF-APWZRJJASA-N 2 1 345.487 3.770 20 5 EHBDMP C[N@@H+](CCCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000453590839 1030381170 /nfs/dbraw/zinc/38/11/70/1030381170.db2.gz BVUXQWLLUTZMIE-UHFFFAOYSA-N 2 1 343.427 3.819 20 5 EHBDMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950663 1032035380 /nfs/dbraw/zinc/03/53/80/1032035380.db2.gz HTEWZVLQVWMNJN-IAGOWNOFSA-N 2 1 333.476 3.922 20 5 EHBDMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950663 1032035399 /nfs/dbraw/zinc/03/53/99/1032035399.db2.gz HTEWZVLQVWMNJN-IAGOWNOFSA-N 2 1 333.476 3.922 20 5 EHBDMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000550665500 1033836231 /nfs/dbraw/zinc/83/62/31/1033836231.db2.gz KRUQTVFYVBMCOE-UYAOXDASSA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000550665500 1033836244 /nfs/dbraw/zinc/83/62/44/1033836244.db2.gz KRUQTVFYVBMCOE-UYAOXDASSA-N 2 1 339.439 3.562 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596097529 1034060583 /nfs/dbraw/zinc/06/05/83/1034060583.db2.gz YSLCWDCUIXHZLA-NVXWUHKLSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596097529 1034060596 /nfs/dbraw/zinc/06/05/96/1034060596.db2.gz YSLCWDCUIXHZLA-NVXWUHKLSA-N 2 1 331.460 3.676 20 5 EHBDMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000236666064 1035037391 /nfs/dbraw/zinc/03/73/91/1035037391.db2.gz YTYSAQIKBMHLQY-UHFFFAOYSA-N 2 1 327.428 3.725 20 5 EHBDMP CCCC[N@H+](CC)CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900624 1131883441 /nfs/dbraw/zinc/88/34/41/1131883441.db2.gz WXALFGKAFPQYPN-SFHVURJKSA-N 2 1 333.476 3.554 20 5 EHBDMP CCCC[N@@H+](CC)CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900624 1131883449 /nfs/dbraw/zinc/88/34/49/1131883449.db2.gz WXALFGKAFPQYPN-SFHVURJKSA-N 2 1 333.476 3.554 20 5 EHBDMP [NH3+]CCC[C@H]1CCCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172904904 1131886784 /nfs/dbraw/zinc/88/67/84/1131886784.db2.gz GUDRRTXDURNVHV-APWZRJJASA-N 2 1 345.487 3.683 20 5 EHBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001184376085 1133932865 /nfs/dbraw/zinc/93/28/65/1133932865.db2.gz ZSOVJZWVMRGHHT-PTNGSMBKSA-N 2 1 331.460 3.851 20 5 EHBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001184376085 1133932869 /nfs/dbraw/zinc/93/28/69/1133932869.db2.gz ZSOVJZWVMRGHHT-PTNGSMBKSA-N 2 1 331.460 3.851 20 5 EHBDMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023193 1137565393 /nfs/dbraw/zinc/56/53/93/1137565393.db2.gz CZRCRVJCVPEKQF-KBPBESRZSA-N 2 1 337.489 3.699 20 5 EHBDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023193 1137565394 /nfs/dbraw/zinc/56/53/94/1137565394.db2.gz CZRCRVJCVPEKQF-KBPBESRZSA-N 2 1 337.489 3.699 20 5 EHBDMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770287 1138240909 /nfs/dbraw/zinc/24/09/09/1138240909.db2.gz BKCGETOOGFJFSP-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770287 1138240912 /nfs/dbraw/zinc/24/09/12/1138240912.db2.gz BKCGETOOGFJFSP-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770287 1138240914 /nfs/dbraw/zinc/24/09/14/1138240914.db2.gz BKCGETOOGFJFSP-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770287 1138240918 /nfs/dbraw/zinc/24/09/18/1138240918.db2.gz BKCGETOOGFJFSP-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](CC)CC1 ZINC000271136029 1141312902 /nfs/dbraw/zinc/31/29/02/1141312902.db2.gz NDCRGNFPKFTAEW-CQSZACIVSA-N 2 1 337.489 3.539 20 5 EHBDMP Cc1c(CN2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475455 1023246471 /nfs/dbraw/zinc/24/64/71/1023246471.db2.gz XAKNSKZHOLWYIM-WMZOPIPTSA-N 2 1 345.487 3.990 20 5 EHBDMP CC(C)[N@@H+](C)CC1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000535811317 1023651647 /nfs/dbraw/zinc/65/16/47/1023651647.db2.gz CTRABTBPFIUHSK-SOFGYWHQSA-N 2 1 331.460 3.660 20 5 EHBDMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000277436976 1025104358 /nfs/dbraw/zinc/10/43/58/1025104358.db2.gz JXQMWSMQNWVZKQ-MRXNPFEDSA-N 2 1 343.427 3.771 20 5 EHBDMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000277436976 1025104368 /nfs/dbraw/zinc/10/43/68/1025104368.db2.gz JXQMWSMQNWVZKQ-MRXNPFEDSA-N 2 1 343.427 3.771 20 5 EHBDMP C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000347165157 1025602735 /nfs/dbraw/zinc/60/27/35/1025602735.db2.gz JQSUSPBSFVPMPX-YIONKMFJSA-N 2 1 341.411 3.570 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000347165157 1025602742 /nfs/dbraw/zinc/60/27/42/1025602742.db2.gz JQSUSPBSFVPMPX-YIONKMFJSA-N 2 1 341.411 3.570 20 5 EHBDMP CCC[C@H]([NH2+]C1CCN(CCCOC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000159143003 1026498816 /nfs/dbraw/zinc/49/88/16/1026498816.db2.gz NVXCAUHQZPHVGQ-IBGZPJMESA-N 2 1 349.475 3.527 20 5 EHBDMP CCC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1cccc([N+](=O)[O-])c1 ZINC000178702030 1028120798 /nfs/dbraw/zinc/12/07/98/1028120798.db2.gz JZHKCVMIRSYDRO-KDOFPFPSSA-N 2 1 330.432 3.867 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595293668 1033720593 /nfs/dbraw/zinc/72/05/93/1033720593.db2.gz RXKATAGHNJJEDA-UHFFFAOYSA-N 2 1 337.439 3.678 20 5 EHBDMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095282 1034078744 /nfs/dbraw/zinc/07/87/44/1034078744.db2.gz OOSGJCXCQWEPIK-QFBILLFUSA-N 2 1 331.460 3.758 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000290423578 1037601006 /nfs/dbraw/zinc/60/10/06/1037601006.db2.gz KWRKYSCHXFUODI-UHFFFAOYSA-N 2 1 330.432 3.574 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000290423578 1037601015 /nfs/dbraw/zinc/60/10/15/1037601015.db2.gz KWRKYSCHXFUODI-UHFFFAOYSA-N 2 1 330.432 3.574 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000470174382 1038493161 /nfs/dbraw/zinc/49/31/61/1038493161.db2.gz KJCUVTKLXJHNGV-FLXZHSAZSA-N 2 1 343.471 3.948 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000470174382 1038493166 /nfs/dbraw/zinc/49/31/66/1038493166.db2.gz KJCUVTKLXJHNGV-FLXZHSAZSA-N 2 1 343.471 3.948 20 5 EHBDMP CC(C)[NH+]1CCC([NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417316983 1039657731 /nfs/dbraw/zinc/65/77/31/1039657731.db2.gz VMFYWFSWELJXCT-LJQANCHMSA-N 2 1 331.460 3.825 20 5 EHBDMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278976859 1043115361 /nfs/dbraw/zinc/11/53/61/1043115361.db2.gz COWMMUBKPKWPAH-KRWDZBQOSA-N 2 1 328.416 3.502 20 5 EHBDMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000153345694 1121745537 /nfs/dbraw/zinc/74/55/37/1121745537.db2.gz VRMGAJLMWCFHSE-OAHLLOKOSA-N 2 1 349.475 3.909 20 5 EHBDMP CCC[N@@H+](CCC[NH+](C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914062 1131902974 /nfs/dbraw/zinc/90/29/74/1131902974.db2.gz YSDCBOREFJZZCY-GOSISDBHSA-N 2 1 333.476 3.506 20 5 EHBDMP CC[NH+](CC)CC1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746666404 1133985157 /nfs/dbraw/zinc/98/51/57/1133985157.db2.gz MJIWEYIVLOHJBT-UHFFFAOYSA-N 2 1 339.867 3.802 20 5 EHBDMP C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CC[NH+](C)CC1 ZINC000809946249 1135903099 /nfs/dbraw/zinc/90/30/99/1135903099.db2.gz AUTOMRUIIQAPGX-UHFFFAOYSA-N 2 1 346.258 3.675 20 5 EHBDMP Cc1[nH]c(C2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)[nH+]c1C ZINC000886665542 1138111572 /nfs/dbraw/zinc/11/15/72/1138111572.db2.gz AOTVICFYYZIKLV-CQSZACIVSA-N 2 1 328.416 3.875 20 5 EHBDMP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000449084117 1032139614 /nfs/dbraw/zinc/13/96/14/1032139614.db2.gz WPPJGDBYFZTHER-SJORKVTESA-N 2 1 333.476 3.770 20 5 EHBDMP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000449084116 1032139646 /nfs/dbraw/zinc/13/96/46/1032139646.db2.gz WPPJGDBYFZTHER-IRXDYDNUSA-N 2 1 333.476 3.770 20 5 EHBDMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]1 ZINC000414944941 1017345034 /nfs/dbraw/zinc/34/50/34/1017345034.db2.gz HRKYYBAYAJVPBA-RYUDHWBXSA-N 2 1 349.818 3.738 20 5 EHBDMP C[C@@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379637261 1019011304 /nfs/dbraw/zinc/01/13/04/1019011304.db2.gz SHBRLPZFBRZXLD-VQIMIIECSA-N 2 1 339.439 3.738 20 5 EHBDMP C[C@@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000379637261 1019011318 /nfs/dbraw/zinc/01/13/18/1019011318.db2.gz SHBRLPZFBRZXLD-VQIMIIECSA-N 2 1 339.439 3.738 20 5 EHBDMP C[C@@H](N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186686 1020542341 /nfs/dbraw/zinc/54/23/41/1020542341.db2.gz BPFDIQXJBPXMOY-BFYDXBDKSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186686 1020542345 /nfs/dbraw/zinc/54/23/45/1020542345.db2.gz BPFDIQXJBPXMOY-BFYDXBDKSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186686 1020542352 /nfs/dbraw/zinc/54/23/52/1020542352.db2.gz BPFDIQXJBPXMOY-BFYDXBDKSA-N 2 1 331.460 3.898 20 5 EHBDMP [NH3+][C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000424374573 1029033891 /nfs/dbraw/zinc/03/38/91/1029033891.db2.gz ZKNPIVHBMVXREH-HUUCEWRRSA-N 2 1 331.441 3.683 20 5 EHBDMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093693 1034078897 /nfs/dbraw/zinc/07/88/97/1034078897.db2.gz DPIRGJCUGCTNFT-NVXWUHKLSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093693 1034078910 /nfs/dbraw/zinc/07/89/10/1034078910.db2.gz DPIRGJCUGCTNFT-NVXWUHKLSA-N 2 1 331.460 3.676 20 5 EHBDMP O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443601361 1036656421 /nfs/dbraw/zinc/65/64/21/1036656421.db2.gz NWIVXAZBONXTBE-UHFFFAOYSA-N 2 1 349.450 3.822 20 5 EHBDMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417358006 1039719985 /nfs/dbraw/zinc/71/99/85/1039719985.db2.gz HIUQUHHQQKWJLM-KXBFYZLASA-N 2 1 331.460 3.684 20 5 EHBDMP CC(C)[NH+](CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)C ZINC001172896658 1131901871 /nfs/dbraw/zinc/90/18/71/1131901871.db2.gz QLQWZNACYQPRQC-GOSISDBHSA-N 2 1 333.476 3.551 20 5 EHBDMP CCC[N@H+]1CC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001177483360 1133068368 /nfs/dbraw/zinc/06/83/68/1133068368.db2.gz ONTXXKCKZVKPKE-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001177483360 1133068372 /nfs/dbraw/zinc/06/83/72/1133068372.db2.gz ONTXXKCKZVKPKE-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001177483360 1133068378 /nfs/dbraw/zinc/06/83/78/1133068378.db2.gz ONTXXKCKZVKPKE-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP COc1ccc(C[C@@H](C)[N@@H+](CCC[NH3+])C2CCCCC2)c([N+](=O)[O-])c1 ZINC001170295628 1134737656 /nfs/dbraw/zinc/73/76/56/1134737656.db2.gz CTHBOGHCJHTPTL-OAHLLOKOSA-N 2 1 349.475 3.518 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000271025753 1141296571 /nfs/dbraw/zinc/29/65/71/1141296571.db2.gz BCQKHZXNUIZQRZ-CQSZACIVSA-N 2 1 347.459 3.661 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536835053 1032331241 /nfs/dbraw/zinc/33/12/41/1032331241.db2.gz ZGSGKAUHUBYGMZ-IRXDYDNUSA-N 2 1 333.476 3.922 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000536835053 1032331248 /nfs/dbraw/zinc/33/12/48/1032331248.db2.gz ZGSGKAUHUBYGMZ-IRXDYDNUSA-N 2 1 333.476 3.922 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC[NH2+]C3CC3)o2)c(Cl)c1 ZINC000415070579 1017512667 /nfs/dbraw/zinc/51/26/67/1017512667.db2.gz RCDSVWZUMMPMGD-UHFFFAOYSA-N 2 1 349.818 3.740 20 5 EHBDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379637250 1019011828 /nfs/dbraw/zinc/01/18/28/1019011828.db2.gz SHBRLPZFBRZXLD-APWZRJJASA-N 2 1 339.439 3.738 20 5 EHBDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000379637250 1019011846 /nfs/dbraw/zinc/01/18/46/1019011846.db2.gz SHBRLPZFBRZXLD-APWZRJJASA-N 2 1 339.439 3.738 20 5 EHBDMP C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1CC[NH+](C)CC1 ZINC000093088914 1028447114 /nfs/dbraw/zinc/44/71/14/1028447114.db2.gz AGYJTSYHFLSTMK-UHFFFAOYSA-N 2 1 343.427 3.628 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc1[N+](=O)[O-] ZINC000154141106 1029732841 /nfs/dbraw/zinc/73/28/41/1029732841.db2.gz SMTSRYDHQNRPOY-IMJJTQAJSA-N 2 1 335.448 3.517 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCC[NH+](C)C1 ZINC000508579741 1029872923 /nfs/dbraw/zinc/87/29/23/1029872923.db2.gz PWQOCJQOUNYMAE-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCC[NH+](C)C1 ZINC000508579741 1029872929 /nfs/dbraw/zinc/87/29/29/1029872929.db2.gz PWQOCJQOUNYMAE-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCC[N@H+](C)C1 ZINC000508579741 1029872934 /nfs/dbraw/zinc/87/29/34/1029872934.db2.gz PWQOCJQOUNYMAE-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000508579741 1029872939 /nfs/dbraw/zinc/87/29/39/1029872939.db2.gz PWQOCJQOUNYMAE-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP Cc1c(CN[C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177392 1031076891 /nfs/dbraw/zinc/07/68/91/1031076891.db2.gz YKLAVQXVDLWFLU-ICSRJNTNSA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(CN[C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177392 1031076907 /nfs/dbraw/zinc/07/69/07/1031076907.db2.gz YKLAVQXVDLWFLU-ICSRJNTNSA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177392 1031076922 /nfs/dbraw/zinc/07/69/22/1031076922.db2.gz YKLAVQXVDLWFLU-ICSRJNTNSA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177392 1031076938 /nfs/dbraw/zinc/07/69/38/1031076938.db2.gz YKLAVQXVDLWFLU-ICSRJNTNSA-N 2 1 339.439 3.828 20 5 EHBDMP O=[N+]([O-])c1ccccc1/C=C/CNC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000598992026 1033644916 /nfs/dbraw/zinc/64/49/16/1033644916.db2.gz JQPCZTQHQCRJDA-JHTBKMLMSA-N 2 1 329.444 3.605 20 5 EHBDMP O=[N+]([O-])c1ccccc1/C=C/CNC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000598992026 1033644929 /nfs/dbraw/zinc/64/49/29/1033644929.db2.gz JQPCZTQHQCRJDA-JHTBKMLMSA-N 2 1 329.444 3.605 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000477926282 1039034288 /nfs/dbraw/zinc/03/42/88/1039034288.db2.gz GXDIQUBSRSUABF-HNNXBMFYSA-N 2 1 349.475 3.766 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCCC2 ZINC000417328258 1039671308 /nfs/dbraw/zinc/67/13/08/1039671308.db2.gz SFFPXTDINIHVMQ-GPMSIDNRSA-N 2 1 329.444 3.579 20 5 EHBDMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192831004 1040042558 /nfs/dbraw/zinc/04/25/58/1040042558.db2.gz UERRIUXWVZNHJE-DNVCBOLYSA-N 2 1 331.460 3.682 20 5 EHBDMP CC1(C)C[C@H](N[C@H]2CC[N@H+]3CCC[C@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170621 1040963203 /nfs/dbraw/zinc/96/32/03/1040963203.db2.gz YGOJIYJMFHWIAY-DEYYWGMASA-N 2 1 329.444 3.534 20 5 EHBDMP CC1(C)C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170621 1040963226 /nfs/dbraw/zinc/96/32/26/1040963226.db2.gz YGOJIYJMFHWIAY-DEYYWGMASA-N 2 1 329.444 3.534 20 5 EHBDMP CC1(C)C[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170621 1040963247 /nfs/dbraw/zinc/96/32/47/1040963247.db2.gz YGOJIYJMFHWIAY-DEYYWGMASA-N 2 1 329.444 3.534 20 5 EHBDMP CCC[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421088 1043157878 /nfs/dbraw/zinc/15/78/78/1043157878.db2.gz FSRYGANXJJIWEW-QFBILLFUSA-N 2 1 349.475 3.527 20 5 EHBDMP CCC[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421088 1043157882 /nfs/dbraw/zinc/15/78/82/1043157882.db2.gz FSRYGANXJJIWEW-QFBILLFUSA-N 2 1 349.475 3.527 20 5 EHBDMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900959 1131883295 /nfs/dbraw/zinc/88/32/95/1131883295.db2.gz HWRZXGJUXDCXJK-LPHOPBHVSA-N 2 1 345.487 3.696 20 5 EHBDMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168998116 1132627282 /nfs/dbraw/zinc/62/72/82/1132627282.db2.gz ILULUGZIBZHFQP-MKXGPGLRSA-N 2 1 337.508 3.584 20 5 EHBDMP CC1CC[NH+](CC[C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001175353473 1132646940 /nfs/dbraw/zinc/64/69/40/1132646940.db2.gz ZTTDOXYWBWQQDH-LJQANCHMSA-N 2 1 345.487 3.724 20 5 EHBDMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000809738604 1135882918 /nfs/dbraw/zinc/88/29/18/1135882918.db2.gz