smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=[N+]([O-])c1ccc(Nc2ccc3c(c2)[nH+]c2n3CCCCC2)nc1 ZINC000023611809 1013559920 /nfs/dbraw/zinc/55/99/20/1013559920.db2.gz NXEXLLQJMSOAMM-UHFFFAOYSA-N 1 1 323.356 3.810 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccncc3)C2)c(Cl)c1 ZINC000519641797 1013585237 /nfs/dbraw/zinc/58/52/37/1013585237.db2.gz GSFIRTKHVPSDEN-CYBMUJFWSA-N 1 1 317.776 3.633 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000079723781 1013904238 /nfs/dbraw/zinc/90/42/38/1013904238.db2.gz LSGHVPUMHZAVME-RYUDHWBXSA-N 1 1 315.329 3.915 20 5 DHBDMO C[N@@H+](CCNc1ccc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000064916254 1014045389 /nfs/dbraw/zinc/04/53/89/1014045389.db2.gz JNVUHARMAQBHAZ-UHFFFAOYSA-N 1 1 319.792 3.792 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000441464281 1014168024 /nfs/dbraw/zinc/16/80/24/1014168024.db2.gz AIVCFAACSYKGRX-JKIFEVAISA-N 1 1 304.390 3.627 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1C[C@@H]1c1ccccc1 ZINC000580602332 1014246339 /nfs/dbraw/zinc/24/63/39/1014246339.db2.gz FZBXVNDDHYIXQW-QZTJIDSGSA-N 1 1 310.397 3.873 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@]1(C)CCCO ZINC000579764991 1014271626 /nfs/dbraw/zinc/27/16/26/1014271626.db2.gz QWXJGHAWAIUZNI-WTQUMQLASA-N 1 1 318.417 3.625 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000320030439 1014376877 /nfs/dbraw/zinc/37/68/77/1014376877.db2.gz JNRYDSWFPIODPT-BZSNNMDCSA-N 1 1 317.433 3.652 20 5 DHBDMO CCC[C@H]([NH2+][C@H]1CCN2CCCC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000320030439 1014376887 /nfs/dbraw/zinc/37/68/87/1014376887.db2.gz JNRYDSWFPIODPT-BZSNNMDCSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C2CCOCC2)C1 ZINC000933082459 1014540196 /nfs/dbraw/zinc/54/01/96/1014540196.db2.gz NECRDNXVKPCBGH-YOEHRIQHSA-N 1 1 318.417 3.794 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCC[C@H]2C)c1F ZINC001173187082 1033584352 /nfs/dbraw/zinc/58/43/52/1033584352.db2.gz WMFSSOCOHGGEHH-VXGBXAGGSA-N 1 1 310.369 3.548 20 5 DHBDMO C[NH+](C)[C@@H](CNc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000025346711 1015227623 /nfs/dbraw/zinc/22/76/23/1015227623.db2.gz ZNKVHQQIHBXWCR-INIZCTEOSA-N 1 1 319.792 3.963 20 5 DHBDMO Cc1ccc([C@@H](C)NCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000610799332 1015845063 /nfs/dbraw/zinc/84/50/63/1015845063.db2.gz SICKPKWTOCKBQG-IJEWVQPXSA-N 1 1 319.449 3.532 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]CCN2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000610799332 1015845069 /nfs/dbraw/zinc/84/50/69/1015845069.db2.gz SICKPKWTOCKBQG-IJEWVQPXSA-N 1 1 319.449 3.532 20 5 DHBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000119446449 1016073158 /nfs/dbraw/zinc/07/31/58/1016073158.db2.gz GVEGDLSVQJQWTB-LBPRGKRZSA-N 1 1 318.348 3.503 20 5 DHBDMO COc1ccc(-c2ccc(C[N@H+]3CCC3(C)C)o2)c([N+](=O)[O-])c1 ZINC000538735724 1016163783 /nfs/dbraw/zinc/16/37/83/1016163783.db2.gz XNENFWSHACGWLN-UHFFFAOYSA-N 1 1 316.357 3.848 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000051532246 1016517937 /nfs/dbraw/zinc/51/79/37/1016517937.db2.gz SDCWSHOSPMJBDU-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000072555483 1016557050 /nfs/dbraw/zinc/55/70/50/1016557050.db2.gz SMWPJVPAWCDUHX-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO CCCC[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000158149106 1016651522 /nfs/dbraw/zinc/65/15/22/1016651522.db2.gz REAYOXXPANAIQY-UHFFFAOYSA-N 1 1 305.403 3.950 20 5 DHBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](CC)c1ccccc1 ZINC000478418540 1016679980 /nfs/dbraw/zinc/67/99/80/1016679980.db2.gz QBIXPLSCNRBOCN-MRXNPFEDSA-N 1 1 316.405 3.655 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H]1CC[C@H](C2CC2)O1)C1CC1 ZINC001168317350 1032229051 /nfs/dbraw/zinc/22/90/51/1032229051.db2.gz MYQKTLKZCWNHFW-SJLPKXTDSA-N 1 1 316.401 3.517 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H]1CC[C@H](C2CC2)O1)C1CC1 ZINC001168317350 1032229062 /nfs/dbraw/zinc/22/90/62/1032229062.db2.gz MYQKTLKZCWNHFW-SJLPKXTDSA-N 1 1 316.401 3.517 20 5 DHBDMO CC1=CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000537626290 1032340590 /nfs/dbraw/zinc/34/05/90/1032340590.db2.gz MMNKJLUIPHONMA-UHFFFAOYSA-N 1 1 315.398 3.870 20 5 DHBDMO CC1=CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000537626290 1032340596 /nfs/dbraw/zinc/34/05/96/1032340596.db2.gz MMNKJLUIPHONMA-UHFFFAOYSA-N 1 1 315.398 3.870 20 5 DHBDMO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000073007515 1017088269 /nfs/dbraw/zinc/08/82/69/1017088269.db2.gz NWUQBLLADVFKKP-QMMMGPOBSA-N 1 1 309.753 3.704 20 5 DHBDMO C[C@H]1CSCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000537636779 1032465917 /nfs/dbraw/zinc/46/59/17/1032465917.db2.gz VAUUSEBHGWGYDU-LBPRGKRZSA-N 1 1 318.398 3.792 20 5 DHBDMO COc1cc(C[N@@H+]2CCCC3(CCC3)C2)c([N+](=O)[O-])cc1F ZINC000348182631 1032491565 /nfs/dbraw/zinc/49/15/65/1032491565.db2.gz RSAOGVSFBUSULH-UHFFFAOYSA-N 1 1 308.353 3.509 20 5 DHBDMO COc1cc(C[N@H+]2CCCC3(CCC3)C2)c([N+](=O)[O-])cc1F ZINC000348182631 1032491570 /nfs/dbraw/zinc/49/15/70/1032491570.db2.gz RSAOGVSFBUSULH-UHFFFAOYSA-N 1 1 308.353 3.509 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1CCCC(F)(F)C1)CC2 ZINC000514080841 1012263531 /nfs/dbraw/zinc/26/35/31/1012263531.db2.gz YCOTULSVUOYAMI-GFCCVEGCSA-N 1 1 310.344 3.778 20 5 DHBDMO COc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000127057131 1012546106 /nfs/dbraw/zinc/54/61/06/1012546106.db2.gz SNIFLKMHICBPLA-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO CCC[C@@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001167959720 1012598784 /nfs/dbraw/zinc/59/87/84/1012598784.db2.gz PKVDSHSHQLSLDP-OAHLLOKOSA-N 1 1 306.406 3.876 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)cs1 ZINC000609233160 1012883622 /nfs/dbraw/zinc/88/36/22/1012883622.db2.gz AKUUEENLNDIWMB-OAHLLOKOSA-N 1 1 318.398 3.620 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)cs1 ZINC000609233160 1012883639 /nfs/dbraw/zinc/88/36/39/1012883639.db2.gz AKUUEENLNDIWMB-OAHLLOKOSA-N 1 1 318.398 3.620 20 5 DHBDMO CC[N@H+]1CCC[C@H]1CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000137538903 1017173601 /nfs/dbraw/zinc/17/36/01/1017173601.db2.gz ZCSCDEMMJVQLHT-NSHDSACASA-N 1 1 317.311 3.510 20 5 DHBDMO CO[C@@]1(C)CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000475552651 1017422100 /nfs/dbraw/zinc/42/21/00/1017422100.db2.gz XHQJYDKRYCCSMV-XOVFHRFOSA-N 1 1 318.417 3.889 20 5 DHBDMO CC(C)CC[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000053364146 1017548364 /nfs/dbraw/zinc/54/83/64/1017548364.db2.gz HSEAXDJWULWMOG-GFCCVEGCSA-N 1 1 318.377 3.684 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCCCCC1 ZINC000083132913 1017569216 /nfs/dbraw/zinc/56/92/16/1017569216.db2.gz MABYHCAWTNYBJD-UHFFFAOYSA-N 1 1 303.362 3.891 20 5 DHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444611579 1017586833 /nfs/dbraw/zinc/58/68/33/1017586833.db2.gz QSBQUCHOQDZMJQ-ZDUSSCGKSA-N 1 1 316.405 3.872 20 5 DHBDMO CC(C)C[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444665333 1017619074 /nfs/dbraw/zinc/61/90/74/1017619074.db2.gz UBEAGSRWLFGDBC-CYBMUJFWSA-N 1 1 316.405 3.872 20 5 DHBDMO Cc1cc(C)cc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444692565 1017634808 /nfs/dbraw/zinc/63/48/08/1017634808.db2.gz FKPPQGPFRLKBEU-UHFFFAOYSA-N 1 1 324.384 3.720 20 5 DHBDMO Cc1cc(C)cc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444692565 1017634817 /nfs/dbraw/zinc/63/48/17/1017634817.db2.gz FKPPQGPFRLKBEU-UHFFFAOYSA-N 1 1 324.384 3.720 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000444828574 1017690493 /nfs/dbraw/zinc/69/04/93/1017690493.db2.gz OGRFCVFNXCENNN-NWDGAFQWSA-N 1 1 309.797 3.595 20 5 DHBDMO CC[C@H](NC[C@H]1CCC[N@@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125910222 1032723217 /nfs/dbraw/zinc/72/32/17/1032723217.db2.gz QEVPBCUAWFOHBF-QAPCUYQASA-N 1 1 319.449 3.756 20 5 DHBDMO CC[C@H](NC[C@H]1CCC[N@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125910222 1032723234 /nfs/dbraw/zinc/72/32/34/1032723234.db2.gz QEVPBCUAWFOHBF-QAPCUYQASA-N 1 1 319.449 3.756 20 5 DHBDMO COc1cccc(C[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000523843304 1017810395 /nfs/dbraw/zinc/81/03/95/1017810395.db2.gz NZJUUWIUTIMHRX-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1cccc(C[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000523843304 1017810418 /nfs/dbraw/zinc/81/04/18/1017810418.db2.gz NZJUUWIUTIMHRX-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO CCc1ccccc1CC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001167646303 1017932244 /nfs/dbraw/zinc/93/22/44/1017932244.db2.gz AFAFPKKRUDIFAG-UHFFFAOYSA-N 1 1 310.397 3.758 20 5 DHBDMO CC[N@@H+](CCc1cccs1)CCc1ccc([N+](=O)[O-])cc1 ZINC000524426352 1017993347 /nfs/dbraw/zinc/99/33/47/1017993347.db2.gz KXUOMMBHHRVAGI-UHFFFAOYSA-N 1 1 304.415 3.763 20 5 DHBDMO C[C@@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000278080674 1018047063 /nfs/dbraw/zinc/04/70/63/1018047063.db2.gz GHRVOFGQJDSGDD-AEJSXWLSSA-N 1 1 322.390 3.640 20 5 DHBDMO C[C@@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000278080674 1018047074 /nfs/dbraw/zinc/04/70/74/1018047074.db2.gz GHRVOFGQJDSGDD-AEJSXWLSSA-N 1 1 322.390 3.640 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(F)cc1 ZINC000172673687 1018078449 /nfs/dbraw/zinc/07/84/49/1018078449.db2.gz QRDIDZJRPNYKHO-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000524895234 1018119681 /nfs/dbraw/zinc/11/96/81/1018119681.db2.gz PSVFTJUBXZOVNL-HZPDHXFCSA-N 1 1 306.406 3.539 20 5 DHBDMO CS[C@H]1CCCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000441121481 1018261849 /nfs/dbraw/zinc/26/18/49/1018261849.db2.gz YCRCPMHOQOUMJI-ZDUSSCGKSA-N 1 1 314.838 3.966 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2cccs2)C2CC2)cc1 ZINC000764493691 1018295931 /nfs/dbraw/zinc/29/59/31/1018295931.db2.gz RBHZCJBUXYBJMD-UHFFFAOYSA-N 1 1 302.399 3.863 20 5 DHBDMO C[N@@H+](CCCCOc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000527356063 1018559938 /nfs/dbraw/zinc/55/99/38/1018559938.db2.gz APVCGNSRRCCIPK-UHFFFAOYSA-N 1 1 314.385 3.886 20 5 DHBDMO CCc1onc(C)c1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000922986434 1018967678 /nfs/dbraw/zinc/96/76/78/1018967678.db2.gz ADHNONYCLBJBIY-UHFFFAOYSA-N 1 1 317.389 3.867 20 5 DHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ncccc2[N+](=O)[O-])cc1 ZINC000080914788 1019118787 /nfs/dbraw/zinc/11/87/87/1019118787.db2.gz WVVKGPFAWDJEKR-GFCCVEGCSA-N 1 1 323.356 3.657 20 5 DHBDMO Cc1cnc(Cl)c(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000922048699 1019362660 /nfs/dbraw/zinc/36/26/60/1019362660.db2.gz LJBNVMFERZGBPI-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO Cc1cc([N+](=O)[O-])cnc1Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000092689528 1019531735 /nfs/dbraw/zinc/53/17/35/1019531735.db2.gz LTVYBRXEYLNPDS-UHFFFAOYSA-N 1 1 323.356 3.806 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1OC ZINC000192757534 1032843358 /nfs/dbraw/zinc/84/33/58/1032843358.db2.gz SEEIBOXYMHWGRZ-HNNXBMFYSA-N 1 1 300.358 3.844 20 5 DHBDMO COc1cc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])ccn1 ZINC000347568298 1019687489 /nfs/dbraw/zinc/68/74/89/1019687489.db2.gz YLMPOMRMHQJBEC-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H](C)C(C)C ZINC000067653801 1019769623 /nfs/dbraw/zinc/76/96/23/1019769623.db2.gz AUBWCLWOEXTDSF-LBPRGKRZSA-N 1 1 318.377 3.511 20 5 DHBDMO C[N@@H+](CC[N+](=O)[O-])[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC001168765357 1020069420 /nfs/dbraw/zinc/06/94/20/1020069420.db2.gz INLOPDDTBCQJNY-ZIAGYGMSSA-N 1 1 316.323 3.550 20 5 DHBDMO C[N@@H+](CC[N+](=O)[O-])[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC001168765354 1020072654 /nfs/dbraw/zinc/07/26/54/1020072654.db2.gz INLOPDDTBCQJNY-KGLIPLIRSA-N 1 1 316.323 3.550 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H](c2ccccn2)C2CC2)c1 ZINC000922586996 1020147371 /nfs/dbraw/zinc/14/73/71/1020147371.db2.gz VEOLAYFBFYUJBL-INIZCTEOSA-N 1 1 317.776 3.884 20 5 DHBDMO C[C@@H](O)CC[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000093481440 1020154072 /nfs/dbraw/zinc/15/40/72/1020154072.db2.gz NBEQJGRYLIJHSY-GFCCVEGCSA-N 1 1 320.414 3.526 20 5 DHBDMO CC(C)c1ccc(CN(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000093644437 1020163789 /nfs/dbraw/zinc/16/37/89/1020163789.db2.gz RCEWKEZYHNIZFD-ZBFHGGJFSA-N 1 1 319.449 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@H+](C)[C@H]2CCN(C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000093644437 1020163794 /nfs/dbraw/zinc/16/37/94/1020163794.db2.gz RCEWKEZYHNIZFD-ZBFHGGJFSA-N 1 1 319.449 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)[C@H]2CCN(C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000093644437 1020163801 /nfs/dbraw/zinc/16/38/01/1020163801.db2.gz RCEWKEZYHNIZFD-ZBFHGGJFSA-N 1 1 319.449 3.633 20 5 DHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000155219610 1020201595 /nfs/dbraw/zinc/20/15/95/1020201595.db2.gz DKSOLMSEWJAGAH-INIZCTEOSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC[C@@H]1C ZINC000603854126 1020207314 /nfs/dbraw/zinc/20/73/14/1020207314.db2.gz QZMXGYFISWVGPW-NWDGAFQWSA-N 1 1 311.813 3.923 20 5 DHBDMO C[C@H](NCCC[N@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000162381387 1020485243 /nfs/dbraw/zinc/48/52/43/1020485243.db2.gz DQPPMXZAUPIVGS-GJZGRUSLSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@@H](N[C@H]1CC[N@@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000153770713 1020581632 /nfs/dbraw/zinc/58/16/32/1020581632.db2.gz FCJIZHJQKLZKMY-MAUKXSAKSA-N 1 1 317.433 3.652 20 5 DHBDMO CC[C@@H](N[C@H]1CC[N@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000153770713 1020581639 /nfs/dbraw/zinc/58/16/39/1020581639.db2.gz FCJIZHJQKLZKMY-MAUKXSAKSA-N 1 1 317.433 3.652 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000612578237 1020630740 /nfs/dbraw/zinc/63/07/40/1020630740.db2.gz XVZOVARZMCXLDW-SFHVURJKSA-N 1 1 312.369 3.946 20 5 DHBDMO CC[N@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000740870914 1020956924 /nfs/dbraw/zinc/95/69/24/1020956924.db2.gz LZCFCLIEBVCPPB-RYUDHWBXSA-N 1 1 311.813 3.557 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccns2)cc1[N+](=O)[O-] ZINC000858578675 1032954801 /nfs/dbraw/zinc/95/48/01/1032954801.db2.gz XETNQKAEJUCXGC-MNOVXSKESA-N 1 1 321.402 3.862 20 5 DHBDMO C[C@@H]1CCC[N@H+]1CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000742427867 1021120857 /nfs/dbraw/zinc/12/08/57/1021120857.db2.gz SDFSZNJAMDOUAR-SNVBAGLBSA-N 1 1 317.311 3.510 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccns2)cc1[N+](=O)[O-] ZINC000858578679 1032955492 /nfs/dbraw/zinc/95/54/92/1032955492.db2.gz XETNQKAEJUCXGC-WDEREUQCSA-N 1 1 321.402 3.862 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2cccs2)cc1 ZINC000776276441 1021218997 /nfs/dbraw/zinc/21/89/97/1021218997.db2.gz NCFKWNPMPLKTBD-CABCVRRESA-N 1 1 318.398 3.527 20 5 DHBDMO CC[N@H+](Cc1ccccc1C)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917436949 1021260259 /nfs/dbraw/zinc/26/02/59/1021260259.db2.gz PHVYOLVXLNMNKW-UHFFFAOYSA-N 1 1 324.384 3.733 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCc2c1cc(F)cc2F ZINC000154601522 1021417827 /nfs/dbraw/zinc/41/78/27/1021417827.db2.gz YAOBGHXUFZDXAS-OAHLLOKOSA-N 1 1 304.296 3.650 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cc(C(C)C)no1)c1cccc([N+](=O)[O-])c1 ZINC000169264139 1021513157 /nfs/dbraw/zinc/51/31/57/1021513157.db2.gz WKVSLZVCZUIGAH-OAHLLOKOSA-N 1 1 303.362 3.947 20 5 DHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000744442061 1021546537 /nfs/dbraw/zinc/54/65/37/1021546537.db2.gz WBZHVTXCGMOFEK-MNOVXSKESA-N 1 1 321.402 3.950 20 5 DHBDMO CCCC[N@@H+](CC)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000158969917 1021611519 /nfs/dbraw/zinc/61/15/19/1021611519.db2.gz YEEGDPUOFSCTFR-UHFFFAOYSA-N 1 1 316.405 3.617 20 5 DHBDMO C[C@H]1C[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H](C)S1 ZINC000070383163 1021658512 /nfs/dbraw/zinc/65/85/12/1021658512.db2.gz INXDYHGTNLWNBF-UWVGGRQHSA-N 1 1 300.811 3.574 20 5 DHBDMO CC(C)c1ccc(CN[C@@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000236656846 1021745342 /nfs/dbraw/zinc/74/53/42/1021745342.db2.gz OWFCRDWDXJRSIU-HNNXBMFYSA-N 1 1 319.449 3.682 20 5 DHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@H+]2C2CCCCC2)s1 ZINC000619549305 1021785523 /nfs/dbraw/zinc/78/55/23/1021785523.db2.gz BPOHYQIRIGDFEU-ZDUSSCGKSA-N 1 1 309.435 3.865 20 5 DHBDMO C[N@H+](Cc1cccc2cnccc21)Cc1ccccc1[N+](=O)[O-] ZINC000183062639 1021948486 /nfs/dbraw/zinc/94/84/86/1021948486.db2.gz IGTZPTGOBFMOOC-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO CC(C)[C@H]1CCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000920484997 1022127713 /nfs/dbraw/zinc/12/77/13/1022127713.db2.gz NBQLSWSPFNJHMR-GFCCVEGCSA-N 1 1 321.402 3.950 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)C1 ZINC001169005675 1022212313 /nfs/dbraw/zinc/21/23/13/1022212313.db2.gz BYMNTSNFZQRQBX-GUYCJALGSA-N 1 1 320.820 3.875 20 5 DHBDMO C[N@@H+](Cc1ccccc1C(F)(F)F)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169033594 1022219622 /nfs/dbraw/zinc/21/96/22/1022219622.db2.gz CDHSUQCFVLDJPE-WCQYABFASA-N 1 1 316.323 3.583 20 5 DHBDMO C[N@@H+](Cc1c(Cl)cccc1Cl)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169038558 1022221229 /nfs/dbraw/zinc/22/12/29/1022221229.db2.gz ZPIJDGDBNBZHMY-GHMZBOCLSA-N 1 1 317.216 3.871 20 5 DHBDMO C[N@@H+](Cc1cccc(Cl)c1Cl)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035290 1022221323 /nfs/dbraw/zinc/22/13/23/1022221323.db2.gz KARLPOILWUESCC-PWSUYJOCSA-N 1 1 317.216 3.871 20 5 DHBDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169036172 1022223171 /nfs/dbraw/zinc/22/31/71/1022223171.db2.gz FPELEXPEHUVXPF-JSGCOSHPSA-N 1 1 316.323 3.583 20 5 DHBDMO CCC1(CC)C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CCS1 ZINC001169023671 1022226593 /nfs/dbraw/zinc/22/65/93/1022226593.db2.gz HSOVBSXDOZJUEO-UHFFFAOYSA-N 1 1 312.410 3.842 20 5 DHBDMO CCC1(CC)C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CCS1 ZINC001169023671 1022226598 /nfs/dbraw/zinc/22/65/98/1022226598.db2.gz HSOVBSXDOZJUEO-UHFFFAOYSA-N 1 1 312.410 3.842 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC001169025502 1022229792 /nfs/dbraw/zinc/22/97/92/1022229792.db2.gz JQUTUPUUFOVXSQ-XJKCOSOUSA-N 1 1 308.809 3.922 20 5 DHBDMO Cc1cccc(C[N@@H+](C2CC2)[C@H]2CC[C@H](C[N+](=O)[O-])C2)c1C ZINC001169053919 1022230639 /nfs/dbraw/zinc/23/06/39/1022230639.db2.gz KJMNUZQDOINTMF-YJBOKZPZSA-N 1 1 302.418 3.713 20 5 DHBDMO Cc1cccc(C[N@@H+](C2CC2)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c1C ZINC001169053916 1022231724 /nfs/dbraw/zinc/23/17/24/1022231724.db2.gz KJMNUZQDOINTMF-CRAIPNDOSA-N 1 1 302.418 3.713 20 5 DHBDMO C[C@@H]1c2ccc(F)cc2CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000610004021 1022397974 /nfs/dbraw/zinc/39/79/74/1022397974.db2.gz ZEKYGCNMKOBVTL-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000610004021 1022397990 /nfs/dbraw/zinc/39/79/90/1022397990.db2.gz ZEKYGCNMKOBVTL-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H]1c2ccc(F)cc2CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610004027 1022400039 /nfs/dbraw/zinc/40/00/39/1022400039.db2.gz ZWDDQSNFWODBAE-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610004027 1022400042 /nfs/dbraw/zinc/40/00/42/1022400042.db2.gz ZWDDQSNFWODBAE-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000616123419 1022648197 /nfs/dbraw/zinc/64/81/97/1022648197.db2.gz GCXDAYOQMNJFAX-UTUOFQBUSA-N 1 1 303.362 3.602 20 5 DHBDMO CCOc1cc(C[N@H+](C)Cc2ccsc2)ccc1[N+](=O)[O-] ZINC000617194782 1022886526 /nfs/dbraw/zinc/88/65/26/1022886526.db2.gz ORVJJJYYZOQETA-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2ccsc2)ccc1[N+](=O)[O-] ZINC000617194782 1022886544 /nfs/dbraw/zinc/88/65/44/1022886544.db2.gz ORVJJJYYZOQETA-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO CN(C)c1ccccc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893350152 1023071433 /nfs/dbraw/zinc/07/14/33/1023071433.db2.gz FZZSEBXVERBNKA-UHFFFAOYSA-N 1 1 319.792 3.604 20 5 DHBDMO COC[C@@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)CCO1 ZINC000769459540 1023158786 /nfs/dbraw/zinc/15/87/86/1023158786.db2.gz GDNODLXLUGMVIY-SFHVURJKSA-N 1 1 321.420 3.840 20 5 DHBDMO Cc1ncc(C[N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)s1 ZINC000876622558 1033110485 /nfs/dbraw/zinc/11/04/85/1033110485.db2.gz IIIDNHOPTFVFKK-UHFFFAOYSA-N 1 1 305.403 3.609 20 5 DHBDMO Cc1ncc(C[N@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)s1 ZINC000876622558 1033110490 /nfs/dbraw/zinc/11/04/90/1033110490.db2.gz IIIDNHOPTFVFKK-UHFFFAOYSA-N 1 1 305.403 3.609 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000746674388 1023431108 /nfs/dbraw/zinc/43/11/08/1023431108.db2.gz VUYJPCZVILMEJV-LLVKDONJSA-N 1 1 306.749 3.831 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(OCC2CC2)CC1 ZINC000746675700 1023785600 /nfs/dbraw/zinc/78/56/00/1023785600.db2.gz VURYRNFGIZUALC-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1c1ccccc1 ZINC000788483916 1023900586 /nfs/dbraw/zinc/90/05/86/1023900586.db2.gz YVQMCWFZOBPEPJ-PXAZEXFGSA-N 1 1 300.333 3.927 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1c1ccccc1 ZINC000788483916 1023900589 /nfs/dbraw/zinc/90/05/89/1023900589.db2.gz YVQMCWFZOBPEPJ-PXAZEXFGSA-N 1 1 300.333 3.927 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCc2ccc(Cl)nc21)c1cccc([N+](=O)[O-])c1 ZINC000788643705 1023912905 /nfs/dbraw/zinc/91/29/05/1023912905.db2.gz QIKZTVIRNVDSOB-YGRLFVJLSA-N 1 1 317.776 3.981 20 5 DHBDMO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cn1 ZINC000266767086 1024044639 /nfs/dbraw/zinc/04/46/39/1024044639.db2.gz IKOFYDZSJXCUGS-CHWSQXEVSA-N 1 1 302.378 3.784 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccs2)cc1[N+](=O)[O-] ZINC000051501874 1024220275 /nfs/dbraw/zinc/22/02/75/1024220275.db2.gz HEJIIPIIAMOATE-NSHDSACASA-N 1 1 306.387 3.858 20 5 DHBDMO CCCC[N@H+]1CCCC[C@H]1CNCc1ccc(C)c([N+](=O)[O-])c1 ZINC000520214217 1024260842 /nfs/dbraw/zinc/26/08/42/1024260842.db2.gz JMAQVUVIVXIJHX-KRWDZBQOSA-N 1 1 319.449 3.647 20 5 DHBDMO CCCCN1CCCC[C@H]1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000520214217 1024260858 /nfs/dbraw/zinc/26/08/58/1024260858.db2.gz JMAQVUVIVXIJHX-KRWDZBQOSA-N 1 1 319.449 3.647 20 5 DHBDMO Cc1ccncc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000271260427 1024479856 /nfs/dbraw/zinc/47/98/56/1024479856.db2.gz ANMOKWUFHFAODM-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO CCn1ccnc1[C@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000453362506 1024486359 /nfs/dbraw/zinc/48/63/59/1024486359.db2.gz RIIUKOXXNHEMIP-BLLLJJGKSA-N 1 1 314.389 3.539 20 5 DHBDMO Cc1csc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)n1 ZINC000283161083 1024603146 /nfs/dbraw/zinc/60/31/46/1024603146.db2.gz OYJREPCOMLLEQO-AWEZNQCLSA-N 1 1 321.377 3.740 20 5 DHBDMO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC000106876651 1024606948 /nfs/dbraw/zinc/60/69/48/1024606948.db2.gz GPIBDGWUJRTMRG-LLVKDONJSA-N 1 1 305.403 3.861 20 5 DHBDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC000106876651 1024606953 /nfs/dbraw/zinc/60/69/53/1024606953.db2.gz GPIBDGWUJRTMRG-LLVKDONJSA-N 1 1 305.403 3.861 20 5 DHBDMO CCn1ccc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000792184964 1024644441 /nfs/dbraw/zinc/64/44/41/1024644441.db2.gz YFJPYQLFLJPIMQ-UHFFFAOYSA-N 1 1 307.781 3.702 20 5 DHBDMO CC(C)c1[nH+]c(/C=C/c2ccc([N+](=O)[O-])cn2)c2ccccn21 ZINC000475731102 1024687097 /nfs/dbraw/zinc/68/70/97/1024687097.db2.gz CHLUOOMCUSPSHN-VQHVLOKHSA-N 1 1 308.341 3.931 20 5 DHBDMO CC(C)[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1cccnc1 ZINC000349287017 1024696931 /nfs/dbraw/zinc/69/69/31/1024696931.db2.gz UAXPXBUCIFDFOQ-RMKNXTFCSA-N 1 1 311.385 3.914 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001170328304 1024744409 /nfs/dbraw/zinc/74/44/09/1024744409.db2.gz JBTHJSTVNGXQSQ-KGLIPLIRSA-N 1 1 306.406 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170328303 1024744917 /nfs/dbraw/zinc/74/49/17/1024744917.db2.gz JBTHJSTVNGXQSQ-KBPBESRZSA-N 1 1 306.406 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC[C@](C)(F)C2)c([N+](=O)[O-])c1 ZINC001170336313 1024746535 /nfs/dbraw/zinc/74/65/35/1024746535.db2.gz WGJFXUKGLQQJSZ-GUYCJALGSA-N 1 1 324.396 3.749 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170353471 1024748453 /nfs/dbraw/zinc/74/84/53/1024748453.db2.gz YNWHJFQQXZIRPI-HZSPNIEDSA-N 1 1 306.406 3.512 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+](CC2CC2)C(C)C)c([N+](=O)[O-])c1 ZINC001170348487 1024758449 /nfs/dbraw/zinc/75/84/49/1024758449.db2.gz XOZBNPLRBJSYAY-ZDUSSCGKSA-N 1 1 306.406 3.655 20 5 DHBDMO CC[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CCCC1 ZINC000728895755 1024773936 /nfs/dbraw/zinc/77/39/36/1024773936.db2.gz AYLRLRIDOQGXNN-UHFFFAOYSA-N 1 1 314.389 3.680 20 5 DHBDMO CCCC[N@@H+](CC)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728898450 1024807557 /nfs/dbraw/zinc/80/75/57/1024807557.db2.gz WBJVZUDESBYTDF-UHFFFAOYSA-N 1 1 302.378 3.538 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792868906 1024812713 /nfs/dbraw/zinc/81/27/13/1024812713.db2.gz YLZAYXATRFLISS-TYNCELHUSA-N 1 1 319.361 3.656 20 5 DHBDMO CCc1nc(C)c(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000291876740 1025018104 /nfs/dbraw/zinc/01/81/04/1025018104.db2.gz JBJFGWHNFWYNRX-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(OC3CCCC3)CC2)cs1 ZINC000121135519 1025075402 /nfs/dbraw/zinc/07/54/02/1025075402.db2.gz FTTXZBMQUSVAPK-UHFFFAOYSA-N 1 1 310.419 3.580 20 5 DHBDMO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCC1CC1 ZINC000135265013 1033268767 /nfs/dbraw/zinc/26/87/67/1033268767.db2.gz KQAHUQNDJYLMQK-UHFFFAOYSA-N 1 1 315.373 3.524 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000353884232 1025278070 /nfs/dbraw/zinc/27/80/70/1025278070.db2.gz WIBUCUFZIHWPIH-CHWSQXEVSA-N 1 1 322.405 3.623 20 5 DHBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886014086 1025438026 /nfs/dbraw/zinc/43/80/26/1025438026.db2.gz BWHGTUSGCIDNSU-GDBMZVCRSA-N 1 1 311.385 3.676 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCCCC[C@@H]1c1ccco1 ZINC000886014705 1025439531 /nfs/dbraw/zinc/43/95/31/1025439531.db2.gz NXGMRWRQOSNOFH-CQSZACIVSA-N 1 1 301.346 3.700 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000886014705 1025439541 /nfs/dbraw/zinc/43/95/41/1025439541.db2.gz NXGMRWRQOSNOFH-CQSZACIVSA-N 1 1 301.346 3.700 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000886062094 1025460657 /nfs/dbraw/zinc/46/06/57/1025460657.db2.gz GRLLKWLRDKXQIO-UHFFFAOYSA-N 1 1 317.776 3.812 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000342819253 1025518352 /nfs/dbraw/zinc/51/83/52/1025518352.db2.gz AMMLVCYWIWLXGP-AEFFLSMTSA-N 1 1 318.417 3.862 20 5 DHBDMO CCC[N@@H+](CCc1cccs1)Cc1cccnc1[N+](=O)[O-] ZINC000886135943 1025523260 /nfs/dbraw/zinc/52/32/60/1025523260.db2.gz BJGNLDIVSNGZEF-UHFFFAOYSA-N 1 1 305.403 3.506 20 5 DHBDMO CSc1ccc([C@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1 ZINC000886186237 1025551420 /nfs/dbraw/zinc/55/14/20/1025551420.db2.gz SZBDRJVVUZKQJV-NSHDSACASA-N 1 1 303.387 3.563 20 5 DHBDMO C[C@@H](NCCC[N@@H+](C)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000322117201 1025731071 /nfs/dbraw/zinc/73/10/71/1025731071.db2.gz QJDLFTWXUBZWOS-OAHLLOKOSA-N 1 1 319.449 3.900 20 5 DHBDMO COc1ccc(C[N@@H+](C)CCCc2ccccc2)cc1[N+](=O)[O-] ZINC000051852745 1025977500 /nfs/dbraw/zinc/97/75/00/1025977500.db2.gz JSVXSPKRWSFWJY-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO COc1ccc(C[N@H+]([C@H](C)c2ccco2)C2CC2)cc1[N+](=O)[O-] ZINC000086235960 1026019035 /nfs/dbraw/zinc/01/90/35/1026019035.db2.gz RAABSWUCUDNKCQ-GFCCVEGCSA-N 1 1 316.357 3.922 20 5 DHBDMO COc1ccc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)cc1[N+](=O)[O-] ZINC000086235960 1026019055 /nfs/dbraw/zinc/01/90/55/1026019055.db2.gz RAABSWUCUDNKCQ-GFCCVEGCSA-N 1 1 316.357 3.922 20 5 DHBDMO C[C@@H]([N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1(C)CC1 ZINC000089909237 1026071448 /nfs/dbraw/zinc/07/14/48/1026071448.db2.gz ZVQRWJVIEAOETA-GFCCVEGCSA-N 1 1 315.373 3.870 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(OC2CCC2)CC1 ZINC000419294763 1026105550 /nfs/dbraw/zinc/10/55/50/1026105550.db2.gz BKTVXEBELMUQAX-UHFFFAOYSA-N 1 1 324.808 3.782 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000289652357 1026113316 /nfs/dbraw/zinc/11/33/16/1026113316.db2.gz TWFCIOPFHZVQDF-XOKHGSTOSA-N 1 1 316.401 3.689 20 5 DHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000280133342 1026596483 /nfs/dbraw/zinc/59/64/83/1026596483.db2.gz CNZRBMURTDJRMD-HNNXBMFYSA-N 1 1 312.797 3.639 20 5 DHBDMO CC[C@@H](CSC)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809767832 1026605386 /nfs/dbraw/zinc/60/53/86/1026605386.db2.gz VNHFCTFIJOQRPQ-NSHDSACASA-N 1 1 302.827 3.822 20 5 DHBDMO CC[N@H+](Cc1ccncc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809726351 1026606406 /nfs/dbraw/zinc/60/64/06/1026606406.db2.gz HHQYXABZEFYLJU-UHFFFAOYSA-N 1 1 305.765 3.665 20 5 DHBDMO CC[N@@H+](Cc1ccncc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809726351 1026606411 /nfs/dbraw/zinc/60/64/11/1026606411.db2.gz HHQYXABZEFYLJU-UHFFFAOYSA-N 1 1 305.765 3.665 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCSC1 ZINC000809965935 1026647191 /nfs/dbraw/zinc/64/71/91/1026647191.db2.gz QCHGDGRHVFUMMU-SNVBAGLBSA-N 1 1 321.229 3.839 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](CCO)CC2)cc1[N+](=O)[O-] ZINC000421391210 1026979062 /nfs/dbraw/zinc/97/90/62/1026979062.db2.gz ABIAIUFDYORVJN-HNNXBMFYSA-N 1 1 320.433 3.703 20 5 DHBDMO C[C@@H]1C[C@H](Nc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000228852796 1027146552 /nfs/dbraw/zinc/14/65/52/1027146552.db2.gz IJBKLTKFVMWOCC-RKDXNWHRSA-N 1 1 318.204 3.796 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc2cc[nH]c21 ZINC000572988572 1027248408 /nfs/dbraw/zinc/24/84/08/1027248408.db2.gz JXVCQMHWQRVGNW-UHFFFAOYSA-N 1 1 309.369 3.751 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C2CCOCC2)C1 ZINC000933079264 1027669677 /nfs/dbraw/zinc/66/96/77/1027669677.db2.gz KXFISTXLJRQKPZ-GDBMZVCRSA-N 1 1 318.417 3.794 20 5 DHBDMO CC1CC[NH+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1 ZINC000007315002 1027792384 /nfs/dbraw/zinc/79/23/84/1027792384.db2.gz CSYBVYPLJGQQCY-UHFFFAOYSA-N 1 1 307.375 3.561 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)[nH]n1 ZINC000364017059 1027796773 /nfs/dbraw/zinc/79/67/73/1027796773.db2.gz ZFTSMRXURVFKBI-DZGCQCFKSA-N 1 1 314.389 3.567 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n[nH]1 ZINC000364017059 1027796775 /nfs/dbraw/zinc/79/67/75/1027796775.db2.gz ZFTSMRXURVFKBI-DZGCQCFKSA-N 1 1 314.389 3.567 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n[nH]1 ZINC000364017059 1027796782 /nfs/dbraw/zinc/79/67/82/1027796782.db2.gz ZFTSMRXURVFKBI-DZGCQCFKSA-N 1 1 314.389 3.567 20 5 DHBDMO CC(C)c1ccc(CNC[C@@H]2CC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000577634693 1027855148 /nfs/dbraw/zinc/85/51/48/1027855148.db2.gz VBWXJISNIJBNIJ-INIZCTEOSA-N 1 1 319.449 3.538 20 5 DHBDMO CO[C@@H]1CC[C@@H]1[N@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000934111841 1027902541 /nfs/dbraw/zinc/90/25/41/1027902541.db2.gz PRSGUAADJJJCRC-NWDGAFQWSA-N 1 1 319.188 3.511 20 5 DHBDMO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000934111841 1027902567 /nfs/dbraw/zinc/90/25/67/1027902567.db2.gz PRSGUAADJJJCRC-NWDGAFQWSA-N 1 1 319.188 3.511 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]Cc1c(F)cc(F)cc1F ZINC000815151588 1028381659 /nfs/dbraw/zinc/38/16/59/1028381659.db2.gz IKLWZEJRSMYXBY-HWKANZROSA-N 1 1 322.286 3.815 20 5 DHBDMO Cc1cccc2nc(C[NH2+][C@@H](C)Cc3ccccc3[N+](=O)[O-])[nH]c21 ZINC000449207983 1028446309 /nfs/dbraw/zinc/44/63/09/1028446309.db2.gz OSKUWDBWPMWWSF-ZDUSSCGKSA-N 1 1 324.384 3.500 20 5 DHBDMO Cc1ccnc([C@@H]2CC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)c1 ZINC000564582361 1028479905 /nfs/dbraw/zinc/47/99/05/1028479905.db2.gz CCPPDSMJDDGQQH-HUUCEWRRSA-N 1 1 311.385 3.849 20 5 DHBDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000449458873 1028660739 /nfs/dbraw/zinc/66/07/39/1028660739.db2.gz JIRJHFSIADFWBU-KOLCDFICSA-N 1 1 320.286 3.897 20 5 DHBDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000449458873 1028660746 /nfs/dbraw/zinc/66/07/46/1028660746.db2.gz JIRJHFSIADFWBU-KOLCDFICSA-N 1 1 320.286 3.897 20 5 DHBDMO Cc1ncc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449496007 1028708088 /nfs/dbraw/zinc/70/80/88/1028708088.db2.gz FTHIYXHXDUZBLP-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO CSC1(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000449501562 1028721400 /nfs/dbraw/zinc/72/14/00/1028721400.db2.gz PZJPWVMTBNEDMZ-AWEZNQCLSA-N 1 1 306.431 3.670 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H](O)c2ccccc2C1 ZINC000371875849 1028769354 /nfs/dbraw/zinc/76/93/54/1028769354.db2.gz GWOMUVOQURKROV-MEQKGCOVSA-N 1 1 324.380 3.547 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000449617838 1028871040 /nfs/dbraw/zinc/87/10/40/1028871040.db2.gz IYONWJXNNAGAHT-OAHLLOKOSA-N 1 1 320.433 3.701 20 5 DHBDMO C[C@@H](O)[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000567358543 1028879873 /nfs/dbraw/zinc/87/98/73/1028879873.db2.gz VQXBNQYIIHZNEL-JKDFXYPNSA-N 1 1 318.348 3.507 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CC[C@H]1CC1(Cl)Cl)CC2 ZINC001326676057 1028931256 /nfs/dbraw/zinc/93/12/56/1028931256.db2.gz GJIKLKWBSWYTAU-LBPRGKRZSA-N 1 1 315.200 3.537 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CC[C@H]1CC1(Cl)Cl)CC2 ZINC001326676057 1028931270 /nfs/dbraw/zinc/93/12/70/1028931270.db2.gz GJIKLKWBSWYTAU-LBPRGKRZSA-N 1 1 315.200 3.537 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000449731146 1028938545 /nfs/dbraw/zinc/93/85/45/1028938545.db2.gz HKQMCAXDZWBTIT-ZNNBYXKUSA-N 1 1 318.442 3.827 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000449731145 1028939547 /nfs/dbraw/zinc/93/95/47/1028939547.db2.gz HKQMCAXDZWBTIT-SVEBXFOSSA-N 1 1 318.442 3.827 20 5 DHBDMO COC[C@H]1CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000449774918 1028989103 /nfs/dbraw/zinc/98/91/03/1028989103.db2.gz LMQAVODKMAROPG-QZFKAFNDSA-N 1 1 318.417 3.747 20 5 DHBDMO CC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1ccncc1 ZINC000568139612 1029015257 /nfs/dbraw/zinc/01/52/57/1029015257.db2.gz JQELOGGYSLWEHU-PTNGSMBKSA-N 1 1 311.385 3.915 20 5 DHBDMO CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000570368217 1029358805 /nfs/dbraw/zinc/35/88/05/1029358805.db2.gz YYCQSSNIRBDHBK-GOSISDBHSA-N 1 1 320.433 3.703 20 5 DHBDMO O=C(CCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000450481896 1029503926 /nfs/dbraw/zinc/50/39/26/1029503926.db2.gz FSJSJUXJPBSEBU-UHFFFAOYSA-N 1 1 324.380 3.616 20 5 DHBDMO O=C(CCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000450481896 1029503933 /nfs/dbraw/zinc/50/39/33/1029503933.db2.gz FSJSJUXJPBSEBU-UHFFFAOYSA-N 1 1 324.380 3.616 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](c2ccncc2)C1 ZINC000451002208 1029763389 /nfs/dbraw/zinc/76/33/89/1029763389.db2.gz SEZSOVUMBSVMKO-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO COC(C)(C)CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544889 1029909046 /nfs/dbraw/zinc/90/90/46/1029909046.db2.gz GCXVNERRYASTON-HNNXBMFYSA-N 1 1 306.406 3.589 20 5 DHBDMO Cc1nc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)oc1C ZINC000451553629 1029917846 /nfs/dbraw/zinc/91/78/46/1029917846.db2.gz YFFPRDHVWGTIKZ-HNNXBMFYSA-N 1 1 315.373 3.579 20 5 DHBDMO Cc1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)oc1C ZINC000451553629 1029917865 /nfs/dbraw/zinc/91/78/65/1029917865.db2.gz YFFPRDHVWGTIKZ-HNNXBMFYSA-N 1 1 315.373 3.579 20 5 DHBDMO CSc1ccccc1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000358059454 1030304124 /nfs/dbraw/zinc/30/41/24/1030304124.db2.gz FGEBZHIYESVHAD-UHFFFAOYSA-N 1 1 302.399 3.949 20 5 DHBDMO CSc1ccccc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000358059454 1030304142 /nfs/dbraw/zinc/30/41/42/1030304142.db2.gz FGEBZHIYESVHAD-UHFFFAOYSA-N 1 1 302.399 3.949 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cnn(C2CCC2)c1 ZINC000925696310 1030456094 /nfs/dbraw/zinc/45/60/94/1030456094.db2.gz ZEQABVMEQXHQHR-OLZOCXBDSA-N 1 1 314.389 3.928 20 5 DHBDMO CCc1nc(C)c(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000291910698 1030693258 /nfs/dbraw/zinc/69/32/58/1030693258.db2.gz MRMORPIIEYRVBW-OAHLLOKOSA-N 1 1 315.373 3.621 20 5 DHBDMO CC[C@H](C)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000122991243 1030936017 /nfs/dbraw/zinc/93/60/17/1030936017.db2.gz JKJQMXTXUCHYKX-VIFPVBQESA-N 1 1 301.184 3.588 20 5 DHBDMO COc1ccccc1/C=C\C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536672635 1031379531 /nfs/dbraw/zinc/37/95/31/1031379531.db2.gz ZHLXMVYZGYEZLH-YVMONPNESA-N 1 1 324.380 3.675 20 5 DHBDMO COc1ccccc1/C=C\C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536672635 1031379549 /nfs/dbraw/zinc/37/95/49/1031379549.db2.gz ZHLXMVYZGYEZLH-YVMONPNESA-N 1 1 324.380 3.675 20 5 DHBDMO COc1cc(C)cc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872052885 1031440623 /nfs/dbraw/zinc/44/06/23/1031440623.db2.gz RLBHHRADROQHDK-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO COCc1csc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872085430 1031481210 /nfs/dbraw/zinc/48/12/10/1031481210.db2.gz NJHYNMOKKWTUJK-JTQLQIEISA-N 1 1 324.377 3.793 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000360686012 1031521518 /nfs/dbraw/zinc/52/15/18/1031521518.db2.gz PEOGJIIBKDGGJC-LJQANCHMSA-N 1 1 324.380 3.616 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293837456 1031648407 /nfs/dbraw/zinc/64/84/07/1031648407.db2.gz SRMALUSVPCFEDP-UWVGGRQHSA-N 1 1 321.327 3.867 20 5 DHBDMO Cc1nc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)sc1C ZINC000873066441 1031700490 /nfs/dbraw/zinc/70/04/90/1031700490.db2.gz WTZHCSGCAWTTGM-UHFFFAOYSA-N 1 1 305.403 3.575 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846109768 1031860008 /nfs/dbraw/zinc/86/00/08/1031860008.db2.gz VNDUYDDLZYKSEL-VFQAQYNWSA-N 1 1 308.328 3.729 20 5 DHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000877491098 1033319118 /nfs/dbraw/zinc/31/91/18/1033319118.db2.gz DROPIRUJUPAJRI-KRWDZBQOSA-N 1 1 306.406 3.603 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000877607499 1033380546 /nfs/dbraw/zinc/38/05/46/1033380546.db2.gz GQYFLEVIVVXMNZ-CQSZACIVSA-N 1 1 318.417 3.603 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCCC[C@H](F)C1)CC2 ZINC001172907129 1033439698 /nfs/dbraw/zinc/43/96/98/1033439698.db2.gz DIJVDOPQBFAKEO-HOTGVXAUSA-N 1 1 306.381 3.666 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@]3(CC3(F)F)C1)CC2 ZINC001172917682 1033463737 /nfs/dbraw/zinc/46/37/37/1033463737.db2.gz WLAVDUHSEFJPKS-GOEBONIOSA-N 1 1 322.355 3.573 20 5 DHBDMO CC[C@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172919320 1033467447 /nfs/dbraw/zinc/46/74/47/1033467447.db2.gz FVNDVBMDCYMMAN-YOEHRIQHSA-N 1 1 302.418 3.964 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCCCC13CC3)CC2 ZINC001172921309 1033470079 /nfs/dbraw/zinc/47/00/79/1033470079.db2.gz ODTZOAWEWUWQOM-MRXNPFEDSA-N 1 1 300.402 3.861 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2[C@H](C)CCC[C@@H]2C)c1F ZINC001173181065 1033581456 /nfs/dbraw/zinc/58/14/56/1033581456.db2.gz BGMKATIQIJKQHN-XQQFMLRXSA-N 1 1 324.396 3.936 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001173221294 1033603770 /nfs/dbraw/zinc/60/37/70/1033603770.db2.gz HPEOMKPKKLGRGG-FPMFFAJLSA-N 1 1 310.344 3.503 20 5 DHBDMO Cc1ccc2c(c1)C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173226515 1033606187 /nfs/dbraw/zinc/60/61/87/1033606187.db2.gz MIZFYJXVCDPOGN-OAHLLOKOSA-N 1 1 310.397 3.893 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2c(F)cccc2C1 ZINC001173235717 1033607983 /nfs/dbraw/zinc/60/79/83/1033607983.db2.gz YVKIBSCAQWPSKK-CYBMUJFWSA-N 1 1 314.360 3.723 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1nccs1 ZINC001173233981 1033608756 /nfs/dbraw/zinc/60/87/56/1033608756.db2.gz NLKLRRSGGCZPCX-WFASDCNBSA-N 1 1 317.414 3.819 20 5 DHBDMO COc1cccc2c1C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173231554 1033609022 /nfs/dbraw/zinc/60/90/22/1033609022.db2.gz MRCDZKXCIFXSJJ-CYBMUJFWSA-N 1 1 312.369 3.550 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1cccc(F)c1 ZINC001173233399 1033609204 /nfs/dbraw/zinc/60/92/04/1033609204.db2.gz WGMXRPSUNYBXOR-AWEZNQCLSA-N 1 1 316.376 3.839 20 5 DHBDMO Cc1ccc(C[N@H+](C)C[C@@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000183253623 1034366705 /nfs/dbraw/zinc/36/67/05/1034366705.db2.gz QYAXOJMZDVLTSQ-GFCCVEGCSA-N 1 1 305.403 3.595 20 5 DHBDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000183338519 1034378448 /nfs/dbraw/zinc/37/84/48/1034378448.db2.gz DGZYYIUHRNRFGC-QGZVFWFLSA-N 1 1 306.406 3.684 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000777440460 1034743905 /nfs/dbraw/zinc/74/39/05/1034743905.db2.gz WUPBOUGZOHJMGK-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO CCC[C@H](C)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159418699 1035052218 /nfs/dbraw/zinc/05/22/18/1035052218.db2.gz RLIDAXAXUKVRMK-JTQLQIEISA-N 1 1 315.211 3.978 20 5 DHBDMO Cc1[nH+]c2ccc(F)cn2c1Nc1cc([N+](=O)[O-])ccc1F ZINC001175734842 1035097343 /nfs/dbraw/zinc/09/73/43/1035097343.db2.gz FHNHWLMLZRFHFC-UHFFFAOYSA-N 1 1 304.256 3.573 20 5 DHBDMO Cc1cccc([C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)n1 ZINC000160059707 1035131165 /nfs/dbraw/zinc/13/11/65/1035131165.db2.gz SDWRNDRZYAHXQU-GOSISDBHSA-N 1 1 311.385 3.678 20 5 DHBDMO CC[C@@H](C)C[N@@H+](CC)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000482883841 1035194507 /nfs/dbraw/zinc/19/45/07/1035194507.db2.gz BEKDALKMNBAYPK-CYBMUJFWSA-N 1 1 321.421 3.600 20 5 DHBDMO Cc1ccc([C@@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000483186837 1035240347 /nfs/dbraw/zinc/24/03/47/1035240347.db2.gz SBWJANMXSQKIPP-PBHICJAKSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000483186837 1035240350 /nfs/dbraw/zinc/24/03/50/1035240350.db2.gz SBWJANMXSQKIPP-PBHICJAKSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)nc2c1 ZINC000483853149 1035306413 /nfs/dbraw/zinc/30/64/13/1035306413.db2.gz FPIODMWIGJNJJF-ZDUSSCGKSA-N 1 1 324.384 3.939 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)[nH]c2c1 ZINC000483853149 1035306419 /nfs/dbraw/zinc/30/64/19/1035306419.db2.gz FPIODMWIGJNJJF-ZDUSSCGKSA-N 1 1 324.384 3.939 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1C[C@@H](C2CC2)C[C@H]1C1CC1 ZINC001176655209 1035316180 /nfs/dbraw/zinc/31/61/80/1035316180.db2.gz FOUMMJMCZSKTLM-HOCLYGCPSA-N 1 1 304.365 3.744 20 5 DHBDMO COc1ccccc1C[N@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001180497747 1035704192 /nfs/dbraw/zinc/70/41/92/1035704192.db2.gz RBQBFYYWFCZHEA-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO COc1ccccc1C[N@@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001180497747 1035704208 /nfs/dbraw/zinc/70/42/08/1035704208.db2.gz RBQBFYYWFCZHEA-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494699988 1035777557 /nfs/dbraw/zinc/77/75/57/1035777557.db2.gz AJCNDYSZYSLEOI-UKRRQHHQSA-N 1 1 304.390 3.547 20 5 DHBDMO CSc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC001180984893 1035809597 /nfs/dbraw/zinc/80/95/97/1035809597.db2.gz DNMGQNCUZQZMCN-UHFFFAOYSA-N 1 1 306.362 3.746 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(F)c(F)c1F ZINC001181155252 1035853930 /nfs/dbraw/zinc/85/39/30/1035853930.db2.gz ZTGYDCXAWGTSKP-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(F)c(F)c1F ZINC001181155252 1035853948 /nfs/dbraw/zinc/85/39/48/1035853948.db2.gz ZTGYDCXAWGTSKP-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO COC(C)(C)C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000539927905 1035932673 /nfs/dbraw/zinc/93/26/73/1035932673.db2.gz WXDNITWQHGBHKP-UHFFFAOYSA-N 1 1 318.373 3.712 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000027211595 1036219077 /nfs/dbraw/zinc/21/90/77/1036219077.db2.gz AQLQYEKHUOOWAR-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(F)c1 ZINC000271812436 1036547713 /nfs/dbraw/zinc/54/77/13/1036547713.db2.gz RCVLHPAOMCICRF-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO CC[C@@H]1CCC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000915209294 1036706994 /nfs/dbraw/zinc/70/69/94/1036706994.db2.gz MGWKRBZNGVBCIT-LLVKDONJSA-N 1 1 321.402 3.951 20 5 DHBDMO CC[C@@H]1CCC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000915209294 1036707008 /nfs/dbraw/zinc/70/70/08/1036707008.db2.gz MGWKRBZNGVBCIT-LLVKDONJSA-N 1 1 321.402 3.951 20 5 DHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cccc(CO)c1 ZINC000271957676 1036755194 /nfs/dbraw/zinc/75/51/94/1036755194.db2.gz LBEJJHLVPJWSQD-LLVKDONJSA-N 1 1 320.776 3.591 20 5 DHBDMO CS[C@H]1CCCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000492209499 1036787192 /nfs/dbraw/zinc/78/71/92/1036787192.db2.gz LOOSPPXOHLRIIE-NSHDSACASA-N 1 1 314.838 3.966 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccccc2)C2CC2)c(F)c1 ZINC001198063100 1036948963 /nfs/dbraw/zinc/94/89/63/1036948963.db2.gz ZQYYGDORLPXFHP-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@@H](C(C)(C)C)CC1 ZINC001198800933 1037139362 /nfs/dbraw/zinc/13/93/62/1037139362.db2.gz NNWMITOICIVDKM-XJKSGUPXSA-N 1 1 306.406 3.793 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCC[C@@]12CCCOC2 ZINC001198820870 1037140850 /nfs/dbraw/zinc/14/08/50/1037140850.db2.gz MSERIPONNVCGJN-INIZCTEOSA-N 1 1 324.808 3.783 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCC[C@@]12CCCOC2 ZINC001198820870 1037140869 /nfs/dbraw/zinc/14/08/69/1037140869.db2.gz MSERIPONNVCGJN-INIZCTEOSA-N 1 1 324.808 3.783 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC3(C2)CCCCC3)c([N+](=O)[O-])c1 ZINC000774910221 1037202217 /nfs/dbraw/zinc/20/22/17/1037202217.db2.gz UIXHFGQMUZYZLN-UHFFFAOYSA-N 1 1 319.361 3.659 20 5 DHBDMO CC(C)(C)C1=CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000774915780 1037226622 /nfs/dbraw/zinc/22/66/22/1037226622.db2.gz VHCUPUHYODDVQW-UHFFFAOYSA-N 1 1 319.361 3.681 20 5 DHBDMO CC(C)(C)C1=CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000774915780 1037226638 /nfs/dbraw/zinc/22/66/38/1037226638.db2.gz VHCUPUHYODDVQW-UHFFFAOYSA-N 1 1 319.361 3.681 20 5 DHBDMO CC(C)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CCS1 ZINC000761515158 1037341064 /nfs/dbraw/zinc/34/10/64/1037341064.db2.gz QQTOTKHFFAQLKL-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CCS1 ZINC000761515158 1037341046 /nfs/dbraw/zinc/34/10/46/1037341046.db2.gz QQTOTKHFFAQLKL-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000387363709 1037631205 /nfs/dbraw/zinc/63/12/05/1037631205.db2.gz QNRMGFGIOSJKFI-ZDUSSCGKSA-N 1 1 300.358 3.763 20 5 DHBDMO C[C@H]1c2ccccc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490398975 1037707274 /nfs/dbraw/zinc/70/72/74/1037707274.db2.gz HDDAHEZOUAYDPB-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490398975 1037707294 /nfs/dbraw/zinc/70/72/94/1037707294.db2.gz HDDAHEZOUAYDPB-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c(F)c1 ZINC000491114909 1037907665 /nfs/dbraw/zinc/90/76/65/1037907665.db2.gz QRLMHOBOZAPYNS-HNNXBMFYSA-N 1 1 314.360 3.799 20 5 DHBDMO Cc1cccc(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000570935903 1038039727 /nfs/dbraw/zinc/03/97/27/1038039727.db2.gz LRLBECQFTHNSJH-OWCLPIDISA-N 1 1 317.433 3.745 20 5 DHBDMO COc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(C)c1 ZINC000776253465 1038071419 /nfs/dbraw/zinc/07/14/19/1038071419.db2.gz QLFNMAPAYPHAHV-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000609196494 1038074689 /nfs/dbraw/zinc/07/46/89/1038074689.db2.gz VYMLPBPLVUGIEW-ZDUSSCGKSA-N 1 1 318.323 3.863 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[C@@H](C2CC2)O1 ZINC001190528947 1038337792 /nfs/dbraw/zinc/33/77/92/1038337792.db2.gz OPQVZPHOLMXYSS-ROUUACIJSA-N 1 1 318.417 3.763 20 5 DHBDMO C[C@@H](C[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC001190809489 1038378727 /nfs/dbraw/zinc/37/87/27/1038378727.db2.gz KFUMGFAGFXZAIV-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc2ccccc2[nH]1 ZINC000589184924 1038445028 /nfs/dbraw/zinc/44/50/28/1038445028.db2.gz ASNLSLBNRWTEKM-UHFFFAOYSA-N 1 1 309.369 3.751 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000589192462 1038447581 /nfs/dbraw/zinc/44/75/81/1038447581.db2.gz CAXXHQPQAZVGGY-SVEBXFOSSA-N 1 1 309.369 3.840 20 5 DHBDMO CC(C)([NH2+]Cc1cccc(O)c1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000590185026 1038599361 /nfs/dbraw/zinc/59/93/61/1038599361.db2.gz WSPPUFFXTWAWCC-UHFFFAOYSA-N 1 1 320.776 3.979 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCCc2scnc21)c1cccc([N+](=O)[O-])c1 ZINC000599023755 1038988421 /nfs/dbraw/zinc/98/84/21/1038988421.db2.gz LGWVYMXYPINZKZ-MFKMUULPSA-N 1 1 303.387 3.780 20 5 DHBDMO Cc1[nH]c2nc[nH+]c(N[C@@H](C)c3ccccc3[N+](=O)[O-])c2c1C ZINC000591927977 1039042793 /nfs/dbraw/zinc/04/27/93/1039042793.db2.gz FPOMQHSJJKELPB-NSHDSACASA-N 1 1 311.345 3.656 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000592189854 1039170109 /nfs/dbraw/zinc/17/01/09/1039170109.db2.gz XWPJGHVHEAKQPV-KBPBESRZSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000592189854 1039170112 /nfs/dbraw/zinc/17/01/12/1039170112.db2.gz XWPJGHVHEAKQPV-KBPBESRZSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@@H](c1ccccc1F)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603855203 1039189956 /nfs/dbraw/zinc/18/99/56/1039189956.db2.gz OEBFTXZKDVEMIK-ZDUSSCGKSA-N 1 1 318.348 3.806 20 5 DHBDMO COc1ccc([C@H](C)[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000603871973 1039206442 /nfs/dbraw/zinc/20/64/42/1039206442.db2.gz CQGLKHJLDFWNBL-AWEZNQCLSA-N 1 1 314.385 3.839 20 5 DHBDMO C[C@H](C1CC1)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000604012344 1039279869 /nfs/dbraw/zinc/27/98/69/1039279869.db2.gz YSACRBOKQFKNOT-CYBMUJFWSA-N 1 1 304.390 3.627 20 5 DHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1cccc(F)c1 ZINC000604012487 1039280210 /nfs/dbraw/zinc/28/02/10/1039280210.db2.gz OVMYODXKISABHT-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO CC[N@@H+](CCNc1c(C)cccc1[N+](=O)[O-])CCC(F)(F)F ZINC000574212422 1039420123 /nfs/dbraw/zinc/42/01/23/1039420123.db2.gz LSWDCLNHBJIPRP-UHFFFAOYSA-N 1 1 319.327 3.589 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC3(F)F)CC2)c(Cl)c1 ZINC000593073652 1039445517 /nfs/dbraw/zinc/44/55/17/1039445517.db2.gz VPRCHDQYXMXKSK-UHFFFAOYSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000604409309 1039457277 /nfs/dbraw/zinc/45/72/77/1039457277.db2.gz WCRZVACMSXYQJK-CQSZACIVSA-N 1 1 317.414 3.733 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2C2CCCC2)cc1 ZINC000604473343 1039480794 /nfs/dbraw/zinc/48/07/94/1039480794.db2.gz WSYVNZCMJQSTLH-KRWDZBQOSA-N 1 1 304.390 3.628 20 5 DHBDMO C[N@H+](Cc1ccc(OC(F)F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000061780231 1039549646 /nfs/dbraw/zinc/54/96/46/1039549646.db2.gz FLRXBTJLRWGORD-UHFFFAOYSA-N 1 1 322.311 3.828 20 5 DHBDMO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000061780231 1039549660 /nfs/dbraw/zinc/54/96/60/1039549660.db2.gz FLRXBTJLRWGORD-UHFFFAOYSA-N 1 1 322.311 3.828 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594612900 1039874039 /nfs/dbraw/zinc/87/40/39/1039874039.db2.gz OUBJFSDCZQVKRV-DANOYGIBSA-N 1 1 316.401 3.642 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595338378 1040102562 /nfs/dbraw/zinc/10/25/62/1040102562.db2.gz RRLPMIJEUNIDOA-MEBBXXQBSA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595338378 1040102568 /nfs/dbraw/zinc/10/25/68/1040102568.db2.gz RRLPMIJEUNIDOA-MEBBXXQBSA-N 1 1 319.336 3.613 20 5 DHBDMO CCc1ccc([C@H]([NH2+]Cc2onc(C)c2[N+](=O)[O-])C(C)C)cc1 ZINC000595351284 1040124500 /nfs/dbraw/zinc/12/45/00/1040124500.db2.gz QBJSVLXLBMFCML-MRXNPFEDSA-N 1 1 317.389 3.941 20 5 DHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C(C)C)C2CCCC2)c1 ZINC000593016183 1040130314 /nfs/dbraw/zinc/13/03/14/1040130314.db2.gz KEEJLGNBEOJQAZ-UHFFFAOYSA-N 1 1 320.389 3.534 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@H](C)CC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595482097 1040139422 /nfs/dbraw/zinc/13/94/22/1040139422.db2.gz HMOBUXUOCJMIAR-DOMZBBRYSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1noc(C[N@H+]2C[C@H](C)CC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595482097 1040139428 /nfs/dbraw/zinc/13/94/28/1040139428.db2.gz HMOBUXUOCJMIAR-DOMZBBRYSA-N 1 1 315.373 3.864 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000595551041 1040169738 /nfs/dbraw/zinc/16/97/38/1040169738.db2.gz KCIIEFRGBILWRL-SNVBAGLBSA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000595551041 1040169746 /nfs/dbraw/zinc/16/97/46/1040169746.db2.gz KCIIEFRGBILWRL-SNVBAGLBSA-N 1 1 320.286 3.898 20 5 DHBDMO CC[C@H](C)[N@@H+](CC)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000595600871 1040201815 /nfs/dbraw/zinc/20/18/15/1040201815.db2.gz QGQMOKNWAUDFRC-LBPRGKRZSA-N 1 1 303.362 3.870 20 5 DHBDMO COc1ccc2c(c1)CC[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000595760181 1040232544 /nfs/dbraw/zinc/23/25/44/1040232544.db2.gz RQZFKEYLVATRMA-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc2c(c1)CC[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000595760181 1040232556 /nfs/dbraw/zinc/23/25/56/1040232556.db2.gz RQZFKEYLVATRMA-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO Cc1cc(N[C@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])s1 ZINC000596174468 1040335372 /nfs/dbraw/zinc/33/53/72/1040335372.db2.gz BDROJHGGOJCJJF-AWEZNQCLSA-N 1 1 303.387 3.563 20 5 DHBDMO Cc1cc(N[C@H]2C[N@H+](C)Cc3ccccc32)c([N+](=O)[O-])s1 ZINC000596174468 1040335381 /nfs/dbraw/zinc/33/53/81/1040335381.db2.gz BDROJHGGOJCJJF-AWEZNQCLSA-N 1 1 303.387 3.563 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000174350075 1040629949 /nfs/dbraw/zinc/62/99/49/1040629949.db2.gz GIGGLRIVAARAGA-KGLIPLIRSA-N 1 1 312.410 3.840 20 5 DHBDMO C[C@H](NCCC[N@H+]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000122129030 1040983998 /nfs/dbraw/zinc/98/39/98/1040983998.db2.gz BYCBXEDJYIXQOZ-GJZGRUSLSA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](c2cccnc2)C1 ZINC000602854948 1041264940 /nfs/dbraw/zinc/26/49/40/1041264940.db2.gz NWSRISKBGJBTEQ-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000090458802 185297568 /nfs/dbraw/zinc/29/75/68/185297568.db2.gz HWHXGZXBDFQAMN-SNVBAGLBSA-N 1 1 303.387 3.780 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccccc1F ZINC000027539040 182475699 /nfs/dbraw/zinc/47/56/99/182475699.db2.gz BGQILCNYTCODNR-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO CC(C)(C)c1ncc(C[NH2+]Cc2ccccc2[N+](=O)[O-])s1 ZINC000059181009 184135134 /nfs/dbraw/zinc/13/51/34/184135134.db2.gz YJHHPMAGTFZFGE-UHFFFAOYSA-N 1 1 305.403 3.639 20 5 DHBDMO COCC[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccco1 ZINC000273318793 130106504 /nfs/dbraw/zinc/10/65/04/130106504.db2.gz WBPRNJUIZJKOCE-ZDUSSCGKSA-N 1 1 324.764 3.709 20 5 DHBDMO Cc1cncc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000274338663 130226960 /nfs/dbraw/zinc/22/69/60/130226960.db2.gz AIPAGXIGGLMAPL-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)nc1)c1ccccc1[N+](=O)[O-] ZINC000284374384 131075364 /nfs/dbraw/zinc/07/53/64/131075364.db2.gz NWPMKAGXFKJXOS-GFCCVEGCSA-N 1 1 314.389 3.533 20 5 DHBDMO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000285365343 131161316 /nfs/dbraw/zinc/16/13/16/131161316.db2.gz BQZLMSPOWZBLQX-UHFFFAOYSA-N 1 1 303.362 3.533 20 5 DHBDMO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000285487932 