BFGAMHREAGHFBI-UHFFFAOYSA-N 2 1 347.846 3.942 20 5 EHBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000809738604 1135882921 /nfs/dbraw/zinc/88/29/21/1135882921.db2.gz BFGAMHREAGHFBI-UHFFFAOYSA-N 2 1 347.846 3.942 20 5 EHBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC001199344080 1135896417 /nfs/dbraw/zinc/89/64/17/1135896417.db2.gz DPJWDNSWIJRBKQ-HNNXBMFYSA-N 2 1 333.476 3.813 20 5 EHBDMP C[N@@H+](CCCCCC[NH3+])Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000873231543 1137594508 /nfs/dbraw/zinc/59/45/08/1137594508.db2.gz MYCPHHJFJFIOTQ-UHFFFAOYSA-N 2 1 348.472 3.669 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000504927451 1029072751 /nfs/dbraw/zinc/07/27/51/1029072751.db2.gz PAQMFSIPRGYPME-HOTGVXAUSA-N 2 1 349.475 3.766 20 5 EHBDMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@@H+]1C ZINC000525709364 1030048031 /nfs/dbraw/zinc/04/80/31/1030048031.db2.gz VNFCZCWSPMQWII-ZFWWWQNUSA-N 2 1 345.468 3.896 20 5 EHBDMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@H+]1C ZINC000525709364 1030048053 /nfs/dbraw/zinc/04/80/53/1030048053.db2.gz VNFCZCWSPMQWII-ZFWWWQNUSA-N 2 1 345.468 3.896 20 5 EHBDMP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509105 1030257086 /nfs/dbraw/zinc/25/70/86/1030257086.db2.gz LUISUPNLAKOLBL-KXBFYZLASA-N 2 1 331.460 3.826 20 5 EHBDMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509105 1030257090 /nfs/dbraw/zinc/25/70/90/1030257090.db2.gz LUISUPNLAKOLBL-KXBFYZLASA-N 2 1 331.460 3.826 20 5 EHBDMP Cc1c(CN[C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177393 1031078269 /nfs/dbraw/zinc/07/82/69/1031078269.db2.gz YKLAVQXVDLWFLU-QUCCMNQESA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(CN[C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177393 1031078288 /nfs/dbraw/zinc/07/82/88/1031078288.db2.gz YKLAVQXVDLWFLU-QUCCMNQESA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177393 1031078304 /nfs/dbraw/zinc/07/83/04/1031078304.db2.gz YKLAVQXVDLWFLU-QUCCMNQESA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177393 1031078322 /nfs/dbraw/zinc/07/83/22/1031078322.db2.gz YKLAVQXVDLWFLU-QUCCMNQESA-N 2 1 339.439 3.828 20 5 EHBDMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717337 1038488002 /nfs/dbraw/zinc/48/80/02/1038488002.db2.gz UXNFTKTYNVEJRB-MAUKXSAKSA-N 2 1 333.476 3.880 20 5 EHBDMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717337 1038488007 /nfs/dbraw/zinc/48/80/07/1038488007.db2.gz UXNFTKTYNVEJRB-MAUKXSAKSA-N 2 1 333.476 3.880 20 5 EHBDMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717337 1038488015 /nfs/dbraw/zinc/48/80/15/1038488015.db2.gz UXNFTKTYNVEJRB-MAUKXSAKSA-N 2 1 333.476 3.880 20 5 EHBDMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717337 1038488019 /nfs/dbraw/zinc/48/80/19/1038488019.db2.gz UXNFTKTYNVEJRB-MAUKXSAKSA-N 2 1 333.476 3.880 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000543418038 1129474886 /nfs/dbraw/zinc/47/48/86/1129474886.db2.gz MFRPFGRKJBZBSX-HZPDHXFCSA-N 2 1 349.475 3.909 20 5 EHBDMP Cc1cc(NCC[N@@H+]2CC=C(C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302138890 1129769396 /nfs/dbraw/zinc/76/93/96/1129769396.db2.gz FWFNYIKIOWJCNL-UHFFFAOYSA-N 2 1 326.400 3.515 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000245515208 1130228188 /nfs/dbraw/zinc/22/81/88/1130228188.db2.gz DFVPQKYQLNKJSS-IAGOWNOFSA-N 2 1 331.460 3.915 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000245515208 1130228193 /nfs/dbraw/zinc/22/81/93/1130228193.db2.gz DFVPQKYQLNKJSS-IAGOWNOFSA-N 2 1 331.460 3.915 20 5 EHBDMP Cc1ccccc1C[N@@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168998339 1132627124 /nfs/dbraw/zinc/62/71/24/1132627124.db2.gz LLZLHXKKHPKGFS-AFYVEPGGSA-N 2 1 345.487 3.512 20 5 EHBDMP O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000746666707 1133986077 /nfs/dbraw/zinc/98/60/77/1133986077.db2.gz PFQPAKDPYUUZPD-UHFFFAOYSA-N 2 1 337.851 3.556 20 5 EHBDMP CC[N@@H+](CCC1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1)CC(C)C ZINC000886104564 1138047184 /nfs/dbraw/zinc/04/71/84/1138047184.db2.gz GBADOTZKXVTUFU-UHFFFAOYSA-N 2 1 348.491 3.570 20 5 EHBDMP C[C@@H]([NH3+])[C@H](C)[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000415012778 1017408793 /nfs/dbraw/zinc/40/87/93/1017408793.db2.gz JYXHIEIEDDZFGA-NEPJUHHUSA-N 2 1 349.818 3.866 20 5 EHBDMP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435375543 1024843205 /nfs/dbraw/zinc/84/32/05/1024843205.db2.gz NBAATNSQDUWYJW-GFCCVEGCSA-N 2 1 349.818 3.550 20 5 EHBDMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435375543 1024843222 /nfs/dbraw/zinc/84/32/22/1024843222.db2.gz NBAATNSQDUWYJW-GFCCVEGCSA-N 2 1 349.818 3.550 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000420311167 1027456314 /nfs/dbraw/zinc/45/63/14/1027456314.db2.gz GYRRKUNYFUJASP-VPWXQRGCSA-N 2 1 339.439 3.639 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475576817 1027681281 /nfs/dbraw/zinc/68/12/81/1027681281.db2.gz XZEBNIUHORZWEV-XNTDXEJSSA-N 2 1 329.444 3.605 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000504926270 1029073062 /nfs/dbraw/zinc/07/30/62/1029073062.db2.gz HEYVYOIKRBTDGY-PMPSAXMXSA-N 2 1 349.500 3.682 20 5 EHBDMP COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000595023878 1033617099 /nfs/dbraw/zinc/61/70/99/1033617099.db2.gz ZDYMKGXOENHQBS-JKSUJKDBSA-N 2 1 349.475 3.622 20 5 EHBDMP C[N@@H+]1CC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000550704417 1033894423 /nfs/dbraw/zinc/89/44/23/1033894423.db2.gz XKSPOEQZIJADTE-ICSRJNTNSA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000550704417 1033894434 /nfs/dbraw/zinc/89/44/34/1033894434.db2.gz XKSPOEQZIJADTE-ICSRJNTNSA-N 2 1 339.439 3.562 20 5 EHBDMP O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000171139430 1034138715 /nfs/dbraw/zinc/13/87/15/1034138715.db2.gz SSLGOQJONHQBIZ-UHFFFAOYSA-N 2 1 337.851 3.556 20 5 EHBDMP C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109834 1037324906 /nfs/dbraw/zinc/32/49/06/1037324906.db2.gz WRKRLLLLXQNTMD-LJQANCHMSA-N 2 1 339.439 3.549 20 5 EHBDMP C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109834 1037324925 /nfs/dbraw/zinc/32/49/25/1037324925.db2.gz WRKRLLLLXQNTMD-LJQANCHMSA-N 2 1 339.439 3.549 20 5 EHBDMP C[NH+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076109834 1037324950 /nfs/dbraw/zinc/32/49/50/1037324950.db2.gz WRKRLLLLXQNTMD-LJQANCHMSA-N 2 1 339.439 3.549 20 5 EHBDMP C[NH+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076109834 1037324968 /nfs/dbraw/zinc/32/49/68/1037324968.db2.gz WRKRLLLLXQNTMD-LJQANCHMSA-N 2 1 339.439 3.549 20 5 EHBDMP C[N@@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000271817600 1037359466 /nfs/dbraw/zinc/35/94/66/1037359466.db2.gz MGNKDZCDOVFFIG-UHFFFAOYSA-N 2 1 343.452 3.675 20 5 EHBDMP CCCC[N@@H+](C)CC1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000103554993 1037927971 /nfs/dbraw/zinc/92/79/71/1037927971.db2.gz RQJGHMSEYVJQJN-UHFFFAOYSA-N 2 1 337.439 3.678 20 5 EHBDMP CCCC[N@H+](C)CC1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000103554993 1037927977 /nfs/dbraw/zinc/92/79/77/1037927977.db2.gz RQJGHMSEYVJQJN-UHFFFAOYSA-N 2 1 337.439 3.678 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000103554993 1037927990 /nfs/dbraw/zinc/92/79/90/1037927990.db2.gz RQJGHMSEYVJQJN-UHFFFAOYSA-N 2 1 337.439 3.678 20 5 EHBDMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717336 1038487441 /nfs/dbraw/zinc/48/74/41/1038487441.db2.gz UXNFTKTYNVEJRB-CRAIPNDOSA-N 2 1 333.476 3.880 20 5 EHBDMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717336 1038487425 /nfs/dbraw/zinc/48/74/25/1038487425.db2.gz UXNFTKTYNVEJRB-CRAIPNDOSA-N 2 1 333.476 3.880 20 5 EHBDMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717336 1038487433 /nfs/dbraw/zinc/48/74/33/1038487433.db2.gz UXNFTKTYNVEJRB-CRAIPNDOSA-N 2 1 333.476 3.880 20 5 EHBDMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717336 1038487436 /nfs/dbraw/zinc/48/74/36/1038487436.db2.gz UXNFTKTYNVEJRB-CRAIPNDOSA-N 2 1 333.476 3.880 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000490037572 1040302359 /nfs/dbraw/zinc/30/23/59/1040302359.db2.gz IBUOPEXCVKJFDK-DOTOQJQBSA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000490037572 1040302375 /nfs/dbraw/zinc/30/23/75/1040302375.db2.gz IBUOPEXCVKJFDK-DOTOQJQBSA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000490037572 1040302389 /nfs/dbraw/zinc/30/23/89/1040302389.db2.gz IBUOPEXCVKJFDK-DOTOQJQBSA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000490037572 1040302403 /nfs/dbraw/zinc/30/24/03/1040302403.db2.gz IBUOPEXCVKJFDK-DOTOQJQBSA-N 2 1 331.460 3.628 20 5 EHBDMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000125742675 1129713247 /nfs/dbraw/zinc/71/32/47/1129713247.db2.gz GOCYNTSAKDXIKP-APWZRJJASA-N 2 1 345.487 3.626 20 5 EHBDMP COc1ccc(C[C@H](C)[N@@H+](CCC[NH3+])C2CCCCC2)c([N+](=O)[O-])c1 ZINC001170295627 1134736070 /nfs/dbraw/zinc/73/60/70/1134736070.db2.gz CTHBOGHCJHTPTL-HNNXBMFYSA-N 2 1 349.475 3.518 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCCC[N@@H+](C)C1 ZINC000872088541 1137570632 /nfs/dbraw/zinc/57/06/32/1137570632.db2.gz RSJLEVUPXPQVSF-KGLIPLIRSA-N 2 1 337.489 3.699 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000872088541 1137570633 /nfs/dbraw/zinc/57/06/33/1137570633.db2.gz RSJLEVUPXPQVSF-KGLIPLIRSA-N 2 1 337.489 3.699 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000872088541 1137570634 /nfs/dbraw/zinc/57/06/34/1137570634.db2.gz RSJLEVUPXPQVSF-KGLIPLIRSA-N 2 1 337.489 3.699 20 5 EHBDMP Cc1[nH]c(C2CC[NH+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)[nH+]c1C ZINC000886670043 1138112046 /nfs/dbraw/zinc/11/20/46/1138112046.db2.gz ILRUNIMYYMBUCQ-CQSZACIVSA-N 2 1 328.416 3.875 20 5 EHBDMP C[C@@H]1C[C@H](N(C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000093644279 1138239436 /nfs/dbraw/zinc/23/94/36/1138239436.db2.gz QVJALBYKUFALHM-HUUCEWRRSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000093644279 1138239437 /nfs/dbraw/zinc/23/94/37/1138239437.db2.gz QVJALBYKUFALHM-HUUCEWRRSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000093644279 1138239438 /nfs/dbraw/zinc/23/94/38/1138239438.db2.gz QVJALBYKUFALHM-HUUCEWRRSA-N 2 1 343.427 3.769 20 5 EHBDMP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000125466910 1138309341 /nfs/dbraw/zinc/30/93/41/1138309341.db2.gz BTFAVUIDFLIGMK-CQSZACIVSA-N 2 1 345.468 3.707 20 5 EHBDMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000125466910 1138309345 /nfs/dbraw/zinc/30/93/45/1138309345.db2.gz BTFAVUIDFLIGMK-CQSZACIVSA-N 2 1 345.468 3.707 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CCC2 ZINC000278745112 1032281396 /nfs/dbraw/zinc/28/13/96/1032281396.db2.gz NOEGGZYHTVRXHR-LJQANCHMSA-N 2 1 329.444 3.579 20 5 EHBDMP CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1[NH3+] ZINC000592427622 1032816924 /nfs/dbraw/zinc/81/69/24/1032816924.db2.gz JFBZSKYVLDHTCJ-CJNGLKHVSA-N 2 1 345.468 3.883 20 5 EHBDMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000442931116 1025593304 /nfs/dbraw/zinc/59/33/04/1025593304.db2.gz VCOPYSWMYBAUFL-AWEZNQCLSA-N 2 1 345.468 3.884 20 5 EHBDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@@H+]1C ZINC000525709362 1030047939 /nfs/dbraw/zinc/04/79/39/1030047939.db2.gz VNFCZCWSPMQWII-HIFRSBDPSA-N 2 1 345.468 3.896 20 5 EHBDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@H+]1C ZINC000525709362 1030047955 /nfs/dbraw/zinc/04/79/55/1030047955.db2.gz VNFCZCWSPMQWII-HIFRSBDPSA-N 2 1 345.468 3.896 20 5 EHBDMP Cc1c(CN[C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177391 1031077995 /nfs/dbraw/zinc/07/79/95/1031077995.db2.gz YKLAVQXVDLWFLU-AZUAARDMSA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(CN[C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177391 1031078008 /nfs/dbraw/zinc/07/80/08/1031078008.db2.gz YKLAVQXVDLWFLU-AZUAARDMSA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177391 1031078026 /nfs/dbraw/zinc/07/80/26/1031078026.db2.gz YKLAVQXVDLWFLU-AZUAARDMSA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177391 1031078045 /nfs/dbraw/zinc/07/80/45/1031078045.db2.gz YKLAVQXVDLWFLU-AZUAARDMSA-N 2 1 339.439 3.828 20 5 EHBDMP C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1CCC[NH3+] ZINC000595904557 1034026887 /nfs/dbraw/zinc/02/68/87/1034026887.db2.gz GEAQFEPZBGLDDZ-IUODEOHRSA-N 2 1 325.840 3.588 20 5 EHBDMP CC(C)[NH+]1CCC([NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417316982 1039658264 /nfs/dbraw/zinc/65/82/64/1039658264.db2.gz VMFYWFSWELJXCT-IBGZPJMESA-N 2 1 331.460 3.825 20 5 EHBDMP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C[NH+]1CCCCCC1 ZINC000480660232 1039824523 /nfs/dbraw/zinc/82/45/23/1039824523.db2.gz FJIVVIBNADVIOX-IRXDYDNUSA-N 2 1 333.476 3.770 20 5 EHBDMP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000236914593 1043981471 /nfs/dbraw/zinc/98/14/71/1043981471.db2.gz AKXYDQKONRTCTR-UHFFFAOYSA-N 2 1 333.457 3.788 20 5 EHBDMP Cc1ccccc1C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168998342 1132627108 /nfs/dbraw/zinc/62/71/08/1132627108.db2.gz LLZLHXKKHPKGFS-VBSBHUPXSA-N 2 1 345.487 3.512 20 5 EHBDMP Cc1ccc(C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001168997173 1132627605 /nfs/dbraw/zinc/62/76/05/1132627605.db2.gz BVQVQDKQMNEPSY-LWYYNNOASA-N 2 1 345.487 3.512 20 5 EHBDMP CC[NH+]1CCC(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001181880411 1133545532 /nfs/dbraw/zinc/54/55/32/1133545532.db2.gz VKIGIWXCYRYBES-SFHVURJKSA-N 2 1 331.460 3.506 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000872037394 1137566840 /nfs/dbraw/zinc/56/68/40/1137566840.db2.gz BIYTXWKRIFTKGV-CYBMUJFWSA-N 2 1 348.472 3.953 20 5 EHBDMP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414942858 1022931168 /nfs/dbraw/zinc/93/11/68/1022931168.db2.gz NCOKEUMGQYQKJU-ZBEGNZNMSA-N 2 1 349.818 3.596 20 5 EHBDMP C[C@@H]([NH2+]C[C@H]([NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423333858 1028371270 /nfs/dbraw/zinc/37/12/70/1028371270.db2.gz WEXDMJSEEMJPAI-RISCZKNCSA-N 2 1 331.441 3.711 20 5 EHBDMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093695 1034079596 /nfs/dbraw/zinc/07/95/96/1034079596.db2.gz DPIRGJCUGCTNFT-WBVHZDCISA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093695 1034079600 /nfs/dbraw/zinc/07/96/00/1034079600.db2.gz DPIRGJCUGCTNFT-WBVHZDCISA-N 2 1 331.460 3.676 20 5 EHBDMP CC(C)c1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2F)cc1[N+](=O)[O-] ZINC000593315836 1034634093 /nfs/dbraw/zinc/63/40/93/1034634093.db2.gz FPPUTUBJNXKKFW-UHFFFAOYSA-N 2 1 331.391 3.606 20 5 EHBDMP C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272135627 1037088815 /nfs/dbraw/zinc/08/88/15/1037088815.db2.gz AJQSHDVZEQQYCE-APWZRJJASA-N 2 1 339.439 3.595 20 5 EHBDMP C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109669 1037325640 /nfs/dbraw/zinc/32/56/40/1037325640.db2.gz FHPVBXZAUXZMAL-LJQANCHMSA-N 2 1 339.439 3.549 20 5 EHBDMP C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109669 1037325658 /nfs/dbraw/zinc/32/56/58/1037325658.db2.gz FHPVBXZAUXZMAL-LJQANCHMSA-N 2 1 339.439 3.549 20 5 EHBDMP C[NH+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076109669 1037325677 /nfs/dbraw/zinc/32/56/77/1037325677.db2.gz FHPVBXZAUXZMAL-LJQANCHMSA-N 2 1 339.439 3.549 20 5 EHBDMP C[NH+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076109669 1037325693 /nfs/dbraw/zinc/32/56/93/1037325693.db2.gz FHPVBXZAUXZMAL-LJQANCHMSA-N 2 1 339.439 3.549 20 5 EHBDMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990961 1040026450 /nfs/dbraw/zinc/02/64/50/1040026450.db2.gz HEUIXBDWCXXSOL-XYJFISCASA-N 2 1 333.476 3.624 20 5 EHBDMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990961 1040026463 /nfs/dbraw/zinc/02/64/63/1040026463.db2.gz HEUIXBDWCXXSOL-XYJFISCASA-N 2 1 333.476 3.624 20 5 EHBDMP C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272380203 1121598255 /nfs/dbraw/zinc/59/82/55/1121598255.db2.gz BRNLJXUGSOIIOA-LPHOPBHVSA-N 2 1 339.439 3.595 20 5 EHBDMP C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272380203 1121598258 /nfs/dbraw/zinc/59/82/58/1121598258.db2.gz BRNLJXUGSOIIOA-LPHOPBHVSA-N 2 1 339.439 3.595 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1[N+](=O)[O-] ZINC000245508723 1130224089 /nfs/dbraw/zinc/22/40/89/1130224089.db2.gz SMTSRYDHQNRPOY-NUEKZKHPSA-N 2 1 335.448 3.517 20 5 EHBDMP CC(C)C[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])CC1CC[NH+](C)CC1 ZINC001197194089 1135657574 /nfs/dbraw/zinc/65/75/74/1135657574.db2.gz IYUGFVYOVDRYJL-UHFFFAOYSA-N 2 1 337.439 3.534 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000872079458 1137570155 /nfs/dbraw/zinc/57/01/55/1137570155.db2.gz MYLGMJGGZDZBCE-KBPBESRZSA-N 2 1 337.489 3.699 20 5 EHBDMP C[C@@H]1C[C@@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000130639206 1138466264 /nfs/dbraw/zinc/46/62/64/1138466264.db2.gz ORYPXUNXPRKABX-PBHICJAKSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000130639206 1138466266 /nfs/dbraw/zinc/46/62/66/1138466266.db2.gz ORYPXUNXPRKABX-PBHICJAKSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000130639206 1138466268 /nfs/dbraw/zinc/46/62/68/1138466268.db2.gz ORYPXUNXPRKABX-PBHICJAKSA-N 2 1 343.427 3.769 20 5 EHBDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449131925 1032227648 /nfs/dbraw/zinc/22/76/48/1032227648.db2.gz QJQXSFDJTICKHQ-INIZCTEOSA-N 2 1 341.455 3.767 20 5 EHBDMP O=[N+]([O-])c1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c(F)c1 ZINC000610476219 1020403283 /nfs/dbraw/zinc/40/32/83/1020403283.db2.gz FETNHEMGZZFJCW-UHFFFAOYSA-N 2 1 349.450 3.822 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H]4[NH2+]CC[C@H]4C3)s2)cc1 ZINC000427128686 1023236555 /nfs/dbraw/zinc/23/65/55/1023236555.db2.gz OQJAOUIRYFJEKE-YOEHRIQHSA-N 2 1 343.452 3.507 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4[NH2+]CC[C@H]4C3)s2)cc1 ZINC000427128686 1023236564 /nfs/dbraw/zinc/23/65/64/1023236564.db2.gz OQJAOUIRYFJEKE-YOEHRIQHSA-N 2 1 343.452 3.507 20 5 EHBDMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717339 1024493514 /nfs/dbraw/zinc/49/35/14/1024493514.db2.gz UXNFTKTYNVEJRB-YJBOKZPZSA-N 2 1 333.476 3.880 20 5 EHBDMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717339 1024493528 /nfs/dbraw/zinc/49/35/28/1024493528.db2.gz UXNFTKTYNVEJRB-YJBOKZPZSA-N 2 1 333.476 3.880 20 5 EHBDMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717339 1024493535 /nfs/dbraw/zinc/49/35/35/1024493535.db2.gz UXNFTKTYNVEJRB-YJBOKZPZSA-N 2 1 333.476 3.880 20 5 EHBDMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717339 1024493541 /nfs/dbraw/zinc/49/35/41/1024493541.db2.gz UXNFTKTYNVEJRB-YJBOKZPZSA-N 2 1 333.476 3.880 20 5 EHBDMP CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000414715210 1028158060 /nfs/dbraw/zinc/15/80/60/1028158060.db2.gz MSUINIBHQAUMCE-MRXNPFEDSA-N 2 1 343.427 3.819 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000504920105 1029046054 /nfs/dbraw/zinc/04/60/54/1029046054.db2.gz NDIKXVVYSGJAEK-RRFJBIMHSA-N 2 1 337.489 3.538 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000504920105 1029046072 /nfs/dbraw/zinc/04/60/72/1029046072.db2.gz NDIKXVVYSGJAEK-RRFJBIMHSA-N 2 1 337.489 3.538 20 5 EHBDMP C[C@]1(CNCc2cccc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000310852782 1036638566 /nfs/dbraw/zinc/63/85/66/1036638566.db2.gz AVXQRNAGHFYDER-HXUWFJFHSA-N 2 1 339.439 3.597 20 5 EHBDMP C[C@]1(C[NH2+]Cc2cccc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000310852782 1036638585 /nfs/dbraw/zinc/63/85/85/1036638585.db2.gz AVXQRNAGHFYDER-HXUWFJFHSA-N 2 1 339.439 3.597 20 5 EHBDMP CC[N@@H+](CCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1)CC1CC1 ZINC000539958654 1037406624 /nfs/dbraw/zinc/40/66/24/1037406624.db2.gz YKYXRDIZXNVGEG-UHFFFAOYSA-N 2 1 345.487 3.929 20 5 EHBDMP CC1(C)C[C@@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000591582567 1037518048 /nfs/dbraw/zinc/51/80/48/1037518048.db2.gz LPNOQXBNVUQZRM-SUMWQHHRSA-N 2 1 329.444 3.582 20 5 EHBDMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278966359 1043099005 /nfs/dbraw/zinc/09/90/05/1043099005.db2.gz BSTAOPNNOCHXCX-GOSISDBHSA-N 2 1 342.443 3.892 20 5 EHBDMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903496 1131886328 /nfs/dbraw/zinc/88/63/28/1131886328.db2.gz HBRRSSTVUBMJRE-ROUUACIJSA-N 2 1 345.487 3.695 20 5 EHBDMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903496 1131886334 /nfs/dbraw/zinc/88/63/34/1131886334.db2.gz HBRRSSTVUBMJRE-ROUUACIJSA-N 2 1 345.487 3.695 20 5 EHBDMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168998115 1132627859 /nfs/dbraw/zinc/62/78/59/1132627859.db2.gz ILULUGZIBZHFQP-CADBVGFASA-N 2 1 337.508 3.584 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000180403462 1139831991 /nfs/dbraw/zinc/83/19/91/1139831991.db2.gz WLVXRACUKDAIRG-AWEZNQCLSA-N 2 1 335.448 3.517 20 5 EHBDMP C[N@@H+]1CC[C@@H](NCc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000340279948 1016849082 /nfs/dbraw/zinc/84/90/82/1016849082.db2.gz RQJIRDKWDPAXNH-IEBWSBKVSA-N 2 1 325.412 3.520 20 5 EHBDMP C[N@H+]1CC[C@@H](NCc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000340279948 1016849095 /nfs/dbraw/zinc/84/90/95/1016849095.db2.gz RQJIRDKWDPAXNH-IEBWSBKVSA-N 2 1 325.412 3.520 20 5 EHBDMP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000580221183 1018818060 /nfs/dbraw/zinc/81/80/60/1018818060.db2.gz FFDWYDVQLLAHST-QUCCMNQESA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000580221183 1018818077 /nfs/dbraw/zinc/81/80/77/1018818077.db2.gz FFDWYDVQLLAHST-QUCCMNQESA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCC[NH2+]CC1 ZINC000414756657 1028573502 /nfs/dbraw/zinc/57/35/02/1028573502.db2.gz VQXQINJIOAJONV-AWEZNQCLSA-N 2 1 345.468 3.897 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000504927453 1029073803 /nfs/dbraw/zinc/07/38/03/1029073803.db2.gz PAQMFSIPRGYPME-JKSUJKDBSA-N 2 1 349.475 3.766 20 5 EHBDMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000592395494 1037939420 /nfs/dbraw/zinc/93/94/20/1037939420.db2.gz CLFCZSMZUUSPLT-ZTNFWEORSA-N 2 1 339.439 3.591 20 5 EHBDMP CC(C)[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCCC1 ZINC000480535605 1039655501 /nfs/dbraw/zinc/65/55/01/1039655501.db2.gz KWTUTTHXVYZFLU-ICSRJNTNSA-N 2 1 345.487 3.626 20 5 EHBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314606 1039669549 /nfs/dbraw/zinc/66/95/49/1039669549.db2.gz RMKMAWOBCIGZOC-IFXJQAMLSA-N 2 1 342.443 3.793 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CCCC2 ZINC000417328262 1039672699 /nfs/dbraw/zinc/67/26/99/1039672699.db2.gz SFFPXTDINIHVMQ-JTDSTZFVSA-N 2 1 329.444 3.579 20 5 EHBDMP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000491066964 1040899465 /nfs/dbraw/zinc/89/94/65/1040899465.db2.gz PLBQAZWULQPQLD-UHFFFAOYSA-N 2 1 337.439 3.678 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000491066964 1040899477 /nfs/dbraw/zinc/89/94/77/1040899477.db2.gz PLBQAZWULQPQLD-UHFFFAOYSA-N 2 1 337.439 3.678 20 5 EHBDMP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192971998 1040927202 /nfs/dbraw/zinc/92/72/02/1040927202.db2.gz JWVRCNUYEUXVPO-GOSISDBHSA-N 2 1 331.460 3.825 20 5 EHBDMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433282948 1041232464 /nfs/dbraw/zinc/23/24/64/1041232464.db2.gz NJYOOWYMVBWBLW-PMUMKWKESA-N 2 1 331.460 3.780 20 5 EHBDMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433282946 1041233281 /nfs/dbraw/zinc/23/32/81/1041233281.db2.gz NJYOOWYMVBWBLW-IYOUNJFTSA-N 2 1 331.460 3.780 20 5 EHBDMP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000531430328 1129412017 /nfs/dbraw/zinc/41/20/17/1129412017.db2.gz WIDHFSHWPBAXQF-IAGOWNOFSA-N 2 1 349.475 3.594 20 5 EHBDMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000337946012 1138704230 /nfs/dbraw/zinc/70/42/30/1138704230.db2.gz GMNGJJVVQIZBKF-UHFFFAOYSA-N 2 1 340.383 3.540 20 5 EHBDMP C[N@@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000340279940 1016849892 /nfs/dbraw/zinc/84/98/92/1016849892.db2.gz RQJIRDKWDPAXNH-HKUYNNGSSA-N 2 1 325.412 3.520 20 5 EHBDMP C[N@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000340279940 1016849908 /nfs/dbraw/zinc/84/99/08/1016849908.db2.gz RQJIRDKWDPAXNH-HKUYNNGSSA-N 2 1 325.412 3.520 20 5 EHBDMP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000449233802 1032328989 /nfs/dbraw/zinc/32/89/89/1032328989.db2.gz NEFQQRHDNBOIIQ-JFIYKMOQSA-N 2 1 345.487 3.768 20 5 EHBDMP CC(C)c1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000513641967 1019899501 /nfs/dbraw/zinc/89/95/01/1019899501.db2.gz CDTJHQQRWAMGLU-MRXNPFEDSA-N 2 1 333.476 3.930 20 5 EHBDMP CC[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000178039008 1021026526 /nfs/dbraw/zinc/02/65/26/1021026526.db2.gz LOUPBUDTVBBJBF-JTDSTZFVSA-N 2 1 349.475 3.525 20 5 EHBDMP C[N@@H+](CCCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000453593091 1030352454 /nfs/dbraw/zinc/35/24/54/1030352454.db2.gz GFWIXTQDYNIXJX-UHFFFAOYSA-N 2 1 343.427 3.819 20 5 EHBDMP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000598994762 1033647606 /nfs/dbraw/zinc/64/76/06/1033647606.db2.gz RGFDQAPAFNDOIE-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000598994762 1033647613 /nfs/dbraw/zinc/64/76/13/1033647613.db2.gz RGFDQAPAFNDOIE-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP C[C@@]1(CNCc2cccc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000310852780 1036638488 /nfs/dbraw/zinc/63/84/88/1036638488.db2.gz AVXQRNAGHFYDER-FQEVSTJZSA-N 2 1 339.439 3.597 20 5 EHBDMP C[C@@]1(C[NH2+]Cc2cccc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000310852780 1036638512 /nfs/dbraw/zinc/63/85/12/1036638512.db2.gz AVXQRNAGHFYDER-FQEVSTJZSA-N 2 1 339.439 3.597 20 5 EHBDMP C[N@@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000271785236 1037273926 /nfs/dbraw/zinc/27/39/26/1037273926.db2.gz FIVFICQDRSHVJQ-UHFFFAOYSA-N 2 1 343.452 3.675 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001173232842 1132010757 /nfs/dbraw/zinc/01/07/57/1132010757.db2.gz IFTUMZWMXFCADK-UXPWSPDFSA-N 2 1 345.487 3.865 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001173232842 1132010767 /nfs/dbraw/zinc/01/07/67/1132010767.db2.gz IFTUMZWMXFCADK-UXPWSPDFSA-N 2 1 345.487 3.865 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001173232842 1132010776 /nfs/dbraw/zinc/01/07/76/1132010776.db2.gz IFTUMZWMXFCADK-UXPWSPDFSA-N 2 1 345.487 3.865 20 5 EHBDMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168998117 1132627342 /nfs/dbraw/zinc/62/73/42/1132627342.db2.gz ILULUGZIBZHFQP-NCXUSEDFSA-N 2 1 337.508 3.584 20 5 EHBDMP O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000817906661 1136845305 /nfs/dbraw/zinc/84/53/05/1136845305.db2.gz AQHNUWHMHALHJT-HYVNUMGLSA-N 2 1 337.851 3.649 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000872079358 1137570242 /nfs/dbraw/zinc/57/02/42/1137570242.db2.gz XVMVBBUPSLMRMV-CYBMUJFWSA-N 2 1 337.489 3.842 20 5 EHBDMP CC[N@@H+](CCC[NH+]1CCCC1)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000579776480 1014454853 /nfs/dbraw/zinc/45/48/53/1014454853.db2.gz OVYWTANSNSQQPX-SAPNQHFASA-N 2 1 331.460 3.806 20 5 EHBDMP CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[NH2+]CC1 ZINC000414715203 1017150775 /nfs/dbraw/zinc/15/07/75/1017150775.db2.gz MSUINIBHQAUMCE-INIZCTEOSA-N 2 1 343.427 3.819 20 5 EHBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000236653719 1017642110 /nfs/dbraw/zinc/64/21/10/1017642110.db2.gz PSZRXAYMKUVHHB-AWEZNQCLSA-N 2 1 330.432 3.649 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000182916190 1019782392 /nfs/dbraw/zinc/78/23/92/1019782392.db2.gz LHMOJWQCRRULKB-RZQQEMMASA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000182916190 1019782407 /nfs/dbraw/zinc/78/24/07/1019782407.db2.gz LHMOJWQCRRULKB-RZQQEMMASA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000182916190 1019782424 /nfs/dbraw/zinc/78/24/24/1019782424.db2.gz LHMOJWQCRRULKB-RZQQEMMASA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000182916190 1019782442 /nfs/dbraw/zinc/78/24/42/1019782442.db2.gz LHMOJWQCRRULKB-RZQQEMMASA-N 2 1 343.471 3.913 20 5 EHBDMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000108427928 1023120600 /nfs/dbraw/zinc/12/06/00/1023120600.db2.gz YTVVKTTXXKFSGH-AWEZNQCLSA-N 2 1 345.468 3.755 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000477926283 1023582293 /nfs/dbraw/zinc/58/22/93/1023582293.db2.gz GXDIQUBSRSUABF-OAHLLOKOSA-N 2 1 349.475 3.766 20 5 EHBDMP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000523856121 1028684035 /nfs/dbraw/zinc/68/40/35/1028684035.db2.gz DCJWUEZWCYOGJS-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000523856121 1028684040 /nfs/dbraw/zinc/68/40/40/1028684040.db2.gz DCJWUEZWCYOGJS-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000424386624 1029038526 /nfs/dbraw/zinc/03/85/26/1029038526.db2.gz XRVHDSCBUJLLBL-HNNXBMFYSA-N 2 1 331.460 3.682 20 5 EHBDMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@@H+]1C ZINC000525709361 1030049494 /nfs/dbraw/zinc/04/94/94/1030049494.db2.gz VNFCZCWSPMQWII-DZGCQCFKSA-N 2 1 345.468 3.896 20 5 EHBDMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@H+]1C ZINC000525709361 1030049512 /nfs/dbraw/zinc/04/95/12/1030049512.db2.gz VNFCZCWSPMQWII-DZGCQCFKSA-N 2 1 345.468 3.896 20 5 EHBDMP [NH3+]C1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCC1 ZINC000594739221 1033509761 /nfs/dbraw/zinc/50/97/61/1033509761.db2.gz OLILRALHWCKJQM-UHFFFAOYSA-N 2 1 331.441 3.684 20 5 EHBDMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000599071671 1033713314 /nfs/dbraw/zinc/71/33/14/1033713314.db2.gz SFHPGSYSQCZAHC-ZHALLVOQSA-N 2 1 345.487 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595900211 1034026636 /nfs/dbraw/zinc/02/66/36/1034026636.db2.gz BERHXONURATMNX-DOTOQJQBSA-N 2 1 331.460 3.676 20 5 EHBDMP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596096622 1034079354 /nfs/dbraw/zinc/07/93/54/1034079354.db2.gz VMEDWXJMCQELRH-FUHWJXTLSA-N 2 1 345.487 3.628 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC3CC3)C1)CCC2 ZINC000596092472 1034079781 /nfs/dbraw/zinc/07/97/81/1034079781.db2.gz ANXVASDKIBDLBR-JXFKEZNVSA-N 2 1 343.471 3.684 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)o2)cc1 ZINC000591282639 1037319301 /nfs/dbraw/zinc/31/93/01/1037319301.db2.gz ITXFLOFHSNEOMK-HNNXBMFYSA-N 2 1 341.411 3.619 20 5 EHBDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173350 1040992046 /nfs/dbraw/zinc/99/20/46/1040992046.db2.gz GHBAZFJDXQENIC-KSSFIOAISA-N 2 1 331.460 3.639 20 5 EHBDMP CC1(C)C[C@@H](NC2CC[NH+](C3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279129142 1043404326 /nfs/dbraw/zinc/40/43/26/1043404326.db2.gz QWJWOJXXEZIRKJ-GOSISDBHSA-N 2 1 329.444 3.534 20 5 EHBDMP CC1(C)C[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279129142 1043404331 /nfs/dbraw/zinc/40/43/31/1043404331.db2.gz QWJWOJXXEZIRKJ-GOSISDBHSA-N 2 1 329.444 3.534 20 5 EHBDMP C[N@@H+]1CC=C(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000494987436 1120923874 /nfs/dbraw/zinc/92/38/74/1120923874.db2.gz JGRYGNRJCFJAQX-HXUWFJFHSA-N 2 1 337.423 3.536 20 5 EHBDMP