131173031 /nfs/dbraw/zinc/17/30/31/131173031.db2.gz BWJHLOCHPOVHFL-UHFFFAOYSA-N 1 1 323.780 3.878 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC=C(c2cccnc2)C1 ZINC000289270988 131369990 /nfs/dbraw/zinc/36/99/90/131369990.db2.gz FCLGLZJVALHXAN-CQSZACIVSA-N 1 1 309.369 3.840 20 5 DHBDMO CCC(CC)[N@@H+](CC)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000289372237 131379914 /nfs/dbraw/zinc/37/99/14/131379914.db2.gz IIZPESMMAKYEGT-UHFFFAOYSA-N 1 1 318.377 3.655 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000289484383 131389597 /nfs/dbraw/zinc/38/95/97/131389597.db2.gz IOROJLZPPYOOGI-XYPHTWIQSA-N 1 1 316.401 3.689 20 5 DHBDMO CC(C)(CO)[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000340564303 132006884 /nfs/dbraw/zinc/00/68/84/132006884.db2.gz ZBUQXMUDCKLFSD-OAHLLOKOSA-N 1 1 320.414 3.506 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353610003 132111603 /nfs/dbraw/zinc/11/16/03/132111603.db2.gz VKJFIXPGKPLQCK-LBPRGKRZSA-N 1 1 300.449 3.764 20 5 DHBDMO C[C@H](C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC000525875381 335089468 /nfs/dbraw/zinc/08/94/68/335089468.db2.gz SQFZUANEBWTQIU-CYBMUJFWSA-N 1 1 314.360 3.896 20 5 DHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCCC1 ZINC000409859342 332060032 /nfs/dbraw/zinc/06/00/32/332060032.db2.gz RSTCHIJRUGOQOB-UHFFFAOYSA-N 1 1 319.405 3.578 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC=C(c2ccccn2)C1 ZINC000555878328 332266131 /nfs/dbraw/zinc/26/61/31/332266131.db2.gz JBVCTGHHMZUYEC-CQSZACIVSA-N 1 1 309.369 3.840 20 5 DHBDMO COc1cccc(F)c1[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000179924914 333026777 /nfs/dbraw/zinc/02/67/77/333026777.db2.gz JCGMSSZLTQUFFQ-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO C[C@@H]([NH2+]CC1(N(C)C)CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000314122311 333088303 /nfs/dbraw/zinc/08/83/03/333088303.db2.gz PMFVKAXTQJMFMV-CQSZACIVSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccn(C(C)C)n2)cc1[N+](=O)[O-] ZINC000178509919 333139939 /nfs/dbraw/zinc/13/99/39/333139939.db2.gz BONYBTWNSFUWGI-CYBMUJFWSA-N 1 1 302.378 3.531 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1ccc2cncn2c1)c1cccc([N+](=O)[O-])c1 ZINC000414193719 333911906 /nfs/dbraw/zinc/91/19/06/333911906.db2.gz UPPBKJDSWDWPFT-GOSISDBHSA-N 1 1 324.384 3.874 20 5 DHBDMO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000276365620 334076182 /nfs/dbraw/zinc/07/61/82/334076182.db2.gz ZXHLNSUKVKYZLY-LLVKDONJSA-N 1 1 304.321 3.633 20 5 DHBDMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000276365620 334076183 /nfs/dbraw/zinc/07/61/83/334076183.db2.gz ZXHLNSUKVKYZLY-LLVKDONJSA-N 1 1 304.321 3.633 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC2(C1)CCCCC2 ZINC000303839562 334336010 /nfs/dbraw/zinc/33/60/10/334336010.db2.gz BKDRJSZLMJEOOS-UHFFFAOYSA-N 1 1 304.390 3.760 20 5 DHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000535250906 334382615 /nfs/dbraw/zinc/38/26/15/334382615.db2.gz GJFNMIYFKMHNHQ-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H](c1ccc(F)cc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000535250906 334382617 /nfs/dbraw/zinc/38/26/17/334382617.db2.gz GJFNMIYFKMHNHQ-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc2ncccc2c1 ZINC000352570014 336225118 /nfs/dbraw/zinc/22/51/18/336225118.db2.gz AVGPWOLCUIUACH-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCO[C@H](C)C1 ZINC000352717262 336232039 /nfs/dbraw/zinc/23/20/39/336232039.db2.gz HXCSRZLOFNDIBS-ZBFHGGJFSA-N 1 1 306.406 3.620 20 5 DHBDMO C[C@H]1C[C@H](C)[NH+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000526989546 336278776 /nfs/dbraw/zinc/27/87/76/336278776.db2.gz OTDRKQDEJPVAMT-QWRGUYRKSA-N 1 1 303.387 3.701 20 5 DHBDMO C[N@H+]1CC[C@@H](Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000301879375 336335776 /nfs/dbraw/zinc/33/57/76/336335776.db2.gz ZIQZGYVUKFOQPI-WBVHZDCISA-N 1 1 315.348 3.591 20 5 DHBDMO C[C@H](CNc1sccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000301995912 336342083 /nfs/dbraw/zinc/34/20/83/336342083.db2.gz PQQOZVCGOLCLMP-SNVBAGLBSA-N 1 1 323.443 3.577 20 5 DHBDMO C[C@H](CNc1sccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000301995912 336342084 /nfs/dbraw/zinc/34/20/84/336342084.db2.gz PQQOZVCGOLCLMP-SNVBAGLBSA-N 1 1 323.443 3.577 20 5 DHBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302067076 336346609 /nfs/dbraw/zinc/34/66/09/336346609.db2.gz WNAAUNNKWOBGDD-CHWSQXEVSA-N 1 1 321.396 3.799 20 5 DHBDMO Cc1ccc(C(C)(C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000353575305 336426283 /nfs/dbraw/zinc/42/62/83/336426283.db2.gz ZTCJZSRDVIKKNP-UHFFFAOYSA-N 1 1 319.792 3.977 20 5 DHBDMO Cc1c(C[NH2+][C@@H](C)c2ccc(Cl)cn2)cccc1[N+](=O)[O-] ZINC000358330765 336624449 /nfs/dbraw/zinc/62/44/49/336624449.db2.gz YOBRWKQWOACZFO-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000375395218 337010337 /nfs/dbraw/zinc/01/03/37/337010337.db2.gz XBRYYSORHFZSSK-RDJZCZTQSA-N 1 1 314.389 3.580 20 5 DHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000376551862 337036538 /nfs/dbraw/zinc/03/65/38/337036538.db2.gz JFDQXWPSCWOEPG-SJKOYZFVSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000376551862 337036539 /nfs/dbraw/zinc/03/65/39/337036539.db2.gz JFDQXWPSCWOEPG-SJKOYZFVSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000194243194 337086411 /nfs/dbraw/zinc/08/64/11/337086411.db2.gz ANPSWIGKEBRXPI-ZDUSSCGKSA-N 1 1 322.368 3.836 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000582877416 337209690 /nfs/dbraw/zinc/20/96/90/337209690.db2.gz OBLWUTPFODPYFW-RPHSKFLZSA-N 1 1 310.344 3.975 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000583173589 337253520 /nfs/dbraw/zinc/25/35/20/337253520.db2.gz GJZLDRGAMNEGHY-GJZGRUSLSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000583173589 337253521 /nfs/dbraw/zinc/25/35/21/337253521.db2.gz GJZLDRGAMNEGHY-GJZGRUSLSA-N 1 1 307.438 3.674 20 5 DHBDMO CC[C@@H](NC[C@H](C)C[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000321477760 337270641 /nfs/dbraw/zinc/27/06/41/337270641.db2.gz ATJWBJSDEHGCGR-MAUKXSAKSA-N 1 1 319.449 3.758 20 5 DHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CC1(C)C ZINC000426550624 338034594 /nfs/dbraw/zinc/03/45/94/338034594.db2.gz XIOYILZPDZEKEC-AWEZNQCLSA-N 1 1 317.414 3.949 20 5 DHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CC1(C)C ZINC000426550624 338034595 /nfs/dbraw/zinc/03/45/95/338034595.db2.gz XIOYILZPDZEKEC-AWEZNQCLSA-N 1 1 317.414 3.949 20 5 DHBDMO CCCc1nc(C)c(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000428963529 338066997 /nfs/dbraw/zinc/06/69/97/338066997.db2.gz DBTKQMPATFFMOQ-UHFFFAOYSA-N 1 1 317.389 3.518 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](CSC)C2)ccc1[N+](=O)[O-] ZINC000429290432 338076539 /nfs/dbraw/zinc/07/65/39/338076539.db2.gz GAHRSZYXGAJRFN-CQSZACIVSA-N 1 1 324.446 3.569 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000430192563 338100385 /nfs/dbraw/zinc/10/03/85/338100385.db2.gz CFFBCBJDYCTZSC-UGSOOPFHSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000430192563 338100386 /nfs/dbraw/zinc/10/03/86/338100386.db2.gz CFFBCBJDYCTZSC-UGSOOPFHSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cccc(Cl)c1 ZINC000430215078 338101790 /nfs/dbraw/zinc/10/17/90/338101790.db2.gz CYYDIBDCLBNVQQ-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cccc(Cl)c1 ZINC000430215078 338101791 /nfs/dbraw/zinc/10/17/91/338101791.db2.gz CYYDIBDCLBNVQQ-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1cc(C)oc1C ZINC000430230317 338102339 /nfs/dbraw/zinc/10/23/39/338102339.db2.gz XXJLYHCYFCQESQ-LLVKDONJSA-N 1 1 304.346 3.664 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CC1CC1)CC1CCC1 ZINC000430236473 338102615 /nfs/dbraw/zinc/10/26/15/338102615.db2.gz BDEBAVVLUWOTRL-UHFFFAOYSA-N 1 1 304.390 3.616 20 5 DHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ccc([N+](=O)[O-])nc2)cc1 ZINC000433414962 338194975 /nfs/dbraw/zinc/19/49/75/338194975.db2.gz PQACXFCVPSMQNY-LBPRGKRZSA-N 1 1 323.356 3.657 20 5 DHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCOc1ccccc1 ZINC000434991445 338229118 /nfs/dbraw/zinc/22/91/18/338229118.db2.gz MPSNZVYHSNCVTR-VQHVLOKHSA-N 1 1 312.369 3.619 20 5 DHBDMO Cc1cnc(NC[C@@H]2CCC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000435589566 338243006 /nfs/dbraw/zinc/24/30/06/338243006.db2.gz SZBNKSSUYQZXRK-HNNXBMFYSA-N 1 1 318.421 3.507 20 5 DHBDMO Cc1nc(C(C)C)oc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451102988 338721246 /nfs/dbraw/zinc/72/12/46/338721246.db2.gz MGLSVVMPJIRLLS-NSHDSACASA-N 1 1 303.362 3.865 20 5 DHBDMO CCCc1ncc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000453382229 338835446 /nfs/dbraw/zinc/83/54/46/338835446.db2.gz LTTLZVZBJCBTCH-LBPRGKRZSA-N 1 1 303.362 3.695 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@H](C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000464482908 339143070 /nfs/dbraw/zinc/14/30/70/339143070.db2.gz BIJGWMBBNSXDRA-LBPRGKRZSA-N 1 1 310.369 3.611 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCOCc1ccccc1 ZINC000464859808 339158440 /nfs/dbraw/zinc/15/84/40/339158440.db2.gz YTIQZFXERBNORM-HNNXBMFYSA-N 1 1 314.385 3.804 20 5 DHBDMO C[C@H]([NH2+]CCN1[C@@H](C)CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000467857774 339247744 /nfs/dbraw/zinc/24/77/44/339247744.db2.gz BSDSPJYRFKJDKU-KKUMJFAQSA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1c([C@H](C)[NH2+][C@@H]2COc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000468052176 339252880 /nfs/dbraw/zinc/25/28/80/339252880.db2.gz RIBVTIBMBNUUAX-XHDPSFHLSA-N 1 1 316.332 3.827 20 5 DHBDMO Cc1c([C@@H](C)[NH2+][C@@H]2COc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000468052174 339252902 /nfs/dbraw/zinc/25/29/02/339252902.db2.gz RIBVTIBMBNUUAX-IAQYHMDHSA-N 1 1 316.332 3.827 20 5 DHBDMO COCC[C@@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000468690461 339268704 /nfs/dbraw/zinc/26/87/04/339268704.db2.gz PPGFWDRXUWURRX-HNNXBMFYSA-N 1 1 306.406 3.542 20 5 DHBDMO CCOC[C@@H]1CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000470174963 339312925 /nfs/dbraw/zinc/31/29/25/339312925.db2.gz OIAINSPEFDPKPC-XBNGYDHASA-N 1 1 318.417 3.747 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCC(F)(F)F ZINC000470178882 339312953 /nfs/dbraw/zinc/31/29/53/339312953.db2.gz PHHVWECEYLQBAA-DHZHZOJOSA-N 1 1 302.296 3.882 20 5 DHBDMO CC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1ccccn1 ZINC000470178296 339312998 /nfs/dbraw/zinc/31/29/98/339312998.db2.gz XZANNQXBTLLOBP-RVDMUPIBSA-N 1 1 311.385 3.915 20 5 DHBDMO CSC[C@H]1CCC[N@H+]1C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470179517 339313163 /nfs/dbraw/zinc/31/31/63/339313163.db2.gz YFZCAROPLDTYHX-RCBBPTIPSA-N 1 1 306.431 3.826 20 5 DHBDMO C[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000471049527 339335857 /nfs/dbraw/zinc/33/58/57/339335857.db2.gz ZMAYKIHXMHJEGL-RDTXWAMCSA-N 1 1 312.369 3.667 20 5 DHBDMO COc1ccccc1CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000505533893 340170522 /nfs/dbraw/zinc/17/05/22/340170522.db2.gz PPVVUIUBZVEHCW-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO Cc1cc(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000506948322 340204269 /nfs/dbraw/zinc/20/42/69/340204269.db2.gz WNBBNNSBDRZODZ-HLLBOEOZSA-N 1 1 317.433 3.745 20 5 DHBDMO CCc1nocc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000507251796 340215630 /nfs/dbraw/zinc/21/56/30/340215630.db2.gz KGORJNZLOUIOEG-UHFFFAOYSA-N 1 1 303.362 3.556 20 5 DHBDMO CCc1nocc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000507251796 340215631 /nfs/dbraw/zinc/21/56/31/340215631.db2.gz KGORJNZLOUIOEG-UHFFFAOYSA-N 1 1 303.362 3.556 20 5 DHBDMO CC[C@H]1C[C@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCO1 ZINC000507790120 340231514 /nfs/dbraw/zinc/23/15/14/340231514.db2.gz ABTPLEYQSFSZMS-QAPCUYQASA-N 1 1 318.417 3.764 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2cc(F)ccc2C1 ZINC000509418814 340268879 /nfs/dbraw/zinc/26/88/79/340268879.db2.gz SSJXTBVYJHORPI-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2cc(F)ccc2C1 ZINC000509418814 340268880 /nfs/dbraw/zinc/26/88/80/340268880.db2.gz SSJXTBVYJHORPI-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[N@@H+](CCc1ccc(F)c(F)c1)CCc1ccccc1[N+](=O)[O-] ZINC000511104856 340320984 /nfs/dbraw/zinc/32/09/84/340320984.db2.gz GSIKYNNQUYRZIM-UHFFFAOYSA-N 1 1 320.339 3.590 20 5 DHBDMO CCOCC[N@@H+](CC)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000512291173 340355727 /nfs/dbraw/zinc/35/57/27/340355727.db2.gz FSMDBZTZXYAEAX-UHFFFAOYSA-N 1 1 318.373 3.713 20 5 DHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC000512697619 340373528 /nfs/dbraw/zinc/37/35/28/340373528.db2.gz CYSJWHUVBJRSJZ-GOEBONIOSA-N 1 1 311.385 3.842 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC4(C3)CCCCC4)nc2c1 ZINC000547853015 341237887 /nfs/dbraw/zinc/23/78/87/341237887.db2.gz OMKRJDCXFSIYIU-UHFFFAOYSA-N 1 1 314.389 3.627 20 5 DHBDMO COc1ccc(C)cc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548934652 341281540 /nfs/dbraw/zinc/28/15/40/341281540.db2.gz MWTUCAKXNHPVKV-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO C[N@@H+](CCCOc1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000548934612 341281618 /nfs/dbraw/zinc/28/16/18/341281618.db2.gz LZODJTUCKSNOAI-UHFFFAOYSA-N 1 1 314.385 3.538 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(F)c(F)c(F)c1 ZINC000549407704 341293541 /nfs/dbraw/zinc/29/35/41/341293541.db2.gz IKZYSEABWOIOQD-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000550444420 341317235 /nfs/dbraw/zinc/31/72/35/341317235.db2.gz UXPNMWXZVDLCQN-TZMCWYRMSA-N 1 1 322.380 3.753 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000246076729 341323899 /nfs/dbraw/zinc/32/38/99/341323899.db2.gz DKXNPEXPBXIETC-HUUCEWRRSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000246076729 341323900 /nfs/dbraw/zinc/32/39/00/341323900.db2.gz DKXNPEXPBXIETC-HUUCEWRRSA-N 1 1 310.394 3.594 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000552926026 341408982 /nfs/dbraw/zinc/40/89/82/341408982.db2.gz SNXQHVBCYJZCJT-IAQYHMDHSA-N 1 1 316.332 3.827 20 5 DHBDMO COC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccco1 ZINC000156631823 522377639 /nfs/dbraw/zinc/37/76/39/522377639.db2.gz MAGGORXIKRUPSJ-IUODEOHRSA-N 1 1 304.346 3.535 20 5 DHBDMO COC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000156427503 522766100 /nfs/dbraw/zinc/76/61/00/522766100.db2.gz YLPSCAHZKKCAJP-HIFRSBDPSA-N 1 1 318.373 3.843 20 5 DHBDMO CCc1noc(C)c1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000339435275 522845346 /nfs/dbraw/zinc/84/53/46/522845346.db2.gz CWHVXKXATCTBCK-UHFFFAOYSA-N 1 1 317.389 3.867 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc2cccnc21 ZINC000338345106 522947263 /nfs/dbraw/zinc/94/72/63/522947263.db2.gz DVNGPTSVZNFGBL-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000130956524 523016172 /nfs/dbraw/zinc/01/61/72/523016172.db2.gz MLQCWVSWUATZOG-INIZCTEOSA-N 1 1 316.357 3.671 20 5 DHBDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000130956524 523016179 /nfs/dbraw/zinc/01/61/79/523016179.db2.gz MLQCWVSWUATZOG-INIZCTEOSA-N 1 1 316.357 3.671 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181827261 524317073 /nfs/dbraw/zinc/31/70/73/524317073.db2.gz CBLAGSGBWHRCHD-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000158055933 524814768 /nfs/dbraw/zinc/81/47/68/524814768.db2.gz DODQDKMVKUETFV-HNNXBMFYSA-N 1 1 312.369 3.593 20 5 DHBDMO Cc1nc([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000189786231 527052871 /nfs/dbraw/zinc/05/28/71/527052871.db2.gz OGPDRCLLAIQKFT-INIZCTEOSA-N 1 1 317.414 3.739 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H]3CCCO3)CC2)c(Cl)c1 ZINC000189130532 527349800 /nfs/dbraw/zinc/34/98/00/527349800.db2.gz HZBOZVCRUPPXNK-INIZCTEOSA-N 1 1 324.808 3.639 20 5 DHBDMO CCOC1CC2(C1)CC[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000285638711 535400107 /nfs/dbraw/zinc/40/01/07/535400107.db2.gz ZELVNJXGBQDDBP-NVPAJSRCSA-N 1 1 304.390 3.547 20 5 DHBDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000122332364 536639167 /nfs/dbraw/zinc/63/91/67/536639167.db2.gz MGDAEVXFKAASBO-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)cs1 ZINC000054173445 1013250957 /nfs/dbraw/zinc/25/09/57/1013250957.db2.gz LZVTUEWGPBQAND-OAHLLOKOSA-N 1 1 302.399 3.863 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1COCc2ccccc21 ZINC000894951374 1013753223 /nfs/dbraw/zinc/75/32/23/1013753223.db2.gz ODKHUSYQVUMIBG-HNNXBMFYSA-N 1 1 318.760 3.609 20 5 DHBDMO C[C@@H]1c2ccc(F)cc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610003630 1013841694 /nfs/dbraw/zinc/84/16/94/1013841694.db2.gz CUSQWMJAMZLYNL-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610003630 1013841701 /nfs/dbraw/zinc/84/17/01/1013841701.db2.gz CUSQWMJAMZLYNL-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ncccc1F)CCCC2 ZINC000520547078 1014334818 /nfs/dbraw/zinc/33/48/18/1014334818.db2.gz PJYDGGZCCVDVIQ-MRXNPFEDSA-N 1 1 315.348 3.686 20 5 DHBDMO C[C@H](C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000248437210 1014444231 /nfs/dbraw/zinc/44/42/31/1014444231.db2.gz BDWOMHGPKLWEFU-VXGBXAGGSA-N 1 1 305.403 3.848 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C2CCOCC2)C1 ZINC000933082453 1014540242 /nfs/dbraw/zinc/54/02/42/1014540242.db2.gz NECRDNXVKPCBGH-WMLDXEAASA-N 1 1 318.417 3.794 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C(C)C)N2CCCC2)cc1[N+](=O)[O-] ZINC000320113497 1014587562 /nfs/dbraw/zinc/58/75/62/1014587562.db2.gz CMGOSGNWCYZIAQ-QAPCUYQASA-N 1 1 319.449 3.674 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000610505392 1014811623 /nfs/dbraw/zinc/81/16/23/1014811623.db2.gz JYSGPHRDNBGHST-OAHLLOKOSA-N 1 1 316.332 3.560 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000610505392 1014811638 /nfs/dbraw/zinc/81/16/38/1014811638.db2.gz JYSGPHRDNBGHST-OAHLLOKOSA-N 1 1 316.332 3.560 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@H]1c1cccc(F)c1 ZINC000610505391 1014812200 /nfs/dbraw/zinc/81/22/00/1014812200.db2.gz JYSGPHRDNBGHST-HNNXBMFYSA-N 1 1 316.332 3.560 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000610505391 1014812210 /nfs/dbraw/zinc/81/22/10/1014812210.db2.gz JYSGPHRDNBGHST-HNNXBMFYSA-N 1 1 316.332 3.560 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581720 1014857848 /nfs/dbraw/zinc/85/78/48/1014857848.db2.gz FRWHYOIVWHMZJY-LALPHHSUSA-N 1 1 315.373 3.889 20 5 DHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000276291995 1014916232 /nfs/dbraw/zinc/91/62/32/1014916232.db2.gz HZPQSXDVKWOIJJ-OAHLLOKOSA-N 1 1 303.337 3.712 20 5 DHBDMO CC[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1nccs1 ZINC000276324044 1014954063 /nfs/dbraw/zinc/95/40/63/1014954063.db2.gz PJDVDHPZQFQYPP-CQSZACIVSA-N 1 1 309.366 3.605 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1C[C@@H](O)c2ccccc21 ZINC000895369987 1015106274 /nfs/dbraw/zinc/10/62/74/1015106274.db2.gz ZCTQNDVCQGNXCO-GOEBONIOSA-N 1 1 318.760 3.516 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3nccs3)C2)cc1Cl ZINC000895580055 1015215891 /nfs/dbraw/zinc/21/58/91/1015215891.db2.gz FBQKVOYPGCYEDS-LLVKDONJSA-N 1 1 323.805 3.694 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000051180653 1015255307 /nfs/dbraw/zinc/25/53/07/1015255307.db2.gz ILDUWGZKNMYVID-INIZCTEOSA-N 1 1 312.369 3.811 20 5 DHBDMO CC[C@H](NC[C@H](CC)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000151692021 1015404707 /nfs/dbraw/zinc/40/47/07/1015404707.db2.gz FIDCHDICGOCJJP-RDJZCZTQSA-N 1 1 305.422 3.510 20 5 DHBDMO CCn1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)n1 ZINC000891624793 1015461930 /nfs/dbraw/zinc/46/19/30/1015461930.db2.gz GQFLBBLMBQUZGX-UHFFFAOYSA-N 1 1 316.405 3.530 20 5 DHBDMO COCC[N@@H+](Cc1cccs1)Cc1cccc([N+](=O)[O-])c1C ZINC000051283086 1015472301 /nfs/dbraw/zinc/47/23/01/1015472301.db2.gz CQMYKRKXRQGCLP-UHFFFAOYSA-N 1 1 320.414 3.613 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@@H](c3ccncc3)C2)c1 ZINC000846905390 1032129015 /nfs/dbraw/zinc/12/90/15/1032129015.db2.gz IZMPLMPKFWWRFF-CYBMUJFWSA-N 1 1 317.776 3.633 20 5 DHBDMO CC(C)(C)OCCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000610864876 1015902356 /nfs/dbraw/zinc/90/23/56/1015902356.db2.gz SPBHFIPNBQVTAH-UHFFFAOYSA-N 1 1 306.406 3.764 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2c2ccsc2)cc1 ZINC000065534699 1016213023 /nfs/dbraw/zinc/21/30/23/1016213023.db2.gz QMGAZWGUDADLTN-MRXNPFEDSA-N 1 1 318.398 3.872 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000846905886 1032144501 /nfs/dbraw/zinc/14/45/01/1032144501.db2.gz MODXMRXQKLOVRC-ZDUSSCGKSA-N 1 1 317.776 3.633 20 5 DHBDMO COCC[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000051375671 1016303976 /nfs/dbraw/zinc/30/39/76/1016303976.db2.gz AZDSOJYUTRKBCP-UHFFFAOYSA-N 1 1 314.385 3.552 20 5 DHBDMO O=[N+]([O-])c1cccc(CN2C[C@@H]3CCC[N@H+]3Cc3ccccc32)c1 ZINC000342527072 1016685840 /nfs/dbraw/zinc/68/58/40/1016685840.db2.gz UGJLQWOLCHVIOZ-SFHVURJKSA-N 1 1 323.396 3.579 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC34CCC4)cs2)c1 ZINC000537636001 1032441498 /nfs/dbraw/zinc/44/14/98/1032441498.db2.gz HRQRNKFHVIJVGV-UHFFFAOYSA-N 1 1 315.398 3.847 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC34CCC4)cs2)c1 ZINC000537636001 1032441502 /nfs/dbraw/zinc/44/15/02/1032441502.db2.gz HRQRNKFHVIJVGV-UHFFFAOYSA-N 1 1 315.398 3.847 20 5 DHBDMO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000282716843 1032462137 /nfs/dbraw/zinc/46/21/37/1032462137.db2.gz LTUODGFSFNXNMA-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@@H]1C ZINC000120125282 1012048046 /nfs/dbraw/zinc/04/80/46/1012048046.db2.gz OIAGDSLHKLGYJU-XKQJLSEDSA-N 1 1 306.406 3.529 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@]1(C)CCCO ZINC000579764992 1012051108 /nfs/dbraw/zinc/05/11/08/1012051108.db2.gz QWXJGHAWAIUZNI-XOVFHRFOSA-N 1 1 318.417 3.625 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000514206738 1012296768 /nfs/dbraw/zinc/29/67/68/1012296768.db2.gz UAAAGXJOFWXFPW-UHFFFAOYSA-N 1 1 319.449 3.852 20 5 DHBDMO CC[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1OC ZINC000037562876 1032639612 /nfs/dbraw/zinc/63/96/12/1032639612.db2.gz NTDJGHMVYJTEFH-ZDUSSCGKSA-N 1 1 306.387 3.906 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000515392423 1012611683 /nfs/dbraw/zinc/61/16/83/1012611683.db2.gz VPVYEJQZNXAYFC-SECBINFHSA-N 1 1 316.188 3.550 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000515392423 1012611694 /nfs/dbraw/zinc/61/16/94/1012611694.db2.gz VPVYEJQZNXAYFC-SECBINFHSA-N 1 1 316.188 3.550 20 5 DHBDMO CC(C)[N@H+](C)C[C@@H](C)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000515559889 1012666435 /nfs/dbraw/zinc/66/64/35/1012666435.db2.gz PYIBYSOECFDUMD-DYVFJYSZSA-N 1 1 319.449 3.636 20 5 DHBDMO CC(C)N(C)C[C@@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000515559889 1012666443 /nfs/dbraw/zinc/66/64/43/1012666443.db2.gz PYIBYSOECFDUMD-DYVFJYSZSA-N 1 1 319.449 3.636 20 5 DHBDMO CCC[C@@H]([NH2+][C@@H](C)CN(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000336852405 1012950262 /nfs/dbraw/zinc/95/02/62/1012950262.db2.gz QCNPHZLUTVJKBN-WMLDXEAASA-N 1 1 307.438 3.756 20 5 DHBDMO CC[N@@H+](CCNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1CC1 ZINC000336861668 1013015709 /nfs/dbraw/zinc/01/57/09/1013015709.db2.gz DSOHWSUSGBTZLJ-UHFFFAOYSA-N 1 1 317.311 3.510 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC000075744910 1017327673 /nfs/dbraw/zinc/32/76/73/1017327673.db2.gz JVCXIFXZPHJNPB-ZBFHGGJFSA-N 1 1 312.369 3.809 20 5 DHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444651432 1017606507 /nfs/dbraw/zinc/60/65/07/1017606507.db2.gz VFZOYRLTQVVBCV-LRDDRELGSA-N 1 1 316.405 3.872 20 5 DHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083211607 1017637679 /nfs/dbraw/zinc/63/76/79/1017637679.db2.gz DAQCJAZQPZROGH-RYUDHWBXSA-N 1 1 303.362 3.747 20 5 DHBDMO Cc1c(C[N@H+](C)Cc2cc(F)cc(F)c2)cccc1[N+](=O)[O-] ZINC000444708608 1017644382 /nfs/dbraw/zinc/64/43/82/1017644382.db2.gz RQNPMOKWVOZTSW-UHFFFAOYSA-N 1 1 306.312 3.813 20 5 DHBDMO Cc1c(C[N@@H+](C)Cc2cc(F)cc(F)c2)cccc1[N+](=O)[O-] ZINC000444708608 1017644384 /nfs/dbraw/zinc/64/43/84/1017644384.db2.gz RQNPMOKWVOZTSW-UHFFFAOYSA-N 1 1 306.312 3.813 20 5 DHBDMO CC[C@@H](NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125910007 1032723454 /nfs/dbraw/zinc/72/34/54/1032723454.db2.gz QEVPBCUAWFOHBF-MAUKXSAKSA-N 1 1 319.449 3.756 20 5 DHBDMO CC[C@@H](NC[C@@H]1CCC[N@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125910007 1032723473 /nfs/dbraw/zinc/72/34/73/1032723473.db2.gz QEVPBCUAWFOHBF-MAUKXSAKSA-N 1 1 319.449 3.756 20 5 DHBDMO C[N@H+](CCOc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000523842051 1017810324 /nfs/dbraw/zinc/81/03/24/1017810324.db2.gz BVTVDDRDCQNBMI-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000523842051 1017810344 /nfs/dbraw/zinc/81/03/44/1017810344.db2.gz BVTVDDRDCQNBMI-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093339786 1017953859 /nfs/dbraw/zinc/95/38/59/1017953859.db2.gz HHHWYYOBXJYKGE-UHFFFAOYSA-N 1 1 317.414 3.950 20 5 DHBDMO Cc1ccc([C@@H](C)N[C@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153722492 1017992079 /nfs/dbraw/zinc/99/20/79/1017992079.db2.gz RIKVHLGLHPLCEV-ZBFHGGJFSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153722492 1017992091 /nfs/dbraw/zinc/99/20/91/1017992091.db2.gz RIKVHLGLHPLCEV-ZBFHGGJFSA-N 1 1 317.433 3.571 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCC4(CCCC4)C3)nc2c1 ZINC000445867587 1018000450 /nfs/dbraw/zinc/00/04/50/1018000450.db2.gz WUTZGJMFXBQMGU-UHFFFAOYSA-N 1 1 315.373 3.892 20 5 DHBDMO Cc1cc(C)cc(OCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000248028138 1018129013 /nfs/dbraw/zinc/12/90/13/1018129013.db2.gz HFZBAAXRPKVJOE-UHFFFAOYSA-N 1 1 314.385 3.722 20 5 DHBDMO Cc1cc(C)cc(OCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000248028138 1018129018 /nfs/dbraw/zinc/12/90/18/1018129018.db2.gz HFZBAAXRPKVJOE-UHFFFAOYSA-N 1 1 314.385 3.722 20 5 DHBDMO C[C@]1(c2ccccc2)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000446713779 1018210787 /nfs/dbraw/zinc/21/07/87/1018210787.db2.gz AIMULNRVWKAMCJ-IBGZPJMESA-N 1 1 310.397 3.801 20 5 DHBDMO C[C@@H]1CCCC[C@H]1OCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000446715947 1018222760 /nfs/dbraw/zinc/22/27/60/1018222760.db2.gz WGIPGHGXKRWVLF-RDTXWAMCSA-N 1 1 318.417 3.548 20 5 DHBDMO C[C@@H]1CCCC[C@H]1OCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000446715947 1018222776 /nfs/dbraw/zinc/22/27/76/1018222776.db2.gz WGIPGHGXKRWVLF-RDTXWAMCSA-N 1 1 318.417 3.548 20 5 DHBDMO CCCCCC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000780763154 1032750272 /nfs/dbraw/zinc/75/02/72/1032750272.db2.gz XOMIMNXHXPHLJY-MRXNPFEDSA-N 1 1 316.405 3.588 20 5 DHBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000447057986 1018319203 /nfs/dbraw/zinc/31/92/03/1018319203.db2.gz FPQDFLRSMKVDDU-QGZVFWFLSA-N 1 1 306.406 3.684 20 5 DHBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000447389606 1018386633 /nfs/dbraw/zinc/38/66/33/1018386633.db2.gz ZPNWYZIVPIYAMI-KRWDZBQOSA-N 1 1 306.406 3.684 20 5 DHBDMO Cc1nn(C[N@@H+](C)Cc2ccccc2C)c2ccc([N+](=O)[O-])cc12 ZINC000764849800 1018404189 /nfs/dbraw/zinc/40/41/89/1018404189.db2.gz SUUOFGUDPDAWBD-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1nn(C[N@H+](C)Cc2ccccc2C)c2ccc([N+](=O)[O-])cc12 ZINC000764849800 1018404195 /nfs/dbraw/zinc/40/41/95/1018404195.db2.gz SUUOFGUDPDAWBD-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000526001123 1018437417 /nfs/dbraw/zinc/43/74/17/1018437417.db2.gz JMFVGISCRCGFIT-OAHLLOKOSA-N 1 1 300.333 3.723 20 5 DHBDMO C[N@H+]1Cc2ccccc2[C@H](Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000536023075 1018460290 /nfs/dbraw/zinc/46/02/90/1018460290.db2.gz LNSXWSCMIBEYHZ-MRXNPFEDSA-N 1 1 317.776 3.847 20 5 DHBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000536023075 1018460294 /nfs/dbraw/zinc/46/02/94/1018460294.db2.gz LNSXWSCMIBEYHZ-MRXNPFEDSA-N 1 1 317.776 3.847 20 5 DHBDMO CC[C@H](C)C[N@@H+](CC)Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000765062142 1018466183 /nfs/dbraw/zinc/46/61/83/1018466183.db2.gz POXFPFDDVCEJCG-LBPRGKRZSA-N 1 1 304.394 3.578 20 5 DHBDMO CC[N@@H+]1CCC[C@@H](Oc2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC001228204198 1018532225 /nfs/dbraw/zinc/53/22/25/1018532225.db2.gz ICEPDAUTAVEWER-SNVBAGLBSA-N 1 1 319.188 3.765 20 5 DHBDMO CC[N@H+]1CCC[C@@H](Oc2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC001228204198 1018532231 /nfs/dbraw/zinc/53/22/31/1018532231.db2.gz ICEPDAUTAVEWER-SNVBAGLBSA-N 1 1 319.188 3.765 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000514947800 1018802780 /nfs/dbraw/zinc/80/27/80/1018802780.db2.gz KSEIAIUZRPCVRP-CYBMUJFWSA-N 1 1 317.776 3.633 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCC2(CCCC2)O1 ZINC000584104263 1018956825 /nfs/dbraw/zinc/95/68/25/1018956825.db2.gz FVVPJEFIFLMPTK-INIZCTEOSA-N 1 1 318.417 3.561 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000248632032 1019080892 /nfs/dbraw/zinc/08/08/92/1019080892.db2.gz RKPQQCPDRJNGHC-SMDDNHRTSA-N 1 1 308.353 3.507 20 5 DHBDMO CCCO[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255356027 1019406744 /nfs/dbraw/zinc/40/67/44/1019406744.db2.gz VJOCPNJQWAXQGF-CTEOGUNLSA-N 1 1 318.417 3.889 20 5 DHBDMO CCCO[C@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255356023 1019407271 /nfs/dbraw/zinc/40/72/71/1019407271.db2.gz VJOCPNJQWAXQGF-AFCDSYGPSA-N 1 1 318.417 3.889 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000611265352 1019427898 /nfs/dbraw/zinc/42/78/98/1019427898.db2.gz AHPDSBQFUQXZTA-KRWDZBQOSA-N 1 1 312.369 3.946 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000611350315 1019451219 /nfs/dbraw/zinc/45/12/19/1019451219.db2.gz ICCQPDDBOPEGOT-JKSUJKDBSA-N 1 1 318.417 3.542 20 5 DHBDMO COc1cc(C[N@H+](Cc2ccc(C)o2)C2CC2)ccc1[N+](=O)[O-] ZINC000611515364 1019509330 /nfs/dbraw/zinc/50/93/30/1019509330.db2.gz QXMPMKXJDRCLDA-UHFFFAOYSA-N 1 1 316.357 3.669 20 5 DHBDMO COc1cc(C[N@@H+](Cc2ccc(C)o2)C2CC2)ccc1[N+](=O)[O-] ZINC000611515364 1019509335 /nfs/dbraw/zinc/50/93/35/1019509335.db2.gz QXMPMKXJDRCLDA-UHFFFAOYSA-N 1 1 316.357 3.669 20 5 DHBDMO Cc1cnc(Cl)c(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000922144784 1019516722 /nfs/dbraw/zinc/51/67/22/1019516722.db2.gz XIOCDKWCEVAPHT-UHFFFAOYSA-N 1 1 319.792 3.977 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCc2ccccc2[C@@H]1C ZINC000730260560 1019969280 /nfs/dbraw/zinc/96/92/80/1019969280.db2.gz BLMCLQSGPVHYKE-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2ccccc2[C@@H]1C ZINC000730260560 1019969283 /nfs/dbraw/zinc/96/92/83/1019969283.db2.gz BLMCLQSGPVHYKE-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000092332259 1020084042 /nfs/dbraw/zinc/08/40/42/1020084042.db2.gz LIAYWHGGBFXGIX-QMMMGPOBSA-N 1 1 309.753 3.704 20 5 DHBDMO Cc1ccc(C[N@H+](C)[C@H](C)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000093324673 1020147801 /nfs/dbraw/zinc/14/78/01/1020147801.db2.gz YKCSATWOLSEIQT-CQSZACIVSA-N 1 1 314.385 3.672 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1 ZINC000280901543 1020314803 /nfs/dbraw/zinc/31/48/03/1020314803.db2.gz DVBPFGCGUVSWCQ-RCCFBDPRSA-N 1 1 318.417 3.500 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451963647 1020463205 /nfs/dbraw/zinc/46/32/05/1020463205.db2.gz HTBWHROUPGRXLH-CZUORRHYSA-N 1 1 306.431 3.875 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000177205271 1020515457 /nfs/dbraw/zinc/51/54/57/1020515457.db2.gz QVQPZPDWOPGHLS-LSDHHAIUSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000177205271 1020515459 /nfs/dbraw/zinc/51/54/59/1020515459.db2.gz QVQPZPDWOPGHLS-LSDHHAIUSA-N 1 1 310.394 3.594 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1nn(C)c2ccccc12 ZINC000612829292 1020721833 /nfs/dbraw/zinc/72/18/33/1020721833.db2.gz RNTUPKNYGCKGTK-ZDUSSCGKSA-N 1 1 324.384 3.641 20 5 DHBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000740870913 1020956809 /nfs/dbraw/zinc/95/68/09/1020956809.db2.gz LZCFCLIEBVCPPB-NWDGAFQWSA-N 1 1 311.813 3.557 20 5 DHBDMO Cc1nc2ccccc2nc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180426942 1021113591 /nfs/dbraw/zinc/11/35/91/1021113591.db2.gz LWYNHYGRSYREIA-LBPRGKRZSA-N 1 1 322.368 3.697 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2c2cccs2)cc1 ZINC000776276444 1021220283 /nfs/dbraw/zinc/22/02/83/1021220283.db2.gz NCFKWNPMPLKTBD-GJZGRUSLSA-N 1 1 318.398 3.527 20 5 DHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776278162 1021226205 /nfs/dbraw/zinc/22/62/05/1021226205.db2.gz RVTFIBQZNPFBSJ-RRQGHBQHSA-N 1 1 306.406 3.529 20 5 DHBDMO CCC1CC[NH+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1 ZINC000917483721 1021273112 /nfs/dbraw/zinc/27/31/12/1021273112.db2.gz VDZDYVIKPLAMQB-UHFFFAOYSA-N 1 1 321.402 3.951 20 5 DHBDMO CC1(C)CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000743391441 1021282015 /nfs/dbraw/zinc/28/20/15/1021282015.db2.gz UKMVWYHMMAUDQG-UHFFFAOYSA-N 1 1 307.375 3.561 20 5 DHBDMO CC1(C)CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000743391441 1021282023 /nfs/dbraw/zinc/28/20/23/1021282023.db2.gz UKMVWYHMMAUDQG-UHFFFAOYSA-N 1 1 307.375 3.561 20 5 DHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000744440703 1021546124 /nfs/dbraw/zinc/54/61/24/1021546124.db2.gz GTMRCDPALZELNZ-CZUORRHYSA-N 1 1 314.389 3.536 20 5 DHBDMO COc1ccc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000541117834 1021658595 /nfs/dbraw/zinc/65/85/95/1021658595.db2.gz KGCYKZYAHSVMFI-NWANDNLSSA-N 1 1 304.390 3.614 20 5 DHBDMO CSCC[C@H](C)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122664213 1021924358 /nfs/dbraw/zinc/92/43/58/1021924358.db2.gz GARCYVSVLRVCKD-JTQLQIEISA-N 1 1 302.827 3.822 20 5 DHBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc2c(c1)CCCO2 ZINC000852782063 1022176560 /nfs/dbraw/zinc/17/65/60/1022176560.db2.gz NSPPGXCUMPBVMQ-LLVKDONJSA-N 1 1 318.398 3.832 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)C1 ZINC001169039718 1022222563 /nfs/dbraw/zinc/22/25/63/1022222563.db2.gz SPXIJRBSLXUUCP-IVMMDQJWSA-N 1 1 308.809 3.575 20 5 DHBDMO C[N@@H+](Cc1cccc(Cl)c1Cl)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035288 1022222762 /nfs/dbraw/zinc/22/27/62/1022222762.db2.gz KARLPOILWUESCC-CMPLNLGQSA-N 1 1 317.216 3.871 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C1 ZINC001169057500 1022232976 /nfs/dbraw/zinc/23/29/76/1022232976.db2.gz WDDAPLUWUDDOQH-HFBAOOFYSA-N 1 1 310.344 3.547 20 5 DHBDMO CCC[N@H+](CC)Cc1cccc([N+](=O)[O-])c1Br ZINC000233019565 1022275361 /nfs/dbraw/zinc/27/53/61/1022275361.db2.gz SZVQLLWOLUPRKC-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO CCC[N@@H+](CC)Cc1cccc([N+](=O)[O-])c1Br ZINC000233019565 1022275366 /nfs/dbraw/zinc/27/53/66/1022275366.db2.gz SZVQLLWOLUPRKC-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO Cc1cn2cc(Nc3ccc([N+](=O)[O-])cc3Cl)ccc2[nH+]1 ZINC000610116231 1022421198 /nfs/dbraw/zinc/42/11/98/1022421198.db2.gz NDVRQALJJBZJRA-UHFFFAOYSA-N 1 1 302.721 3.948 20 5 DHBDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000616123416 1022646903 /nfs/dbraw/zinc/64/69/03/1022646903.db2.gz GCXDAYOQMNJFAX-GRYCIOLGSA-N 1 1 303.362 3.602 20 5 DHBDMO C[C@H](CNc1ccc([N+](=O)[O-])s1)[N@H+]1CCc2ccccc2C1 ZINC000139414585 1022726960 /nfs/dbraw/zinc/72/69/60/1022726960.db2.gz YVLPUZNUNLBNFP-GFCCVEGCSA-N 1 1 317.414 3.515 20 5 DHBDMO CSC[C@@H]1CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000767907959 1022840448 /nfs/dbraw/zinc/84/04/48/1022840448.db2.gz YISCMCCBENRBCI-LBPRGKRZSA-N 1 1 300.811 3.576 20 5 DHBDMO CO[C@@H](C)C[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C(C)C ZINC000538718784 1033146109 /nfs/dbraw/zinc/14/61/09/1033146109.db2.gz NMUURFNIMIRQGL-AWEZNQCLSA-N 1 1 308.422 3.964 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000538722832 1033147570 /nfs/dbraw/zinc/14/75/70/1033147570.db2.gz UBFFJJVNUYELNL-OPUMOTSWSA-N 1 1 308.381 3.925 20 5 DHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)C(C)C ZINC000112658120 1023815881 /nfs/dbraw/zinc/81/58/81/1023815881.db2.gz LNKGRBCFTFVUTA-AWEZNQCLSA-N 1 1 321.421 3.598 20 5 DHBDMO Cc1[nH+]c(N)ccc1CNc1ncnc2cc3ccccc3cc21 ZINC001167785818 1023843489 /nfs/dbraw/zinc/84/34/89/1023843489.db2.gz AQSCEDHHSWNARZ-UHFFFAOYSA-N 1 1 315.380 3.681 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000859561504 1033168242 /nfs/dbraw/zinc/16/82/42/1033168242.db2.gz FQSIJZBHRVELKL-KRWDZBQOSA-N 1 1 315.348 3.760 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCc2ccc(Cl)nc21)c1cccc([N+](=O)[O-])c1 ZINC000788643702 1023912603 /nfs/dbraw/zinc/91/26/03/1023912603.db2.gz QIKZTVIRNVDSOB-QMTHXVAHSA-N 1 1 317.776 3.981 20 5 DHBDMO COC[C@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000452110147 1023978939 /nfs/dbraw/zinc/97/89/39/1023978939.db2.gz YEJKFAHURGCQDG-CABCVRRESA-N 1 1 306.406 3.713 20 5 DHBDMO C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000051650296 1024322907 /nfs/dbraw/zinc/32/29/07/1024322907.db2.gz LTQQAWXCEAFNNN-QGZVFWFLSA-N 1 1 300.333 3.853 20 5 DHBDMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000051650296 1024322920 /nfs/dbraw/zinc/32/29/20/1024322920.db2.gz LTQQAWXCEAFNNN-QGZVFWFLSA-N 1 1 300.333 3.853 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000051650299 1024324725 /nfs/dbraw/zinc/32/47/25/1024324725.db2.gz ZXOYHSCEOQLEEM-INIZCTEOSA-N 1 1 312.369 3.723 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cnc(C3CC3)o2)cc1[N+](=O)[O-] ZINC000453349124 1024475068 /nfs/dbraw/zinc/47/50/68/1024475068.db2.gz JEGLNAJSSXSCCV-LLVKDONJSA-N 1 1 301.346 3.619 20 5 DHBDMO CCCc1ncc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000453358591 1024481267 /nfs/dbraw/zinc/48/12/67/1024481267.db2.gz DWRVDDQJTPRXLW-INIZCTEOSA-N 1 1 315.373 3.703 20 5 DHBDMO COc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])cc1F ZINC000182003359 1024552396 /nfs/dbraw/zinc/55/23/96/1024552396.db2.gz PZPGVKXAYYPMHV-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000532192720 1024573107 /nfs/dbraw/zinc/57/31/07/1024573107.db2.gz DWFDZRPKVVNCGZ-XHSDSOJGSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000532192720 1024573113 /nfs/dbraw/zinc/57/31/13/1024573113.db2.gz DWFDZRPKVVNCGZ-XHSDSOJGSA-N 1 1 319.449 3.817 20 5 DHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000585754700 1024597167 /nfs/dbraw/zinc/59/71/67/1024597167.db2.gz VAFRMDOQJCJVTQ-UHFFFAOYSA-N 1 1 314.385 3.841 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)cccc1[N+](=O)[O-] ZINC000585765570 1024604155 /nfs/dbraw/zinc/60/41/55/1024604155.db2.gz SVMDXIIWAOFWJL-CYBMUJFWSA-N 1 1 324.384 3.673 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000585767909 1024605566 /nfs/dbraw/zinc/60/55/66/1024605566.db2.gz FCFGQEXIBVHJRI-KAPURRDVSA-N 1 1 316.401 3.501 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H](C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC001170347995 1024757100 /nfs/dbraw/zinc/75/71/00/1024757100.db2.gz UNJRKOODBWBGKX-MJBXVCDLSA-N 1 1 306.406 3.655 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CSc3ccccc32)c(F)c1 ZINC000350288029 1024801942 /nfs/dbraw/zinc/80/19/42/1024801942.db2.gz NVUSNWVDHUICSM-CQSZACIVSA-N 1 1 304.346 3.671 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCCCC1 ZINC000792862128 1024808018 /nfs/dbraw/zinc/80/80/18/1024808018.db2.gz JPSSHJUFZBFSTL-UHFFFAOYSA-N 1 1 307.350 3.658 20 5 DHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792865936 1024812124 /nfs/dbraw/zinc/81/21/24/1024812124.db2.gz DLJVZRQJPTZDOZ-CQSZACIVSA-N 1 1 307.350 3.514 20 5 DHBDMO CC(C)[N@H+]1CC[C@@H](CNc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000319064533 1025144013 /nfs/dbraw/zinc/14/40/13/1025144013.db2.gz XOUJMPOHWSXBHY-NSHDSACASA-N 1 1 313.348 3.675 20 5 DHBDMO C[N@H+](Cc1ccc[nH]1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000354033090 1025329078 /nfs/dbraw/zinc/32/90/78/1025329078.db2.gz HZHPYIRWLBGPGM-UHFFFAOYSA-N 1 1 311.341 3.815 20 5 DHBDMO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000354033090 1025329091 /nfs/dbraw/zinc/32/90/91/1025329091.db2.gz HZHPYIRWLBGPGM-UHFFFAOYSA-N 1 1 311.341 3.815 20 5 DHBDMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886014618 1025439042 /nfs/dbraw/zinc/43/90/42/1025439042.db2.gz LUOLCDDZUXDLHV-LBPRGKRZSA-N 1 1 319.792 3.706 20 5 DHBDMO Cc1cccc(C2=CC[N@H+](Cc3cccnc3[N+](=O)[O-])CC2)c1 ZINC000886102918 1025505249 /nfs/dbraw/zinc/50/52/49/1025505249.db2.gz UPKIAYLBSQJBKX-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO Cc1cccc(C2=CC[N@@H+](Cc3cccnc3[N+](=O)[O-])CC2)c1 ZINC000886102918 1025505258 /nfs/dbraw/zinc/50/52/58/1025505258.db2.gz UPKIAYLBSQJBKX-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886107684 1025508045 /nfs/dbraw/zinc/50/80/45/1025508045.db2.gz XNXXSTGGRPTVLL-ZDUSSCGKSA-N 1 1 315.373 3.628 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000886247573 1025570704 /nfs/dbraw/zinc/57/07/04/1025570704.db2.gz VFERHJQNJJICRG-KRWDZBQOSA-N 1 1 323.396 3.760 20 5 DHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCC[C@@H]1c1ccccc1 ZINC000886242932 1025571403 /nfs/dbraw/zinc/57/14/03/1025571403.db2.gz JFHBCQPONVHVNI-SJORKVTESA-N 1 1 311.385 3.758 20 5 DHBDMO CC(C)[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1F ZINC000886279392 1025581034 /nfs/dbraw/zinc/58/10/34/1025581034.db2.gz XMHVUIHCICRNJW-HNNXBMFYSA-N 1 1 303.337 3.616 20 5 DHBDMO CO[C@H]1CCC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000076347837 1025865905 /nfs/dbraw/zinc/86/59/05/1025865905.db2.gz KRUDQKLCGHVLPN-INIZCTEOSA-N 1 1 323.392 3.557 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000886925084 1025982212 /nfs/dbraw/zinc/98/22/12/1025982212.db2.gz DTVINZBOVQDLME-OAHLLOKOSA-N 1 1 304.296 3.650 20 5 DHBDMO C[C@H]([NH2+]CCN1[C@H](C)CCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000482631585 1026106076 /nfs/dbraw/zinc/10/60/76/1026106076.db2.gz SNLBIKNEEMLHGM-KFWWJZLASA-N 1 1 305.422 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000747532692 1026415987 /nfs/dbraw/zinc/41/59/87/1026415987.db2.gz QTJYHOUGVLPSFB-INIZCTEOSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000513483093 1026518541 /nfs/dbraw/zinc/51/85/41/1026518541.db2.gz AVHOERNMVHULDB-HNNXBMFYSA-N 1 1 300.333 3.723 20 5 DHBDMO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cs1 ZINC000293746582 1027111145 /nfs/dbraw/zinc/11/11/45/1027111145.db2.gz NVTKPNHDCRSTJM-VHSXEESVSA-N 1 1 320.418 3.608 20 5 DHBDMO Cc1[nH+]c(NCc2ccccc2[N+](=O)[O-])ccc1-c1ccccc1 ZINC000571334605 1027119515 /nfs/dbraw/zinc/11/95/15/1027119515.db2.gz QXRCFRKHWWDLJU-UHFFFAOYSA-N 1 1 319.364 4.577 20 5 DHBDMO C[C@@H]1c2ccsc2CC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000573789301 1027329246 /nfs/dbraw/zinc/32/92/46/1027329246.db2.gz XGYBHJNHWVKIJR-GFCCVEGCSA-N 1 1 318.398 3.654 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](Cc2nccs2)C1 ZINC000932199367 1027410208 /nfs/dbraw/zinc/41/02/08/1027410208.db2.gz XIFSZSDLQLIMDT-ZDUSSCGKSA-N 1 1 317.414 3.506 20 5 DHBDMO C[C@@H](C[C@H]1CCCCC[NH2+]1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423142610 1027433496 /nfs/dbraw/zinc/43/34/96/1027433496.db2.gz AUDFXRAEUMRQFX-OFQRWUPVSA-N 1 1 305.422 3.556 20 5 DHBDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]c1ccc2c(c1)CCN2 ZINC000423220260 1027462662 /nfs/dbraw/zinc/46/26/62/1027462662.db2.gz VFPYJPVTBFVCIB-CYBMUJFWSA-N 1 1 311.385 3.996 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000576554750 1027631622 /nfs/dbraw/zinc/63/16/22/1027631622.db2.gz AIZIGWPYFPKUKC-HIFRSBDPSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000576554750 1027631628 /nfs/dbraw/zinc/63/16/28/1027631628.db2.gz AIZIGWPYFPKUKC-HIFRSBDPSA-N 1 1 307.438 3.674 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)[nH]n1 ZINC000364017064 1027796456 /nfs/dbraw/zinc/79/64/56/1027796456.db2.gz ZFTSMRXURVFKBI-UKRRQHHQSA-N 1 1 314.389 3.567 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n[nH]1 ZINC000364017064 1027796472 /nfs/dbraw/zinc/79/64/72/1027796472.db2.gz ZFTSMRXURVFKBI-UKRRQHHQSA-N 1 1 314.389 3.567 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n[nH]1 ZINC000364017064 1027796488 /nfs/dbraw/zinc/79/64/88/1027796488.db2.gz ZFTSMRXURVFKBI-UKRRQHHQSA-N 1 1 314.389 3.567 20 5 DHBDMO COc1cccc(CCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000579300683 1028376408 /nfs/dbraw/zinc/37/64/08/1028376408.db2.gz UNISPPWRZVOMAV-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]Cc1c(F)cc(F)cc1F ZINC000815151590 1028383624 /nfs/dbraw/zinc/38/36/24/1028383624.db2.gz IKLWZEJRSMYXBY-HYXAFXHYSA-N 1 1 322.286 3.815 20 5 DHBDMO Cc1ccnc([C@H]2CC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)c1 ZINC000564582345 1028478496 /nfs/dbraw/zinc/47/84/96/1028478496.db2.gz CCPPDSMJDDGQQH-CABCVRRESA-N 1 1 311.385 3.849 20 5 DHBDMO C[C@H]1CCCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000187961809 1028487912 /nfs/dbraw/zinc/48/79/12/1028487912.db2.gz VUNDXRQOUZSHHU-ZDUSSCGKSA-N 1 1 315.373 3.872 20 5 DHBDMO COc1cccc([C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000009902481 1028524059 /nfs/dbraw/zinc/52/40/59/1028524059.db2.gz YEZXUCPFOIDZIB-QGZVFWFLSA-N 1 1 312.369 3.941 20 5 DHBDMO CC[C@H](CO)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449375559 1028585922 /nfs/dbraw/zinc/58/59/22/1028585922.db2.gz HPSVZYNPAUUUCB-CYBMUJFWSA-N 1 1 320.414 3.526 20 5 DHBDMO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000449462326 1028682950 /nfs/dbraw/zinc/68/29/50/1028682950.db2.gz SJRMCMZTDZXNSP-CMPLNLGQSA-N 1 1 302.296 3.758 20 5 DHBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@H](C)[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000816646675 1028973547 /nfs/dbraw/zinc/97/35/47/1028973547.db2.gz HMJTWMZIHJDPJW-NWDGAFQWSA-N 1 1 316.357 3.704 20 5 DHBDMO COC[C@H]1CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000449774920 1028988932 /nfs/dbraw/zinc/98/89/32/1028988932.db2.gz LMQAVODKMAROPG-SFKKXYGYSA-N 1 1 318.417 3.747 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1C[C@H]1c1cccc(F)c1 ZINC000411131477 1029044007 /nfs/dbraw/zinc/04/40/07/1029044007.db2.gz JPZVTHQCKFDERB-RDJZCZTQSA-N 1 1 300.333 3.722 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H]2CCC(F)(F)C2)C2CC2)c1 ZINC000450497909 1029504453 /nfs/dbraw/zinc/50/44/53/1029504453.db2.gz GZFFDJCTARTLHH-ZDUSSCGKSA-N 1 1 310.344 3.995 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCCCC1(F)F ZINC000450972981 1029753685 /nfs/dbraw/zinc/75/36/85/1029753685.db2.gz JPDQZVQSIHNIPV-CQSZACIVSA-N 1 1 312.360 3.895 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2ccncc2)C1 ZINC000451000646 1029763098 /nfs/dbraw/zinc/76/30/98/1029763098.db2.gz GGZPZANJVSZHBU-GDBMZVCRSA-N 1 1 311.385 3.930 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451429039 1029868769 /nfs/dbraw/zinc/86/87/69/1029868769.db2.gz YRIDMKWKCPQNSC-OXXUSNJHSA-N 1 1 318.417 3.590 20 5 DHBDMO COC1(CC[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCC1 ZINC000451545934 1029906531 /nfs/dbraw/zinc/90/65/31/1029906531.db2.gz HYTSPCWGKXTLFA-INIZCTEOSA-N 1 1 318.417 3.733 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCC(F)(F)F)C2)cc1 ZINC000451547284 1029913875 /nfs/dbraw/zinc/91/38/75/1029913875.db2.gz LBFHNNHLLHCBIV-GFCCVEGCSA-N 1 1 302.296 3.727 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCC3CCOCC3)C2)cc1 ZINC000451554103 1029917275 /nfs/dbraw/zinc/91/72/75/1029917275.db2.gz ZGCNJWITCWHLDU-KRWDZBQOSA-N 1 1 318.417 3.591 20 5 DHBDMO C[C@H](c1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451963688 1030067550 /nfs/dbraw/zinc/06/75/50/1030067550.db2.gz HXZXBFZVKDLTAO-CZUORRHYSA-N 1 1 306.431 3.875 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC[C@H]1CC1(Cl)Cl ZINC000823116157 1030214155 /nfs/dbraw/zinc/21/41/55/1030214155.db2.gz QLZMZOAJTYIZFT-LBPRGKRZSA-N 1 1 317.216 3.653 20 5 DHBDMO Cc1noc(C)c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350447 1030564780 /nfs/dbraw/zinc/56/47/80/1030564780.db2.gz BRHRCTOGRILLTF-UHFFFAOYSA-N 1 1 303.362 3.610 20 5 DHBDMO Cc1noc(C)c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350447 1030564794 /nfs/dbraw/zinc/56/47/94/1030564794.db2.gz BRHRCTOGRILLTF-UHFFFAOYSA-N 1 1 303.362 3.610 20 5 DHBDMO Cc1c(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)cccc1[N+](=O)[O-] ZINC000358824928 1030638429 /nfs/dbraw/zinc/63/84/29/1030638429.db2.gz NXZZQYULPRKJTD-SCLBCKFNSA-N 1 1 311.385 3.881 20 5 DHBDMO CCc1nc(C)c(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000291910697 1030693708 /nfs/dbraw/zinc/69/37/08/1030693708.db2.gz MRMORPIIEYRVBW-HNNXBMFYSA-N 1 1 315.373 3.621 20 5 DHBDMO C[C@H](C1CC1)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000122995109 1030936432 /nfs/dbraw/zinc/93/64/32/1030936432.db2.gz UKGPIGJPVXSLGL-SECBINFHSA-N 1 1 313.195 3.588 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000559073709 1031091484 /nfs/dbraw/zinc/09/14/84/1031091484.db2.gz UXEFMSXGIPIONL-PKOBYXMFSA-N 1 1 310.397 3.873 20 5 DHBDMO CCOc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872026877 1031410733 /nfs/dbraw/zinc/41/07/33/1031410733.db2.gz IGBCZLWNPPPLBU-GFCCVEGCSA-N 1 1 318.348 3.983 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc2c(c1)COC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872050671 1031438440 /nfs/dbraw/zinc/43/84/40/1031438440.db2.gz BEQLYAVEQOBWLJ-NSHDSACASA-N 1 1 316.332 3.615 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(O)c1F ZINC000872072788 1031469731 /nfs/dbraw/zinc/46/97/31/1031469731.db2.gz JZQUAQZXYWQDOH-WDEREUQCSA-N 1 1 304.321 3.851 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCSCC[C@@H]1C ZINC000429773947 1031490967 /nfs/dbraw/zinc/49/09/67/1031490967.db2.gz RRZQZRVATRCTJN-ZDUSSCGKSA-N 1 1 324.446 3.709 20 5 DHBDMO CCC[C@@H]([NH2+][C@@H](C)c1nccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000872132582 1031525217 /nfs/dbraw/zinc/52/52/17/1031525217.db2.gz GPXPPERJVKVOPD-XJKSGUPXSA-N 1 1 314.389 3.885 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](OC3CCC3)CC2)cs1 ZINC000872260037 1031564835 /nfs/dbraw/zinc/56/48/35/1031564835.db2.gz GZOJIRJZHMGEEH-CQSZACIVSA-N 1 1 310.419 3.580 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)cs1 ZINC000872260037 1031564852 /nfs/dbraw/zinc/56/48/52/1031564852.db2.gz GZOJIRJZHMGEEH-CQSZACIVSA-N 1 1 310.419 3.580 20 5 DHBDMO Cc1nn(C[N@@H+]2CCCC[C@H]2CCC(C)C)c(C)c1[N+](=O)[O-] ZINC000760408147 1031707890 /nfs/dbraw/zinc/70/78/90/1031707890.db2.gz MZRWLYOIVPPTEI-HNNXBMFYSA-N 1 1 308.426 3.656 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)o1 ZINC000846111252 1031863851 /nfs/dbraw/zinc/86/38/51/1031863851.db2.gz KUDGEMWBWVSORP-BETUJISGSA-N 1 1 320.295 3.552 20 5 DHBDMO C[C@]1(F)CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172906116 1033438193 /nfs/dbraw/zinc/43/81/93/1033438193.db2.gz WILNKDKVPPEXOL-RDJZCZTQSA-N 1 1 306.381 3.666 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@@H](F)CC1)CC2 ZINC001172907095 1033440027 /nfs/dbraw/zinc/44/00/27/1033440027.db2.gz CVZOVIHBJDQWJZ-HZPDHXFCSA-N 1 1 306.381 3.666 20 5 DHBDMO C[N@@H+](C1CC(F)(F)C1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907665 1033441024 /nfs/dbraw/zinc/44/10/24/1033441024.db2.gz HIZXUWQLXHXLPD-ZDUSSCGKSA-N 1 1 310.344 3.572 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@]3(CC3(F)F)C1)CC2 ZINC001172917688 1033463767 /nfs/dbraw/zinc/46/37/67/1033463767.db2.gz WLAVDUHSEFJPKS-HOCLYGCPSA-N 1 1 322.355 3.573 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)C2CCCCC2)c1F ZINC001173185934 1033584231 /nfs/dbraw/zinc/58/42/31/1033584231.db2.gz QCBDPONNFXLUEW-GFCCVEGCSA-N 1 1 324.396 3.938 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](CC2CC2)C(C)C)c1F ZINC001173188618 1033585009 /nfs/dbraw/zinc/58/50/09/1033585009.db2.gz GUTWGEZVQLJPCE-GFCCVEGCSA-N 1 1 324.396 3.794 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC3(CCC3)C2)c1F ZINC001173195163 1033587554 /nfs/dbraw/zinc/58/75/54/1033587554.db2.gz CNVGUAIOLNCWTJ-GFCCVEGCSA-N 1 1 322.380 3.550 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)C(F)(F)CC1 ZINC001173229506 1033605558 /nfs/dbraw/zinc/60/55/58/1033605558.db2.gz VGRYZWUBFFYMPI-CHWSQXEVSA-N 1 1 312.360 3.893 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](Cc1ccco1)C1CC1 ZINC001173230283 1033606571 /nfs/dbraw/zinc/60/65/71/1033606571.db2.gz DNUGVCBCLIEQBW-ZDUSSCGKSA-N 1 1 300.358 3.783 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccc(F)cc2C1 ZINC001173234638 1033608428 /nfs/dbraw/zinc/60/84/28/1033608428.db2.gz SXLZGHFYZGUMEN-CYBMUJFWSA-N 1 1 314.360 3.723 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc(F)cc1F ZINC001173233834 1033608538 /nfs/dbraw/zinc/60/85/38/1033608538.db2.gz ZNGVXTROUYHAJD-GFCCVEGCSA-N 1 1 320.339 3.936 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc(F)cc1F ZINC001173233835 1033609288 /nfs/dbraw/zinc/60/92/88/1033609288.db2.gz ZNGVXTROUYHAJD-LBPRGKRZSA-N 1 1 320.339 3.936 20 5 DHBDMO Cc1c(F)nccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000862220668 1033783872 /nfs/dbraw/zinc/78/38/72/1033783872.db2.gz XPFDMLWILNGKHD-UHFFFAOYSA-N 1 1 317.364 3.848 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880313429 1034292375 /nfs/dbraw/zinc/29/23/75/1034292375.db2.gz AOTWRBKIPQUURG-AAEUAGOBSA-N 1 1 303.387 3.602 20 5 DHBDMO Cc1c([C@H](C)NC[C@H](CC(C)C)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000480543822 1034310071 /nfs/dbraw/zinc/31/00/71/1034310071.db2.gz XQFRRUUAMXATSA-GJZGRUSLSA-N 1 1 307.438 3.530 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1F ZINC000554846524 1034364202 /nfs/dbraw/zinc/36/42/02/1034364202.db2.gz AAXHTLMPONDMNS-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000183338540 1034377767 /nfs/dbraw/zinc/37/77/67/1034377767.db2.gz DGZYYIUHRNRFGC-KRWDZBQOSA-N 1 1 306.406 3.684 20 5 DHBDMO CCc1[nH+]c(C)cn1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000865394331 1034626163 /nfs/dbraw/zinc/62/61/63/1034626163.db2.gz CUFZMIULLIYSED-UHFFFAOYSA-N 1 1 313.279 3.729 20 5 DHBDMO Cc1c([C@H](C)N[C@@H](C)C[N@@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000481183182 1034637485 /nfs/dbraw/zinc/63/74/85/1034637485.db2.gz QPBAFBTYTVQATP-YCPHGPKFSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c([C@H](C)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000481183182 1034637488 /nfs/dbraw/zinc/63/74/88/1034637488.db2.gz QPBAFBTYTVQATP-YCPHGPKFSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c(C[N@H+]2Cc3ccccc3C3(CC3)C2)cccc1[N+](=O)[O-] ZINC000481734433 1034957348 /nfs/dbraw/zinc/95/73/48/1034957348.db2.gz KMOQORJIHUIXIT-UHFFFAOYSA-N 1 1 308.381 3.951 20 5 DHBDMO C[C@H]1CCCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159412246 1035048556 /nfs/dbraw/zinc/04/85/56/1035048556.db2.gz FEKRSUSFDIHZSY-JTQLQIEISA-N 1 1 313.195 3.732 20 5 DHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159412246 1035048573 /nfs/dbraw/zinc/04/85/73/1035048573.db2.gz FEKRSUSFDIHZSY-JTQLQIEISA-N 1 1 313.195 3.732 20 5 DHBDMO Cc1ccc(C(=O)CC[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000160126414 1035136568 /nfs/dbraw/zinc/13/65/68/1035136568.db2.gz BGLJQOBRDACVQD-UHFFFAOYSA-N 1 1 324.380 3.534 20 5 DHBDMO Cc1ccc(C(=O)CC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000160126414 1035136571 /nfs/dbraw/zinc/13/65/71/1035136571.db2.gz BGLJQOBRDACVQD-UHFFFAOYSA-N 1 1 324.380 3.534 20 5 DHBDMO C[C@@H](NCC[N@@H+]1[C@H](C)CCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000482631587 1035150937 /nfs/dbraw/zinc/15/09/37/1035150937.db2.gz SNLBIKNEEMLHGM-QLFBSQMISA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@@H]([NH2+]CCN1[C@H](C)CCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000482631587 1035150942 /nfs/dbraw/zinc/15/09/42/1035150942.db2.gz SNLBIKNEEMLHGM-QLFBSQMISA-N 1 1 305.422 3.508 20 5 DHBDMO O=[N+]([O-])C=Cc1ccc(Nc2cc[nH+]cc2C(F)(F)F)cc1 ZINC001175900693 1035156434 /nfs/dbraw/zinc/15/64/34/1035156434.db2.gz SWQFGHUEJNYPDY-SOFGYWHQSA-N 1 1 309.247 3.513 20 5 DHBDMO Cc1c([C@@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000483195229 1035238994 /nfs/dbraw/zinc/23/89/94/1035238994.db2.gz JMEGLCSUBKEEFX-RHSMWYFYSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1c([C@@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000483195229 1035238997 /nfs/dbraw/zinc/23/89/97/1035238997.db2.gz JMEGLCSUBKEEFX-RHSMWYFYSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc([C@@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000483186839 1035240055 /nfs/dbraw/zinc/24/00/55/1035240055.db2.gz SBWJANMXSQKIPP-RHSMWYFYSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000483186839 1035240058 /nfs/dbraw/zinc/24/00/58/1035240058.db2.gz SBWJANMXSQKIPP-RHSMWYFYSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc(C[N@@H+](Cc2ccccn2)CC(C)C)cc1[N+](=O)[O-] ZINC001176346919 1035245959 /nfs/dbraw/zinc/24/59/59/1035245959.db2.gz UFKVIBJYPMEXLH-UHFFFAOYSA-N 1 1 313.401 3.956 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCSCC[C@@H]1C ZINC000483424816 1035268761 /nfs/dbraw/zinc/26/87/61/1035268761.db2.gz GEYUGRNJRNYPMM-UELRPHRMSA-N 1 1 306.431 3.826 20 5 DHBDMO C[C@]1(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCO1 ZINC001179913628 1035547507 /nfs/dbraw/zinc/54/75/07/1035547507.db2.gz AUXOLNJZAHJWEJ-QGZVFWFLSA-N 1 1 304.390 3.518 20 5 DHBDMO C[N@H+](CCCOc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000491238427 1035563882 /nfs/dbraw/zinc/56/38/82/1035563882.db2.gz GUPOHZJDCDJVQE-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO C[N@@H+](CCCOc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000491238427 1035563887 /nfs/dbraw/zinc/56/38/87/1035563887.db2.gz GUPOHZJDCDJVQE-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)Cc1ccc(F)cc1 ZINC001180566511 1035723066 /nfs/dbraw/zinc/72/30/66/1035723066.db2.gz PAQXSCDVHPZPEJ-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494705577 1035770343 /nfs/dbraw/zinc/77/03/43/1035770343.db2.gz XKWCTTWERMYXRU-DYVFJYSZSA-N 1 1 304.390 3.547 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3nc[nH]c3c2)cc1[N+](=O)[O-] ZINC000539530066 1035772450 /nfs/dbraw/zinc/77/24/50/1035772450.db2.gz AHROKPBRKHRIAT-GFCCVEGCSA-N 1 1 310.357 3.630 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089907257 1035785321 /nfs/dbraw/zinc/78/53/21/1035785321.db2.gz WKVKEDDWHOLWGN-OLZOCXBDSA-N 1 1 315.373 3.870 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000076069434 1035805398 /nfs/dbraw/zinc/80/53/98/1035805398.db2.gz XAZWUZFMBOSXKP-NEPJUHHUSA-N 1 1 312.410 3.840 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000076069434 1035805416 /nfs/dbraw/zinc/80/54/16/1035805416.db2.gz XAZWUZFMBOSXKP-NEPJUHHUSA-N 1 1 312.410 3.840 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000485719869 1035901728 /nfs/dbraw/zinc/90/17/28/1035901728.db2.gz WPLMDJMZUFFEAI-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])C12CCC2 ZINC001194384231 1035916388 /nfs/dbraw/zinc/91/63/88/1035916388.db2.gz JTECZFDDJRODNC-CABCVRRESA-N 1 1 324.808 3.638 20 5 DHBDMO COC[C@H](C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C(C)C ZINC001194478416 1035944119 /nfs/dbraw/zinc/94/41/19/1035944119.db2.gz VEUNVNARSUSKII-IRXDYDNUSA-N 1 1 320.433 3.693 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000494819097 1036049908 /nfs/dbraw/zinc/04/99/08/1036049908.db2.gz AEBVQPZYTGZZNS-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO CCOC[C@H]1CCCC[N@H+]1Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001182283602 1036179249 /nfs/dbraw/zinc/17/92/49/1036179249.db2.gz BOADMHLMOQRSGI-OAHLLOKOSA-N 1 1 306.406 3.603 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cccc3cccnc31)C2 ZINC000153281027 1036199709 /nfs/dbraw/zinc/19/97/09/1036199709.db2.gz DQUQYPAIYPSAEK-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccccc1O ZINC000541387335 1036316213 /nfs/dbraw/zinc/31/62/13/1036316213.db2.gz MBWYGERQTAMTPU-ZDUSSCGKSA-N 1 1 300.358 3.536 20 5 DHBDMO CC12CC(C1)C[N@@H+]2Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595920546 1036474983 /nfs/dbraw/zinc/47/49/83/1036474983.db2.gz UOFZKBZDCWVVQH-UHFFFAOYSA-N 1 1 300.280 3.598 20 5 DHBDMO CC12CC(C1)C[N@H+]2Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595920546 1036474989 /nfs/dbraw/zinc/47/49/89/1036474989.db2.gz UOFZKBZDCWVVQH-UHFFFAOYSA-N 1 1 300.280 3.598 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C)s2)cc1[N+](=O)[O-] ZINC000076342189 1036480343 /nfs/dbraw/zinc/48/03/43/1036480343.db2.gz CLTQWTWIYFBSLR-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO Cc1ccc(C)c(C[N@@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)c1 ZINC000762069474 1036499193 /nfs/dbraw/zinc/49/91/93/1036499193.db2.gz WQVAKHRYHHXLMC-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 ZINC000774603419 1036546065 /nfs/dbraw/zinc/54/60/65/1036546065.db2.gz SLYVOXAGFVDFOW-NEPJUHHUSA-N 1 1 315.329 3.915 20 5 DHBDMO CC[N@@H+](CCNc1ccc([N+](=O)[O-])c(C)c1)CCC(F)(F)F ZINC000491587777 1036613036 /nfs/dbraw/zinc/61/30/36/1036613036.db2.gz BRXZTTHDLQPEOJ-UHFFFAOYSA-N 1 1 319.327 3.589 20 5 DHBDMO CCOc1cc(C[N@@H+](C)C[C@@H]2CC=CCC2)ccc1[N+](=O)[O-] ZINC000491651950 1036618540 /nfs/dbraw/zinc/61/85/40/1036618540.db2.gz DICVEWFJVFCMBQ-CQSZACIVSA-N 1 1 304.390 3.782 20 5 DHBDMO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089512413 1036738960 /nfs/dbraw/zinc/73/89/60/1036738960.db2.gz ZIJSHFZJBJAUEP-LBPRGKRZSA-N 1 1 316.405 3.706 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000174998925 1036907492 /nfs/dbraw/zinc/90/74/92/1036907492.db2.gz TXFGFTHEJKJVSM-INIZCTEOSA-N 1 1 316.332 3.520 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000492829319 1037025518 /nfs/dbraw/zinc/02/55/18/1037025518.db2.gz KQNVNQMORGVHKH-ARFHVFGLSA-N 1 1 318.417 3.713 20 5 DHBDMO Cc1ccc(NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001185158106 1037047761 /nfs/dbraw/zinc/04/77/61/1037047761.db2.gz MQHQEAAIUVZRTD-CQSZACIVSA-N 1 1 305.422 3.826 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000493108261 1037178962 /nfs/dbraw/zinc/17/89/62/1037178962.db2.gz VDSKHGMNOSNCCT-MRXNPFEDSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CC[C@@H]2CCCCO2)C2CC2)c1 ZINC000347433047 1037194114 /nfs/dbraw/zinc/19/41/14/1037194114.db2.gz GJMVEDMJIVBBGT-KRWDZBQOSA-N 1 1 304.390 3.518 20 5 DHBDMO C[N@@H+](CCOc1ccccc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761511261 1037335776 /nfs/dbraw/zinc/33/57/76/1037335776.db2.gz PBGIRQYEAQLWFW-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO COC1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761511497 1037340119 /nfs/dbraw/zinc/34/01/19/1037340119.db2.gz KYMKXWWCFTZQOW-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO COc1cc(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000490063136 1037601642 /nfs/dbraw/zinc/60/16/42/1037601642.db2.gz XBCYTPAXEXURNH-FZKQIMNGSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000490063136 1037601648 /nfs/dbraw/zinc/60/16/48/1037601648.db2.gz XBCYTPAXEXURNH-FZKQIMNGSA-N 1 1 312.369 3.796 20 5 DHBDMO C[N@H+](Cc1cccc2[nH]ccc21)Cc1ccc([N+](=O)[O-])cc1F ZINC000494018965 1037620608 /nfs/dbraw/zinc/62/06/08/1037620608.db2.gz RPDWUSWEYAASLJ-UHFFFAOYSA-N 1 1 313.332 3.847 20 5 DHBDMO C[N@@H+](Cc1cccc2[nH]ccc21)Cc1ccc([N+](=O)[O-])cc1F ZINC000494018965 1037620621 /nfs/dbraw/zinc/62/06/21/1037620621.db2.gz RPDWUSWEYAASLJ-UHFFFAOYSA-N 1 1 313.332 3.847 20 5 DHBDMO C[C@H]1CC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000494145489 1037652011 /nfs/dbraw/zinc/65/20/11/1037652011.db2.gz OBICAZZNLKEHJO-JTQLQIEISA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000494145489 1037652015 /nfs/dbraw/zinc/65/20/15/1037652015.db2.gz OBICAZZNLKEHJO-JTQLQIEISA-N 1 1 300.811 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c(F)c1 ZINC000490406349 1037710090 /nfs/dbraw/zinc/71/00/90/1037710090.db2.gz YTGBQXDDRJSTJA-CABCVRRESA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c(F)c1 ZINC000490406349 1037710098 /nfs/dbraw/zinc/71/00/98/1037710098.db2.gz YTGBQXDDRJSTJA-CABCVRRESA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+](CC2CC2)C2CCCCC2)c1 ZINC000153944297 1037739063 /nfs/dbraw/zinc/73/90/63/1037739063.db2.gz MWQAAMHAENDWEP-GOSISDBHSA-N 1 1 318.417 3.673 20 5 DHBDMO COc1ccc([C@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491137043 1037917461 /nfs/dbraw/zinc/91/74/61/1037917461.db2.gz PJPLXERWAWZWSR-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491137043 1037917471 /nfs/dbraw/zinc/91/74/71/1037917471.db2.gz PJPLXERWAWZWSR-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO C[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000917041072 1038122979 /nfs/dbraw/zinc/12/29/79/1038122979.db2.gz YBOXJZKEXUXTGD-AWEZNQCLSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@H](C[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC001190809487 1038379134 /nfs/dbraw/zinc/37/91/34/1038379134.db2.gz KFUMGFAGFXZAIV-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000589187855 1038445614 /nfs/dbraw/zinc/44/56/14/1038445614.db2.gz ZYIXGJCOQUATNG-PRLJZHDASA-N 1 1 318.417 3.624 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000589200246 1038448726 /nfs/dbraw/zinc/44/87/26/1038448726.db2.gz YAOKVPOMRWAKTB-HZPDHXFCSA-N 1 1 318.417 3.542 20 5 DHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589502097 1038487940 /nfs/dbraw/zinc/48/79/40/1038487940.db2.gz LWVYGEQTMWDFPE-OAHLLOKOSA-N 1 1 320.389 3.536 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H]3CCC[C@@H]32)c1 ZINC000590174245 1038606674 /nfs/dbraw/zinc/60/66/74/1038606674.db2.gz BGWUVTHLHUPCPN-YGRLFVJLSA-N 1 1 314.307 3.988 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CC(C(F)F)C3)o2)cc1 ZINC000590968790 1038733535 /nfs/dbraw/zinc/73/35/35/1038733535.db2.gz NIPWHBQKDGIVSE-UHFFFAOYSA-N 1 1 308.284 3.552 20 5 DHBDMO CCC(CC)[N@@H+](Cn1nc(C)c2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000761288875 1038887174 /nfs/dbraw/zinc/88/71/74/1038887174.db2.gz VCMNCYKAMSGBFB-UHFFFAOYSA-N 1 1 316.405 3.863 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599073967 1039028569 /nfs/dbraw/zinc/02/85/69/1039028569.db2.gz OTGBNEZDUGHOPW-RHSMWYFYSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599073967 1039028590 /nfs/dbraw/zinc/02/85/90/1039028590.db2.gz OTGBNEZDUGHOPW-RHSMWYFYSA-N 1 1 317.433 3.571 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000046037609 1039061707 /nfs/dbraw/zinc/06/17/07/1039061707.db2.gz SMPVURRXGUBKSE-OAHLLOKOSA-N 1 1 318.398 3.872 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@]3(CC3(F)F)C2)cc1[N+](=O)[O-] ZINC000593695210 1039084197 /nfs/dbraw/zinc/08/41/97/1039084197.db2.gz IKZPEBYIAPLIJI-HNNXBMFYSA-N 1 1 310.344 3.949 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCC1CC1)[C@H]1CC[C@H](O)CC1 ZINC000592130299 1039123995 /nfs/dbraw/zinc/12/39/95/1039123995.db2.gz AXGPPXPSQJVYFL-QAQDUYKDSA-N 1 1 318.417 3.500 20 5 DHBDMO C[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000603847240 1039183601 /nfs/dbraw/zinc/18/36/01/1039183601.db2.gz KRFHLEZWGCYHIN-PMPSAXMXSA-N 1 1 318.417 3.874 20 5 DHBDMO CC[N@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000061785475 1039549055 /nfs/dbraw/zinc/54/90/55/1039549055.db2.gz XLPVGCHUILAWNJ-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO CC[N@@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000061785475 1039549073 /nfs/dbraw/zinc/54/90/73/1039549073.db2.gz XLPVGCHUILAWNJ-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594027745 1039956661 /nfs/dbraw/zinc/95/66/61/1039956661.db2.gz ZFXLKPYNJPRCOU-YOEHRIQHSA-N 1 1 318.417 3.998 20 5 DHBDMO CCC[C@@H]([NH2+][C@H](C)c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000595109949 1040068908 /nfs/dbraw/zinc/06/89/08/1040068908.db2.gz XPFLCZSXVMPHTD-IUODEOHRSA-N 1 1 302.378 3.520 20 5 DHBDMO Cn1cc[nH+]c1C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000078559003 1040083983 /nfs/dbraw/zinc/08/39/83/1040083983.db2.gz PULQDKYYPWNMAY-QGZVFWFLSA-N 1 1 322.368 3.724 20 5 DHBDMO CC(C)[N@H+](Cc1cc(C2CC2)no1)Cc1ccc([N+](=O)[O-])cc1 ZINC000595295218 1040090780 /nfs/dbraw/zinc/09/07/80/1040090780.db2.gz IMGOPAHURWRFIA-UHFFFAOYSA-N 1 1 315.373 3.871 20 5 DHBDMO CC(C)[N@@H+](Cc1cc(C2CC2)no1)Cc1ccc([N+](=O)[O-])cc1 ZINC000595295218 1040090797 /nfs/dbraw/zinc/09/07/97/1040090797.db2.gz IMGOPAHURWRFIA-UHFFFAOYSA-N 1 1 315.373 3.871 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@@H]2c2ccc(C)c(C)c2)c1[N+](=O)[O-] ZINC000595295282 1040091455 /nfs/dbraw/zinc/09/14/55/1040091455.db2.gz WWVKBKSKWPLQST-OAHLLOKOSA-N 1 1 315.373 3.845 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2c2ccc(C)c(C)c2)c1[N+](=O)[O-] ZINC000595295282 1040091465 /nfs/dbraw/zinc/09/14/65/1040091465.db2.gz WWVKBKSKWPLQST-OAHLLOKOSA-N 1 1 315.373 3.845 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000595340861 1040102249 /nfs/dbraw/zinc/10/22/49/1040102249.db2.gz YGXZVPBYUGZFMZ-DZGCQCFKSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000595340861 1040102251 /nfs/dbraw/zinc/10/22/51/1040102251.db2.gz YGXZVPBYUGZFMZ-DZGCQCFKSA-N 1 1 310.394 3.594 20 5 DHBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595349744 1040104389 /nfs/dbraw/zinc/10/43/89/1040104389.db2.gz DVCWICRVJZNGHQ-GFCCVEGCSA-N 1 1 318.348 3.503 20 5 DHBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595349745 1040105649 /nfs/dbraw/zinc/10/56/49/1040105649.db2.gz DVCWICRVJZNGHQ-LBPRGKRZSA-N 1 1 318.348 3.503 20 5 DHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595439051 1040139603 /nfs/dbraw/zinc/13/96/03/1040139603.db2.gz WTFQKYDAPJPDEY-MLGOLLRUSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595439051 1040139608 /nfs/dbraw/zinc/13/96/08/1040139608.db2.gz WTFQKYDAPJPDEY-MLGOLLRUSA-N 1 1 315.348 3.712 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccco3)CC2)c(F)c1 ZINC000595619014 1040193748 /nfs/dbraw/zinc/19/37/48/1040193748.db2.gz YGWCYRGSPZAEEU-UHFFFAOYSA-N 1 1 304.321 3.707 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)c(F)c1 ZINC000595786547 1040254596 /nfs/dbraw/zinc/25/45/96/1040254596.db2.gz BHMJGLKLXITJGW-PBHICJAKSA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(c2ccon2)CC1 ZINC000595828117 1040265092 /nfs/dbraw/zinc/26/50/92/1040265092.db2.gz JHMXAFLCQOOZAL-UHFFFAOYSA-N 1 1 321.764 3.616 20 5 DHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000174032436 1040500968 /nfs/dbraw/zinc/50/09/68/1040500968.db2.gz IOPHLDBOQBQRMF-NSHDSACASA-N 1 1 300.399 3.697 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CCS1 ZINC000228087606 1040641771 /nfs/dbraw/zinc/64/17/71/1040641771.db2.gz UXKIQVKQSYFTST-UHFFFAOYSA-N 1 1 314.838 3.966 20 5 DHBDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1CCSC1 ZINC000602441527 1041037152 /nfs/dbraw/zinc/03/71/52/1041037152.db2.gz OMLGSKAZLPCIFO-LLVKDONJSA-N 1 1 320.336 3.551 20 5 DHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000060876973 1041214102 /nfs/dbraw/zinc/21/41/02/1041214102.db2.gz DBTWLIQETLEBDZ-AWEZNQCLSA-N 1 1 306.406 3.874 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H](c3cccnc3)C2)cccc1[N+](=O)[O-] ZINC000602851619 1041262519 /nfs/dbraw/zinc/26/25/19/1041262519.db2.gz BAPSMPQYJZDLAD-KRWDZBQOSA-N 1 1 311.385 3.678 20 5 DHBDMO CC[C@@H](c1ccccc1)[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])C(C)C ZINC000602903825 1041302520 /nfs/dbraw/zinc/30/25/20/1041302520.db2.gz STLLNYYLJYHNHB-INIZCTEOSA-N 1 1 316.405 3.690 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](c4ccccc4)C3)nc2c1 ZINC000083169746 185215537 /nfs/dbraw/zinc/21/55/37/185215537.db2.gz NEOQLJFXSOUUMG-CQSZACIVSA-N 1 1 323.352 3.726 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCc3c2cccc3O)c1 ZINC000105486816 194106264 /nfs/dbraw/zinc/10/62/64/194106264.db2.gz ANQWTNOCCBHSNM-HNNXBMFYSA-N 1 1 318.760 3.731 20 5 DHBDMO C[C@]12CC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@H]1C2(F)F ZINC000298184399 132049527 /nfs/dbraw/zinc/04/95/27/132049527.db2.gz AJKIEISNDRCAHC-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@]12CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@H]1C2(F)F ZINC000298184399 132049528 /nfs/dbraw/zinc/04/95/28/132049528.db2.gz AJKIEISNDRCAHC-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(C)c(F)c1 ZINC000176127496 332925533 /nfs/dbraw/zinc/92/55/33/332925533.db2.gz KJLBTTXOAZNENJ-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO CC(C)c1ccc(C[NH2+]CCN2CCCCCC2)cc1[N+](=O)[O-] ZINC000518269472 332003447 /nfs/dbraw/zinc/00/34/47/332003447.db2.gz BTCXNBMCVRBKHO-UHFFFAOYSA-N 1 1 319.449 3.684 20 5 DHBDMO COc1cc(C)ccc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000449341997 332052992 /nfs/dbraw/zinc/05/29/92/332052992.db2.gz YEYXDSAQXJOSIZ-UHFFFAOYSA-N 1 1 314.385 3.937 20 5 DHBDMO COc1ccc(Cl)cc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000048326866 332303044 /nfs/dbraw/zinc/30/30/44/332303044.db2.gz UFOJRZMAVJPUGD-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO COc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000049963449 332331177 /nfs/dbraw/zinc/33/11/77/332331177.db2.gz OVSPFCHCGIVTOK-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO CCC(CC)[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)N(C)C ZINC000314289401 333098734 /nfs/dbraw/zinc/09/87/34/333098734.db2.gz XIISTHCKZGQOQZ-GUYCJALGSA-N 1 1 307.438 3.612 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccn(C(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000178511095 333140013 /nfs/dbraw/zinc/14/00/13/333140013.db2.gz OWNMIFPFVKSSNI-MRXNPFEDSA-N 1 1 302.378 3.613 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000187452449 333233004 /nfs/dbraw/zinc/23/30/04/333233004.db2.gz IMXWDDJQRUPFBH-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO O=[N+]([O-])c1ccccc1NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000390705829 333316310 /nfs/dbraw/zinc/31/63/10/333316310.db2.gz QBZDVPBCBACICG-MRXNPFEDSA-N 1 1 311.385 3.671 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2cccnc21 ZINC000365015579 333334460 /nfs/dbraw/zinc/33/44/60/333334460.db2.gz COBYBFWUWSFTJT-QGZVFWFLSA-N 1 1 311.385 3.542 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCSC3(CCCCC3)C2)cs1 ZINC000531430113 333351622 /nfs/dbraw/zinc/35/16/22/333351622.db2.gz MRHKATNSUZSBEP-UHFFFAOYSA-N 1 1 312.460 3.908 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCSC3(CCCCC3)C2)cs1 ZINC000531430113 333351623 /nfs/dbraw/zinc/35/16/23/333351623.db2.gz MRHKATNSUZSBEP-UHFFFAOYSA-N 1 1 312.460 3.908 20 5 DHBDMO CC(C)(C)c1ccncc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000414493979 333997063 /nfs/dbraw/zinc/99/70/63/333997063.db2.gz DBKCDZOWRSBOOZ-UHFFFAOYSA-N 1 1 317.364 3.716 20 5 DHBDMO Cc1cc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c(C)s1 ZINC000534515846 334278372 /nfs/dbraw/zinc/27/83/72/334278372.db2.gz YJCJKXINZKPMDN-UHFFFAOYSA-N 1 1 302.399 3.831 20 5 DHBDMO Cc1cc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c(C)s1 ZINC000534515846 334278374 /nfs/dbraw/zinc/27/83/74/334278374.db2.gz YJCJKXINZKPMDN-UHFFFAOYSA-N 1 1 302.399 3.831 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1nccs1)CCCC2 ZINC000417346249 334705953 /nfs/dbraw/zinc/70/59/53/334705953.db2.gz VOZQIYSOQLHOJL-CQSZACIVSA-N 1 1 303.387 3.609 20 5 DHBDMO COc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1C ZINC000343654033 335185225 /nfs/dbraw/zinc/18/52/25/335185225.db2.gz GYPYBUFOJPUXTQ-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1C ZINC000343654033 335185226 /nfs/dbraw/zinc/18/52/26/335185226.db2.gz GYPYBUFOJPUXTQ-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)nc2c1 ZINC000344002380 335206773 /nfs/dbraw/zinc/20/67/73/335206773.db2.gz HOXINUGBTGBXFH-GFCCVEGCSA-N 1 1 310.357 3.630 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC2(CCC2)C1 ZINC000344217178 335235401 /nfs/dbraw/zinc/23/54/01/335235401.db2.gz MRMGPWNUPSEEKI-UHFFFAOYSA-N 1 1 304.390 3.758 20 5 DHBDMO C[C@H](C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000346244788 335393976 /nfs/dbraw/zinc/39/39/76/335393976.db2.gz CLGXYRZNAVMVEP-SCXUMTSISA-N 1 1 317.414 3.800 20 5 DHBDMO CCCCCn1cc(C[NH2+]Cc2csc([N+](=O)[O-])c2)c(C)n1 ZINC000348355876 335580222 /nfs/dbraw/zinc/58/02/22/335580222.db2.gz YBSDZIKGXXAMKG-UHFFFAOYSA-N 1 1 322.434 3.641 20 5 DHBDMO CC(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCC1 ZINC000331822697 336149968 /nfs/dbraw/zinc/14/99/68/336149968.db2.gz ZMWBQWWZSJRHNT-UHFFFAOYSA-N 1 1 302.378 3.624 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000332317054 336167680 /nfs/dbraw/zinc/16/76/80/336167680.db2.gz MWTWDSWNRDVVPW-CHWSQXEVSA-N 1 1 317.414 3.992 20 5 DHBDMO CCCCOC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000352608242 336226711 /nfs/dbraw/zinc/22/67/11/336226711.db2.gz HTBIGZNYDWCVGK-UHFFFAOYSA-N 1 1 310.369 3.515 20 5 DHBDMO CC[N@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000352652413 336228923 /nfs/dbraw/zinc/22/89/23/336228923.db2.gz NPZCYSZSCZHWMN-OAHLLOKOSA-N 1 1 306.406 3.719 20 5 DHBDMO CC(C)CCOC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000352733326 336232854 /nfs/dbraw/zinc/23/28/54/336232854.db2.gz ZPUUALOTUMDVHA-UHFFFAOYSA-N 1 1 324.396 3.761 20 5 DHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000352777576 336235955 /nfs/dbraw/zinc/23/59/55/336235955.db2.gz HKIJDFJMDITRNR-OAHLLOKOSA-N 1 1 315.373 3.582 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(SC)s1 ZINC000352824393 336258632 /nfs/dbraw/zinc/25/86/32/336258632.db2.gz QCDAZZGJPMQUFI-UHFFFAOYSA-N 1 1 324.427 3.677 20 5 DHBDMO O=[N+]([O-])c1ccsc1NCCC[N@H+]1CCc2ccccc2C1 ZINC000301979899 336341116 /nfs/dbraw/zinc/34/11/16/336341116.db2.gz GCLGOFBNNNPPCD-UHFFFAOYSA-N 1 1 317.414 3.517 20 5 DHBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302031747 336344330 /nfs/dbraw/zinc/34/43/30/336344330.db2.gz CHYFRVVLBXZGMS-KGLIPLIRSA-N 1 1 303.406 3.660 20 5 DHBDMO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1nccn1-c1ccccc1 ZINC000376605457 337037841 /nfs/dbraw/zinc/03/78/41/337037841.db2.gz DUPGEETUQPPWEH-AWEZNQCLSA-N 1 1 322.368 3.631 20 5 DHBDMO COc1ccc2oc(C[NH2+]Cc3ccccc3[N+](=O)[O-])cc2c1 ZINC000123376313 337045363 /nfs/dbraw/zinc/04/53/63/337045363.db2.gz MYHPIWXEITZZJM-UHFFFAOYSA-N 1 1 312.325 3.639 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccccc2)O1 ZINC000063581496 337282011 /nfs/dbraw/zinc/28/20/11/337282011.db2.gz HCFOFRWMFZMIPN-RDTXWAMCSA-N 1 1 312.369 3.557 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccccc2)O1 ZINC000063581496 337282012 /nfs/dbraw/zinc/28/20/12/337282012.db2.gz HCFOFRWMFZMIPN-RDTXWAMCSA-N 1 1 312.369 3.557 20 5 DHBDMO CC[N@@H+](CCNc1cccc(C)c1[N+](=O)[O-])CCC(F)(F)F ZINC000516196148 338006792 /nfs/dbraw/zinc/00/67/92/338006792.db2.gz OPELYKAQGAFCRD-UHFFFAOYSA-N 1 1 319.327 3.589 20 5 DHBDMO C[C@H](c1ccco1)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000086235956 338014789 /nfs/dbraw/zinc/01/47/89/338014789.db2.gz MFLKQMYGTQDPJL-CYBMUJFWSA-N 1 1 300.358 3.956 20 5 DHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CC1(C)C ZINC000426550625 338034522 /nfs/dbraw/zinc/03/45/22/338034522.db2.gz XIOYILZPDZEKEC-CQSZACIVSA-N 1 1 317.414 3.949 20 5 DHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CC1(C)C ZINC000426550625 338034523 /nfs/dbraw/zinc/03/45/23/338034523.db2.gz XIOYILZPDZEKEC-CQSZACIVSA-N 1 1 317.414 3.949 20 5 DHBDMO CCc1nc(C)c(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000428456658 338052813 /nfs/dbraw/zinc/05/28/13/338052813.db2.gz GBUUVOUOQMMRSN-UHFFFAOYSA-N 1 1 317.389 3.864 20 5 DHBDMO CCc1nc(C)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000428456658 338052814 /nfs/dbraw/zinc/05/28/14/338052814.db2.gz GBUUVOUOQMMRSN-UHFFFAOYSA-N 1 1 317.389 3.864 20 5 DHBDMO Cc1c(C[N@@H+]2Cc3ccccc3O[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000429194446 338072882 /nfs/dbraw/zinc/07/28/82/338072882.db2.gz ZRVGIPBRMPYILP-CYBMUJFWSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1c(C[N@H+]2Cc3ccccc3O[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000429194446 338072883 /nfs/dbraw/zinc/07/28/83/338072883.db2.gz ZRVGIPBRMPYILP-CYBMUJFWSA-N 1 1 312.369 3.686 20 5 DHBDMO CC[N@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430196691 338100811 /nfs/dbraw/zinc/10/08/11/338100811.db2.gz MEOMPYGZLVLOBT-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO CC[N@@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430196691 338100812 /nfs/dbraw/zinc/10/08/12/338100812.db2.gz MEOMPYGZLVLOBT-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000430208228 338101390 /nfs/dbraw/zinc/10/13/90/338101390.db2.gz AVRMUXDVXGMILJ-AWEZNQCLSA-N 1 1 314.385 3.839 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC000430217496 338101888 /nfs/dbraw/zinc/10/18/88/338101888.db2.gz HSSZKCLCANGMGA-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000430217496 338101889 /nfs/dbraw/zinc/10/18/89/338101889.db2.gz HSSZKCLCANGMGA-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccccc1C ZINC000430225114 338102240 /nfs/dbraw/zinc/10/22/40/338102240.db2.gz XABCPZDGPZBEIV-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccccc1C ZINC000430225114 338102241 /nfs/dbraw/zinc/10/22/41/338102241.db2.gz XABCPZDGPZBEIV-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO Cc1cnc(NC[C@H]2CCC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000435589569 338242928 /nfs/dbraw/zinc/24/29/28/338242928.db2.gz SZBNKSSUYQZXRK-OAHLLOKOSA-N 1 1 318.421 3.507 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCC2 ZINC000459638224 339039657 /nfs/dbraw/zinc/03/96/57/339039657.db2.gz TUNOVXUCXFUWHW-QWRGUYRKSA-N 1 1 317.414 3.952 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H]3C[C@H]2CS3)o1 ZINC000459774691 339047816 /nfs/dbraw/zinc/04/78/16/339047816.db2.gz WJPKWXIYQPAXID-AAEUAGOBSA-N 1 1 316.382 3.545 20 5 DHBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H](C)OC ZINC000462828718 339092945 /nfs/dbraw/zinc/09/29/45/339092945.db2.gz ZHAAEJRHQPRHIV-ZDUSSCGKSA-N 1 1 318.373 3.712 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1C[C@H]1c1ccccc1)CCO2 ZINC000463190563 339108638 /nfs/dbraw/zinc/10/86/38/339108638.db2.gz FKXZXJHDGVBWRJ-YJBOKZPZSA-N 1 1 324.380 3.593 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]2C(C)(C)C)c([N+](=O)[O-])cc1F ZINC000464104193 339134533 /nfs/dbraw/zinc/13/45/33/339134533.db2.gz KOWTZWJYLFVMJO-OAHLLOKOSA-N 1 1 310.369 3.753 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@H](CC(C)C)C2)c([N+](=O)[O-])cc1F ZINC000464678730 339148675 /nfs/dbraw/zinc/14/86/75/339148675.db2.gz GQZNBJDTYJCKIT-LBPRGKRZSA-N 1 1 310.369 3.611 20 5 DHBDMO CC(C)[C@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000464770824 339152066 /nfs/dbraw/zinc/15/20/66/339152066.db2.gz JXYPHKUCSMADSG-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@H]1C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000464770824 339152067 /nfs/dbraw/zinc/15/20/67/339152067.db2.gz JXYPHKUCSMADSG-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO C[C@H](NCC[N@@H+](C)C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000467837250 339247222 /nfs/dbraw/zinc/24/72/22/339247222.db2.gz ZFXJXZOSJJDWMT-AWEZNQCLSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@H]([NH2+]CCN(C)C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000467837250 339247223 /nfs/dbraw/zinc/24/72/23/339247223.db2.gz ZFXJXZOSJJDWMT-AWEZNQCLSA-N 1 1 305.422 3.510 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@H](CC(C)C)[NH+](C)C ZINC000468654865 339268135 /nfs/dbraw/zinc/26/81/35/339268135.db2.gz CTAVHUDVAAZDOV-KAPURRDVSA-N 1 1 319.449 3.564 20 5 DHBDMO COCC[C@H]1CCCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000468692167 339268701 /nfs/dbraw/zinc/26/87/01/339268701.db2.gz ZZEZSZSFDZWVFN-CXOKCQFOSA-N 1 1 318.417 3.747 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCC1CCOCC1 ZINC000470178618 339312991 /nfs/dbraw/zinc/31/29/91/339312991.db2.gz LLAVVDQHCBSKPA-NTCAYCPXSA-N 1 1 318.417 3.747 20 5 DHBDMO CC[C@@H]1C[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CCS1 ZINC000470183904 339313246 /nfs/dbraw/zinc/31/32/46/339313246.db2.gz SVOCJPFCNZDDLI-RCBBPTIPSA-N 1 1 306.431 3.826 20 5 DHBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000471522762 339346760 /nfs/dbraw/zinc/34/67/60/339346760.db2.gz PAEIEVOLAHAAFT-WCQYABFASA-N 1 1 311.813 3.557 20 5 DHBDMO Cc1c(C[N@@H+]2CCCC[C@@H]2c2cccn2C)cccc1[N+](=O)[O-] ZINC000472341817 339370288 /nfs/dbraw/zinc/37/02/88/339370288.db2.gz SCEIHLHKVDZLRC-GOSISDBHSA-N 1 1 313.401 3.969 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000497112394 340020551 /nfs/dbraw/zinc/02/05/51/340020551.db2.gz DZUBLUOGVOSYEI-QAPCUYQASA-N 1 1 320.433 3.701 20 5 DHBDMO C[C@H]1CCCC[C@H]1OCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000501861401 340089897 /nfs/dbraw/zinc/08/98/97/340089897.db2.gz JFPMBJFBMHLSOO-WMLDXEAASA-N 1 1 306.406 3.622 20 5 DHBDMO C[C@H]1CCCC[C@H]1OCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000501861401 340089898 /nfs/dbraw/zinc/08/98/98/340089898.db2.gz JFPMBJFBMHLSOO-WMLDXEAASA-N 1 1 306.406 3.622 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCCCCC2)c1 ZINC000505413531 340167881 /nfs/dbraw/zinc/16/78/81/340167881.db2.gz HNDUREJDRWOHAJ-UHFFFAOYSA-N 1 1 300.305 3.572 20 5 DHBDMO C[N@H+](Cc1ccc2ncccc2c1)Cc1ccccc1[N+](=O)[O-] ZINC000507152445 340209839 /nfs/dbraw/zinc/20/98/39/340209839.db2.gz UIAQRPLBSZFKOT-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO C[N@@H+](Cc1ccc2ncccc2c1)Cc1ccccc1[N+](=O)[O-] ZINC000507152445 340209840 /nfs/dbraw/zinc/20/98/40/340209840.db2.gz UIAQRPLBSZFKOT-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO CC[C@@H]1C[C@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCO1 ZINC000507790118 340231587 /nfs/dbraw/zinc/23/15/87/340231587.db2.gz ABTPLEYQSFSZMS-CRAIPNDOSA-N 1 1 318.417 3.764 20 5 DHBDMO COc1ccc(-c2ccc(C[N@@H+](C)CC3CC3)o2)c([N+](=O)[O-])c1 ZINC000510409114 340298459 /nfs/dbraw/zinc/29/84/59/340298459.db2.gz DMZVZFLPWFYSTR-UHFFFAOYSA-N 1 1 316.357 3.705 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCCC(F)(F)C1 ZINC000511145634 340322380 /nfs/dbraw/zinc/32/23/80/340322380.db2.gz WNUIITSIWDQOKV-CYBMUJFWSA-N 1 1 312.360 3.895 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000511353430 340325705 /nfs/dbraw/zinc/32/57/05/340325705.db2.gz ZDNPYYIHJXWKBP-HUUCEWRRSA-N 1 1 317.433 3.968 20 5 DHBDMO C[C@@H](N[C@@H]1CC[N@@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173453364 340365440 /nfs/dbraw/zinc/36/54/40/340365440.db2.gz UIWWGICLQYDETC-RHSMWYFYSA-N 1 1 317.433 3.510 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCN(CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173453364 340365441 /nfs/dbraw/zinc/36/54/41/340365441.db2.gz UIWWGICLQYDETC-RHSMWYFYSA-N 1 1 317.433 3.510 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C(C1CC1)C1CC1 ZINC000512677409 340372563 /nfs/dbraw/zinc/37/25/63/340372563.db2.gz IUQPVHKHWXTMGK-UHFFFAOYSA-N 1 1 304.390 3.614 20 5 DHBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000542320735 341004855 /nfs/dbraw/zinc/00/48/55/341004855.db2.gz UIWAFTMNRDYUET-LLVKDONJSA-N 1 1 303.362 3.604 20 5 DHBDMO Cc1ccc([C@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000543248331 341038373 /nfs/dbraw/zinc/03/83/73/341038373.db2.gz XKCVIVXWUVFMEF-SFHVURJKSA-N 1 1 310.397 3.935 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000543628352 341051880 /nfs/dbraw/zinc/05/18/80/341051880.db2.gz PZSWCDFGRPOWTO-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO C[C@H]([NH2+][C@H]1COc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000545235660 341116369 /nfs/dbraw/zinc/11/63/69/341116369.db2.gz JPLRANUORHFKBN-BONVTDFDSA-N 1 1 302.305 3.518 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2C3CCC2CC3)c1 ZINC000549770630 341302775 /nfs/dbraw/zinc/30/27/75/341302775.db2.gz SPGIAKONNUCRPY-UHFFFAOYSA-N 1 1 300.280 3.740 20 5 DHBDMO COc1ccc(F)c(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000550174605 341311654 /nfs/dbraw/zinc/31/16/54/341311654.db2.gz LCFJDNNOFMRTEH-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO CC(C)(C)Oc1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)cn1 ZINC000180890135 518892220 /nfs/dbraw/zinc/89/22/20/518892220.db2.gz WJMINUIUOSDMPT-UHFFFAOYSA-N 1 1 321.402 3.518 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cccnc1 ZINC000182889237 519782089 /nfs/dbraw/zinc/78/20/89/519782089.db2.gz RMRXITUJGFBPMH-ZDUSSCGKSA-N 1 1 315.373 3.628 20 5 DHBDMO CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCCc2cccnc21 ZINC000365000702 521387636 /nfs/dbraw/zinc/38/76/36/521387636.db2.gz RARJELQSMAZEBP-KRWDZBQOSA-N 1 1 311.385 3.889 20 5 DHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCCc2cccnc21 ZINC000365000702 521387643 /nfs/dbraw/zinc/38/76/43/521387643.db2.gz RARJELQSMAZEBP-KRWDZBQOSA-N 1 1 311.385 3.889 20 5 DHBDMO COC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(C)o1 ZINC000156444598 522759080 /nfs/dbraw/zinc/75/90/80/522759080.db2.gz PBGKTDJGJQTBNZ-BBRMVZONSA-N 1 1 318.373 3.843 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc2ncccc2c1 ZINC000338346789 522947512 /nfs/dbraw/zinc/94/75/12/522947512.db2.gz GUJXXAAEALJWAR-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000015372025 1013517050 /nfs/dbraw/zinc/51/70/50/1013517050.db2.gz XBKLULBOOYBKAA-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000015372025 1013517061 /nfs/dbraw/zinc/51/70/61/1013517061.db2.gz XBKLULBOOYBKAA-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000599572945 1013637579 /nfs/dbraw/zinc/63/75/79/1013637579.db2.gz DCYBHAQSFPZVGH-KRWDZBQOSA-N 1 1 315.348 3.760 20 5 DHBDMO CC1(C)CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000083212026 1014000174 /nfs/dbraw/zinc/00/01/74/1014000174.db2.gz FKNAUOVNZACVEP-UHFFFAOYSA-N 1 1 303.362 3.748 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC4(C3)CCCCC4)nc2c1 ZINC000083213022 1014001165 /nfs/dbraw/zinc/00/11/65/1014001165.db2.gz IUMRWTDUTJIFPN-UHFFFAOYSA-N 1 1 315.373 3.892 20 5 DHBDMO CC(C)[C@H]1C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CCS1 ZINC000687935367 1014323987 /nfs/dbraw/zinc/32/39/87/1014323987.db2.gz PNEUXZMIFREDGL-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@H]1C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CCS1 ZINC000687935367 1014324001 /nfs/dbraw/zinc/32/40/01/1014324001.db2.gz PNEUXZMIFREDGL-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC(C)(C)[C@H]1[C@H]1CCCO1 ZINC000580802735 1014356534 /nfs/dbraw/zinc/35/65/34/1014356534.db2.gz OYXZRLTZQHDGRC-IAOVAPTHSA-N 1 1 318.417 3.854 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2F)C2CC2)cc1 ZINC000067445679 1014409062 /nfs/dbraw/zinc/40/90/62/1014409062.db2.gz AGXQXUAEZAUMHU-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2F)C2CC2)cc1 ZINC000067445679 1014409067 /nfs/dbraw/zinc/40/90/67/1014409067.db2.gz AGXQXUAEZAUMHU-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO Cc1ccc([C@@H](C)[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000520845099 1014597351 /nfs/dbraw/zinc/59/73/51/1014597351.db2.gz CTKAINFEZIZZTB-OAHLLOKOSA-N 1 1 314.385 3.975 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2c2cccs2)cc1 ZINC000520845218 1014597878 /nfs/dbraw/zinc/59/78/78/1014597878.db2.gz RERKTOXRAVOAET-HNNXBMFYSA-N 1 1 318.398 3.872 20 5 DHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001167457840 1014772550 /nfs/dbraw/zinc/77/25/50/1014772550.db2.gz LYIOMEUPFNRSAJ-PBHICJAKSA-N 1 1 306.406 3.874 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(c2ccsc2[N+](=O)[O-])CC1 ZINC000610515136 1015065981 /nfs/dbraw/zinc/06/59/81/1015065981.db2.gz WATCHFBAGOCWPD-UHFFFAOYSA-N 1 1 311.451 3.605 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000051129848 1015101956 /nfs/dbraw/zinc/10/19/56/1015101956.db2.gz CCYQQAIWQMXHGV-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccns1 ZINC000895454186 1015165573 /nfs/dbraw/zinc/16/55/73/1015165573.db2.gz WEEWPEZOOOIVHQ-XYOKQWHBSA-N 1 1 303.387 3.587 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccns1 ZINC000895454186 1015165580 /nfs/dbraw/zinc/16/55/80/1015165580.db2.gz WEEWPEZOOOIVHQ-XYOKQWHBSA-N 1 1 303.387 3.587 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895583625 1015210394 /nfs/dbraw/zinc/21/03/94/1015210394.db2.gz MISGIMWXPGNWIP-KQIUPUNMSA-N 1 1 315.398 3.554 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)cc1[N+](=O)[O-] ZINC000895846878 1015330042 /nfs/dbraw/zinc/33/00/42/1015330042.db2.gz RJLMQVJIJLEKQO-QAPCUYQASA-N 1 1 318.417 3.719 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]CC2(N(C)C)CCCCC2)cc1[N+](=O)[O-] ZINC000320205045 1015390594 /nfs/dbraw/zinc/39/05/94/1015390594.db2.gz SCOHWESBDNQTAX-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO COc1c(O)ccc(C[N@H+](C)[C@H](C)c2cccs2)c1[N+](=O)[O-] ZINC000891639905 1015476895 /nfs/dbraw/zinc/47/68/95/1015476895.db2.gz JUBAZBCAZDMWRU-SNVBAGLBSA-N 1 1 322.386 3.564 20 5 DHBDMO COc1c(O)ccc(C[N@@H+](C)[C@H](C)c2cccs2)c1[N+](=O)[O-] ZINC000891639905 1015476901 /nfs/dbraw/zinc/47/69/01/1015476901.db2.gz JUBAZBCAZDMWRU-SNVBAGLBSA-N 1 1 322.386 3.564 20 5 DHBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580878 1015629522 /nfs/dbraw/zinc/62/95/22/1015629522.db2.gz SGITVHRMFHEWHL-LBPRGKRZSA-N 1 1 311.341 3.929 20 5 DHBDMO CC[N@@H+](CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(C)C ZINC000522623323 1015784299 /nfs/dbraw/zinc/78/42/99/1015784299.db2.gz DSVZHLLHLRRLDF-UHFFFAOYSA-N 1 1 319.327 3.756 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]CCN2C[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000610799331 1015844772 /nfs/dbraw/zinc/84/47/72/1015844772.db2.gz SICKPKWTOCKBQG-FMKPAKJESA-N 1 1 319.449 3.532 20 5 DHBDMO CC[C@@H](NCC1([NH+](C)C)CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000320228990 1015850999 /nfs/dbraw/zinc/85/09/99/1015850999.db2.gz WNBCLLFYOJLFFK-QGZVFWFLSA-N 1 1 319.449 3.900 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1C ZINC000071959573 1016285036 /nfs/dbraw/zinc/28/50/36/1016285036.db2.gz GUYVAUKZPOQUNI-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCC(F)(F)F)C2)cc1 ZINC000451547286 1016521580 /nfs/dbraw/zinc/52/15/80/1016521580.db2.gz LBFHNNHLLHCBIV-LBPRGKRZSA-N 1 1 302.296 3.727 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000072557461 1016575617 /nfs/dbraw/zinc/57/56/17/1016575617.db2.gz SDJHJGUSYOSLSD-LBPRGKRZSA-N 1 1 314.341 3.517 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000072557461 1016575634 /nfs/dbraw/zinc/57/56/34/1016575634.db2.gz SDJHJGUSYOSLSD-LBPRGKRZSA-N 1 1 314.341 3.517 20 5 DHBDMO Cc1cnc([C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C2CC2)s1 ZINC000185332510 1016861180 /nfs/dbraw/zinc/86/11/80/1016861180.db2.gz HBRJLXKXIMZTHE-HNNXBMFYSA-N 1 1 317.414 3.909 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000897071813 1017032998 /nfs/dbraw/zinc/03/29/98/1017032998.db2.gz NLNZQNQOPFZMJW-AWEZNQCLSA-N 1 1 317.776 3.810 20 5 DHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CC[C@H](C)C1 ZINC000362160761 1032254945 /nfs/dbraw/zinc/25/49/45/1032254945.db2.gz YMLDXURRYRPCIQ-XJKSGUPXSA-N 1 1 306.406 3.540 20 5 DHBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@H]1C(C)(C)C ZINC001171297981 1032283474 /nfs/dbraw/zinc/28/34/74/1032283474.db2.gz QXCNDVIQCLANJW-ZACQAIPSSA-N 1 1 320.433 3.775 20 5 DHBDMO Cc1ccc(C[N@H+]2CCSC[C@@H]2C2CCC2)cc1[N+](=O)[O-] ZINC001171344447 1032500097 /nfs/dbraw/zinc/50/00/97/1032500097.db2.gz OOOCOUYWRGNIAW-MRXNPFEDSA-N 1 1 306.431 3.621 20 5 DHBDMO C[C@H](c1ccccc1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000515123777 1012561493 /nfs/dbraw/zinc/56/14/93/1012561493.db2.gz RCQQGCJAEMZLSV-CQSZACIVSA-N 1 1 300.358 3.667 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCc2ccccc21 ZINC000083138845 1017579476 /nfs/dbraw/zinc/57/94/76/1017579476.db2.gz LNDNLFSARZKOOU-MRXNPFEDSA-N 1 1 323.352 3.855 20 5 DHBDMO CCC(CC)C[N@@H+](CC)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444592271 1017579468 /nfs/dbraw/zinc/57/94/68/1017579468.db2.gz GIFLNOZORLMYAT-UHFFFAOYSA-N 1 1 304.394 3.729 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000405020640 1017749380 /nfs/dbraw/zinc/74/93/80/1017749380.db2.gz QYQGUJJBYSSJHN-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000613184935 1017970703 /nfs/dbraw/zinc/97/07/03/1017970703.db2.gz ZBACJVYBLUDEEV-JSGCOSHPSA-N 1 1 317.414 3.589 20 5 DHBDMO Cc1c([C@H](C)N[C@@H]2CC[N@H+](C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000153741731 1018003845 /nfs/dbraw/zinc/00/38/45/1018003845.db2.gz MVCPBLKVTCSHHM-LSDHHAIUSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c([C@H](C)[NH2+][C@@H]2CCN(C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000153741731 1018003857 /nfs/dbraw/zinc/00/38/57/1018003857.db2.gz MVCPBLKVTCSHHM-LSDHHAIUSA-N 1 1 317.433 3.571 20 5 DHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000524895235 1018119079 /nfs/dbraw/zinc/11/90/79/1018119079.db2.gz PSVFTJUBXZOVNL-JKSUJKDBSA-N 1 1 306.406 3.539 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000079926961 1018224762 /nfs/dbraw/zinc/22/47/62/1018224762.db2.gz FATVLRXWBXISBI-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278613668 1018926317 /nfs/dbraw/zinc/92/63/17/1018926317.db2.gz FQAZXPQOBRJMFV-GHMZBOCLSA-N 1 1 302.296 3.930 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(c2sccc2[N+](=O)[O-])CC1 ZINC000611290026 1019435195 /nfs/dbraw/zinc/43/51/95/1019435195.db2.gz VHIDUQZBXBRDAK-UHFFFAOYSA-N 1 1 311.451 3.605 20 5 DHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccsc2[N+](=O)[O-])C1 ZINC000611370281 1019457470 /nfs/dbraw/zinc/45/74/70/1019457470.db2.gz FOWLEMNOTJNMAG-GXTWGEPZSA-N 1 1 317.414 3.904 20 5 DHBDMO C[C@H]1C[C@H](Nc2sccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000611413470 1019477222 /nfs/dbraw/zinc/47/72/22/1019477222.db2.gz WHVYFBGQGJMMNY-JSGCOSHPSA-N 1 1 317.414 3.731 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000092471206 1019511781 /nfs/dbraw/zinc/51/17/81/1019511781.db2.gz VJGGOIKQOXETQD-LLVKDONJSA-N 1 1 303.387 3.560 20 5 DHBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000611555206 1019517842 /nfs/dbraw/zinc/51/78/42/1019517842.db2.gz RHLRQKLAKOXVGL-ZYHUDNBSSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000611554553 1019520775 /nfs/dbraw/zinc/52/07/75/1019520775.db2.gz UWXURUAAAXVQAR-ZYHUDNBSSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000611554553 1019520781 /nfs/dbraw/zinc/52/07/81/1019520781.db2.gz UWXURUAAAXVQAR-ZYHUDNBSSA-N 1 1 302.296 3.758 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000370671224 1019711213 /nfs/dbraw/zinc/71/12/13/1019711213.db2.gz OPRITEJKMGTBPS-NUJGCVRESA-N 1 1 317.433 3.652 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000370671224 1019711231 /nfs/dbraw/zinc/71/12/31/1019711231.db2.gz OPRITEJKMGTBPS-NUJGCVRESA-N 1 1 317.433 3.652 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc3c[nH]nc3c2)C2CC2)c1 ZINC000154278624 1020092396 /nfs/dbraw/zinc/09/23/96/1020092396.db2.gz NFXMGQPWFTZMRM-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO CCCn1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000154464539 1020112202 /nfs/dbraw/zinc/11/22/02/1020112202.db2.gz PDZOPBMDCJECQN-UHFFFAOYSA-N 1 1 316.405 3.612 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC(C)(C)O ZINC000093414543 1020152763 /nfs/dbraw/zinc/15/27/63/1020152763.db2.gz YAZYLQCAEUFNHE-UHFFFAOYSA-N 1 1 320.414 3.526 20 5 DHBDMO C[C@H](O)CC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000093481192 1020154647 /nfs/dbraw/zinc/15/46/47/1020154647.db2.gz AFCMPBYUMZQJLZ-LBPRGKRZSA-N 1 1 320.414 3.526 20 5 DHBDMO CC(C)[N@@H+](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000390484540 1020201313 /nfs/dbraw/zinc/20/13/13/1020201313.db2.gz GDLDOQOSNHYXBA-SNVBAGLBSA-N 1 1 319.327 3.754 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])CC1=Cc2ccccc2OC1 ZINC000179315896 1020252359 /nfs/dbraw/zinc/25/23/59/1020252359.db2.gz XRZYIIFDCVMLON-UHFFFAOYSA-N 1 1 310.353 3.503 20 5 DHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])CC1=Cc2ccccc2OC1 ZINC000179315896 1020252367 /nfs/dbraw/zinc/25/23/67/1020252367.db2.gz XRZYIIFDCVMLON-UHFFFAOYSA-N 1 1 310.353 3.503 20 5 DHBDMO C[C@H](C1CC1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000235397752 1020310998 /nfs/dbraw/zinc/31/09/98/1020310998.db2.gz CXROJOWOUPKTRR-SECBINFHSA-N 1 1 313.195 3.588 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1 ZINC000280901535 1020315688 /nfs/dbraw/zinc/31/56/88/1020315688.db2.gz DVBPFGCGUVSWCQ-KURKYZTESA-N 1 1 318.417 3.500 20 5 DHBDMO CCCc1[nH+]ccn1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000162476857 1020495401 /nfs/dbraw/zinc/49/54/01/1020495401.db2.gz UKUWYZDOTIONFG-UHFFFAOYSA-N 1 1 324.178 3.555 20 5 DHBDMO CC(C)[C@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000738242751 1020867515 /nfs/dbraw/zinc/86/75/15/1020867515.db2.gz ZGCULJOSBMYYKB-AWEZNQCLSA-N 1 1 316.405 3.660 20 5 DHBDMO COC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000537984377 1032961186 /nfs/dbraw/zinc/96/11/86/1032961186.db2.gz SITNTKUSQKBYFY-SJKOYZFVSA-N 1 1 318.348 3.772 20 5 DHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154470515 1021335402 /nfs/dbraw/zinc/33/54/02/1021335402.db2.gz GKAIXOXYJXNFME-JQFCIGGWSA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccncc2Cl)cc1[N+](=O)[O-] ZINC000181832823 1021361241 /nfs/dbraw/zinc/36/12/41/1021361241.db2.gz FFSBYMYNXRVNKG-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2C[C@H](O)c3ccccc32)c(Cl)c1 ZINC000850371957 1021494031 /nfs/dbraw/zinc/49/40/31/1021494031.db2.gz NRAUXWOTCKTMNV-CVEARBPZSA-N 1 1 318.760 3.516 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000556609946 1021794322 /nfs/dbraw/zinc/79/43/22/1021794322.db2.gz WGQUYCFRBSGNBI-QKNCTXAOSA-N 1 1 316.401 3.642 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCCCO2)C1 ZINC000365705311 1021882524 /nfs/dbraw/zinc/88/25/24/1021882524.db2.gz PMIGIWMMBSICOL-WMLDXEAASA-N 1 1 304.390 3.691 20 5 DHBDMO Cc1noc(C[NH+]2CCC(C3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000851728113 1021975387 /nfs/dbraw/zinc/97/53/87/1021975387.db2.gz GCFNUGQIMQOVAR-UHFFFAOYSA-N 1 1 307.394 3.684 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1OC ZINC000851898752 1022033635 /nfs/dbraw/zinc/03/36/35/1022033635.db2.gz XKKWGBJWQOZMCK-HNNXBMFYSA-N 1 1 318.348 3.983 20 5 DHBDMO CC(C)CC[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587605 1022102591 /nfs/dbraw/zinc/10/25/91/1022102591.db2.gz XHCKMDUGYZMPJM-RDJZCZTQSA-N 1 1 306.406 3.529 20 5 DHBDMO CCC[C@]1(C)CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776587438 1022105014 /nfs/dbraw/zinc/10/50/14/1022105014.db2.gz GNUAXSNRGSXLMB-DLBZAZTESA-N 1 1 306.406 3.530 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@H](c2nccs2)C1 ZINC000195340116 1022121655 /nfs/dbraw/zinc/12/16/55/1022121655.db2.gz KZOZAZUJTRTPHW-NSHDSACASA-N 1 1 321.377 3.570 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000195340116 1022121658 /nfs/dbraw/zinc/12/16/58/1022121658.db2.gz KZOZAZUJTRTPHW-NSHDSACASA-N 1 1 321.377 3.570 20 5 DHBDMO C[N@@H+](Cc1ccccc1C(F)(F)F)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169033595 1022218960 /nfs/dbraw/zinc/21/89/60/1022218960.db2.gz CDHSUQCFVLDJPE-YPMHNXCESA-N 1 1 316.323 3.583 20 5 DHBDMO C[N@@H+](Cc1ccccc1C(F)(F)F)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169033593 1022219654 /nfs/dbraw/zinc/21/96/54/1022219654.db2.gz CDHSUQCFVLDJPE-DGCLKSJQSA-N 1 1 316.323 3.583 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H]2c2ccc(F)cc2F)C1 ZINC001169048429 1022228285 /nfs/dbraw/zinc/22/82/85/1022228285.db2.gz UZJIYWJFTTUSLJ-KFNAQCHYSA-N 1 1 310.344 3.547 20 5 DHBDMO Cc1c(F)cc([N+](=O)[O-])cc1NCCC[N@@H+]1CCCC[C@H]1C ZINC001167754313 1023047941 /nfs/dbraw/zinc/04/79/41/1023047941.db2.gz RUKRTYWTZXMTEQ-GFCCVEGCSA-N 1 1 309.385 3.719 20 5 DHBDMO CCOc1ccccc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000046783389 1023071525 /nfs/dbraw/zinc/07/15/25/1023071525.db2.gz ANNUTGFCUFFDAL-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO CCOc1ccccc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000046783389 1023071535 /nfs/dbraw/zinc/07/15/35/1023071535.db2.gz ANNUTGFCUFFDAL-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO C[N@H+](CCC1CC1)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000770377281 1023301228 /nfs/dbraw/zinc/30/12/28/1023301228.db2.gz ZNZNHRZKBREHLS-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO C[N@@H+](CCC1CC1)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000770377281 1023301238 /nfs/dbraw/zinc/30/12/38/1023301238.db2.gz ZNZNHRZKBREHLS-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO Cc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000108098195 1023524720 /nfs/dbraw/zinc/52/47/20/1023524720.db2.gz FCNZSKYUEHMEHF-QGZVFWFLSA-N 1 1 311.385 3.590 20 5 DHBDMO COC[C@@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000452110150 1023979578 /nfs/dbraw/zinc/97/95/78/1023979578.db2.gz YEJKFAHURGCQDG-LSDHHAIUSA-N 1 1 306.406 3.713 20 5 DHBDMO COc1ccc(C2CC2)cc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000883259000 1024329123 /nfs/dbraw/zinc/32/91/23/1024329123.db2.gz XSDOIOCGSCXZDR-UHFFFAOYSA-N 1 1 312.369 3.771 20 5 DHBDMO CCCO[C@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000108395595 1024639713 /nfs/dbraw/zinc/63/97/13/1024639713.db2.gz KIWBZVKDVHLPJV-YOEHRIQHSA-N 1 1 306.406 3.937 20 5 DHBDMO CCc1noc(CC)c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000166965052 1024666016 /nfs/dbraw/zinc/66/60/16/1024666016.db2.gz MRMRDETWAVJCMA-LBPRGKRZSA-N 1 1 317.389 3.867 20 5 DHBDMO CCC[N@@H+](CC1CC1)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170328786 1024745225 /nfs/dbraw/zinc/74/52/25/1024745225.db2.gz MRMDAMUOMTZDNU-ZDUSSCGKSA-N 1 1 306.406 3.656 20 5 DHBDMO CCC[N@@H+](CC1CC1)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170328785 1024745962 /nfs/dbraw/zinc/74/59/62/1024745962.db2.gz MRMDAMUOMTZDNU-CYBMUJFWSA-N 1 1 306.406 3.656 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001170328632 1024746897 /nfs/dbraw/zinc/74/68/97/1024746897.db2.gz KXVVQYLVYVDLKT-CYBMUJFWSA-N 1 1 306.406 3.799 20 5 DHBDMO CC1(C)CC[C@H](C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)O1 ZINC001170424645 1024865665 /nfs/dbraw/zinc/86/56/65/1024865665.db2.gz OGIGWHLLLVIHQZ-DOTOQJQBSA-N 1 1 318.417 3.732 20 5 DHBDMO Cc1ccncc1C[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000793342081 1024984706 /nfs/dbraw/zinc/98/47/06/1024984706.db2.gz WFQJASSNMLSPDU-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO Cc1ccncc1C[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000793342081 1024984717 /nfs/dbraw/zinc/98/47/17/1024984717.db2.gz WFQJASSNMLSPDU-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO CSCC[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000134849645 1025135393 /nfs/dbraw/zinc/13/53/93/1025135393.db2.gz AHWWEDNKQFXVHC-JTQLQIEISA-N 1 1 302.827 3.822 20 5 DHBDMO O=[N+]([O-])c1ccc([O-])cc1C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000353902025 1025284388 /nfs/dbraw/zinc/28/43/88/1025284388.db2.gz SXFDTQVLRJSYTM-QGZVFWFLSA-N 1 1 302.374 3.623 20 5 DHBDMO CC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000885965256 1025422270 /nfs/dbraw/zinc/42/22/70/1025422270.db2.gz KJFYEJXPUDPWKM-GFCCVEGCSA-N 1 1 303.337 3.712 20 5 DHBDMO CC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000885965256 1025422273 /nfs/dbraw/zinc/42/22/73/1025422273.db2.gz KJFYEJXPUDPWKM-GFCCVEGCSA-N 1 1 303.337 3.712 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000886020645 1025441026 /nfs/dbraw/zinc/44/10/26/1025441026.db2.gz FIIZWAPMVLHYGW-PBHICJAKSA-N 1 1 311.385 3.615 20 5 DHBDMO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cccnc2[N+](=O)[O-])o1 ZINC000886028857 1025446042 /nfs/dbraw/zinc/44/60/42/1025446042.db2.gz ZBTFCSCAYNWTNZ-DOMZBBRYSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cccnc2[N+](=O)[O-])o1 ZINC000886028857 1025446049 /nfs/dbraw/zinc/44/60/49/1025446049.db2.gz ZBTFCSCAYNWTNZ-DOMZBBRYSA-N 1 1 315.373 3.864 20 5 DHBDMO CC(C)[N@H+](Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136897165 1025491210 /nfs/dbraw/zinc/49/12/10/1025491210.db2.gz QTDYVAABKMXGEQ-SFHVURJKSA-N 1 1 314.385 3.539 20 5 DHBDMO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805839048 1025681007 /nfs/dbraw/zinc/68/10/07/1025681007.db2.gz NGTCJWRPZMQRKN-UNEWFSDZSA-N 1 1 320.433 3.775 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](C)c1cscn1 ZINC000573626200 1025738003 /nfs/dbraw/zinc/73/80/03/1025738003.db2.gz YOTZRZHSPZKXRZ-DSDFTUOUSA-N 1 1 303.387 3.805 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2n1C ZINC000453228698 1025765250 /nfs/dbraw/zinc/76/52/50/1025765250.db2.gz BHTWMKYKXKQTJV-STQMWFEESA-N 1 1 324.384 3.893 20 5 DHBDMO CCCCC(N)=[NH+]OCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000729674051 1025902235 /nfs/dbraw/zinc/90/22/35/1025902235.db2.gz HMKRLTVGCALOEW-UHFFFAOYSA-N 1 1 309.366 3.571 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000289649500 1026114643 /nfs/dbraw/zinc/11/46/43/1026114643.db2.gz CAXXHQPQAZVGGY-ZNNBYXKUSA-N 1 1 309.369 3.840 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC12CCC2 ZINC000357062499 1026299707 /nfs/dbraw/zinc/29/97/07/1026299707.db2.gz FKAZMSVEEYKVQA-LBPRGKRZSA-N 1 1 315.373 3.748 20 5 DHBDMO CSC1(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)CCC1 ZINC000811454470 1027003582 /nfs/dbraw/zinc/00/35/82/1027003582.db2.gz LRWHKGNTFJDWNP-UHFFFAOYSA-N 1 1 314.838 3.966 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000355754145 1027106114 /nfs/dbraw/zinc/10/61/14/1027106114.db2.gz ZODQNVVMCJWPQQ-YOEHRIQHSA-N 1 1 304.390 3.548 20 5 DHBDMO CC[N@@H+](CCOc1ccccc1C)Cc1cccc([N+](=O)[O-])c1 ZINC000571425683 1027125380 /nfs/dbraw/zinc/12/53/80/1027125380.db2.gz CQGULXJUEQBRIT-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(F)c(F)c(F)c1 ZINC000561967564 1027150339 /nfs/dbraw/zinc/15/03/39/1027150339.db2.gz GHQCPAKCCQAFTP-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO Cc1noc(C[NH2+][C@H]2CCc3cccc4cccc2c43)c1[N+](=O)[O-] ZINC000931808901 1027263917 /nfs/dbraw/zinc/26/39/17/1027263917.db2.gz MEEGSPDQVYQYLS-HNNXBMFYSA-N 1 1 323.352 3.822 20 5 DHBDMO CCC[C@@H](N[C@H]1CC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000157724359 1027359359 /nfs/dbraw/zinc/35/93/59/1027359359.db2.gz ZTMAEMCYXLUWRT-FUHWJXTLSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@@H](N[C@H]1CC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000157724359 1027359379 /nfs/dbraw/zinc/35/93/79/1027359379.db2.gz ZTMAEMCYXLUWRT-FUHWJXTLSA-N 1 1 317.433 3.510 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](Cc2nccs2)C1 ZINC000932199366 1027408780 /nfs/dbraw/zinc/40/87/80/1027408780.db2.gz XIFSZSDLQLIMDT-CYBMUJFWSA-N 1 1 317.414 3.506 20 5 DHBDMO C[NH2+]CCCN[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423207653 1027445575 /nfs/dbraw/zinc/44/55/75/1027445575.db2.gz XYWLYWQCUXZAJW-LBPRGKRZSA-N 1 1 319.430 3.583 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000932377661 1027469530 /nfs/dbraw/zinc/46/95/30/1027469530.db2.gz ISTXRPPVJDHRRH-MRXNPFEDSA-N 1 1 317.776 3.884 20 5 DHBDMO Cc1noc(C[N@H+]2C[C@H](c3ccccc3)CC2(C)C)c1[N+](=O)[O-] ZINC000932899408 1027644406 /nfs/dbraw/zinc/64/44/06/1027644406.db2.gz UHYQDWBUXRMXTI-CQSZACIVSA-N 1 1 315.373 3.659 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)CCO2 ZINC000933490938 1027745468 /nfs/dbraw/zinc/74/54/68/1027745468.db2.gz BVWVVAZOJWGRPG-LLVKDONJSA-N 1 1 316.332 3.520 20 5 DHBDMO CCC[C@@](C)([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1ccccc1 ZINC000934180424 1027918070 /nfs/dbraw/zinc/91/80/70/1027918070.db2.gz QXBOQRQGCCOPGD-MRXNPFEDSA-N 1 1 303.362 3.696 20 5 DHBDMO CSC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000814179418 1027918837 /nfs/dbraw/zinc/91/88/37/1027918837.db2.gz SVDIMYULFRGSPS-LBPRGKRZSA-N 1 1 314.838 3.823 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934333888 