CC[NH+](CC)CC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609705171 1123647962 /nfs/dbraw/zinc/64/79/62/1123647962.db2.gz ZJRIKGSRNXOGEV-UHFFFAOYSA-N 2 1 339.867 3.802 20 5 EHBDMP CC(C)c1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1[N+](=O)[O-] ZINC000092043387 1129531364 /nfs/dbraw/zinc/53/13/64/1129531364.db2.gz SWPGCFRYHJZMBF-SJLPKXTDSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1[N+](=O)[O-] ZINC000092043387 1129531367 /nfs/dbraw/zinc/53/13/67/1129531367.db2.gz SWPGCFRYHJZMBF-SJLPKXTDSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1[N+](=O)[O-] ZINC000092043387 1129531370 /nfs/dbraw/zinc/53/13/70/1129531370.db2.gz SWPGCFRYHJZMBF-SJLPKXTDSA-N 2 1 331.460 3.634 20 5 EHBDMP CC(C)c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000092043387 1129531372 /nfs/dbraw/zinc/53/13/72/1129531372.db2.gz SWPGCFRYHJZMBF-SJLPKXTDSA-N 2 1 331.460 3.634 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000788479328 1134130654 /nfs/dbraw/zinc/13/06/54/1134130654.db2.gz SQKXIZVJXZXPJG-UHFFFAOYSA-N 2 1 337.439 3.678 20 5 EHBDMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001199843917 1135931861 /nfs/dbraw/zinc/93/18/61/1135931861.db2.gz SJBVADALIZUJQA-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001199843917 1135931862 /nfs/dbraw/zinc/93/18/62/1135931862.db2.gz SJBVADALIZUJQA-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134922576 1138713425 /nfs/dbraw/zinc/71/34/25/1138713425.db2.gz UGWKHLIUPLNLSS-ZSZQSSIHSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134922576 1138713427 /nfs/dbraw/zinc/71/34/27/1138713427.db2.gz UGWKHLIUPLNLSS-ZSZQSSIHSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134922576 1138713429 /nfs/dbraw/zinc/71/34/29/1138713429.db2.gz UGWKHLIUPLNLSS-ZSZQSSIHSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134922576 1138713430 /nfs/dbraw/zinc/71/34/30/1138713430.db2.gz UGWKHLIUPLNLSS-ZSZQSSIHSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000449084115 1032139939 /nfs/dbraw/zinc/13/99/39/1032139939.db2.gz WPPJGDBYFZTHER-IAGOWNOFSA-N 2 1 333.476 3.770 20 5 EHBDMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656692 1017107770 /nfs/dbraw/zinc/10/77/70/1017107770.db2.gz IZXJBBZCULKIES-KBPBESRZSA-N 2 1 345.468 3.883 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000290353387 1018440809 /nfs/dbraw/zinc/44/08/09/1018440809.db2.gz GGZPMVZWEZNXJH-UHFFFAOYSA-N 2 1 330.432 3.574 20 5 EHBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000290353387 1018440817 /nfs/dbraw/zinc/44/08/17/1018440817.db2.gz GGZPMVZWEZNXJH-UHFFFAOYSA-N 2 1 330.432 3.574 20 5 EHBDMP CN(CC[C@@H]1CCCC[N@H+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703464 1018569668 /nfs/dbraw/zinc/56/96/68/1018569668.db2.gz AVXHJTUINJHSDS-AWEZNQCLSA-N 2 1 325.840 3.554 20 5 EHBDMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000277525709 1025676440 /nfs/dbraw/zinc/67/64/40/1025676440.db2.gz PNHNFEHRJNCMCX-MRXNPFEDSA-N 2 1 343.427 3.771 20 5 EHBDMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000277525709 1025676453 /nfs/dbraw/zinc/67/64/53/1025676453.db2.gz PNHNFEHRJNCMCX-MRXNPFEDSA-N 2 1 343.427 3.771 20 5 EHBDMP Cc1c(CN[C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177394 1031078427 /nfs/dbraw/zinc/07/84/27/1031078427.db2.gz YKLAVQXVDLWFLU-UYAOXDASSA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(CN[C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177394 1031078443 /nfs/dbraw/zinc/07/84/43/1031078443.db2.gz YKLAVQXVDLWFLU-UYAOXDASSA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177394 1031078461 /nfs/dbraw/zinc/07/84/61/1031078461.db2.gz YKLAVQXVDLWFLU-UYAOXDASSA-N 2 1 339.439 3.828 20 5 EHBDMP Cc1c(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177394 1031078480 /nfs/dbraw/zinc/07/84/80/1031078480.db2.gz YKLAVQXVDLWFLU-UYAOXDASSA-N 2 1 339.439 3.828 20 5 EHBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596059043 1034063522 /nfs/dbraw/zinc/06/35/22/1034063522.db2.gz MCWNNXXUFRHRLP-NXIIHZOPSA-N 2 1 343.471 3.710 20 5 EHBDMP Cc1c([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094860 1034079650 /nfs/dbraw/zinc/07/96/50/1034079650.db2.gz NQWOMVHQIHTQEW-DOTOQJQBSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1c([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094863 1034080352 /nfs/dbraw/zinc/08/03/52/1034080352.db2.gz NQWOMVHQIHTQEW-WBVHZDCISA-N 2 1 331.460 3.676 20 5 EHBDMP CC1(C)C[C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170622 1040963028 /nfs/dbraw/zinc/96/30/28/1040963028.db2.gz YGOJIYJMFHWIAY-GLJUWKHASA-N 2 1 329.444 3.534 20 5 EHBDMP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170622 1040963045 /nfs/dbraw/zinc/96/30/45/1040963045.db2.gz YGOJIYJMFHWIAY-GLJUWKHASA-N 2 1 329.444 3.534 20 5 EHBDMP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170622 1040963060 /nfs/dbraw/zinc/96/30/60/1040963060.db2.gz YGOJIYJMFHWIAY-GLJUWKHASA-N 2 1 329.444 3.534 20 5 EHBDMP CCC1([NH3+])CC[NH+]([C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000925757188 1042604280 /nfs/dbraw/zinc/60/42/80/1042604280.db2.gz FAPPVARLDJNABB-LJQANCHMSA-N 2 1 339.439 3.888 20 5 EHBDMP CCCC[N@H+](CC)CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900623 1131884310 /nfs/dbraw/zinc/88/43/10/1131884310.db2.gz WXALFGKAFPQYPN-GOSISDBHSA-N 2 1 333.476 3.554 20 5 EHBDMP CCCC[N@@H+](CC)CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900623 1131884317 /nfs/dbraw/zinc/88/43/17/1131884317.db2.gz WXALFGKAFPQYPN-GOSISDBHSA-N 2 1 333.476 3.554 20 5 EHBDMP CCCC[N@@H+](C)CCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899943 1131884425 /nfs/dbraw/zinc/88/44/25/1131884425.db2.gz QHZTZQNEJMBRMW-GOSISDBHSA-N 2 1 333.476 3.554 20 5 EHBDMP CC(C)C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173229658 1132008503 /nfs/dbraw/zinc/00/85/03/1132008503.db2.gz OQYWHVVXZLBYCP-KBAYOESNSA-N 2 1 333.476 3.754 20 5 EHBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199329618 1135898054 /nfs/dbraw/zinc/89/80/54/1135898054.db2.gz XFHLEPUDEJFXGD-GASCZTMLSA-N 2 1 333.476 3.669 20 5 EHBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199329618 1135898057 /nfs/dbraw/zinc/89/80/57/1135898057.db2.gz XFHLEPUDEJFXGD-GASCZTMLSA-N 2 1 333.476 3.669 20 5 EHBDMP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414942851 1022928084 /nfs/dbraw/zinc/92/80/84/1022928084.db2.gz NCOKEUMGQYQKJU-BZNIZROVSA-N 2 1 349.818 3.596 20 5 EHBDMP C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@H]1[NH3+] ZINC000435395022 1024881879 /nfs/dbraw/zinc/88/18/79/1024881879.db2.gz NUSAJONQPWLZPL-MEDUHNTESA-N 2 1 349.818 3.677 20 5 EHBDMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@H]1[NH3+] ZINC000435395022 1024881887 /nfs/dbraw/zinc/88/18/87/1024881887.db2.gz NUSAJONQPWLZPL-MEDUHNTESA-N 2 1 349.818 3.677 20 5 EHBDMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000531430327 1026901723 /nfs/dbraw/zinc/90/17/23/1026901723.db2.gz WIDHFSHWPBAXQF-DLBZAZTESA-N 2 1 349.475 3.594 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000572887067 1028196774 /nfs/dbraw/zinc/19/67/74/1028196774.db2.gz JIYGWDOIXGOULX-APEZIOSESA-N 2 1 343.471 3.662 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000130307976 1029359524 /nfs/dbraw/zinc/35/95/24/1029359524.db2.gz OGQWYZAVJRLONJ-UHFFFAOYSA-N 2 1 328.416 3.545 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000130307976 1029359537 /nfs/dbraw/zinc/35/95/37/1029359537.db2.gz OGQWYZAVJRLONJ-UHFFFAOYSA-N 2 1 328.416 3.545 20 5 EHBDMP COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000595023876 1033615715 /nfs/dbraw/zinc/61/57/15/1033615715.db2.gz ZDYMKGXOENHQBS-HZPDHXFCSA-N 2 1 349.475 3.622 20 5 EHBDMP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596096623 1034080437 /nfs/dbraw/zinc/08/04/37/1034080437.db2.gz VMEDWXJMCQELRH-SJLPKXTDSA-N 2 1 345.487 3.628 20 5 EHBDMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000365462069 1035086469 /nfs/dbraw/zinc/08/64/69/1035086469.db2.gz PMGFHNYVGDAOIV-HNNXBMFYSA-N 2 1 343.427 3.771 20 5 EHBDMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000365462069 1035086480 /nfs/dbraw/zinc/08/64/80/1035086480.db2.gz PMGFHNYVGDAOIV-HNNXBMFYSA-N 2 1 343.427 3.771 20 5 EHBDMP CN(Cc1ccccc1[N+](=O)[O-])C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076110237 1037322632 /nfs/dbraw/zinc/32/26/32/1037322632.db2.gz QCZWISMDYHIKNP-SFHVURJKSA-N 2 1 339.439 3.549 20 5 EHBDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000272722558 1121963611 /nfs/dbraw/zinc/96/36/11/1121963611.db2.gz XSTVDMBNNZSCNK-HRCADAONSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000272722558 1121963617 /nfs/dbraw/zinc/96/36/17/1121963617.db2.gz XSTVDMBNNZSCNK-HRCADAONSA-N 2 1 331.460 3.898 20 5 EHBDMP C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1CC[NH+](C)CC1 ZINC000132217677 1129883459 /nfs/dbraw/zinc/88/34/59/1129883459.db2.gz WGCZFAHWVJSSMA-UHFFFAOYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[C@H](C[NH3+])C[N@@H+](Cc1ccccc1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220892 1132004669 /nfs/dbraw/zinc/00/46/69/1132004669.db2.gz HSRSGIVLFUZHAS-SJORKVTESA-N 2 1 341.455 3.623 20 5 EHBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1 ZINC000809738912 1135883594 /nfs/dbraw/zinc/88/35/94/1135883594.db2.gz OZLUJPPHCXZDCP-SOFGYWHQSA-N 2 1 339.439 3.802 20 5 EHBDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173387610 1136989683 /nfs/dbraw/zinc/98/96/83/1136989683.db2.gz QLWRXOXFRHMFRA-HNNXBMFYSA-N 2 1 327.428 3.897 20 5 EHBDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000123979930 1138277048 /nfs/dbraw/zinc/27/70/48/1138277048.db2.gz JRJYIFSDXJODIH-OAHLLOKOSA-N 2 1 327.428 3.897 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1[N+](=O)[O-] ZINC000179403394 1139754901 /nfs/dbraw/zinc/75/49/01/1139754901.db2.gz CFUWTVMBURUROH-CQSZACIVSA-N 2 1 347.459 3.519 20 5 EHBDMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180042849 1139803856 /nfs/dbraw/zinc/80/38/56/1139803856.db2.gz XSOQRNNBTUSBAQ-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180042849 1139803864 /nfs/dbraw/zinc/80/38/64/1139803864.db2.gz XSOQRNNBTUSBAQ-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180042849 1139803870 /nfs/dbraw/zinc/80/38/70/1139803870.db2.gz XSOQRNNBTUSBAQ-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180042849 1139803880 /nfs/dbraw/zinc/80/38/80/1139803880.db2.gz XSOQRNNBTUSBAQ-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000269672664 1141134480 /nfs/dbraw/zinc/13/44/80/1141134480.db2.gz RKPNDQBAFOYLGJ-RKVPGOIHSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000269672664 1141134484 /nfs/dbraw/zinc/13/44/84/1141134484.db2.gz RKPNDQBAFOYLGJ-RKVPGOIHSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000269672664 1141134487 /nfs/dbraw/zinc/13/44/87/1141134487.db2.gz RKPNDQBAFOYLGJ-RKVPGOIHSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000269672664 1141134490 /nfs/dbraw/zinc/13/44/90/1141134490.db2.gz RKPNDQBAFOYLGJ-RKVPGOIHSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000269672664 1141134496 /nfs/dbraw/zinc/13/44/96/1141134496.db2.gz RKPNDQBAFOYLGJ-RKVPGOIHSA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000269672664 1141134499 /nfs/dbraw/zinc/13/44/99/1141134499.db2.gz RKPNDQBAFOYLGJ-RKVPGOIHSA-N 2 1 329.444 3.605 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)s1 ZINC000261959387 1019768805 /nfs/dbraw/zinc/76/88/05/1019768805.db2.gz HBFHICHXRIAYMB-SFHVURJKSA-N 2 1 343.452 3.509 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@]3(CC[NH2+]C3)C2)s1 ZINC000261959387 1019768822 /nfs/dbraw/zinc/76/88/22/1019768822.db2.gz HBFHICHXRIAYMB-SFHVURJKSA-N 2 1 343.452 3.509 20 5 EHBDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188367 1020545717 /nfs/dbraw/zinc/54/57/17/1020545717.db2.gz DKNFGLYDYGIMST-YQQAZPJKSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471015 1023232793 /nfs/dbraw/zinc/23/27/93/1023232793.db2.gz OVPOHBGFOKIVKP-PKOBYXMFSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471015 1023232796 /nfs/dbraw/zinc/23/27/96/1023232796.db2.gz OVPOHBGFOKIVKP-PKOBYXMFSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471015 1023232807 /nfs/dbraw/zinc/23/28/07/1023232807.db2.gz OVPOHBGFOKIVKP-PKOBYXMFSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471015 1023232814 /nfs/dbraw/zinc/23/28/14/1023232814.db2.gz OVPOHBGFOKIVKP-PKOBYXMFSA-N 2 1 345.487 3.724 20 5 EHBDMP Cc1c(CN2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475454 1023246834 /nfs/dbraw/zinc/24/68/34/1023246834.db2.gz XAKNSKZHOLWYIM-SJLPKXTDSA-N 2 1 345.487 3.990 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCC[NH+](C)C1 ZINC000508516249 1028483526 /nfs/dbraw/zinc/48/35/26/1028483526.db2.gz KUVIPTPUAPDCEP-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCC[NH+](C)C1 ZINC000508516249 1028483535 /nfs/dbraw/zinc/48/35/35/1028483535.db2.gz KUVIPTPUAPDCEP-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCC[N@H+](C)C1 ZINC000508516249 1028483542 /nfs/dbraw/zinc/48/35/42/1028483542.db2.gz KUVIPTPUAPDCEP-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCC[N@@H+](C)C1 ZINC000508516249 1028483548 /nfs/dbraw/zinc/48/35/48/1028483548.db2.gz KUVIPTPUAPDCEP-HNNXBMFYSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](C)CC1(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCC1 ZINC000447601872 1030355507 /nfs/dbraw/zinc/35/55/07/1030355507.db2.gz ROHATBQVAPKILK-GOSISDBHSA-N 2 1 331.460 3.684 20 5 EHBDMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950665 1032037553 /nfs/dbraw/zinc/03/75/53/1032037553.db2.gz HTEWZVLQVWMNJN-SJORKVTESA-N 2 1 333.476 3.922 20 5 EHBDMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950665 1032037569 /nfs/dbraw/zinc/03/75/69/1032037569.db2.gz HTEWZVLQVWMNJN-SJORKVTESA-N 2 1 333.476 3.922 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596097531 1034062279 /nfs/dbraw/zinc/06/22/79/1034062279.db2.gz YSLCWDCUIXHZLA-WBVHZDCISA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596097531 1034062292 /nfs/dbraw/zinc/06/22/92/1034062292.db2.gz YSLCWDCUIXHZLA-WBVHZDCISA-N 2 1 331.460 3.676 20 5 EHBDMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000599662221 1034072859 /nfs/dbraw/zinc/07/28/59/1034072859.db2.gz ZQICGQYPNKITIH-UHFFFAOYSA-N 2 1 345.418 3.818 20 5 EHBDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000599662221 1034072868 /nfs/dbraw/zinc/07/28/68/1034072868.db2.gz ZQICGQYPNKITIH-UHFFFAOYSA-N 2 1 345.418 3.818 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000414204108 1036053423 /nfs/dbraw/zinc/05/34/23/1036053423.db2.gz ZYPRKYGVNYNYBW-KDOFPFPSSA-N 2 1 331.460 3.639 20 5 EHBDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761506938 1037078285 /nfs/dbraw/zinc/07/82/85/1037078285.db2.gz QAXZXMFNNNCXKO-UHFFFAOYSA-N 2 1 339.867 3.800 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)o1 ZINC000591282896 1037318816 /nfs/dbraw/zinc/31/88/16/1037318816.db2.gz YGURXKOCVBFYOV-AWEZNQCLSA-N 2 1 341.411 3.619 20 5 EHBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433115161 1040777817 /nfs/dbraw/zinc/77/78/17/1040777817.db2.gz HVUCDKTWRGWGNW-FZKQIMNGSA-N 2 1 342.443 3.748 20 5 EHBDMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433282945 1041232321 /nfs/dbraw/zinc/23/23/21/1041232321.db2.gz NJYOOWYMVBWBLW-HBUWYVDXSA-N 2 1 331.460 3.780 20 5 EHBDMP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000102423188 1135551112 /nfs/dbraw/zinc/55/11/12/1135551112.db2.gz CKXRLBMWKZJGNO-CQSZACIVSA-N 2 1 345.468 3.755 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)CCC2 ZINC000192932078 1140556060 /nfs/dbraw/zinc/55/60/60/1140556060.db2.gz RSJZRXZNEMUOLK-FQEVSTJZSA-N 2 1 343.471 3.969 20 5 EHBDMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000459727006 1032432883 /nfs/dbraw/zinc/43/28/83/1032432883.db2.gz GXSZLDMAMFNIOA-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000459777275 1032463467 /nfs/dbraw/zinc/46/34/67/1032463467.db2.gz KLXAHJAXQUUYRQ-ZHALLVOQSA-N 2 1 345.487 3.628 20 5 EHBDMP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000513784979 1027704598 /nfs/dbraw/zinc/70/45/98/1027704598.db2.gz COOFMJXOOVPDLL-WOGUSJMUSA-N 2 1 343.471 3.522 20 5 EHBDMP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000513784979 1027704611 /nfs/dbraw/zinc/70/46/11/1027704611.db2.gz COOFMJXOOVPDLL-WOGUSJMUSA-N 2 1 343.471 3.522 20 5 EHBDMP C[N@@H+](CCCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000453390730 1030234394 /nfs/dbraw/zinc/23/43/94/1030234394.db2.gz DIKWEKDPCBEZPB-SFHVURJKSA-N 2 1 331.460 3.781 20 5 EHBDMP C[C@H]1CCCC[N@H+]1CCCNCc1ccc([N+](=O)[O-])cc1Cl ZINC000237505955 1034853316 /nfs/dbraw/zinc/85/33/16/1034853316.db2.gz VBXYIYBWMWBLBH-ZDUSSCGKSA-N 2 1 325.840 3.602 20 5 EHBDMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000271997907 1035701315 /nfs/dbraw/zinc/70/13/15/1035701315.db2.gz HQUNPNDEVOSELN-UHFFFAOYSA-N 2 1 340.383 3.540 20 5 EHBDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000573526908 1040154380 /nfs/dbraw/zinc/15/43/80/1040154380.db2.gz SRTZUWLCZDBJHF-UHFFFAOYSA-N 2 1 341.455 3.987 20 5 EHBDMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433282947 1041234221 /nfs/dbraw/zinc/23/42/21/1041234221.db2.gz NJYOOWYMVBWBLW-LBTNJELSSA-N 2 1 331.460 3.780 20 5 EHBDMP Cc1cc(NC[C@@H]2CC[N@H+](C(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000326334684 1121649154 /nfs/dbraw/zinc/64/91/54/1121649154.db2.gz IJIYDXWYDQBPOJ-AWEZNQCLSA-N 2 1 328.416 3.594 20 5 EHBDMP C[N@H+]1CCC[C@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180507344 1124019348 /nfs/dbraw/zinc/01/93/48/1124019348.db2.gz QFCLJLXJDVBIHZ-UZLBHIALSA-N 2 1 339.439 3.616 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000245515206 1130228330 /nfs/dbraw/zinc/22/83/30/1130228330.db2.gz DFVPQKYQLNKJSS-DLBZAZTESA-N 2 1 331.460 3.915 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000245515206 1130228335 /nfs/dbraw/zinc/22/83/35/1130228335.db2.gz DFVPQKYQLNKJSS-DLBZAZTESA-N 2 1 331.460 3.915 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC[N@H+](CC2CCCCC2)C1 ZINC001173219498 1132002995 /nfs/dbraw/zinc/00/29/95/1132002995.db2.gz COJWEAUVNCFSFX-APWZRJJASA-N 2 1 345.487 3.770 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC[N@@H+](CC2CCCCC2)C1 ZINC001173219498 1132003003 /nfs/dbraw/zinc/00/30/03/1132003003.db2.gz COJWEAUVNCFSFX-APWZRJJASA-N 2 1 345.487 3.770 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001173226557 1132007050 /nfs/dbraw/zinc/00/70/50/1132007050.db2.gz KJSGJZPSVPNKMY-MJGOQNOKSA-N 2 1 345.487 3.866 20 5 EHBDMP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000102423211 1135551263 /nfs/dbraw/zinc/55/12/63/1135551263.db2.gz ROTMMRPKVDVILH-CQSZACIVSA-N 2 1 345.468 3.755 20 5 EHBDMP C[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1CCC[NH3+] ZINC000852758992 1136483579 /nfs/dbraw/zinc/48/35/79/1136483579.db2.gz IOCKGJWKJWRDAL-IUODEOHRSA-N 2 1 325.840 3.588 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCn1cc[nH+]c1C ZINC000872025333 1137565779 /nfs/dbraw/zinc/56/57/79/1137565779.db2.gz KXUKAGHNBLVWLC-GFCCVEGCSA-N 2 1 334.445 3.563 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000459777272 1032464237 /nfs/dbraw/zinc/46/42/37/1032464237.db2.gz KLXAHJAXQUUYRQ-AOIWGVFYSA-N 2 1 345.487 3.628 20 5 EHBDMP CC[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000414716278 1017149416 /nfs/dbraw/zinc/14/94/16/1017149416.db2.gz NUZKJBJBJYWORT-MRXNPFEDSA-N 2 1 343.427 3.819 20 5 EHBDMP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000347110864 1025516068 /nfs/dbraw/zinc/51/60/68/1025516068.db2.gz PWQPIYFJYQDLCD-FKEKPDDDSA-N 2 1 341.411 3.570 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000347110864 1025516079 /nfs/dbraw/zinc/51/60/79/1025516079.db2.gz PWQPIYFJYQDLCD-FKEKPDDDSA-N 2 1 341.411 3.570 20 5 EHBDMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548412 1026099207 /nfs/dbraw/zinc/09/92/07/1026099207.db2.gz MXZTZBHSYLMIPB-ZWKOTPCHSA-N 2 1 331.460 3.649 20 5 EHBDMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548412 1026099217 /nfs/dbraw/zinc/09/92/17/1026099217.db2.gz MXZTZBHSYLMIPB-ZWKOTPCHSA-N 2 1 331.460 3.649 20 5 EHBDMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548412 1026099235 /nfs/dbraw/zinc/09/92/35/1026099235.db2.gz MXZTZBHSYLMIPB-ZWKOTPCHSA-N 2 1 331.460 3.649 20 5 EHBDMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000562096523 1026758551 /nfs/dbraw/zinc/75/85/51/1026758551.db2.gz HEUIXBDWCXXSOL-JFIYKMOQSA-N 2 1 333.476 3.624 20 5 EHBDMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000562096523 1026758563 /nfs/dbraw/zinc/75/85/63/1026758563.db2.gz HEUIXBDWCXXSOL-JFIYKMOQSA-N 2 1 333.476 3.624 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC3CC3)C1)CCC2 ZINC000596092477 1034079504 /nfs/dbraw/zinc/07/95/04/1034079504.db2.gz ANXVASDKIBDLBR-OXQOHEQNSA-N 2 1 343.471 3.684 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CCCC23CC[NH+](C)CC3)cc1[N+](=O)[O-] ZINC000472612860 1037377185 /nfs/dbraw/zinc/37/71/85/1037377185.db2.gz QRNVJKPXELICTK-UHFFFAOYSA-N 2 1 331.460 3.778 20 5 EHBDMP C[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000480253206 1039340569 /nfs/dbraw/zinc/34/05/69/1039340569.db2.gz VHPBZYMNWBXPRN-INIZCTEOSA-N 2 1 339.439 3.694 20 5 EHBDMP C[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000480253206 1039340581 /nfs/dbraw/zinc/34/05/81/1039340581.db2.gz VHPBZYMNWBXPRN-INIZCTEOSA-N 2 1 339.439 3.694 20 5 EHBDMP CC(C)[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCCC1 ZINC000480535603 1039656211 /nfs/dbraw/zinc/65/62/11/1039656211.db2.gz KWTUTTHXVYZFLU-AZUAARDMSA-N 2 1 345.487 3.626 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000182811026 1042436274 /nfs/dbraw/zinc/43/62/74/1042436274.db2.gz WOMHUDFMWBGYAS-DLBZAZTESA-N 2 1 331.460 3.772 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000182811026 1042436276 /nfs/dbraw/zinc/43/62/76/1042436276.db2.gz WOMHUDFMWBGYAS-DLBZAZTESA-N 2 1 331.460 3.772 20 5 EHBDMP Cc1[nH+]ccn1CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000338709113 1128728913 /nfs/dbraw/zinc/72/89/13/1128728913.db2.gz QGEFARDQCCMKLH-UHFFFAOYSA-N 2 1 342.424 3.618 20 5 EHBDMP CCC[NH+](CCC)CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898657 1131882342 /nfs/dbraw/zinc/88/23/42/1131882342.db2.gz IICGKHYDHRKBMP-SFHVURJKSA-N 2 1 333.476 3.554 20 5 EHBDMP CC1=CCC[N@@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001181253855 1133473384 /nfs/dbraw/zinc/47/33/84/1133473384.db2.gz FMMBAEOUQHGNHL-UHFFFAOYSA-N 2 1 343.471 3.501 20 5 EHBDMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000859213994 1137007851 /nfs/dbraw/zinc/00/78/51/1137007851.db2.gz DYHMAWGAZVYIMW-UHFFFAOYSA-N 2 1 347.846 3.942 20 5 EHBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000859213994 1137007853 /nfs/dbraw/zinc/00/78/53/1137007853.db2.gz DYHMAWGAZVYIMW-UHFFFAOYSA-N 2 1 347.846 3.942 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000089512952 1138200437 /nfs/dbraw/zinc/20/04/37/1138200437.db2.gz PMPLXRSARCXMEJ-AWEZNQCLSA-N 2 1 349.475 3.907 20 5 EHBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000271128439 1141310274 /nfs/dbraw/zinc/31/02/74/1141310274.db2.gz LAIZTEMBCWBCRL-CABCVRRESA-N 2 1 349.500 3.539 20 5 EHBDMP C[NH2+]CCC[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000415138998 1017601914 /nfs/dbraw/zinc/60/19/14/1017601914.db2.gz WDYIIWTUDJPMQQ-UHFFFAOYSA-N 2 1 337.807 3.550 20 5 EHBDMP C[NH2+]CCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000415138998 1017601918 /nfs/dbraw/zinc/60/19/18/1017601918.db2.gz WDYIIWTUDJPMQQ-UHFFFAOYSA-N 2 1 337.807 3.550 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592491870 1032928610 /nfs/dbraw/zinc/92/86/10/1032928610.db2.gz MQIAAEHXGPLPSC-YESZJQIVSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000490037575 1021591922 /nfs/dbraw/zinc/59/19/22/1021591922.db2.gz IBUOPEXCVKJFDK-RDJZCZTQSA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000490037575 1021591932 /nfs/dbraw/zinc/59/19/32/1021591932.db2.gz IBUOPEXCVKJFDK-RDJZCZTQSA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000490037575 1021591942 /nfs/dbraw/zinc/59/19/42/1021591942.db2.gz IBUOPEXCVKJFDK-RDJZCZTQSA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000490037575 1021591947 /nfs/dbraw/zinc/59/19/47/1021591947.db2.gz IBUOPEXCVKJFDK-RDJZCZTQSA-N 2 1 331.460 3.628 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)s1 ZINC000427105298 1023216475 /nfs/dbraw/zinc/21/64/75/1023216475.db2.gz XHNPQKXHRIYAGJ-CZUORRHYSA-N 2 1 343.452 3.507 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)s1 ZINC000427105298 1023216481 /nfs/dbraw/zinc/21/64/81/1023216481.db2.gz XHNPQKXHRIYAGJ-CZUORRHYSA-N 2 1 343.452 3.507 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000074319761 1024141891 /nfs/dbraw/zinc/14/18/91/1024141891.db2.gz BJURCKFBNANMMC-UHFFFAOYSA-N 2 1 333.476 3.581 20 5 EHBDMP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000513784977 1027705962 /nfs/dbraw/zinc/70/59/62/1027705962.db2.gz COOFMJXOOVPDLL-CAIZAGQASA-N 2 1 343.471 3.522 20 5 EHBDMP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000513784977 1027705979 /nfs/dbraw/zinc/70/59/79/1027705979.db2.gz COOFMJXOOVPDLL-CAIZAGQASA-N 2 1 343.471 3.522 20 5 EHBDMP C[C@H]([NH2+][C@@H](CN)C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284198 1028322067 /nfs/dbraw/zinc/32/20/67/1028322067.db2.gz WPNATHNSKKNLCX-FZMZJTMJSA-N 2 1 331.441 3.711 20 5 EHBDMP C[C@H]([NH2+][C@@H](C[NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284198 1028322086 /nfs/dbraw/zinc/32/20/86/1028322086.db2.gz WPNATHNSKKNLCX-FZMZJTMJSA-N 2 1 331.441 3.711 20 5 EHBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000504926265 1029072617 /nfs/dbraw/zinc/07/26/17/1029072617.db2.gz HEYVYOIKRBTDGY-BZUAXINKSA-N 2 1 349.500 3.682 20 5 EHBDMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950664 1032036842 /nfs/dbraw/zinc/03/68/42/1032036842.db2.gz HTEWZVLQVWMNJN-IRXDYDNUSA-N 2 1 333.476 3.922 20 5 EHBDMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950664 1032036855 /nfs/dbraw/zinc/03/68/55/1032036855.db2.gz HTEWZVLQVWMNJN-IRXDYDNUSA-N 2 1 333.476 3.922 20 5 EHBDMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180043009 1035254329 /nfs/dbraw/zinc/25/43/29/1035254329.db2.gz XSOQRNNBTUSBAQ-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180043009 1035254336 /nfs/dbraw/zinc/25/43/36/1035254336.db2.gz XSOQRNNBTUSBAQ-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180043009 1035254338 /nfs/dbraw/zinc/25/43/38/1035254338.db2.gz XSOQRNNBTUSBAQ-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180043009 1035254345 /nfs/dbraw/zinc/25/43/45/1035254345.db2.gz XSOQRNNBTUSBAQ-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP Cc1[nH+]ccn1CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000338709875 1128732551 /nfs/dbraw/zinc/73/25/51/1128732551.db2.gz SWJOKIKNQGXVNY-UHFFFAOYSA-N 2 1 342.424 3.618 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000272722564 1121963670 /nfs/dbraw/zinc/96/36/70/1121963670.db2.gz XSTVDMBNNZSCNK-PMPSAXMXSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000272722564 1121963674 /nfs/dbraw/zinc/96/36/74/1121963674.db2.gz XSTVDMBNNZSCNK-PMPSAXMXSA-N 2 1 331.460 3.898 20 5 EHBDMP Cc1ccccc1C[N@@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168998341 1132627193 /nfs/dbraw/zinc/62/71/93/1132627193.db2.gz LLZLHXKKHPKGFS-LEAZDLGRSA-N 2 1 345.487 3.512 20 5 EHBDMP Cc1[nH]c(C2CC[NH+](Cc3ccc(C)c([N+](=O)[O-])c3)CC2)[nH+]c1C ZINC000886659183 1138109708 /nfs/dbraw/zinc/10/97/08/1138109708.db2.gz FSOCWHRFYNMXNF-UHFFFAOYSA-N 2 1 328.416 3.623 20 5 EHBDMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770288 1138241021 /nfs/dbraw/zinc/24/10/21/1138241021.db2.gz BKCGETOOGFJFSP-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770288 1138241023 /nfs/dbraw/zinc/24/10/23/1138241023.db2.gz BKCGETOOGFJFSP-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770288 1138241024 /nfs/dbraw/zinc/24/10/24/1138241024.db2.gz BKCGETOOGFJFSP-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770288 1138241027 /nfs/dbraw/zinc/24/10/27/1138241027.db2.gz BKCGETOOGFJFSP-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](CC)CC1 ZINC000271136027 1141313361 /nfs/dbraw/zinc/31/33/61/1141313361.db2.gz NDCRGNFPKFTAEW-AWEZNQCLSA-N 2 1 337.489 3.539 20 5 EHBDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587025 1030321853 /nfs/dbraw/zinc/32/18/53/1030321853.db2.gz PWWBJURSHFAEKY-UZLBHIALSA-N 2 1 345.487 3.930 20 5 EHBDMP C[N@@H+](CCCC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000453604310 1030392595 /nfs/dbraw/zinc/39/25/95/1030392595.db2.gz ZDEBEZMGHQQYIN-UHFFFAOYSA-N 2 1 343.427 3.819 20 5 EHBDMP CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000536652118 1032036716 /nfs/dbraw/zinc/03/67/16/1032036716.db2.gz LPPJBVOOBCNHEU-UHFFFAOYSA-N 2 1 349.475 3.546 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000603857056 1033980753 /nfs/dbraw/zinc/98/07/53/1033980753.db2.gz PHMHRLXLLVSBDY-UHFFFAOYSA-N 2 1 349.475 3.547 20 5 EHBDMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000414204109 1036051789 /nfs/dbraw/zinc/05/17/89/1036051789.db2.gz ZYPRKYGVNYNYBW-KSSFIOAISA-N 2 1 331.460 3.639 20 5 EHBDMP O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000609144054 1036948388 /nfs/dbraw/zinc/94/83/88/1036948388.db2.gz JNGSDQYUGWNQOZ-UHFFFAOYSA-N 2 1 349.450 3.822 20 5 EHBDMP CCC[NH+]1CCC([NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417320296 1039676516 /nfs/dbraw/zinc/67/65/16/1039676516.db2.gz JIBMJNZTKZKUDY-LJQANCHMSA-N 2 1 331.460 3.826 20 5 EHBDMP Cc1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272892023 1127097448 /nfs/dbraw/zinc/09/74/48/1127097448.db2.gz YCHGULUEOSRMMW-CYBMUJFWSA-N 2 1 337.383 3.559 20 5 EHBDMP C[C@H](C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[NH+]1CCCC1 ZINC001648832609 1120050880 /nfs/dbraw/zinc/05/08/80/1120050880.db2.gz DBNPBRUVSVROPT-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909653 1131917146 /nfs/dbraw/zinc/91/71/46/1131917146.db2.gz UTFRZSUOMSHIGI-XFQXTVEOSA-N 2 1 345.487 3.551 20 5 EHBDMP CCCC[NH+]1CCC([N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173238745 1132028040 /nfs/dbraw/zinc/02/80/40/1132028040.db2.gz XFENHIRWJCVSFV-MRXNPFEDSA-N 2 1 333.476 3.722 20 5 EHBDMP Cc1ccc(C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001168997181 1132627825 /nfs/dbraw/zinc/62/78/25/1132627825.db2.gz BVQVQDKQMNEPSY-WTGUMLROSA-N 2 1 345.487 3.512 20 5 EHBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001199329621 1135898404 /nfs/dbraw/zinc/89/84/04/1135898404.db2.gz XFHLEPUDEJFXGD-HUUCEWRRSA-N 2 1 333.476 3.669 20 5 EHBDMP CC(C)[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccc([N+](=O)[O-])cc1 ZINC000873203593 1137593957 /nfs/dbraw/zinc/59/39/57/1137593957.db2.gz JDNAGAQTPRASGS-UHFFFAOYSA-N 2 1 345.468 3.713 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607134 1139144816 /nfs/dbraw/zinc/14/48/16/1139144816.db2.gz YQPOBXYELWYWTR-HOTGVXAUSA-N 2 1 349.475 3.765 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607134 1139144821 /nfs/dbraw/zinc/14/48/21/1139144821.db2.gz