1027966154 /nfs/dbraw/zinc/96/61/54/1027966154.db2.gz RIAQWTCLRDNOGV-OLZOCXBDSA-N 1 1 317.414 3.677 20 5 DHBDMO CO[C@]1(C)CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601157955 1028005311 /nfs/dbraw/zinc/00/53/11/1028005311.db2.gz JXQUKFFPCKKLIR-QGZVFWFLSA-N 1 1 315.373 3.538 20 5 DHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H](c2ccncc2)C2CC2)c(F)c1 ZINC000934698276 1028079244 /nfs/dbraw/zinc/07/92/44/1028079244.db2.gz KXDCIPXJKPBHCJ-MRXNPFEDSA-N 1 1 319.311 3.509 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCCC23CCOCC3)cc1[N+](=O)[O-] ZINC000371392848 1028700187 /nfs/dbraw/zinc/70/01/87/1028700187.db2.gz LMAPXXQFAHIEQB-UHFFFAOYSA-N 1 1 318.417 3.863 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cccc(O)c3)C2)cc1 ZINC000449495428 1028706657 /nfs/dbraw/zinc/70/66/57/1028706657.db2.gz DEVIUDCGGVYREN-MRXNPFEDSA-N 1 1 312.369 3.680 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449505735 1028727796 /nfs/dbraw/zinc/72/77/96/1028727796.db2.gz XMOWYJXYVGKVNA-KRWDZBQOSA-N 1 1 311.385 3.678 20 5 DHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000449507822 1028729833 /nfs/dbraw/zinc/72/98/33/1028729833.db2.gz UIEFCTHZTCGGST-SUMWQHHRSA-N 1 1 306.406 3.575 20 5 DHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000449507821 1028730624 /nfs/dbraw/zinc/73/06/24/1028730624.db2.gz UIEFCTHZTCGGST-GUYCJALGSA-N 1 1 306.406 3.575 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)cc1[N+](=O)[O-] ZINC000449573050 1028819067 /nfs/dbraw/zinc/81/90/67/1028819067.db2.gz PGCULOAEDJOMTR-IUODEOHRSA-N 1 1 314.389 3.710 20 5 DHBDMO Cc1ccc(C[N@H+](C)[C@H]2CCCc3cccnc32)cc1[N+](=O)[O-] ZINC000372769261 1028896009 /nfs/dbraw/zinc/89/60/09/1028896009.db2.gz UGKMATDVRKCGOE-INIZCTEOSA-N 1 1 311.385 3.808 20 5 DHBDMO C[C@H](C1CC1)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000567893181 1028969230 /nfs/dbraw/zinc/96/92/30/1028969230.db2.gz IVWVWAUAJFLOQB-SECBINFHSA-N 1 1 313.195 3.588 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1F ZINC000817281434 1029113356 /nfs/dbraw/zinc/11/33/56/1029113356.db2.gz KYTYIFRJXBOMGC-NSHDSACASA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1F ZINC000817281434 1029113363 /nfs/dbraw/zinc/11/33/63/1029113363.db2.gz KYTYIFRJXBOMGC-NSHDSACASA-N 1 1 320.286 3.898 20 5 DHBDMO Cc1cnc([C@@H]2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)s1 ZINC000374231794 1029249965 /nfs/dbraw/zinc/24/99/65/1029249965.db2.gz XSFKMORIHSGIPF-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO CC[C@@H]([NH2+][C@@H](C)c1cn(C(C)C)nn1)c1cccc([N+](=O)[O-])c1 ZINC000925227798 1029406749 /nfs/dbraw/zinc/40/67/49/1029406749.db2.gz BHSWYWIHOBTLLI-SWLSCSKDSA-N 1 1 317.393 3.569 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](O)c2ccccc2C1 ZINC000374806657 1029464916 /nfs/dbraw/zinc/46/49/16/1029464916.db2.gz MUFCOEFAANMEKX-UGSOOPFHSA-N 1 1 312.369 3.595 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1F ZINC000374924241 1029499989 /nfs/dbraw/zinc/49/99/89/1029499989.db2.gz CMWZYZHATSIWLU-MRXNPFEDSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1F ZINC000374924241 1029499992 /nfs/dbraw/zinc/49/99/92/1029499992.db2.gz CMWZYZHATSIWLU-MRXNPFEDSA-N 1 1 316.332 3.777 20 5 DHBDMO CC(C)(C)OCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451545933 1029906074 /nfs/dbraw/zinc/90/60/74/1029906074.db2.gz HYPGXCIKWFOQIX-OAHLLOKOSA-N 1 1 306.406 3.589 20 5 DHBDMO CCOC1CC(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000451544107 1029909737 /nfs/dbraw/zinc/90/97/37/1029909737.db2.gz DSELMILMJLBGTG-BFHRDPOASA-N 1 1 318.417 3.589 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1OC ZINC000865824843 1030042945 /nfs/dbraw/zinc/04/29/45/1030042945.db2.gz SRBCLXJGUINPRQ-MRXNPFEDSA-N 1 1 318.348 3.983 20 5 DHBDMO CC[C@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000533423297 1030343967 /nfs/dbraw/zinc/34/39/67/1030343967.db2.gz BUSHGTJSXFFRMZ-AWEZNQCLSA-N 1 1 315.373 3.667 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000866539220 1030360114 /nfs/dbraw/zinc/36/01/14/1030360114.db2.gz JAUJGAWRDAAGCI-GFCCVEGCSA-N 1 1 315.329 3.662 20 5 DHBDMO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805840047 1030398443 /nfs/dbraw/zinc/39/84/43/1030398443.db2.gz WIRFSFKJFBBARA-KMFMINBZSA-N 1 1 320.433 3.775 20 5 DHBDMO CC[C@H](NC[C@H]1CCCC[N@@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000358357024 1030452599 /nfs/dbraw/zinc/45/25/99/1030452599.db2.gz VTTDJXRTQULAPT-MSOLQXFVSA-N 1 1 319.449 3.898 20 5 DHBDMO CC[C@H](NC[C@H]1CCCC[N@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000358357024 1030452609 /nfs/dbraw/zinc/45/26/09/1030452609.db2.gz VTTDJXRTQULAPT-MSOLQXFVSA-N 1 1 319.449 3.898 20 5 DHBDMO Cc1[nH+]c(NCc2ccc([N+](=O)[O-])cc2)ccc1-c1ccccc1 ZINC000558493985 1030603080 /nfs/dbraw/zinc/60/30/80/1030603080.db2.gz QPNDKEMOXMUAIY-UHFFFAOYSA-N 1 1 319.364 4.577 20 5 DHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1CC(F)(F)C1 ZINC000296682551 1030761070 /nfs/dbraw/zinc/76/10/70/1030761070.db2.gz BMGRVOVMJLNFBM-UHFFFAOYSA-N 1 1 304.724 3.725 20 5 DHBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558742446 1030763754 /nfs/dbraw/zinc/76/37/54/1030763754.db2.gz NPHBAQMBFIICQG-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cn2c(n1)CCCC2 ZINC000926493645 1030765265 /nfs/dbraw/zinc/76/52/65/1030765265.db2.gz XDBQNCAXPDEFJF-STQMWFEESA-N 1 1 314.389 3.539 20 5 DHBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1F ZINC000292131753 1030831560 /nfs/dbraw/zinc/83/15/60/1030831560.db2.gz LHFKLPOHBWFCBE-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO CC[C@H](NCC[N@@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000359927193 1031201663 /nfs/dbraw/zinc/20/16/63/1031201663.db2.gz UPWRNUVFJUFGDL-YOEHRIQHSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@H](NCC[N@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000359927193 1031201673 /nfs/dbraw/zinc/20/16/73/1031201673.db2.gz UPWRNUVFJUFGDL-YOEHRIQHSA-N 1 1 305.422 3.510 20 5 DHBDMO CCOc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872026878 1031409217 /nfs/dbraw/zinc/40/92/17/1031409217.db2.gz IGBCZLWNPPPLBU-LBPRGKRZSA-N 1 1 318.348 3.983 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1c(C)noc1C ZINC000872027457 1031412042 /nfs/dbraw/zinc/41/20/42/1031412042.db2.gz LLCSZDUCUVHYKQ-SECBINFHSA-N 1 1 321.402 3.772 20 5 DHBDMO Cc1ccncc1[C@H](C)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042877 1031427907 /nfs/dbraw/zinc/42/79/07/1031427907.db2.gz DXZGSZLNFGMNMG-NWDGAFQWSA-N 1 1 303.337 3.849 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000293421863 1031467888 /nfs/dbraw/zinc/46/78/88/1031467888.db2.gz AMGVTBGLINGXPA-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000877544417 1033347516 /nfs/dbraw/zinc/34/75/16/1033347516.db2.gz WWOHYJLEZJXGGX-CABCVRRESA-N 1 1 310.344 3.689 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000877604052 1033376835 /nfs/dbraw/zinc/37/68/35/1033376835.db2.gz HELOJZBUYPBKRS-MRXNPFEDSA-N 1 1 311.385 3.596 20 5 DHBDMO CCCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](C)c1ccccc1 ZINC000478033321 1033397178 /nfs/dbraw/zinc/39/71/78/1033397178.db2.gz LKKRDOMJPDCVKN-OAHLLOKOSA-N 1 1 316.405 3.655 20 5 DHBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908771 1033439981 /nfs/dbraw/zinc/43/99/81/1033439981.db2.gz NZDQDPOQTHRLKF-SFHVURJKSA-N 1 1 310.397 3.974 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H]3CCC[C@H]3C1)CC2 ZINC001172907001 1033440267 /nfs/dbraw/zinc/44/02/67/1033440267.db2.gz ZLZCZNHTGWJVOB-JCGIZDLHSA-N 1 1 314.429 3.964 20 5 DHBDMO C[C@@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H]1C ZINC001172917850 1033464739 /nfs/dbraw/zinc/46/47/39/1033464739.db2.gz XMKXZPZYBPNMLB-KEYYUXOJSA-N 1 1 302.418 3.963 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@@H](C(F)F)C1)CC2 ZINC001172916098 1033464917 /nfs/dbraw/zinc/46/49/17/1033464917.db2.gz QQGCRXDVSDRBPB-CABCVRRESA-N 1 1 324.371 3.819 20 5 DHBDMO CC[C@@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172919317 1033467022 /nfs/dbraw/zinc/46/70/22/1033467022.db2.gz FVNDVBMDCYMMAN-PBHICJAKSA-N 1 1 302.418 3.964 20 5 DHBDMO CC(C)[C@H]1CCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922633 1033470040 /nfs/dbraw/zinc/47/00/40/1033470040.db2.gz ZIZJOKBTVUSWIQ-SJLPKXTDSA-N 1 1 302.418 3.963 20 5 DHBDMO CCc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)nc1 ZINC000339022960 1033570448 /nfs/dbraw/zinc/57/04/48/1033570448.db2.gz PWESOUTUSVRIFN-UHFFFAOYSA-N 1 1 311.385 3.717 20 5 DHBDMO CCc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)nc1 ZINC000339022960 1033570458 /nfs/dbraw/zinc/57/04/58/1033570458.db2.gz PWESOUTUSVRIFN-UHFFFAOYSA-N 1 1 311.385 3.717 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)C2CCCC2)c1F ZINC001173189833 1033583149 /nfs/dbraw/zinc/58/31/49/1033583149.db2.gz MNBPAZOYSGPTSE-LLVKDONJSA-N 1 1 310.369 3.548 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1cccs1 ZINC001173224986 1033602555 /nfs/dbraw/zinc/60/25/55/1033602555.db2.gz AIBGPFBMRHYORB-CYBMUJFWSA-N 1 1 304.415 3.762 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cccc(F)c1 ZINC001173230720 1033606303 /nfs/dbraw/zinc/60/63/03/1033606303.db2.gz ZWJDWYLMENFSJM-CYBMUJFWSA-N 1 1 302.349 3.797 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)cc1Cl ZINC000862473064 1033862858 /nfs/dbraw/zinc/86/28/58/1033862858.db2.gz CLPWMZALXCWOCA-NEPJUHHUSA-N 1 1 312.822 3.718 20 5 DHBDMO NC1(C[NH2+]Cc2c3ccccc3cc3ccccc32)CCOCC1 ZINC000863646061 1034162963 /nfs/dbraw/zinc/16/29/63/1034162963.db2.gz PLWHUQRQKMLFPE-UHFFFAOYSA-N 1 1 320.436 3.591 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC000879998808 1034174520 /nfs/dbraw/zinc/17/45/20/1034174520.db2.gz ASFFLFUNFADKJX-GXFFZTMASA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC000880000802 1034176003 /nfs/dbraw/zinc/17/60/03/1034176003.db2.gz KXFPYIRUCCRRGU-MFKMUULPSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC000880000798 1034177910 /nfs/dbraw/zinc/17/79/10/1034177910.db2.gz KXFPYIRUCCRRGU-GWCFXTLKSA-N 1 1 302.296 3.930 20 5 DHBDMO Cc1nc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)sc1C ZINC000178182216 1034218487 /nfs/dbraw/zinc/21/84/87/1034218487.db2.gz QXXNMJQTFQBXEL-NSHDSACASA-N 1 1 305.403 3.827 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880313430 1034292591 /nfs/dbraw/zinc/29/25/91/1034292591.db2.gz AOTWRBKIPQUURG-DGCLKSJQSA-N 1 1 303.387 3.602 20 5 DHBDMO CC[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865480494 1034671068 /nfs/dbraw/zinc/67/10/68/1034671068.db2.gz NUNOPGZHSPQGAZ-LLVKDONJSA-N 1 1 313.348 3.676 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2C2CCOCC2)ccc1Cl ZINC000777442454 1034745175 /nfs/dbraw/zinc/74/51/75/1034745175.db2.gz KHOPQZMIWXSDHC-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO Cn1c2ccc(Nc3ncc([N+](=O)[O-])s3)cc2[nH+]c1C1CC1 ZINC000192514930 1034808112 /nfs/dbraw/zinc/80/81/12/1034808112.db2.gz FSNXYWANFSPVDX-UHFFFAOYSA-N 1 1 315.358 3.559 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCO[C@H](C(C)C)C1 ZINC000555794057 1034904752 /nfs/dbraw/zinc/90/47/52/1034904752.db2.gz QVVJIILTNXTOCL-YOEHRIQHSA-N 1 1 306.406 3.711 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2Cc3ccccc3C3(CC3)C2)c1 ZINC000481776827 1034973787 /nfs/dbraw/zinc/97/37/87/1034973787.db2.gz IEEFLIJZXUXOGY-UHFFFAOYSA-N 1 1 324.380 3.521 20 5 DHBDMO C[C@@H]1CCCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159412125 1035048811 /nfs/dbraw/zinc/04/88/11/1035048811.db2.gz FEKRSUSFDIHZSY-SNVBAGLBSA-N 1 1 313.195 3.732 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159412125 1035048814 /nfs/dbraw/zinc/04/88/14/1035048814.db2.gz FEKRSUSFDIHZSY-SNVBAGLBSA-N 1 1 313.195 3.732 20 5 DHBDMO CC[C@H]1CCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159419700 1035052094 /nfs/dbraw/zinc/05/20/94/1035052094.db2.gz FTEJJVSMRPWNAQ-NSHDSACASA-N 1 1 313.195 3.732 20 5 DHBDMO CC[C@H]1CCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159419700 1035052097 /nfs/dbraw/zinc/05/20/97/1035052097.db2.gz FTEJJVSMRPWNAQ-NSHDSACASA-N 1 1 313.195 3.732 20 5 DHBDMO Cc1c([C@@H](C)NC2CC(C)(C)[NH2+]C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000159614898 1035073539 /nfs/dbraw/zinc/07/35/39/1035073539.db2.gz JGEAWTYSNYSCIU-CYBMUJFWSA-N 1 1 319.449 3.863 20 5 DHBDMO C[C@H](C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)(C)C ZINC001175982323 1035173630 /nfs/dbraw/zinc/17/36/30/1035173630.db2.gz FOHFHENIAMQZDN-LLVKDONJSA-N 1 1 304.394 3.585 20 5 DHBDMO Cc1ccc([C@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000483186841 1035239871 /nfs/dbraw/zinc/23/98/71/1035239871.db2.gz SBWJANMXSQKIPP-WMLDXEAASA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000483186841 1035239875 /nfs/dbraw/zinc/23/98/75/1035239875.db2.gz SBWJANMXSQKIPP-WMLDXEAASA-N 1 1 321.465 3.920 20 5 DHBDMO CC[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000161098660 1035297479 /nfs/dbraw/zinc/29/74/79/1035297479.db2.gz LWCNOHFBPNOSBP-ZOBUZTSGSA-N 1 1 305.422 3.508 20 5 DHBDMO CCCn1cc[nH+]c1CCCN(C)c1ccc(C)cc1[N+](=O)[O-] ZINC000758156327 1035354734 /nfs/dbraw/zinc/35/47/34/1035354734.db2.gz SVPCZBYTLPQAKB-UHFFFAOYSA-N 1 1 316.405 3.579 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccccc1Cl ZINC000037011412 1035405127 /nfs/dbraw/zinc/40/51/27/1035405127.db2.gz NIGUCIKOBPCCDB-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO COCC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000485147362 1035478356 /nfs/dbraw/zinc/47/83/56/1035478356.db2.gz ZOLLTWMMRUAFTR-CQSZACIVSA-N 1 1 322.380 3.539 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)c(Cl)c1 ZINC000494703529 1035772261 /nfs/dbraw/zinc/77/22/61/1035772261.db2.gz PSAOWPRCGDZCEC-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c(Cl)c1 ZINC000494703529 1035772272 /nfs/dbraw/zinc/77/22/72/1035772272.db2.gz PSAOWPRCGDZCEC-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494699987 1035779561 /nfs/dbraw/zinc/77/95/61/1035779561.db2.gz AJCNDYSZYSLEOI-HIFRSBDPSA-N 1 1 304.390 3.547 20 5 DHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(C(F)F)nc1 ZINC000595013030 1035843329 /nfs/dbraw/zinc/84/33/29/1035843329.db2.gz FXNOAHYGLSIWQL-JTQLQIEISA-N 1 1 307.300 3.778 20 5 DHBDMO CC1=CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001181256421 1035884558 /nfs/dbraw/zinc/88/45/58/1035884558.db2.gz OEUSKZJAWZVHME-UHFFFAOYSA-N 1 1 300.280 3.766 20 5 DHBDMO CC1=CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001181256421 1035884576 /nfs/dbraw/zinc/88/45/76/1035884576.db2.gz OEUSKZJAWZVHME-UHFFFAOYSA-N 1 1 300.280 3.766 20 5 DHBDMO CO[C@H]1C[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001194384614 1035917737 /nfs/dbraw/zinc/91/77/37/1035917737.db2.gz LPBBGHZIVPBDHZ-CABCVRRESA-N 1 1 324.808 3.638 20 5 DHBDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001194384614 1035917745 /nfs/dbraw/zinc/91/77/45/1035917745.db2.gz LPBBGHZIVPBDHZ-CABCVRRESA-N 1 1 324.808 3.638 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCOCC3CCC3)C2)cc1 ZINC001194476962 1035943286 /nfs/dbraw/zinc/94/32/86/1035943286.db2.gz GNBRZCXBYVVVBB-QGZVFWFLSA-N 1 1 318.417 3.591 20 5 DHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC2(CCCC2)O1 ZINC000443341650 1036075574 /nfs/dbraw/zinc/07/55/74/1036075574.db2.gz IWXUZHKKGWREDZ-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000443348004 1036093889 /nfs/dbraw/zinc/09/38/89/1036093889.db2.gz ZCKLRVNBNPOWEW-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000443348004 1036093897 /nfs/dbraw/zinc/09/38/97/1036093897.db2.gz ZCKLRVNBNPOWEW-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO C[C@@H](C1CCCCC1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000773978553 1036100911 /nfs/dbraw/zinc/10/09/11/1036100911.db2.gz UPNRZZYBYFTAAU-GUYCJALGSA-N 1 1 306.406 3.529 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000541772473 1036429732 /nfs/dbraw/zinc/42/97/32/1036429732.db2.gz BEHLAQQQNDBMQU-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000464770175 1036448322 /nfs/dbraw/zinc/44/83/22/1036448322.db2.gz FKZWSYVGCWKDEI-XJKSGUPXSA-N 1 1 324.446 3.580 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC001183371854 1036585831 /nfs/dbraw/zinc/58/58/31/1036585831.db2.gz UVFWYIRPVLUDSM-OPPWZJLSSA-N 1 1 318.442 3.683 20 5 DHBDMO Cc1ccc(OCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491962070 1036696963 /nfs/dbraw/zinc/69/69/63/1036696963.db2.gz VEYRUQSIPYHJIP-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO Cc1ccc(OCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491962070 1036696990 /nfs/dbraw/zinc/69/69/90/1036696990.db2.gz VEYRUQSIPYHJIP-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO CC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000301060622 1036732416 /nfs/dbraw/zinc/73/24/16/1036732416.db2.gz RBRZMROHHCLXLH-LLVKDONJSA-N 1 1 317.311 3.510 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000081599214 1036990609 /nfs/dbraw/zinc/99/06/09/1036990609.db2.gz NCDYGDHKLQKWNT-GFCCVEGCSA-N 1 1 320.414 3.728 20 5 DHBDMO CC(C)C[N@H+]1CCC[C@@H](CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000090586635 1037124887 /nfs/dbraw/zinc/12/48/87/1037124887.db2.gz MWEQXBYTKOBGDY-HOTGVXAUSA-N 1 1 319.449 3.613 20 5 DHBDMO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000489072899 1037248252 /nfs/dbraw/zinc/24/82/52/1037248252.db2.gz KMONQWIWJUKFSV-ZDUSSCGKSA-N 1 1 302.349 3.797 20 5 DHBDMO CC[N@@H+](CCc1cccs1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000489141496 1037276467 /nfs/dbraw/zinc/27/64/67/1037276467.db2.gz SGIUSPXLHNPTDE-UHFFFAOYSA-N 1 1 320.414 3.730 20 5 DHBDMO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1Br)C1CC1 ZINC001168448852 1037304111 /nfs/dbraw/zinc/30/41/11/1037304111.db2.gz SUQYRGHHBSTAJV-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Br)C1CC1 ZINC001168448852 1037304136 /nfs/dbraw/zinc/30/41/36/1037304136.db2.gz SUQYRGHHBSTAJV-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@@H](C4CC4)C3)c2c1 ZINC000763334247 1037587835 /nfs/dbraw/zinc/58/78/35/1037587835.db2.gz VTEUMGQHWSZIEY-LLVKDONJSA-N 1 1 319.386 3.561 20 5 DHBDMO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000387363706 1037631578 /nfs/dbraw/zinc/63/15/78/1037631578.db2.gz QNRMGFGIOSJKFI-CYBMUJFWSA-N 1 1 300.358 3.763 20 5 DHBDMO Cc1ccnc(Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)c1[N+](=O)[O-] ZINC000089649004 1037707633 /nfs/dbraw/zinc/70/76/33/1037707633.db2.gz LTUWISSUDHEDAX-UHFFFAOYSA-N 1 1 323.356 3.806 20 5 DHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@@H]1CCCCO1 ZINC000491079262 1037894693 /nfs/dbraw/zinc/89/46/93/1037894693.db2.gz SJYOIOYJGIQSTJ-HNNXBMFYSA-N 1 1 310.369 3.515 20 5 DHBDMO CCC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC1CCCCC1 ZINC001190485734 1038318749 /nfs/dbraw/zinc/31/87/49/1038318749.db2.gz QECYSRHFDRGBRR-GOSISDBHSA-N 1 1 320.433 3.921 20 5 DHBDMO CCC(CC)[N@@H+](CC)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000588977333 1038414735 /nfs/dbraw/zinc/41/47/35/1038414735.db2.gz UWQCLYPZZOPRKD-UHFFFAOYSA-N 1 1 321.421 3.742 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc2cnccc2c1 ZINC000589183628 1038444991 /nfs/dbraw/zinc/44/49/91/1038444991.db2.gz APEHFYNCBDDTNL-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1C[C@@H]1c1ccccc1)CCO2 ZINC000589521540 1038500400 /nfs/dbraw/zinc/50/04/00/1038500400.db2.gz FKXZXJHDGVBWRJ-MAUKXSAKSA-N 1 1 324.380 3.593 20 5 DHBDMO Cc1cc(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c(F)cc1[N+](=O)[O-] ZINC000589689882 1038534200 /nfs/dbraw/zinc/53/42/00/1038534200.db2.gz VXOJVCCUDIGYRH-MRXNPFEDSA-N 1 1 315.348 3.641 20 5 DHBDMO Cc1cc(N[C@@H]2C[N@H+](C)Cc3ccccc32)c(F)cc1[N+](=O)[O-] ZINC000589689882 1038534206 /nfs/dbraw/zinc/53/42/06/1038534206.db2.gz VXOJVCCUDIGYRH-MRXNPFEDSA-N 1 1 315.348 3.641 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cs1 ZINC000589743976 1038535141 /nfs/dbraw/zinc/53/51/41/1038535141.db2.gz VKOWHAMJPSQMSM-ZNMIVQPWSA-N 1 1 324.446 3.562 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@H](c1ccc(F)cc1F)C1CC1 ZINC001192617589 1038686896 /nfs/dbraw/zinc/68/68/96/1038686896.db2.gz WLKZZPLXXXGPSZ-HNNXBMFYSA-N 1 1 319.311 3.509 20 5 DHBDMO Cc1ccccc1CC1C[NH+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000590967200 1038733689 /nfs/dbraw/zinc/73/36/89/1038733689.db2.gz JBSNTLFOZJXYLY-UHFFFAOYSA-N 1 1 302.399 3.639 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@@H]2CC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599075006 1039029486 /nfs/dbraw/zinc/02/94/86/1039029486.db2.gz ZNASPFKFWVYSRR-PBHICJAKSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599075006 1039029506 /nfs/dbraw/zinc/02/95/06/1039029506.db2.gz ZNASPFKFWVYSRR-PBHICJAKSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)CCC(C)(C)C)cccc1[N+](=O)[O-] ZINC000592144792 1039138385 /nfs/dbraw/zinc/13/83/85/1039138385.db2.gz IVVRZKUHLBLNBC-ZDUSSCGKSA-N 1 1 321.421 3.598 20 5 DHBDMO C[C@H]1CC2(C[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-])CCOCC2 ZINC000592181476 1039162916 /nfs/dbraw/zinc/16/29/16/1039162916.db2.gz FBTDLLQEEODISR-LBPRGKRZSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000592189855 1039168892 /nfs/dbraw/zinc/16/88/92/1039168892.db2.gz XWPJGHVHEAKQPV-KGLIPLIRSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000592189855 1039168897 /nfs/dbraw/zinc/16/88/97/1039168897.db2.gz XWPJGHVHEAKQPV-KGLIPLIRSA-N 1 1 304.390 3.689 20 5 DHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000603843742 1039177849 /nfs/dbraw/zinc/17/78/49/1039177849.db2.gz YQVMSGNZHPZZAO-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cccc(Cl)c1 ZINC000058575227 1039280375 /nfs/dbraw/zinc/28/03/75/1039280375.db2.gz ZUDDNRWBLPIZOY-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2C2CCCC2)cc1[N+](=O)[O-] ZINC000604013189 1039281324 /nfs/dbraw/zinc/28/13/24/1039281324.db2.gz NZWYUKUFYKOZMU-OAHLLOKOSA-N 1 1 304.390 3.758 20 5 DHBDMO C[C@@H]([NH2+][C@H](CCO)c1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000592404265 1039447408 /nfs/dbraw/zinc/44/74/08/1039447408.db2.gz WMZXGFRHCKWQIB-SJKOYZFVSA-N 1 1 318.348 3.508 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)cs1 ZINC000604484172 1039480425 /nfs/dbraw/zinc/48/04/25/1039480425.db2.gz APYUPESMYSQWBX-AWEZNQCLSA-N 1 1 304.371 3.699 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cs1 ZINC000604484172 1039480432 /nfs/dbraw/zinc/48/04/32/1039480432.db2.gz APYUPESMYSQWBX-AWEZNQCLSA-N 1 1 304.371 3.699 20 5 DHBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000059391549 1039950624 /nfs/dbraw/zinc/95/06/24/1039950624.db2.gz ZWJSNPQZLPRHCE-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594026294 1039950631 /nfs/dbraw/zinc/95/06/31/1039950631.db2.gz IJASOMHFLJLWRP-ZFWWWQNUSA-N 1 1 304.390 3.689 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)c1cnccc1C ZINC000595022671 1039983832 /nfs/dbraw/zinc/98/38/32/1039983832.db2.gz UXQMRVRQLXYLCG-QWHCGFSZSA-N 1 1 315.373 3.719 20 5 DHBDMO CC(C)[C@@H](O)[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000594991546 1040004406 /nfs/dbraw/zinc/00/44/06/1040004406.db2.gz JCGJSALVHWTXSN-JKSUJKDBSA-N 1 1 320.414 3.504 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1c(C)noc1C ZINC000595008381 1040018061 /nfs/dbraw/zinc/01/80/61/1040018061.db2.gz OISLSHXWZMBNJA-UWVGGRQHSA-N 1 1 319.361 3.620 20 5 DHBDMO CC[C@H](c1ccccc1)[N@H+](CC)Cc1onc(C)c1[N+](=O)[O-] ZINC000595296887 1040091644 /nfs/dbraw/zinc/09/16/44/1040091644.db2.gz NMMCLZSELWQOAP-CQSZACIVSA-N 1 1 303.362 3.864 20 5 DHBDMO CC[C@H](c1ccccc1)[N@@H+](CC)Cc1onc(C)c1[N+](=O)[O-] ZINC000595296887 1040091662 /nfs/dbraw/zinc/09/16/62/1040091662.db2.gz NMMCLZSELWQOAP-CQSZACIVSA-N 1 1 303.362 3.864 20 5 DHBDMO Cc1noc(C[N@H+](Cc2ccccc2)[C@@H](C)C2CC2)c1[N+](=O)[O-] ZINC000595291893 1040093488 /nfs/dbraw/zinc/09/34/88/1040093488.db2.gz WTJURONWAPABPL-ZDUSSCGKSA-N 1 1 315.373 3.692 20 5 DHBDMO Cc1noc(C[N@@H+](Cc2ccccc2)[C@@H](C)C2CC2)c1[N+](=O)[O-] ZINC000595291893 1040093503 /nfs/dbraw/zinc/09/35/03/1040093503.db2.gz WTJURONWAPABPL-ZDUSSCGKSA-N 1 1 315.373 3.692 20 5 DHBDMO Cc1noc(C[N@@H+](C)CC(C)(C)c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595328002 1040098402 /nfs/dbraw/zinc/09/84/02/1040098402.db2.gz TYXCVMFGTJXLSO-UHFFFAOYSA-N 1 1 317.389 3.609 20 5 DHBDMO Cc1noc(C[N@H+](C)CC(C)(C)c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595328002 1040098420 /nfs/dbraw/zinc/09/84/20/1040098420.db2.gz TYXCVMFGTJXLSO-UHFFFAOYSA-N 1 1 317.389 3.609 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595329902 1040099614 /nfs/dbraw/zinc/09/96/14/1040099614.db2.gz DOVPNIQCTLYIRM-KBPBESRZSA-N 1 1 312.410 3.840 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000595340868 1040101845 /nfs/dbraw/zinc/10/18/45/1040101845.db2.gz YGXZVPBYUGZFMZ-ZFWWWQNUSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000595340868 1040101852 /nfs/dbraw/zinc/10/18/52/1040101852.db2.gz YGXZVPBYUGZFMZ-ZFWWWQNUSA-N 1 1 310.394 3.594 20 5 DHBDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595312951 1040104477 /nfs/dbraw/zinc/10/44/77/1040104477.db2.gz QAEHWMVQNSIZAK-OAHLLOKOSA-N 1 1 310.369 3.515 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H](c2ccncc2)C1 ZINC000595488991 1040141604 /nfs/dbraw/zinc/14/16/04/1040141604.db2.gz MTNVHUDPMWSPOD-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO CC[C@H](CC(F)F)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000595485040 1040142222 /nfs/dbraw/zinc/14/22/22/1040142222.db2.gz QFPXXEHYBNWBFF-GFCCVEGCSA-N 1 1 300.349 3.751 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595453234 1040144691 /nfs/dbraw/zinc/14/46/91/1040144691.db2.gz DWYJZGHFVQPFEL-GFCCVEGCSA-N 1 1 320.286 3.897 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595453234 1040144700 /nfs/dbraw/zinc/14/47/00/1040144700.db2.gz DWYJZGHFVQPFEL-GFCCVEGCSA-N 1 1 320.286 3.897 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000595503142 1040154863 /nfs/dbraw/zinc/15/48/63/1040154863.db2.gz QRQYICPOQJHSQY-CYBMUJFWSA-N 1 1 315.348 3.509 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000595702205 1040223993 /nfs/dbraw/zinc/22/39/93/1040223993.db2.gz HKRHUJOPDVRWCU-OAHLLOKOSA-N 1 1 316.332 3.560 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000595702205 1040224012 /nfs/dbraw/zinc/22/40/12/1040224012.db2.gz HKRHUJOPDVRWCU-OAHLLOKOSA-N 1 1 316.332 3.560 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC000595830129 1040264515 /nfs/dbraw/zinc/26/45/15/1040264515.db2.gz BAACLPXHTLUFST-RDTXWAMCSA-N 1 1 312.369 3.809 20 5 DHBDMO Cc1noc(COc2cc(C)[nH+]c3cccc(C)c32)c1[N+](=O)[O-] ZINC000596274942 1040352566 /nfs/dbraw/zinc/35/25/66/1040352566.db2.gz YAGKTEKTVSAULW-UHFFFAOYSA-N 1 1 313.313 3.635 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000174350065 1040630202 /nfs/dbraw/zinc/63/02/02/1040630202.db2.gz GIGGLRIVAARAGA-ZIAGYGMSSA-N 1 1 312.410 3.840 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000608976694 1040656506 /nfs/dbraw/zinc/65/65/06/1040656506.db2.gz IKHZGWPKXVKARN-CQSZACIVSA-N 1 1 314.385 3.839 20 5 DHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1OCc1c(C)cc(C)[nH+]c1C ZINC000601927238 1040826262 /nfs/dbraw/zinc/82/62/62/1040826262.db2.gz NZBLTRMWLXMIHU-UHFFFAOYSA-N 1 1 314.341 3.697 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(F)c1N ZINC000602441154 1041032897 /nfs/dbraw/zinc/03/28/97/1041032897.db2.gz UKTZUDSVUBMKJG-UHFFFAOYSA-N 1 1 317.364 3.727 20 5 DHBDMO Cc1nn(C[N@@H+](C)Cc2ccccc2C)c2cc([N+](=O)[O-])ccc12 ZINC000761273324 1041174743 /nfs/dbraw/zinc/17/47/43/1041174743.db2.gz OHLXWOARNLYDFY-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1nn(C[N@H+](C)Cc2ccccc2C)c2cc([N+](=O)[O-])ccc12 ZINC000761273324 1041174754 /nfs/dbraw/zinc/17/47/54/1041174754.db2.gz OHLXWOARNLYDFY-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3cccnc3)C2)c(F)c1 ZINC000602853648 1041266838 /nfs/dbraw/zinc/26/68/38/1041266838.db2.gz KBLRSIGUZVPBPN-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000090458801 