YQPOBXYELWYWTR-HOTGVXAUSA-N 2 1 349.475 3.765 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246944342 1016192914 /nfs/dbraw/zinc/19/29/14/1016192914.db2.gz UGWKHLIUPLNLSS-SIXWZSSISA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246944342 1016192919 /nfs/dbraw/zinc/19/29/19/1016192919.db2.gz UGWKHLIUPLNLSS-SIXWZSSISA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246944342 1016192922 /nfs/dbraw/zinc/19/29/22/1016192922.db2.gz UGWKHLIUPLNLSS-SIXWZSSISA-N 2 1 329.444 3.605 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246944342 1016192925 /nfs/dbraw/zinc/19/29/25/1016192925.db2.gz UGWKHLIUPLNLSS-SIXWZSSISA-N 2 1 329.444 3.605 20 5 EHBDMP CC1([NH3+])CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000592431600 1032835294 /nfs/dbraw/zinc/83/52/94/1032835294.db2.gz NOECVNDKWZIMOU-UHFFFAOYSA-N 2 1 331.441 3.637 20 5 EHBDMP Cc1c(CN2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475452 1023246297 /nfs/dbraw/zinc/24/62/97/1023246297.db2.gz XAKNSKZHOLWYIM-AEFFLSMTSA-N 2 1 345.487 3.990 20 5 EHBDMP CC(C)[N@@H+](C)CC1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000535811318 1023651718 /nfs/dbraw/zinc/65/17/18/1023651718.db2.gz CTRABTBPFIUHSK-VURMDHGXSA-N 2 1 331.460 3.660 20 5 EHBDMP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC[NH2+]CC1 ZINC000435375091 1024843666 /nfs/dbraw/zinc/84/36/66/1024843666.db2.gz ZNRKVZVAOJYRSP-UHFFFAOYSA-N 2 1 349.818 3.692 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC[NH2+]CC1 ZINC000435375091 1024843692 /nfs/dbraw/zinc/84/36/92/1024843692.db2.gz ZNRKVZVAOJYRSP-UHFFFAOYSA-N 2 1 349.818 3.692 20 5 EHBDMP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000598994761 1033647812 /nfs/dbraw/zinc/64/78/12/1033647812.db2.gz RGFDQAPAFNDOIE-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000598994761 1033647815 /nfs/dbraw/zinc/64/78/15/1033647815.db2.gz RGFDQAPAFNDOIE-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000414204107 1036052766 /nfs/dbraw/zinc/05/27/66/1036052766.db2.gz ZYPRKYGVNYNYBW-KBXCAEBGSA-N 2 1 331.460 3.639 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCC[NH2+]CC3)o2)c(Cl)c1 ZINC000591278468 1037318278 /nfs/dbraw/zinc/31/82/78/1037318278.db2.gz DWDGZDBTNOYNIF-GFCCVEGCSA-N 2 1 349.818 3.740 20 5 EHBDMP CCCC[NH+]1CCC([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192772048 1126936666 /nfs/dbraw/zinc/93/66/66/1126936666.db2.gz OFRADJYBFMMUOV-IBGZPJMESA-N 2 1 331.460 3.826 20 5 EHBDMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000153345593 1121745327 /nfs/dbraw/zinc/74/53/27/1121745327.db2.gz VRMGAJLMWCFHSE-HNNXBMFYSA-N 2 1 349.475 3.909 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000543418039 1129474754 /nfs/dbraw/zinc/47/47/54/1129474754.db2.gz MFRPFGRKJBZBSX-JKSUJKDBSA-N 2 1 349.475 3.909 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154396906 1129555226 /nfs/dbraw/zinc/55/52/26/1129555226.db2.gz RORQOZUDQNTDPX-UHFFFAOYSA-N 2 1 328.416 3.545 20 5 EHBDMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154396906 1129555228 /nfs/dbraw/zinc/55/52/28/1129555228.db2.gz RORQOZUDQNTDPX-UHFFFAOYSA-N 2 1 328.416 3.545 20 5 EHBDMP CCC[N@@H+](CCC[NH+](C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914063 1131902504 /nfs/dbraw/zinc/90/25/04/1131902504.db2.gz YSDCBOREFJZZCY-SFHVURJKSA-N 2 1 333.476 3.506 20 5 EHBDMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001177541962 1133079683 /nfs/dbraw/zinc/07/96/83/1133079683.db2.gz GYRNHKJGWYSPAE-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001177541962 1133079687 /nfs/dbraw/zinc/07/96/87/1133079687.db2.gz GYRNHKJGWYSPAE-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP CC[C@H]1CCC[N@H+]1CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001179863573 1133295052 /nfs/dbraw/zinc/29/50/52/1133295052.db2.gz PKOJNLBHPQUQAO-IBGZPJMESA-N 2 1 345.487 3.724 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001184376087 1133932839 /nfs/dbraw/zinc/93/28/39/1133932839.db2.gz ZSOVJZWVMRGHHT-RVDMUPIBSA-N 2 1 331.460 3.851 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001184376087 1133932842 /nfs/dbraw/zinc/93/28/42/1133932842.db2.gz ZSOVJZWVMRGHHT-RVDMUPIBSA-N 2 1 331.460 3.851 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000872030726 1137566388 /nfs/dbraw/zinc/56/63/88/1137566388.db2.gz BCSVSEVUDWRDDI-STQMWFEESA-N 2 1 348.472 3.809 20 5 EHBDMP CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1[NH3+] ZINC000592427624 1032815484 /nfs/dbraw/zinc/81/54/84/1032815484.db2.gz JFBZSKYVLDHTCJ-XJKSGUPXSA-N 2 1 345.468 3.883 20 5 EHBDMP Cc1c(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000478486245 1026125674 /nfs/dbraw/zinc/12/56/74/1026125674.db2.gz FVOGZGANCLQOPD-UHFFFAOYSA-N 2 1 331.460 3.790 20 5 EHBDMP C[C@H]([NH2+]CC1([NH3+])CCC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423318227 1028348864 /nfs/dbraw/zinc/34/88/64/1028348864.db2.gz DDRUNAKYKKDRCS-LBPRGKRZSA-N 2 1 331.441 3.855 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCC[NH+](C)C1 ZINC000508529784 1028792926 /nfs/dbraw/zinc/79/29/26/1028792926.db2.gz TZQFSOFKJNXXLD-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCC[NH+](C)C1 ZINC000508529784 1028792945 /nfs/dbraw/zinc/79/29/45/1028792945.db2.gz TZQFSOFKJNXXLD-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCC[N@H+](C)C1 ZINC000508529784 1028792958 /nfs/dbraw/zinc/79/29/58/1028792958.db2.gz TZQFSOFKJNXXLD-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP C[NH+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000508529784 1028792974 /nfs/dbraw/zinc/79/29/74/1028792974.db2.gz TZQFSOFKJNXXLD-OAHLLOKOSA-N 2 1 343.427 3.628 20 5 EHBDMP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000595003509 1033629117 /nfs/dbraw/zinc/62/91/17/1033629117.db2.gz IDXREQFHGLQZFN-GFCCVEGCSA-N 2 1 335.448 3.563 20 5 EHBDMP C[N@H+]1CCCC[C@@H](C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068692 1033709083 /nfs/dbraw/zinc/70/90/83/1033709083.db2.gz CJHMXCIVKJMZTQ-KSSFIOAISA-N 2 1 331.460 3.639 20 5 EHBDMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000442925059 1036741974 /nfs/dbraw/zinc/74/19/74/1036741974.db2.gz TXUDZVHWARJFPT-AWEZNQCLSA-N 2 1 345.468 3.884 20 5 EHBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314605 1039669218 /nfs/dbraw/zinc/66/92/18/1039669218.db2.gz RMKMAWOBCIGZOC-AUUYWEPGSA-N 2 1 342.443 3.793 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1[N+](=O)[O-] ZINC000179397957 1139753865 /nfs/dbraw/zinc/75/38/65/1139753865.db2.gz SHNKMKSFWUYOMM-HNNXBMFYSA-N 2 1 349.475 3.765 20 5 EHBDMP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000449233805 1032328230 /nfs/dbraw/zinc/32/82/30/1032328230.db2.gz NEFQQRHDNBOIIQ-SOLBZPMBSA-N 2 1 345.487 3.768 20 5 EHBDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000340598136 1018614988 /nfs/dbraw/zinc/61/49/88/1018614988.db2.gz QCRAHTHFYQPWEC-UHFFFAOYSA-N 2 1 327.428 3.679 20 5 EHBDMP CCC[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000178255762 1022325246 /nfs/dbraw/zinc/32/52/46/1022325246.db2.gz QRIDFRMGAQRENN-LJQANCHMSA-N 2 1 331.460 3.900 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000414785340 1029026469 /nfs/dbraw/zinc/02/64/69/1029026469.db2.gz SMSWCTHUKXSGKG-IAGOWNOFSA-N 2 1 331.460 3.540 20 5 EHBDMP CC(C)C[NH+]1CCC([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192646173 1030924299 /nfs/dbraw/zinc/92/42/99/1030924299.db2.gz PAEWCZCBCGLIEM-IBGZPJMESA-N 2 1 331.460 3.682 20 5 EHBDMP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000598993955 1033647230 /nfs/dbraw/zinc/64/72/30/1033647230.db2.gz FKTKLCFMKZGMSC-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000598993955 1033647239 /nfs/dbraw/zinc/64/72/39/1033647239.db2.gz FKTKLCFMKZGMSC-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C(C)(C)C ZINC000761525447 1037109962 /nfs/dbraw/zinc/10/99/62/1037109962.db2.gz KATZRSDCGYJXIR-OAHLLOKOSA-N 2 1 327.856 3.704 20 5 EHBDMP CCC[NH+]1CCC([NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417320295 1039677683 /nfs/dbraw/zinc/67/76/83/1039677683.db2.gz JIBMJNZTKZKUDY-IBGZPJMESA-N 2 1 331.460 3.826 20 5 EHBDMP CCC[NH+](CCC)CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898655 1131882747 /nfs/dbraw/zinc/88/27/47/1131882747.db2.gz IICGKHYDHRKBMP-GOSISDBHSA-N 2 1 333.476 3.554 20 5 EHBDMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001175353472 1132647547 /nfs/dbraw/zinc/64/75/47/1132647547.db2.gz ZTTDOXYWBWQQDH-IBGZPJMESA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@H](CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[NH+](C)C ZINC001203270810 1133899974 /nfs/dbraw/zinc/89/99/74/1133899974.db2.gz OZHYQBVAOMWFHJ-CYBMUJFWSA-N 2 1 333.457 3.753 20 5 EHBDMP Cc1ccc([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1[N+](=O)[O-] ZINC000820822232 1137006028 /nfs/dbraw/zinc/00/60/28/1137006028.db2.gz IKQVZAQEQWCJJD-PNFOFYCQSA-N 2 1 329.444 3.712 20 5 EHBDMP Cc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)cc1[N+](=O)[O-] ZINC000820822232 1137006030 /nfs/dbraw/zinc/00/60/30/1137006030.db2.gz IKQVZAQEQWCJJD-PNFOFYCQSA-N 2 1 329.444 3.712 20 5 EHBDMP Cc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1[N+](=O)[O-] ZINC000820822232 1137006031 /nfs/dbraw/zinc/00/60/31/1137006031.db2.gz IKQVZAQEQWCJJD-PNFOFYCQSA-N 2 1 329.444 3.712 20 5 EHBDMP CC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1[NH3+] ZINC000592427639 1032815142 /nfs/dbraw/zinc/81/51/42/1032815142.db2.gz LTBKCWBPURVAGN-GUYCJALGSA-N 2 1 345.468 3.883 20 5 EHBDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587023 1030321238 /nfs/dbraw/zinc/32/12/38/1030321238.db2.gz PWWBJURSHFAEKY-OXJNMPFZSA-N 2 1 345.487 3.930 20 5 EHBDMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950662 1032036553 /nfs/dbraw/zinc/03/65/53/1032036553.db2.gz HTEWZVLQVWMNJN-DLBZAZTESA-N 2 1 333.476 3.922 20 5 EHBDMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950662 1032036575 /nfs/dbraw/zinc/03/65/75/1032036575.db2.gz HTEWZVLQVWMNJN-DLBZAZTESA-N 2 1 333.476 3.922 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC3CC3)C1)CCC2 ZINC000596092480 1034077620 /nfs/dbraw/zinc/07/76/20/1034077620.db2.gz ANXVASDKIBDLBR-UZLBHIALSA-N 2 1 343.471 3.684 20 5 EHBDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095280 1034078602 /nfs/dbraw/zinc/07/86/02/1034078602.db2.gz OOSGJCXCQWEPIK-LPHOPBHVSA-N 2 1 331.460 3.758 20 5 EHBDMP CC[N@@H+](CCC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1)CC1CC1 ZINC000539957448 1037405485 /nfs/dbraw/zinc/40/54/85/1037405485.db2.gz UJLPWCOLQVKHCZ-UHFFFAOYSA-N 2 1 345.487 3.929 20 5 EHBDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000566474632 1039768560 /nfs/dbraw/zinc/76/85/60/1039768560.db2.gz IDQPXRFVRWWLAH-MAUKXSAKSA-N 2 1 331.460 3.540 20 5 EHBDMP CCC[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421086 1043157839 /nfs/dbraw/zinc/15/78/39/1043157839.db2.gz FSRYGANXJJIWEW-APWZRJJASA-N 2 1 349.475 3.527 20 5 EHBDMP CCC[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421086 1043157840 /nfs/dbraw/zinc/15/78/40/1043157840.db2.gz FSRYGANXJJIWEW-APWZRJJASA-N 2 1 349.475 3.527 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000245522034 1130230946 /nfs/dbraw/zinc/23/09/46/1130230946.db2.gz LHMOJWQCRRULKB-YRNRMSPPSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000245522034 1130230949 /nfs/dbraw/zinc/23/09/49/1130230949.db2.gz LHMOJWQCRRULKB-YRNRMSPPSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000245522034 1130230954 /nfs/dbraw/zinc/23/09/54/1130230954.db2.gz LHMOJWQCRRULKB-YRNRMSPPSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000245522034 1130230959 /nfs/dbraw/zinc/23/09/59/1130230959.db2.gz LHMOJWQCRRULKB-YRNRMSPPSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000245522034 1130230965 /nfs/dbraw/zinc/23/09/65/1130230965.db2.gz LHMOJWQCRRULKB-YRNRMSPPSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000245522034 1130230968 /nfs/dbraw/zinc/23/09/68/1130230968.db2.gz LHMOJWQCRRULKB-YRNRMSPPSA-N 2 1 343.471 3.913 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000245522034 1130230973 /nfs/dbraw/zinc/23/09/73/1130230973.db2.gz LHMOJWQCRRULKB-YRNRMSPPSA-N 2 1 343.471 3.913 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001173226553 1132006672 /nfs/dbraw/zinc/00/66/72/1132006672.db2.gz KJSGJZPSVPNKMY-IEBWSBKVSA-N 2 1 345.487 3.866 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000872030725 1137566263 /nfs/dbraw/zinc/56/62/63/1137566263.db2.gz BCSVSEVUDWRDDI-QWHCGFSZSA-N 2 1 348.472 3.809 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1[N+](=O)[O-] ZINC000179403405 1139754828 /nfs/dbraw/zinc/75/48/28/1139754828.db2.gz CFUWTVMBURUROH-AWEZNQCLSA-N 2 1 347.459 3.519 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000459726044 1032431190 /nfs/dbraw/zinc/43/11/90/1032431190.db2.gz FZPHFERXFPLMEJ-OAHLLOKOSA-N 2 1 343.427 3.676 20 5 EHBDMP C[C@@H]([NH3+])[C@@H](C)[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000415013064 1017409750 /nfs/dbraw/zinc/40/97/50/1017409750.db2.gz JYXHIEIEDDZFGA-VXGBXAGGSA-N 2 1 349.818 3.866 20 5 EHBDMP CC(C)c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1[N+](=O)[O-] ZINC000377629214 1018090591 /nfs/dbraw/zinc/09/05/91/1018090591.db2.gz RBWYVMAPJKTSIY-SJPCQFCGSA-N 2 1 331.460 3.775 20 5 EHBDMP CC(C)c1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1[N+](=O)[O-] ZINC000377629214 1018090603 /nfs/dbraw/zinc/09/06/03/1018090603.db2.gz RBWYVMAPJKTSIY-SJPCQFCGSA-N 2 1 331.460 3.775 20 5 EHBDMP CC(C)c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-] ZINC000377629214 1018090618 /nfs/dbraw/zinc/09/06/18/1018090618.db2.gz RBWYVMAPJKTSIY-SJPCQFCGSA-N 2 1 331.460 3.775 20 5 EHBDMP CC(C)c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000377629214 1018090633 /nfs/dbraw/zinc/09/06/33/1018090633.db2.gz RBWYVMAPJKTSIY-SJPCQFCGSA-N 2 1 331.460 3.775 20 5 EHBDMP C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399509 1018581976 /nfs/dbraw/zinc/58/19/76/1018581976.db2.gz JGULALVSRFBCNA-KDOFPFPSSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399509 1018581987 /nfs/dbraw/zinc/58/19/87/1018581987.db2.gz JGULALVSRFBCNA-KDOFPFPSSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399509 1018581996 /nfs/dbraw/zinc/58/19/96/1018581996.db2.gz JGULALVSRFBCNA-KDOFPFPSSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399509 1018582000 /nfs/dbraw/zinc/58/20/00/1018582000.db2.gz JGULALVSRFBCNA-KDOFPFPSSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399509 1018582011 /nfs/dbraw/zinc/58/20/11/1018582011.db2.gz JGULALVSRFBCNA-KDOFPFPSSA-N 2 1 343.427 3.627 20 5 EHBDMP C[C@H]1C[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414942855 1022928443 /nfs/dbraw/zinc/92/84/43/1022928443.db2.gz NCOKEUMGQYQKJU-MEDUHNTESA-N 2 1 349.818 3.596 20 5 EHBDMP C[C@@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372447 1024857548 /nfs/dbraw/zinc/85/75/48/1024857548.db2.gz RHEHSJHGXYMHCN-NEPJUHHUSA-N 2 1 349.818 3.677 20 5 EHBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596059045 1034063980 /nfs/dbraw/zinc/06/39/80/1034063980.db2.gz MCWNNXXUFRHRLP-OUQXZNHLSA-N 2 1 343.471 3.710 20 5 EHBDMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095278 1034079963 /nfs/dbraw/zinc/07/99/63/1034079963.db2.gz OOSGJCXCQWEPIK-APWZRJJASA-N 2 1 331.460 3.758 20 5 EHBDMP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000125499520 1129696612 /nfs/dbraw/zinc/69/66/12/1129696612.db2.gz QRDCCLOQDHXOBP-CQSZACIVSA-N 2 1 345.468 3.707 20 5 EHBDMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000125499520 1129696615 /nfs/dbraw/zinc/69/66/15/1129696615.db2.gz QRDCCLOQDHXOBP-CQSZACIVSA-N 2 1 345.468 3.707 20 5 EHBDMP CC(C)[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909654 1131917099 /nfs/dbraw/zinc/91/70/99/1131917099.db2.gz UTFRZSUOMSHIGI-ZTNFWEORSA-N 2 1 345.487 3.551 20 5 EHBDMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001177541961 1133079367 /nfs/dbraw/zinc/07/93/67/1133079367.db2.gz GYRNHKJGWYSPAE-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001177541961 1133079371 /nfs/dbraw/zinc/07/93/71/1133079371.db2.gz GYRNHKJGWYSPAE-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC001199329620 1135898237 /nfs/dbraw/zinc/89/82/37/1135898237.db2.gz XFHLEPUDEJFXGD-GJZGRUSLSA-N 2 1 333.476 3.669 20 5 EHBDMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000859995732 1137040051 /nfs/dbraw/zinc/04/00/51/1137040051.db2.gz VZEHMIIAOWGKKZ-UHFFFAOYSA-N 2 1 345.418 3.818 20 5 EHBDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000859995732 1137040052 /nfs/dbraw/zinc/04/00/52/1137040052.db2.gz VZEHMIIAOWGKKZ-UHFFFAOYSA-N 2 1 345.418 3.818 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000271025749 1141296635 /nfs/dbraw/zinc/29/66/35/1141296635.db2.gz BCQKHZXNUIZQRZ-AWEZNQCLSA-N 2 1 347.459 3.661 20 5 EHBDMP CC1([NH3+])CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000592431571 1032836390 /nfs/dbraw/zinc/83/63/90/1032836390.db2.gz KBZCDDHKAHPCPT-UHFFFAOYSA-N 2 1 349.818 3.821 20 5 EHBDMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000442925060 1025602578 /nfs/dbraw/zinc/60/25/78/1025602578.db2.gz TXUDZVHWARJFPT-CQSZACIVSA-N 2 1 345.468 3.884 20 5 EHBDMP CC(C)C[NH+]1CCC([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192646153 1030924857 /nfs/dbraw/zinc/92/48/57/1030924857.db2.gz PAEWCZCBCGLIEM-LJQANCHMSA-N 2 1 331.460 3.682 20 5 EHBDMP O=[N+]([O-])c1ccccc1/C=C\CNC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000598992028 1033645285 /nfs/dbraw/zinc/64/52/85/1033645285.db2.gz JQPCZTQHQCRJDA-XOWYPZSQSA-N 2 1 329.444 3.605 20 5 EHBDMP O=[N+]([O-])c1ccccc1/C=C\CNC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000598992028 1033645292 /nfs/dbraw/zinc/64/52/92/1033645292.db2.gz JQPCZTQHQCRJDA-XOWYPZSQSA-N 2 1 329.444 3.605 20 5 EHBDMP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000596655693 1034330749 /nfs/dbraw/zinc/33/07/49/1034330749.db2.gz XFFNHLNLTDIJGW-MOPGFXCFSA-N 2 1 327.428 3.647 20 5 EHBDMP CC[NH+](CC)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000542933084 1128866306 /nfs/dbraw/zinc/86/63/06/1128866306.db2.gz IRYBXCZDJFDYHU-UHFFFAOYSA-N 2 1 339.867 3.802 20 5 EHBDMP C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272380207 1121597837 /nfs/dbraw/zinc/59/78/37/1121597837.db2.gz BRNLJXUGSOIIOA-QFBILLFUSA-N 2 1 339.439 3.595 20 5 EHBDMP C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272380207 1121597840 /nfs/dbraw/zinc/59/78/40/1121597840.db2.gz BRNLJXUGSOIIOA-QFBILLFUSA-N 2 1 339.439 3.595 20 5 EHBDMP CC[N@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444202 1130208513 /nfs/dbraw/zinc/20/85/13/1130208513.db2.gz XUPBLFHDHOYJRW-YJBOKZPZSA-N 2 1 349.475 3.544 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000872030723 1137566315 /nfs/dbraw/zinc/56/63/15/1137566315.db2.gz BCSVSEVUDWRDDI-CHWSQXEVSA-N 2 1 348.472 3.809 20 5 EHBDMP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000449082279 1032174120 /nfs/dbraw/zinc/17/41/20/1032174120.db2.gz MDCYZVZSRODXPK-SJORKVTESA-N 2 1 333.476 3.628 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000459777274 1032463546 /nfs/dbraw/zinc/46/35/46/1032463546.db2.gz KLXAHJAXQUUYRQ-LMMKCTJWSA-N 2 1 345.487 3.628 20 5 EHBDMP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000052210054 1018869650 /nfs/dbraw/zinc/86/96/50/1018869650.db2.gz XEGOKKMQJRUAIK-UHFFFAOYSA-N 2 1 337.439 3.678 20 5 EHBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000052210054 1018869670 /nfs/dbraw/zinc/86/96/70/1018869670.db2.gz XEGOKKMQJRUAIK-UHFFFAOYSA-N 2 1 337.439 3.678 20 5 EHBDMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471011 1023232569 /nfs/dbraw/zinc/23/25/69/1023232569.db2.gz OVPOHBGFOKIVKP-IEBWSBKVSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471011 1023232575 /nfs/dbraw/zinc/23/25/75/1023232575.db2.gz OVPOHBGFOKIVKP-IEBWSBKVSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471011 1023232586 /nfs/dbraw/zinc/23/25/86/1023232586.db2.gz OVPOHBGFOKIVKP-IEBWSBKVSA-N 2 1 345.487 3.724 20 5 EHBDMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471011 1023232595 /nfs/dbraw/zinc/23/25/95/1023232595.db2.gz OVPOHBGFOKIVKP-IEBWSBKVSA-N 2 1 345.487 3.724 20 5 EHBDMP C[NH2+]C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000435368669 1024851217 /nfs/dbraw/zinc/85/12/17/1024851217.db2.gz BHNWPZLUIXRPRZ-UHFFFAOYSA-N 2 1 331.441 3.507 20 5 EHBDMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414656207 1027719678 /nfs/dbraw/zinc/71/96/78/1027719678.db2.gz HZWKOUGIYNJYFY-DZGCQCFKSA-N 2 1 345.468 3.883 20 5 EHBDMP CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000609029870 1033985018 /nfs/dbraw/zinc/98/50/18/1033985018.db2.gz YLOKYRFEMCITRI-UHFFFAOYSA-N 2 1 341.455 3.721 20 5 EHBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596059041 1034064251 /nfs/dbraw/zinc/06/42/51/1034064251.db2.gz MCWNNXXUFRHRLP-LZOLKVDOSA-N 2 1 343.471 3.710 20 5 EHBDMP CC(C)c1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000604532697 1034414017 /nfs/dbraw/zinc/41/40/17/1034414017.db2.gz TVZUESLAVQTIBP-UHFFFAOYSA-N 2 1 331.460 3.825 20 5 EHBDMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909651 1131917061 /nfs/dbraw/zinc/91/70/61/1131917061.db2.gz UTFRZSUOMSHIGI-BPAFIMBUSA-N 2 1 345.487 3.551 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001173219314 1132003471 /nfs/dbraw/zinc/00/34/71/1132003471.db2.gz ATMIYKWVIVZBGE-NVXWUHKLSA-N 2 1 331.460 3.522 20 5 EHBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001173219314 1132003474 /nfs/dbraw/zinc/00/34/74/1132003474.db2.gz ATMIYKWVIVZBGE-NVXWUHKLSA-N 2 1 331.460 3.522 20 5 EHBDMP CC(C)C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173229660 1132008045 /nfs/dbraw/zinc/00/80/45/1132008045.db2.gz OQYWHVVXZLBYCP-SZMVWBNQSA-N 2 1 333.476 3.754 20 5 EHBDMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788538977 1134139463 /nfs/dbraw/zinc/13/94/63/1134139463.db2.gz JAJIHOQDKYHSLF-XHSDSOJGSA-N 2 1 348.491 3.586 20 5 EHBDMP C[N@@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000340279958 1016849145 /nfs/dbraw/zinc/84/91/45/1016849145.db2.gz RQJIRDKWDPAXNH-PKOBYXMFSA-N 2 1 325.412 3.520 20 5 EHBDMP C[N@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000340279958 1016849153 /nfs/dbraw/zinc/84/91/53/1016849153.db2.gz RQJIRDKWDPAXNH-PKOBYXMFSA-N 2 1 325.412 3.520 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000182811010 1019753408 /nfs/dbraw/zinc/75/34/08/1019753408.db2.gz WOMHUDFMWBGYAS-IAGOWNOFSA-N 2 1 331.460 3.772 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000182811010 1019753423 /nfs/dbraw/zinc/75/34/23/1019753423.db2.gz WOMHUDFMWBGYAS-IAGOWNOFSA-N 2 1 331.460 3.772 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]4[NH2+]CC[C@H]4C3)s2)cc1 ZINC000427128685 1023237253 /nfs/dbraw/zinc/23/72/53/1023237253.db2.gz OQJAOUIRYFJEKE-WMLDXEAASA-N 2 1 343.452 3.507 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]4[NH2+]CC[C@H]4C3)s2)cc1 ZINC000427128685 1023237259 /nfs/dbraw/zinc/23/72/59/1023237259.db2.gz OQJAOUIRYFJEKE-WMLDXEAASA-N 2 1 343.452 3.507 20 5 EHBDMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548411 1026099650 /nfs/dbraw/zinc/09/96/50/1026099650.db2.gz MXZTZBHSYLMIPB-ROUUACIJSA-N 2 1 331.460 3.649 20 5 EHBDMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548411 1026099663 /nfs/dbraw/zinc/09/96/63/1026099663.db2.gz MXZTZBHSYLMIPB-ROUUACIJSA-N 2 1 331.460 3.649 20 5 EHBDMP C[NH+]1CCCC[C@H]1CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548411 1026099678 /nfs/dbraw/zinc/09/96/78/1026099678.db2.gz MXZTZBHSYLMIPB-ROUUACIJSA-N 2 1 331.460 3.649 20 5 EHBDMP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000513784976 1027706376 /nfs/dbraw/zinc/70/63/76/1027706376.db2.gz COOFMJXOOVPDLL-BOLBYERCSA-N 2 1 343.471 3.522 20 5 EHBDMP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000513784976 1027706392 /nfs/dbraw/zinc/70/63/92/1027706392.db2.gz COOFMJXOOVPDLL-BOLBYERCSA-N 2 1 343.471 3.522 20 5 EHBDMP c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@H]1C[N@@H+]2CCC[C@H]2CO1 ZINC000729684798 1028553624 /nfs/dbraw/zinc/55/36/24/1028553624.db2.gz WWXALVNUZANNJU-PMACEKPBSA-N 2 1 346.474 3.946 20 5 EHBDMP c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000729684798 1028553640 /nfs/dbraw/zinc/55/36/40/1028553640.db2.gz WWXALVNUZANNJU-PMACEKPBSA-N 2 1 346.474 3.946 20 5 EHBDMP CC(C)[NH+](CCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C(C)C ZINC000761524470 1037108983 /nfs/dbraw/zinc/10/89/83/1037108983.db2.gz DMZPUYCZZMJNCU-UHFFFAOYSA-N 2 1 327.856 3.847 20 5 EHBDMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417311964 1039666958 /nfs/dbraw/zinc/66/69/58/1039666958.db2.gz MUSOAMLXGLQJOV-IBGZPJMESA-N 2 1 342.443 3.937 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000490037577 1040301228 /nfs/dbraw/zinc/30/12/28/1040301228.db2.gz IBUOPEXCVKJFDK-WBVHZDCISA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000490037577 1040301237 /nfs/dbraw/zinc/30/12/37/1040301237.db2.gz IBUOPEXCVKJFDK-WBVHZDCISA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000490037577 1040301247 /nfs/dbraw/zinc/30/12/47/1040301247.db2.gz IBUOPEXCVKJFDK-WBVHZDCISA-N 2 1 331.460 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000490037577 1040301259 /nfs/dbraw/zinc/30/12/59/1040301259.db2.gz IBUOPEXCVKJFDK-WBVHZDCISA-N 2 1 331.460 3.628 20 5 EHBDMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000125742899 1129713419 /nfs/dbraw/zinc/71/34/19/1129713419.db2.gz GOCYNTSAKDXIKP-LPHOPBHVSA-N 2 1 345.487 3.626 20 5 EHBDMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414656209 1017107328 /nfs/dbraw/zinc/10/73/28/1017107328.db2.gz HZWKOUGIYNJYFY-UKRRQHHQSA-N 2 1 345.468 3.883 20 5 EHBDMP C[C@H]1C[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371217 1024856924 /nfs/dbraw/zinc/85/69/24/1024856924.db2.gz LYFSNRFNLKWPGL-RYUDHWBXSA-N 2 1 349.818 3.677 20 5 EHBDMP C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000347083657 1025503785 /nfs/dbraw/zinc/50/37/85/1025503785.db2.gz ZOZUBIPTCDCMNV-FKEKPDDDSA-N 2 1 341.411 3.570 20 5 EHBDMP C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000347083657 1025503790 /nfs/dbraw/zinc/50/37/90/1025503790.db2.gz ZOZUBIPTCDCMNV-FKEKPDDDSA-N 2 1 341.411 3.570 20 5 EHBDMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093692 1034079302 /nfs/dbraw/zinc/07/93/02/1034079302.db2.gz DPIRGJCUGCTNFT-DOTOQJQBSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093692 1034079319 /nfs/dbraw/zinc/07/93/19/1034079319.db2.gz DPIRGJCUGCTNFT-DOTOQJQBSA-N 2 1 331.460 3.676 20 5 EHBDMP CC1(C)C[C@@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000591582564 1037517765 /nfs/dbraw/zinc/51/77/65/1037517765.db2.gz LPNOQXBNVUQZRM-CXAGYDPISA-N 2 1 329.444 3.582 20 5 EHBDMP CC[N@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000470180257 1038582633 /nfs/dbraw/zinc/58/26/33/1038582633.db2.gz LCIHWSIQINPIEG-RZQYTQJMSA-N 2 1 331.460 3.660 20 5 EHBDMP CC[NH+]1CC[C@H]([N@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000470180257 1038582635 /nfs/dbraw/zinc/58/26/35/1038582635.db2.gz LCIHWSIQINPIEG-RZQYTQJMSA-N 2 1 331.460 3.660 20 5 EHBDMP CC[NH+]1CC[C@H]([N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000470180257 1038582638 /nfs/dbraw/zinc/58/26/38/1038582638.db2.gz LCIHWSIQINPIEG-RZQYTQJMSA-N 2 1 331.460 3.660 20 5 EHBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CCCC2 ZINC000417323084 1039680222 /nfs/dbraw/zinc/68/02/22/1039680222.db2.gz NXGJLNSJBJVNBL-FQEVSTJZSA-N 2 1 343.471 3.826 20 5 EHBDMP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000893329596 1040440914 /nfs/dbraw/zinc/44/09/14/1040440914.db2.gz FLIRTVFJNRJNMQ-UHFFFAOYSA-N 2 1 333.819 3.600 20 5 EHBDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173347 1040992274 /nfs/dbraw/zinc/99/22/74/1040992274.db2.gz GHBAZFJDXQENIC-KBXCAEBGSA-N 2 1 331.460 3.639 20 5 EHBDMP CCC[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421087 1043157959 /nfs/dbraw/zinc/15/79/59/1043157959.db2.gz FSRYGANXJJIWEW-LPHOPBHVSA-N 2 1 349.475 3.527 20 5 EHBDMP CCC[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421087 1043157964 /nfs/dbraw/zinc/15/79/64/1043157964.db2.gz FSRYGANXJJIWEW-LPHOPBHVSA-N 2 1 349.475 3.527 20 5 EHBDMP Cc1ccc([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1[N+](=O)[O-] ZINC000820822239 1137005825 /nfs/dbraw/zinc/00/58/25/1137005825.db2.gz IKQVZAQEQWCJJD-ZVRJUHEZSA-N 2 1 329.444 3.712 20 5 EHBDMP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)cc1[N+](=O)[O-] ZINC000820822239 1137005826 /nfs/dbraw/zinc/00/58/26/1137005826.db2.gz IKQVZAQEQWCJJD-ZVRJUHEZSA-N 2 1 329.444 3.712 20 5 EHBDMP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1[N+](=O)[O-] ZINC000820822239 1137005827 /nfs/dbraw/zinc/00/58/27/1137005827.db2.gz IKQVZAQEQWCJJD-ZVRJUHEZSA-N 2 1 329.444 3.712 20 5 EHBDMP C[NH+](C)CCCC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000123175654 1137497127 /nfs/dbraw/zinc/49/71/27/1137497127.db2.gz WBWUZAQLEYETGS-UHFFFAOYSA-N 2 1 339.867 3.802 20 5 EHBDMP CC(C)c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057906 1017469344 /nfs/dbraw/zinc/46/93/44/1017469344.db2.gz VFAHMMGSIDBCSU-SJLPKXTDSA-N 2 1 331.460 3.682 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057906 1017469349 /nfs/dbraw/zinc/46/93/49/1017469349.db2.gz VFAHMMGSIDBCSU-SJLPKXTDSA-N 2 1 331.460 3.682 20 5 EHBDMP C[C@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000261918146 1019716745 /nfs/dbraw/zinc/71/67/45/1019716745.db2.gz YIXNMTQWACCGRF-QGZVFWFLSA-N 2 1 349.818 3.679 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)s1 ZINC000427105296 1023217982 /nfs/dbraw/zinc/21/79/82/1023217982.db2.gz XHNPQKXHRIYAGJ-BBRMVZONSA-N 2 1 343.452 3.507 20 5 EHBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)s1 ZINC000427105296 1023217991 /nfs/dbraw/zinc/21/79/91/1023217991.db2.gz XHNPQKXHRIYAGJ-BBRMVZONSA-N 2 1 343.452 3.507 20 5 EHBDMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000475335968 1026490740 /nfs/dbraw/zinc/49/07/40/1026490740.db2.gz NNDGMKYYZYGJOB-SOLBZPMBSA-N 2 1 333.476 3.626 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC4(CC[NH2+]4)CC3)s2)cc1 ZINC000422565712 1027791674 /nfs/dbraw/zinc/79/16/74/1027791674.db2.gz ZTPWEJFJJNDLFO-UHFFFAOYSA-N 2 1 343.452 3.651 20 5 EHBDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587024 1030321326 /nfs/dbraw/zinc/32/13/26/1030321326.db2.gz PWWBJURSHFAEKY-OXQOHEQNSA-N 2 1 345.487 3.930 20 5 EHBDMP C[N@@H+]1CC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000550704416 1033893473 /nfs/dbraw/zinc/89/34/73/1033893473.db2.gz XKSPOEQZIJADTE-AZUAARDMSA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000550704416 1033893491 /nfs/dbraw/zinc/89/34/91/1033893491.db2.gz XKSPOEQZIJADTE-AZUAARDMSA-N 2 1 339.439 3.562 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]CCC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000179394455 1034278011 /nfs/dbraw/zinc/27/80/11/1034278011.db2.gz YEFFQSSWOCYCOE-HNNXBMFYSA-N 2 1 335.448 3.520 20 5 EHBDMP CC(C)[C@H]([NH3+])CC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000596655694 1034330146 /nfs/dbraw/zinc/33/01/46/1034330146.db2.gz XFFNHLNLTDIJGW-RTBURBONSA-N 2 1 327.428 3.647 20 5 EHBDMP CC(C)[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCCC1 ZINC000480535609 1039652933 /nfs/dbraw/zinc/65/29/33/1039652933.db2.gz KWTUTTHXVYZFLU-UYAOXDASSA-N 2 1 345.487 3.626 20 5 EHBDMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172902929 1131885433 /nfs/dbraw/zinc/88/54/33/1131885433.db2.gz CQTBOVIMYYTDCZ-FHWLQOOXSA-N 2 1 345.487 3.823 20 5 EHBDMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001199843916 1135931866 /nfs/dbraw/zinc/93/18/66/1135931866.db2.gz SJBVADALIZUJQA-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001199843916 1135931867 /nfs/dbraw/zinc/93/18/67/1135931867.db2.gz SJBVADALIZUJQA-HNNXBMFYSA-N 2 1 343.427 3.676 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCCC[N@@H+](C)C1 ZINC000872088543 1137570615 /nfs/dbraw/zinc/57/06/15/1137570615.db2.gz RSJLEVUPXPQVSF-UONOGXRCSA-N 2 1 337.489 3.699 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000872088543 1137570616 /nfs/dbraw/zinc/57/06/16/1137570616.db2.gz RSJLEVUPXPQVSF-UONOGXRCSA-N 2 1 337.489 3.699 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000872088543 1137570617 /nfs/dbraw/zinc/57/06/17/1137570617.db2.gz RSJLEVUPXPQVSF-UONOGXRCSA-N 2 1 337.489 3.699 20 5 EHBDMP C[C@H]1C[C@@H](N(C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000093644282 1138239184 /nfs/dbraw/zinc/23/91/84/1138239184.db2.gz QVJALBYKUFALHM-GJZGRUSLSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000093644282 1138239185 /nfs/dbraw/zinc/23/91/85/1138239185.db2.gz QVJALBYKUFALHM-GJZGRUSLSA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000093644282 1138239188 /nfs/dbraw/zinc/23/91/88/1138239188.db2.gz QVJALBYKUFALHM-GJZGRUSLSA-N 2 1 343.427 3.769 20 5 EHBDMP O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000078726435 217108840 /nfs/dbraw/zinc/10/88/40/217108840.db2.gz BXRSZSNPJVLACZ-IBGZPJMESA-N 2 1 345.487 3.725 20 5 EHBDMP O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000078726435 217108842 /nfs/dbraw/zinc/10/88/42/217108842.db2.gz BXRSZSNPJVLACZ-IBGZPJMESA-N 2 1 345.487 3.725 20 5 EHBDMP CC(C)c1ccc(C[N@@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057904 1017468576 /nfs/dbraw/zinc/46/85/76/1017468576.db2.gz VFAHMMGSIDBCSU-AEFFLSMTSA-N 2 1 331.460 3.682 20 5 EHBDMP CC(C)c1ccc(C[N@H+]2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057904 1017468582 /nfs/dbraw/zinc/46/85/82/1017468582.db2.gz VFAHMMGSIDBCSU-AEFFLSMTSA-N 2 1 331.460 3.682 20 5 EHBDMP CC[N@@H+](C)Cc1cccc(CNCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000892937987 1017795918 /nfs/dbraw/zinc/79/59/18/1017795918.db2.gz KLUBCIHGPFCXHH-UHFFFAOYSA-N 2 1 347.846 3.990 20 5 EHBDMP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000892937987 1017795932 /nfs/dbraw/zinc/79/59/32/1017795932.db2.gz KLUBCIHGPFCXHH-UHFFFAOYSA-N 2 1 347.846 3.990 20 5 EHBDMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000892937987 1017795947 /nfs/dbraw/zinc/79/59/47/1017795947.db2.gz KLUBCIHGPFCXHH-UHFFFAOYSA-N 2 1 347.846 3.990 20 5 EHBDMP CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1[NH3+] ZINC000592427637 1032816616 /nfs/dbraw/zinc/81/66/16/1032816616.db2.gz LTBKCWBPURVAGN-CXAGYDPISA-N 2 1 345.468 3.883 20 5 EHBDMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000108427925 1023121766 /nfs/dbraw/zinc/12/17/66/1023121766.db2.gz YTVVKTTXXKFSGH-CQSZACIVSA-N 2 1 345.468 3.755 20 5 EHBDMP C[C@@H]([NH2+][C@@H](CN)C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284199 1028322722 /nfs/dbraw/zinc/32/27/22/1028322722.db2.gz WPNATHNSKKNLCX-RISCZKNCSA-N 2 1 331.441 3.711 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C[NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284199 1028322740 /nfs/dbraw/zinc/32/27/40/1028322740.db2.gz WPNATHNSKKNLCX-RISCZKNCSA-N 2 1 331.441 3.711 20 5 EHBDMP CCOc1ccc([C@H](C)NCCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504894984 1029038922 /nfs/dbraw/zinc/03/89/22/1029038922.db2.gz PXPUHKBCKIBBHX-CVEARBPZSA-N 2 1 349.475 3.909 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504894984 1029038939 /nfs/dbraw/zinc/03/89/39/1029038939.db2.gz PXPUHKBCKIBBHX-CVEARBPZSA-N 2 1 349.475 3.909 20 5 EHBDMP CCOc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504894984 1029038953 /nfs/dbraw/zinc/03/89/53/1029038953.db2.gz PXPUHKBCKIBBHX-CVEARBPZSA-N 2 1 349.475 3.909 20 5 EHBDMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068693 1033709931 /nfs/dbraw/zinc/70/99/31/1033709931.db2.gz CJHMXCIVKJMZTQ-RDTXWAMCSA-N 2 1 331.460 3.639 20 5 EHBDMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000599071672 1033712239 /nfs/dbraw/zinc/71/22/39/1033712239.db2.gz SFHPGSYSQCZAHC-ZIFCJYIRSA-N 2 1 345.487 3.628 20 5 EHBDMP C[N@@H+]1CC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000550704419 1033894067 /nfs/dbraw/zinc/89/40/67/1033894067.db2.gz XKSPOEQZIJADTE-UYAOXDASSA-N 2 1 339.439 3.562 20 5 EHBDMP C[N@H+]1CC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000550704419 1033894085 /nfs/dbraw/zinc/89/40/85/1033894085.db2.gz XKSPOEQZIJADTE-UYAOXDASSA-N 2 1 339.439 3.562 20 5 EHBDMP CC1(C)C[C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000591582566 1037517214 /nfs/dbraw/zinc/51/72/14/1037517214.db2.gz LPNOQXBNVUQZRM-GUYCJALGSA-N 2 1 329.444 3.582 20 5 EHBDMP CC1(C)C[C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000591582565 1037518474 /nfs/dbraw/zinc/51/84/74/1037518474.db2.gz LPNOQXBNVUQZRM-DYVFJYSZSA-N 2 1 329.444 3.582 20 5 EHBDMP CCC[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421089 1043157703 /nfs/dbraw/zinc/15/77/03/1043157703.db2.gz FSRYGANXJJIWEW-VQIMIIECSA-N 2 1 349.475 3.527 20 5 EHBDMP CCC[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421089 1043157710 /nfs/dbraw/zinc/15/77/10/1043157710.db2.gz FSRYGANXJJIWEW-VQIMIIECSA-N 2 1 349.475 3.527 20 5 EHBDMP CC1(C)C[C@H](NC2CC[NH+](C3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279129143 1043404701 /nfs/dbraw/zinc/40/47/01/1043404701.db2.gz QWJWOJXXEZIRKJ-SFHVURJKSA-N 2 1 329.444 3.534 20 5 EHBDMP CC1(C)C[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279129143 1043404710 /nfs/dbraw/zinc/40/47/10/1043404710.db2.gz QWJWOJXXEZIRKJ-SFHVURJKSA-N 2 1 329.444 3.534 20 5 EHBDMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000272722560 1121961790 /nfs/dbraw/zinc/96/17/90/1121961790.db2.gz XSTVDMBNNZSCNK-JYJNAYRXSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000272722560 1121961797 /nfs/dbraw/zinc/96/17/97/1121961797.db2.gz XSTVDMBNNZSCNK-JYJNAYRXSA-N 2 1 331.460 3.898 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000245535393 1130233402 /nfs/dbraw/zinc/23/34/02/1130233402.db2.gz WOMHUDFMWBGYAS-SJORKVTESA-N 2 1 331.460 3.772 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000245535393 1130233407 /nfs/dbraw/zinc/23/34/07/1130233407.db2.gz WOMHUDFMWBGYAS-SJORKVTESA-N 2 1 331.460 3.772 20 5 EHBDMP Cc1ccccc1C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168998340 1132627595 /nfs/dbraw/zinc/62/75/95/1132627595.db2.gz LLZLHXKKHPKGFS-FRYIKTPZSA-N 2 1 345.487 3.512 20 5 EHBDMP CC[N@H+](CCC[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)C1CCCCC1 ZINC001179090447 1133227122 /nfs/dbraw/zinc/22/71/22/1133227122.db2.gz CZMZQTYERJGXLS-UHFFFAOYSA-N 2 1 349.475 3.738 20 5 EHBDMP CC[N@@H+](CCC[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)C1CCCCC1 ZINC001179090447 1133227128 /nfs/dbraw/zinc/22/71/28/1133227128.db2.gz CZMZQTYERJGXLS-UHFFFAOYSA-N 2 1 349.475 3.738 20 5 EHBDMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000102423214 1135551061 /nfs/dbraw/zinc/55/10/61/1135551061.db2.gz ROTMMRPKVDVILH-AWEZNQCLSA-N 2 1 345.468 3.755 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000089512951 1138200588 /nfs/dbraw/zinc/20/05/88/1138200588.db2.gz PMPLXRSARCXMEJ-CQSZACIVSA-N 2 1 349.475 3.907 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186653 1140019350 /nfs/dbraw/zinc/01/93/50/1140019350.db2.gz BPFDIQXJBPXMOY-HLLBOEOZSA-N 2 1 331.460 3.898 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186653 1140019356 /nfs/dbraw/zinc/01/93/56/1140019356.db2.gz BPFDIQXJBPXMOY-HLLBOEOZSA-N 2 1 331.460 3.898 20 5 EHBDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449131926 1032227179 /nfs/dbraw/zinc/22/71/79/1032227179.db2.gz QJQXSFDJTICKHQ-MRXNPFEDSA-N 2 1 341.455 3.767 20 5 EHBDMP C[NH2+]CCC[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414863697 1017253860 /nfs/dbraw/zinc/25/38/60/1017253860.db2.gz YENBJZFIZLXQBF-UHFFFAOYSA-N 2 1 349.818 3.740 20 5 EHBDMP C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248392858 1023011818 /nfs/dbraw/zinc/01/18/18/1023011818.db2.gz DKNFGLYDYGIMST-UXLLHSPISA-N 2 1 331.460 3.898 20 5 EHBDMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000108427959 1023128366 /nfs/dbraw/zinc/12/83/66/1023128366.db2.gz NITYVFKZEREGIY-CQSZACIVSA-N 2 1 345.468 3.755 20 5 EHBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000572887069 1028196400 /nfs/dbraw/zinc/19/64/00/1028196400.db2.gz JIYGWDOIXGOULX-KVVHSQDJSA-N 2 1 343.471 3.662 20 5 EHBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)o2)cc1 ZINC000591282640 1037318923 /nfs/dbraw/zinc/31/89/23/1037318923.db2.gz ITXFLOFHSNEOMK-OAHLLOKOSA-N 2 1 341.411 3.619 20 5 EHBDMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136462 1123167580 /nfs/dbraw/zinc/16/75/80/1123167580.db2.gz IWCAWLSRKOURNS-AEFFLSMTSA-N 2 1 339.439 3.768 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001198818840 1135859663 /nfs/dbraw/zinc/85/96/63/1135859663.db2.gz BRJRALKJMCHOJR-AHRSYUTCSA-N 2 1 343.471 3.772 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001198818840 1135859666 /nfs/dbraw/zinc/85/96/66/1135859666.db2.gz BRJRALKJMCHOJR-AHRSYUTCSA-N 2 1 343.471 3.772 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1C[C@@]23C[N@H+](C)C[C@]2(C1)CCCC3 ZINC001198818840 1135859669 /nfs/dbraw/zinc/85/96/69/1135859669.db2.gz BRJRALKJMCHOJR-AHRSYUTCSA-N 2 1 343.471 3.772 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1C[C@@]23C[N@@H+](C)C[C@]2(C1)CCCC3 ZINC001198818840 1135859670 /nfs/dbraw/zinc/85/96/70/1135859670.db2.gz BRJRALKJMCHOJR-AHRSYUTCSA-N 2 1 343.471 3.772 20 5 EHBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1 ZINC000809738913 1135883356 /nfs/dbraw/zinc/88/33/56/1135883356.db2.gz OZLUJPPHCXZDCP-VURMDHGXSA-N 2 1 339.439 3.802 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCn1cc[nH+]c1C ZINC000872025334 1137565656 /nfs/dbraw/zinc/56/56/56/1137565656.db2.gz KXUKAGHNBLVWLC-LBPRGKRZSA-N 2 1 334.445 3.563 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCCC[N@@H+](C)C1 ZINC000872088538 1137570596 /nfs/dbraw/zinc/57/05/96/1137570596.db2.gz RSJLEVUPXPQVSF-KBPBESRZSA-N 2 1 337.489 3.699 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000872088538 1137570597 /nfs/dbraw/zinc/57/05/97/1137570597.db2.gz RSJLEVUPXPQVSF-KBPBESRZSA-N 2 1 337.489 3.699 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000872088538 1137570598 /nfs/dbraw/zinc/57/05/98/1137570598.db2.gz RSJLEVUPXPQVSF-KBPBESRZSA-N 2 1 337.489 3.699 20 5 EHBDMP Cc1[nH]c(C2CC[NH+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)[nH+]c1C ZINC000886670042 1138112097 /nfs/dbraw/zinc/11/20/97/1138112097.db2.gz ILRUNIMYYMBUCQ-AWEZNQCLSA-N 2 1 328.416 3.875 20 5 EHBDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000123979700 1138277000 /nfs/dbraw/zinc/27/70/00/1138277000.db2.gz JRJYIFSDXJODIH-HNNXBMFYSA-N 2 1 327.428 3.897 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000180403445 1139832215 /nfs/dbraw/zinc/83/22/15/1139832215.db2.gz WLVXRACUKDAIRG-CQSZACIVSA-N 2 1 335.448 3.517 20 5 EHBDMP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000449082276 1032174095 /nfs/dbraw/zinc/17/40/95/1032174095.db2.gz MDCYZVZSRODXPK-DLBZAZTESA-N 2 1 333.476 3.628 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592491869 1032927091 /nfs/dbraw/zinc/92/70/91/1032927091.db2.gz MQIAAEHXGPLPSC-ULQDDVLXSA-N 2 1 331.460 3.676 20 5 EHBDMP C[C@H]1C[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371216 1024856791 /nfs/dbraw/zinc/85/67/91/1024856791.db2.gz LYFSNRFNLKWPGL-NWDGAFQWSA-N 2 1 349.818 3.677 20 5 EHBDMP C[N@H+](CCC[NH3+])Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000521875203 1025753153 /nfs/dbraw/zinc/75/31/53/1025753153.db2.gz UKHKUVWUECJQOM-UHFFFAOYSA-N 2 1 349.818 3.821 20 5 EHBDMP C[N@@H+](CCC[NH3+])Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000521875203 1025753170 /nfs/dbraw/zinc/75/31/70/1025753170.db2.gz UKHKUVWUECJQOM-UHFFFAOYSA-N 2 1 349.818 3.821 20 5 EHBDMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479918887 1026890980 /nfs/dbraw/zinc/89/09/80/1026890980.db2.gz WICPTAHVWFSSIU-QFBILLFUSA-N 2 1 345.487 3.770 20 5 EHBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000504927452 1029073120 /nfs/dbraw/zinc/07/31/20/1029073120.db2.gz PAQMFSIPRGYPME-HZPDHXFCSA-N 2 1 349.475 3.766 20 5 EHBDMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000160481673 1030787195 /nfs/dbraw/zinc/78/71/95/1030787195.db2.gz IRSXAKWDBWUFPS-HNNXBMFYSA-N 2 1 331.460 3.961 20 5 EHBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595900212 1034026667 /nfs/dbraw/zinc/02/66/67/1034026667.db2.gz BERHXONURATMNX-NVXWUHKLSA-N 2 1 331.460 3.676 20 5 EHBDMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417302857 1039646144 /nfs/dbraw/zinc/64/61/44/1039646144.db2.gz BYUSKSAVSDSADJ-GOSISDBHSA-N 2 1 328.416 3.547 20 5 EHBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417358003 1039718439 /nfs/dbraw/zinc/71/84/39/1039718439.db2.gz HIUQUHHQQKWJLM-DNVCBOLYSA-N 2 1 331.460 3.684 20 5 EHBDMP C[C@@H](C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000433150153 1040927195 /nfs/dbraw/zinc/92/71/95/1040927195.db2.gz VRRFTATWRBMZSS-KSSFIOAISA-N 2 1 331.460 3.639 20 5 EHBDMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131957 1123165575 /nfs/dbraw/zinc/16/55/75/1123165575.db2.gz BTHPXNWILXEPAA-FUHWJXTLSA-N 2 1 339.439 3.768 20 5 EHBDMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990960 1129185896 /nfs/dbraw/zinc/18/58/96/1129185896.db2.gz HEUIXBDWCXXSOL-LZLYRXPVSA-N 2 1 333.476 3.624 20 5 EHBDMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990960 1129185900 /nfs/dbraw/zinc/18/59/00/1129185900.db2.gz HEUIXBDWCXXSOL-LZLYRXPVSA-N 2 1 333.476 3.624 20 5 EHBDMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768209610 1133107922 /nfs/dbraw/zinc/10/79/22/1133107922.db2.gz SFNKWSYRDFLPRO-OAHLLOKOSA-N 2 1 327.428 3.849 20 5 EHBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC001199344081 1135896625 /nfs/dbraw/zinc/89/66/25/1135896625.db2.gz DPJWDNSWIJRBKQ-OAHLLOKOSA-N 2 1 333.476 3.813 20 5 EHBDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000859997056 1137039967 /nfs/dbraw/zinc/03/99/67/1137039967.db2.gz NGODIDJKZXHLHE-UHFFFAOYSA-N 2 1 345.418 3.818 20 5 EHBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000872079460 1137570213 /nfs/dbraw/zinc/57/02/13/1137570213.db2.gz MYLGMJGGZDZBCE-UONOGXRCSA-N 2 1 337.489 3.699 20 5 EHBDMP C[C@@H]1C[C@@H](N(C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000093644281 1138238890 /nfs/dbraw/zinc/23/88/90/1138238890.db2.gz QVJALBYKUFALHM-CABCVRRESA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000093644281 1138238893 /nfs/dbraw/zinc/23/88/93/1138238893.db2.gz QVJALBYKUFALHM-CABCVRRESA-N 2 1 343.427 3.769 20 5 EHBDMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000093644281 1138238894 /nfs/dbraw/zinc/23/88/94/1138238894.db2.gz QVJALBYKUFALHM-CABCVRRESA-N 2 1 343.427 3.769 20 5 EHBDMP