185297839 /nfs/dbraw/zinc/29/78/39/185297839.db2.gz HWHXGZXBDFQAMN-JTQLQIEISA-N 1 1 303.387 3.780 20 5 DHBDMO CC[C@@](C)([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1nccs1 ZINC000072684513 191215052 /nfs/dbraw/zinc/21/50/52/191215052.db2.gz QVMRUCLOKWILJF-OAHLLOKOSA-N 1 1 305.403 3.775 20 5 DHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCC1 ZINC000093475674 193257173 /nfs/dbraw/zinc/25/71/73/193257173.db2.gz POTUOBRIPCYQBD-UHFFFAOYSA-N 1 1 303.387 3.703 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000022745659 182332362 /nfs/dbraw/zinc/33/23/62/182332362.db2.gz QBOKKMOAFDYLBJ-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000184223004 335064088 /nfs/dbraw/zinc/06/40/88/335064088.db2.gz RKPQQCPDRJNGHC-FZMZJTMJSA-N 1 1 308.353 3.507 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000272409653 130027527 /nfs/dbraw/zinc/02/75/27/130027527.db2.gz FOQPBSMSGHVPKD-ZIAGYGMSSA-N 1 1 314.389 3.567 20 5 DHBDMO COc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(F)cn1 ZINC000287577994 131288321 /nfs/dbraw/zinc/28/83/21/131288321.db2.gz HESJJUSFHVWANI-WDEREUQCSA-N 1 1 319.336 3.549 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)c1cccnc1 ZINC000290628805 131504729 /nfs/dbraw/zinc/50/47/29/131504729.db2.gz XTETUMJSFWIRSG-ZDUSSCGKSA-N 1 1 315.373 3.582 20 5 DHBDMO C[C@]12CC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C[C@H]1C2(F)F ZINC000298235691 132052402 /nfs/dbraw/zinc/05/24/02/132052402.db2.gz IFDANZALRUHXES-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@]12CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C[C@H]1C2(F)F ZINC000298235691 132052403 /nfs/dbraw/zinc/05/24/03/132052403.db2.gz IFDANZALRUHXES-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1c2ccc(F)cc2O[C@H]1C ZINC000569405706 332076820 /nfs/dbraw/zinc/07/68/20/332076820.db2.gz QJDCNIRZTJTEHB-APPDUMDISA-N 1 1 316.332 3.654 20 5 DHBDMO COc1ccc(C[N@H+]2CCC=C(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000560168767 332316566 /nfs/dbraw/zinc/31/65/66/332316566.db2.gz TXCHHWHHUWCHIU-UHFFFAOYSA-N 1 1 324.380 3.893 20 5 DHBDMO COc1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963099 332331083 /nfs/dbraw/zinc/33/10/83/332331083.db2.gz ITSVYYCYLPXVIP-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO Cc1ncsc1CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178000795 333134032 /nfs/dbraw/zinc/13/40/32/333134032.db2.gz NRCQIJRPXXPFSH-UHFFFAOYSA-N 1 1 317.414 3.567 20 5 DHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1Cl ZINC000019992281 333295004 /nfs/dbraw/zinc/29/50/04/333295004.db2.gz SKBKMCICTBIDRI-LBPRGKRZSA-N 1 1 311.813 3.925 20 5 DHBDMO CC(C)c1ccc([C@@H](N)C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000414853828 334127604 /nfs/dbraw/zinc/12/76/04/334127604.db2.gz YGLFYXLNCNMQIU-KRWDZBQOSA-N 1 1 313.401 3.508 20 5 DHBDMO C[C@@]12CC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C[C@@H]1C2(F)F ZINC000298416963 334248471 /nfs/dbraw/zinc/24/84/71/334248471.db2.gz XJOCWBFVLSEPMJ-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@@]12CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C[C@@H]1C2(F)F ZINC000298416963 334248473 /nfs/dbraw/zinc/24/84/73/334248473.db2.gz XJOCWBFVLSEPMJ-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@H]1CCCC[C@H]1OCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000534509756 334279546 /nfs/dbraw/zinc/27/95/46/334279546.db2.gz NLOSPLIWFGEJLX-KBXCAEBGSA-N 1 1 318.417 3.548 20 5 DHBDMO C[C@H]1CCCC[C@H]1OCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000534509756 334279547 /nfs/dbraw/zinc/27/95/47/334279547.db2.gz NLOSPLIWFGEJLX-KBXCAEBGSA-N 1 1 318.417 3.548 20 5 DHBDMO CC[C@@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000340874728 334392301 /nfs/dbraw/zinc/39/23/01/334392301.db2.gz JBMMLUXPDQXECC-CQSZACIVSA-N 1 1 301.346 3.624 20 5 DHBDMO CSc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)ccn1 ZINC000344300062 335238137 /nfs/dbraw/zinc/23/81/37/335238137.db2.gz ICSLJEDZNIHQFG-UHFFFAOYSA-N 1 1 323.805 3.655 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000526084971 335733143 /nfs/dbraw/zinc/73/31/43/335733143.db2.gz FJXRLKQLFCASQD-MRXNPFEDSA-N 1 1 317.776 3.884 20 5 DHBDMO COCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(C)o1 ZINC000350340389 335747188 /nfs/dbraw/zinc/74/71/88/335747188.db2.gz DHIAVOLBMAQOTF-OAHLLOKOSA-N 1 1 322.336 3.503 20 5 DHBDMO COc1cc(C[N@@H+](Cc2cccs2)C2CC2)ccc1[N+](=O)[O-] ZINC000351970748 336184207 /nfs/dbraw/zinc/18/42/07/336184207.db2.gz INZFSFXWBZSWDJ-UHFFFAOYSA-N 1 1 318.398 3.830 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccc(C)s2)ccc1[N+](=O)[O-] ZINC000352406503 336216463 /nfs/dbraw/zinc/21/64/63/336216463.db2.gz QDGNLJQFKWHYDW-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO COc1cc(C[N@@H+]2Cc3ccccc3C[C@H]2C)ccc1[N+](=O)[O-] ZINC000352539935 336223318 /nfs/dbraw/zinc/22/33/18/336223318.db2.gz FGAUWZCUUJYIQG-CYBMUJFWSA-N 1 1 312.369 3.550 20 5 DHBDMO COc1cc(C[N@H+]2Cc3ccccc3C[C@H]2C)ccc1[N+](=O)[O-] ZINC000352539935 336223319 /nfs/dbraw/zinc/22/33/19/336223319.db2.gz FGAUWZCUUJYIQG-CYBMUJFWSA-N 1 1 312.369 3.550 20 5 DHBDMO Cc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000352544572 336223719 /nfs/dbraw/zinc/22/37/19/336223719.db2.gz SCYZTFPCKRVNJG-UHFFFAOYSA-N 1 1 304.415 3.948 20 5 DHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000352777575 336235850 /nfs/dbraw/zinc/23/58/50/336235850.db2.gz HKIJDFJMDITRNR-HNNXBMFYSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2cccc(F)c2[N+](=O)[O-])c1 ZINC000301221483 336295470 /nfs/dbraw/zinc/29/54/70/336295470.db2.gz CBFKFJASDMMWEF-UHFFFAOYSA-N 1 1 317.364 3.798 20 5 DHBDMO CC[N@@H+](c1ccc(Nc2c([N+](=O)[O-])c(C)nn2C)cc1)C(C)C ZINC000301268402 336297698 /nfs/dbraw/zinc/29/76/98/336297698.db2.gz IWMAPWTZUNQMOH-UHFFFAOYSA-N 1 1 317.393 3.615 20 5 DHBDMO CC[N@H+](c1ccc(Nc2c([N+](=O)[O-])c(C)nn2C)cc1)C(C)C ZINC000301268402 336297699 /nfs/dbraw/zinc/29/76/99/336297699.db2.gz IWMAPWTZUNQMOH-UHFFFAOYSA-N 1 1 317.393 3.615 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 ZINC000301272224 336297930 /nfs/dbraw/zinc/29/79/30/336297930.db2.gz JWVWAIZEXMFETB-CVEARBPZSA-N 1 1 317.433 3.686 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 ZINC000301272226 336298046 /nfs/dbraw/zinc/29/80/46/336298046.db2.gz JWVWAIZEXMFETB-HZPDHXFCSA-N 1 1 317.433 3.686 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2ccc(F)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000301823996 336332552 /nfs/dbraw/zinc/33/25/52/336332552.db2.gz CWJXOKGXMVIJPK-DOTOQJQBSA-N 1 1 315.348 3.591 20 5 DHBDMO C[C@H](Nc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302049793 336345517 /nfs/dbraw/zinc/34/55/17/336345517.db2.gz NFFKEHMOOAXYHN-UONOGXRCSA-N 1 1 303.406 3.660 20 5 DHBDMO CSc1cccc(F)c1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000352926865 336377700 /nfs/dbraw/zinc/37/77/00/336377700.db2.gz YECHFGWQCXVQHA-UHFFFAOYSA-N 1 1 306.362 3.746 20 5 DHBDMO C[C@H]([NH2+]C[C@]1(N(C)C)CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000320902659 336384315 /nfs/dbraw/zinc/38/43/15/336384315.db2.gz ZWJUVKCGXBSNIP-VKJFTORMSA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@H]([NH2+][C@H]1c2cccc(F)c2O[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000360061314 337084656 /nfs/dbraw/zinc/08/46/56/337084656.db2.gz SROLILPDGHIMQW-LYOVBCGYSA-N 1 1 316.332 3.907 20 5 DHBDMO COc1cc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)c([N+](=O)[O-])cc1F ZINC000184245583 337197520 /nfs/dbraw/zinc/19/75/20/337197520.db2.gz VWGWTGLRDYINOI-JTQLQIEISA-N 1 1 308.353 3.505 20 5 DHBDMO Cc1ccc(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000186441590 337256154 /nfs/dbraw/zinc/25/61/54/337256154.db2.gz SXNHLVXJRACCTN-IBGZPJMESA-N 1 1 324.380 3.535 20 5 DHBDMO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000188875541 337275995 /nfs/dbraw/zinc/27/59/95/337275995.db2.gz LMXDQQPIEVCMPO-CYBMUJFWSA-N 1 1 304.371 3.578 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(NCCC[N@@H+](C)C2CCCCC2)c1 ZINC000321704468 337284621 /nfs/dbraw/zinc/28/46/21/337284621.db2.gz DTJIMBYKDGSYAI-UHFFFAOYSA-N 1 1 321.421 3.670 20 5 DHBDMO Cc1ccc(C[N@@H+]2Cc3ccccc3O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000430135953 338098500 /nfs/dbraw/zinc/09/85/00/338098500.db2.gz HNCRETZVEAVDBH-AWEZNQCLSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1ccc(C[N@H+]2Cc3ccccc3O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000430135953 338098501 /nfs/dbraw/zinc/09/85/01/338098501.db2.gz HNCRETZVEAVDBH-AWEZNQCLSA-N 1 1 312.369 3.686 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000430192753 338100581 /nfs/dbraw/zinc/10/05/81/338100581.db2.gz BPNMAYYIVYZTAD-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000430192753 338100582 /nfs/dbraw/zinc/10/05/82/338100582.db2.gz BPNMAYYIVYZTAD-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cccc(C)c1 ZINC000430220971 338101909 /nfs/dbraw/zinc/10/19/09/338101909.db2.gz REVBTVISSMYHDC-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cccc(C)c1 ZINC000430220971 338101910 /nfs/dbraw/zinc/10/19/10/338101910.db2.gz REVBTVISSMYHDC-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1sccc1C ZINC000430224686 338102034 /nfs/dbraw/zinc/10/20/34/338102034.db2.gz LDBUCTGPPKSYTM-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1sccc1C ZINC000430224686 338102035 /nfs/dbraw/zinc/10/20/35/338102035.db2.gz LDBUCTGPPKSYTM-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1N1CCC[N@H+](C2CCCC2)CC1 ZINC000432314469 338152751 /nfs/dbraw/zinc/15/27/51/338152751.db2.gz QQKGBKPEBBWSIK-UHFFFAOYSA-N 1 1 323.824 3.703 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCc2c1cccc2O ZINC000451178512 338724766 /nfs/dbraw/zinc/72/47/66/338724766.db2.gz NLPUFZZNZSRSCF-AWEZNQCLSA-N 1 1 318.760 3.731 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000463470907 339118944 /nfs/dbraw/zinc/11/89/44/339118944.db2.gz UEMSHJCDWYVCBR-IUODEOHRSA-N 1 1 322.380 3.897 20 5 DHBDMO CCC1(CC)C[N@H+](Cc2csc([N+](=O)[O-])c2)CCS1 ZINC000464585273 339146173 /nfs/dbraw/zinc/14/61/73/339146173.db2.gz DGYKRUQBRCIKCW-UHFFFAOYSA-N 1 1 300.449 3.764 20 5 DHBDMO CCC1(CC)C[N@@H+](Cc2csc([N+](=O)[O-])c2)CCS1 ZINC000464585273 339146174 /nfs/dbraw/zinc/14/61/74/339146174.db2.gz DGYKRUQBRCIKCW-UHFFFAOYSA-N 1 1 300.449 3.764 20 5 DHBDMO C[C@@H]([NH2+]C[C@H](C1CCCCC1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000467834146 339247066 /nfs/dbraw/zinc/24/70/66/339247066.db2.gz PGCJUHZDJJUHQC-RDTXWAMCSA-N 1 1 319.449 3.756 20 5 DHBDMO CO[C@@H](C)C[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C(C)C ZINC000470179364 339313192 /nfs/dbraw/zinc/31/31/92/339313192.db2.gz WWGZSBIICQKIMR-HNRFISLBSA-N 1 1 306.406 3.743 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCc1ccncc1 ZINC000470204147 339314131 /nfs/dbraw/zinc/31/41/31/339314131.db2.gz UDYRKUAPPSVMNP-NTCAYCPXSA-N 1 1 311.385 3.568 20 5 DHBDMO CCCc1csc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000494312275 339946299 /nfs/dbraw/zinc/94/62/99/339946299.db2.gz NQUXXKSNVPKGIO-LLVKDONJSA-N 1 1 305.403 3.855 20 5 DHBDMO Cc1ccc(F)cc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511141425 340322201 /nfs/dbraw/zinc/32/22/01/340322201.db2.gz LXWAEBPJUPPOLW-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO CC[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000511522692 340329235 /nfs/dbraw/zinc/32/92/35/340329235.db2.gz MVEQOHRLHITXNF-NSHDSACASA-N 1 1 300.305 3.571 20 5 DHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1Cc2ccccc2C1 ZINC000511646393 340333845 /nfs/dbraw/zinc/33/38/45/340333845.db2.gz GRIYSBZKWASEAV-UXBLZVDNSA-N 1 1 308.381 3.707 20 5 DHBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1F ZINC000511724285 340336250 /nfs/dbraw/zinc/33/62/50/340336250.db2.gz VDOYGVMHOUQJNL-FRRDWIJNSA-N 1 1 309.385 3.512 20 5 DHBDMO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000537978289 340795128 /nfs/dbraw/zinc/79/51/28/340795128.db2.gz OIKJJFKRCIQQLZ-CXAGYDPISA-N 1 1 312.369 3.996 20 5 DHBDMO Cc1cn2cc(Nc3ccc([N+](=O)[O-])c4cccnc34)ccc2[nH+]1 ZINC000538936472 340862992 /nfs/dbraw/zinc/86/29/92/340862992.db2.gz CSOLOCWKUVFEOA-UHFFFAOYSA-N 1 1 319.324 3.843 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc1C ZINC000542703706 341018233 /nfs/dbraw/zinc/01/82/33/341018233.db2.gz YUGZLHUVVOUFQX-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@H]1c1cccn1C ZINC000544611467 341088772 /nfs/dbraw/zinc/08/87/72/341088772.db2.gz RRHOLYSYUHQLAT-SFHVURJKSA-N 1 1 313.401 3.969 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccsc1Cl ZINC000564312797 341190718 /nfs/dbraw/zinc/19/07/18/341190718.db2.gz QDMHJLABRWBLEW-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccsc1Cl ZINC000564312797 341190719 /nfs/dbraw/zinc/19/07/19/341190719.db2.gz QDMHJLABRWBLEW-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2occc2C)cc1[N+](=O)[O-] ZINC000293756109 517733492 /nfs/dbraw/zinc/73/34/92/517733492.db2.gz RRKGXTRKQSSKDG-GFCCVEGCSA-N 1 1 304.346 3.746 20 5 DHBDMO CC(C)c1[nH+]ccn1Cc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000182791477 519880246 /nfs/dbraw/zinc/88/02/46/519880246.db2.gz XWDJJIBNSSIOIC-UHFFFAOYSA-N 1 1 313.279 3.982 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1O ZINC000156877496 522357328 /nfs/dbraw/zinc/35/73/28/522357328.db2.gz BJYAEJBTQMADEJ-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO COC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(C)o1 ZINC000156444465 522764183 /nfs/dbraw/zinc/76/41/83/522764183.db2.gz PBGKTDJGJQTBNZ-CJNGLKHVSA-N 1 1 318.373 3.843 20 5 DHBDMO C[C@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000157670176 524095414 /nfs/dbraw/zinc/09/54/14/524095414.db2.gz LEQLUQXXQOWVRF-LBPRGKRZSA-N 1 1 317.414 3.950 20 5 DHBDMO C[C@H]1[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CCC12CCOCC2 ZINC000368813217 525003040 /nfs/dbraw/zinc/00/30/40/525003040.db2.gz DKIUEUSRTRNNTD-GFCCVEGCSA-N 1 1 324.808 3.639 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000267074961 525461584 /nfs/dbraw/zinc/46/15/84/525461584.db2.gz TVZFYSCNMHFOSO-MRXNPFEDSA-N 1 1 316.332 3.520 20 5 DHBDMO Cc1c([C@@H](C)[NH2+][C@@H](C)c2ccncc2F)cccc1[N+](=O)[O-] ZINC000338006519 525904127 /nfs/dbraw/zinc/90/41/27/525904127.db2.gz DIGQHMDOZLPGCH-NEPJUHHUSA-N 1 1 303.337 3.849 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC3(CCOCC3)C2)ccc1Cl ZINC000366389025 527330165 /nfs/dbraw/zinc/33/01/65/527330165.db2.gz MWSIEDHOQSLFIY-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353610002 535704289 /nfs/dbraw/zinc/70/42/89/535704289.db2.gz VKJFIXPGKPLQCK-GFCCVEGCSA-N 1 1 300.449 3.764 20 5 DHBDMO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000122332555 536633975 /nfs/dbraw/zinc/63/39/75/536633975.db2.gz MGDAEVXFKAASBO-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO COCCc1cc[nH+]c(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000287643669 536833043 /nfs/dbraw/zinc/83/30/43/536833043.db2.gz URNWPSONHHHFQQ-ZDUSSCGKSA-N 1 1 315.373 3.660 20 5 DHBDMO COc1cc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(F)cn1 ZINC000287577985 536882208 /nfs/dbraw/zinc/88/22/08/536882208.db2.gz HESJJUSFHVWANI-GHMZBOCLSA-N 1 1 319.336 3.549 20 5 DHBDMO O=C(c1ccccc1)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000025054275 1013464184 /nfs/dbraw/zinc/46/41/84/1013464184.db2.gz ASBPCBYETUPIMI-UHFFFAOYSA-N 1 1 324.380 3.690 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000441460668 1013908465 /nfs/dbraw/zinc/90/84/65/1013908465.db2.gz DRGBQTWIJKALKZ-CKEIUWERSA-N 1 1 304.390 3.627 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C2CCOCC2)C1 ZINC000933082401 1014539871 /nfs/dbraw/zinc/53/98/71/1014539871.db2.gz NECRDNXVKPCBGH-PBHICJAKSA-N 1 1 318.417 3.794 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]C[C@H](C(C)C)N2CCCC2)cc1[N+](=O)[O-] ZINC000320113492 1014588937 /nfs/dbraw/zinc/58/89/37/1014588937.db2.gz CMGOSGNWCYZIAQ-CRAIPNDOSA-N 1 1 319.449 3.674 20 5 DHBDMO CC[N@@H+](CCc1nccs1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000121123234 1015031380 /nfs/dbraw/zinc/03/13/80/1015031380.db2.gz FQRQUJMHAWMPKQ-GFCCVEGCSA-N 1 1 305.403 3.677 20 5 DHBDMO Cc1c(C[N@H+](C)Cc2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000051710006 1015100792 /nfs/dbraw/zinc/10/07/92/1015100792.db2.gz WQLYXPGOABLUKH-UHFFFAOYSA-N 1 1 306.312 3.813 20 5 DHBDMO Cc1c(C[N@@H+](C)Cc2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000051710006 1015100796 /nfs/dbraw/zinc/10/07/96/1015100796.db2.gz WQLYXPGOABLUKH-UHFFFAOYSA-N 1 1 306.312 3.813 20 5 DHBDMO CC[C@@H](NC[C@@H](CC)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000151692218 1015404360 /nfs/dbraw/zinc/40/43/60/1015404360.db2.gz FIDCHDICGOCJJP-NVXWUHKLSA-N 1 1 305.422 3.510 20 5 DHBDMO CCOc1cc(C[N@H+](C)[C@H](C)c2cccnc2)ccc1[N+](=O)[O-] ZINC000276886770 1015730896 /nfs/dbraw/zinc/73/08/96/1015730896.db2.gz JMQFXCPIBNSBQE-CYBMUJFWSA-N 1 1 315.373 3.582 20 5 DHBDMO CCOc1cc(C[N@@H+](C)[C@H](C)c2cccnc2)ccc1[N+](=O)[O-] ZINC000276886770 1015730898 /nfs/dbraw/zinc/73/08/98/1015730898.db2.gz JMQFXCPIBNSBQE-CYBMUJFWSA-N 1 1 315.373 3.582 20 5 DHBDMO COc1ccccc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000051372034 1015783584 /nfs/dbraw/zinc/78/35/84/1015783584.db2.gz FPQQQMNHRVFZEN-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1ccccc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000051372034 1015783590 /nfs/dbraw/zinc/78/35/90/1015783590.db2.gz FPQQQMNHRVFZEN-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cccc(F)c1 ZINC000172573904 1015976076 /nfs/dbraw/zinc/97/60/76/1015976076.db2.gz IKWVLAFUWIBOEZ-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO COc1ncc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1Cl ZINC000538275513 1016092232 /nfs/dbraw/zinc/09/22/32/1016092232.db2.gz GFTTTZBPNVVQBC-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](C2CC2)C2CCCCC2)cc1 ZINC000065534163 1016215657 /nfs/dbraw/zinc/21/56/57/1016215657.db2.gz ONUOOISHQYLBDU-UHFFFAOYSA-N 1 1 304.390 3.771 20 5 DHBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](CC)c1ccccc1 ZINC000478418539 1016681074 /nfs/dbraw/zinc/68/10/74/1016681074.db2.gz QBIXPLSCNRBOCN-INIZCTEOSA-N 1 1 316.405 3.655 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H]1Cc1ccccc1 ZINC000479100479 1016860605 /nfs/dbraw/zinc/86/06/05/1016860605.db2.gz LWNQZYPUTCVRJT-AWEZNQCLSA-N 1 1 300.333 3.551 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000479100479 1016860619 /nfs/dbraw/zinc/86/06/19/1016860619.db2.gz LWNQZYPUTCVRJT-AWEZNQCLSA-N 1 1 300.333 3.551 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c1 ZINC000523007780 1017033259 /nfs/dbraw/zinc/03/32/59/1017033259.db2.gz XGEJTYGTGSHBIC-MRXNPFEDSA-N 1 1 314.360 3.799 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H](OC3CCC3)C2)c1 ZINC000847038650 1032189418 /nfs/dbraw/zinc/18/94/18/1032189418.db2.gz VFCSRUFSUHGEPL-HNNXBMFYSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](OC3CCC3)C2)c1 ZINC000847038650 1032189426 /nfs/dbraw/zinc/18/94/26/1032189426.db2.gz VFCSRUFSUHGEPL-HNNXBMFYSA-N 1 1 324.808 3.782 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)c([N+](=O)[O-])cc1F ZINC000362181288 1032262649 /nfs/dbraw/zinc/26/26/49/1032262649.db2.gz OSCCQYPVAIQENU-GFCCVEGCSA-N 1 1 322.380 3.755 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)c([N+](=O)[O-])cc1F ZINC000362190312 1032265899 /nfs/dbraw/zinc/26/58/99/1032265899.db2.gz LPHUUJBJZBXHEI-SJKOYZFVSA-N 1 1 322.380 3.755 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000475271328 1017109426 /nfs/dbraw/zinc/10/94/26/1017109426.db2.gz CLUHHHASYFDDPY-GXFFZTMASA-N 1 1 302.296 3.676 20 5 DHBDMO Cc1ccc([C@@H](C)NCC(C)(C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000479859870 1017102004 /nfs/dbraw/zinc/10/20/04/1017102004.db2.gz MRMXJMCCYINAIB-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1cc(C)c(COc2c(C)c(C)ncc2[N+](=O)[O-])c(C)[nH+]1 ZINC000601083655 1012412990 /nfs/dbraw/zinc/41/29/90/1012412990.db2.gz JMKGWQOZFZTDMO-UHFFFAOYSA-N 1 1 301.346 3.506 20 5 DHBDMO Cc1ccc([C@@H](C)[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000515479750 1012638088 /nfs/dbraw/zinc/63/80/88/1012638088.db2.gz JVQGSUSWVMOJRB-OAHLLOKOSA-N 1 1 314.385 3.975 20 5 DHBDMO C[C@H]1CCC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1 ZINC000748084830 1012688084 /nfs/dbraw/zinc/68/80/84/1012688084.db2.gz VOPQAJBQZCMQFK-NSHDSACASA-N 1 1 321.402 3.951 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000342819256 1017456031 /nfs/dbraw/zinc/45/60/31/1017456031.db2.gz AMMLVCYWIWLXGP-WMZOPIPTSA-N 1 1 318.417 3.862 20 5 DHBDMO C[N@@H+](CCCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444591597 1017581197 /nfs/dbraw/zinc/58/11/97/1017581197.db2.gz BSUHSAWCLNQPKT-UHFFFAOYSA-N 1 1 324.384 3.536 20 5 DHBDMO C[C@H](C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444611103 1017592909 /nfs/dbraw/zinc/59/29/09/1017592909.db2.gz PWTLOIJOGJOVKI-CYBMUJFWSA-N 1 1 324.384 3.707 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1F ZINC000444659751 1017610527 /nfs/dbraw/zinc/61/05/27/1017610527.db2.gz DZJNWBHZEZGSAZ-BXUZGUMPSA-N 1 1 310.369 3.753 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cc(F)cc(F)c1 ZINC000444703449 1017641095 /nfs/dbraw/zinc/64/10/95/1017641095.db2.gz KTVHATDDQSTQLV-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO CC[C@@H]([NH2+]Cc1nccn1CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000164828262 1017799315 /nfs/dbraw/zinc/79/93/15/1017799315.db2.gz SXXLSBKOJFYINZ-MRXNPFEDSA-N 1 1 316.405 3.688 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@H]3c3ccccc3)nc2c1 ZINC000342964831 1017907174 /nfs/dbraw/zinc/90/71/74/1017907174.db2.gz ZPYWDUHHMIMUMX-QGZVFWFLSA-N 1 1 322.368 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]3c3ccccc3)nc2c1 ZINC000342964831 1017907180 /nfs/dbraw/zinc/90/71/80/1017907180.db2.gz ZPYWDUHHMIMUMX-QGZVFWFLSA-N 1 1 322.368 3.808 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764884229 1018417293 /nfs/dbraw/zinc/41/72/93/1018417293.db2.gz YLYWZQJJVBJQAI-GXTWGEPZSA-N 1 1 316.405 3.721 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000447827490 1018483299 /nfs/dbraw/zinc/48/32/99/1018483299.db2.gz BOVRKQZFSFMUJK-CZUORRHYSA-N 1 1 306.406 3.711 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000447827490 1018483303 /nfs/dbraw/zinc/48/33/03/1018483303.db2.gz BOVRKQZFSFMUJK-CZUORRHYSA-N 1 1 306.406 3.711 20 5 DHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC3(CCCC3)C2)cc1 ZINC000743863771 1018497366 /nfs/dbraw/zinc/49/73/66/1018497366.db2.gz QOYYBZXHCHULLL-UHFFFAOYSA-N 1 1 304.390 3.630 20 5 DHBDMO CC(C)CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000750037572 1019287916 /nfs/dbraw/zinc/28/79/16/1019287916.db2.gz OIYFHOGDDCEIJM-SFHVURJKSA-N 1 1 320.433 3.919 20 5 DHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCOc2ccccc21 ZINC000611254772 1019421404 /nfs/dbraw/zinc/42/14/04/1019421404.db2.gz SBVWNGKVXOKNFK-AWEZNQCLSA-N 1 1 312.369 3.593 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](CCO)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000611269345 1019427576 /nfs/dbraw/zinc/42/75/76/1019427576.db2.gz FBXCNZKVUCRDJS-UHFFFAOYSA-N 1 1 308.422 3.559 20 5 DHBDMO CC(C)([NH2+]Cc1ccnn1C1CCC1)c1ccccc1[N+](=O)[O-] ZINC000922144749 1019517546 /nfs/dbraw/zinc/51/75/46/1019517546.db2.gz VYPUNCONFMXXEC-UHFFFAOYSA-N 1 1 314.389 3.541 20 5 DHBDMO Cc1cnc(Cl)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000922151230 1019537004 /nfs/dbraw/zinc/53/70/04/1019537004.db2.gz YSNGCZBEGUFHAL-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC(C(F)(F)F)CC1 ZINC000255670780 1019554470 /nfs/dbraw/zinc/55/44/70/1019554470.db2.gz LFSTVLSWAXASAF-HYXAFXHYSA-N 1 1 314.307 3.882 20 5 DHBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCCCC1 ZINC000750059689 1019591478 /nfs/dbraw/zinc/59/14/78/1019591478.db2.gz YFJAJURSDUSMQT-QGZVFWFLSA-N 1 1 306.406 3.673 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC[C@@H]2CCCCO2)C2CC2)cc1 ZINC000347550786 1019621404 /nfs/dbraw/zinc/62/14/04/1019621404.db2.gz QNLQAIZYPVOHLF-KRWDZBQOSA-N 1 1 304.390 3.518 20 5 DHBDMO CC[C@@H](NCC1([NH+](C)C)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000317108140 1019958768 /nfs/dbraw/zinc/95/87/68/1019958768.db2.gz KTGLDUZSFJBIDW-MRXNPFEDSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000731450243 1020106096 /nfs/dbraw/zinc/10/60/96/1020106096.db2.gz USNZXQAMTZFAST-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO C[C@H]([NH2+]Cc1cc(O)ccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC001168605008 1020145214 /nfs/dbraw/zinc/14/52/14/1020145214.db2.gz UZPPHPODXNYLAI-JTQLQIEISA-N 1 1 306.749 3.805 20 5 DHBDMO C[C@@H](O)CC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000093481193 1020154059 /nfs/dbraw/zinc/15/40/59/1020154059.db2.gz AFCMPBYUMZQJLZ-GFCCVEGCSA-N 1 1 320.414 3.526 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc2[nH]ccc21 ZINC000555339125 1020215997 /nfs/dbraw/zinc/21/59/97/1020215997.db2.gz UODGVBRJYUEFGG-UHFFFAOYSA-N 1 1 309.369 3.751 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c1 ZINC000281038458 1020322938 /nfs/dbraw/zinc/32/29/38/1020322938.db2.gz PWEAWKPTHJLBPH-KZNAEPCWSA-N 1 1 318.417 3.500 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1sccc1[N+](=O)[O-] ZINC000613184894 1020845571 /nfs/dbraw/zinc/84/55/71/1020845571.db2.gz SKIGMMJKWRUZNB-JSGCOSHPSA-N 1 1 317.414 3.589 20 5 DHBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@@H+]2Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000738284075 1020866517 /nfs/dbraw/zinc/86/65/17/1020866517.db2.gz JIKFJIPZXWGXAR-PBHICJAKSA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000738284075 1020866531 /nfs/dbraw/zinc/86/65/31/1020866531.db2.gz JIKFJIPZXWGXAR-PBHICJAKSA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1nn(C[N@H+]2CCC[C@H](C(C)(C)C)CC2)c(C)c1[N+](=O)[O-] ZINC000738237704 1020867776 /nfs/dbraw/zinc/86/77/76/1020867776.db2.gz BHJKLNWYGXAVHP-AWEZNQCLSA-N 1 1 308.426 3.514 20 5 DHBDMO CCC[C@@H](NCC[N@@H+]1CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000766271987 1021003194 /nfs/dbraw/zinc/00/31/94/1021003194.db2.gz WVAJPJKTTNAMCH-WMLDXEAASA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@@H](NCC[N@H+]1CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000766271987 1021003200 /nfs/dbraw/zinc/00/32/00/1021003200.db2.gz WVAJPJKTTNAMCH-WMLDXEAASA-N 1 1 305.422 3.510 20 5 DHBDMO CC1(C)CC[C@H](C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)O1 ZINC000187308179 1021187556 /nfs/dbraw/zinc/18/75/56/1021187556.db2.gz KTYYKWMLGCNKML-OAHLLOKOSA-N 1 1 304.390 3.517 20 5 DHBDMO CC1(C)CC[C@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)O1 ZINC000187308179 1021187562 /nfs/dbraw/zinc/18/75/62/1021187562.db2.gz KTYYKWMLGCNKML-OAHLLOKOSA-N 1 1 304.390 3.517 20 5 DHBDMO CC(C)C[C@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277260 1021209309 /nfs/dbraw/zinc/20/93/09/1021209309.db2.gz MDQKKMJOLPDLPC-SJORKVTESA-N 1 1 306.406 3.529 20 5 DHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000743381058 1021287670 /nfs/dbraw/zinc/28/76/70/1021287670.db2.gz TUDZNGAUMCHYJK-CZUORRHYSA-N 1 1 316.405 3.803 20 5 DHBDMO CC(C)(C)c1ccncc1C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000414502459 1021515967 /nfs/dbraw/zinc/51/59/67/1021515967.db2.gz UOKUIQYSIPMSLO-UHFFFAOYSA-N 1 1 305.403 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](CC3CC3)CC3CCC3)nc2c1 ZINC000619516857 1021783383 /nfs/dbraw/zinc/78/33/83/1021783383.db2.gz RPOXIISBOWOUNI-UHFFFAOYSA-N 1 1 315.373 3.748 20 5 DHBDMO CC(C)(C)[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000746090120 1021850311 /nfs/dbraw/zinc/85/03/11/1021850311.db2.gz MUIWMNDBBSUFRQ-UHFFFAOYSA-N 1 1 311.813 3.559 20 5 DHBDMO COc1cc(C[N@@H+](CC2CCC2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000195079801 1021887470 /nfs/dbraw/zinc/88/74/70/1021887470.db2.gz CIMGJKXLFFCSFO-UHFFFAOYSA-N 1 1 322.405 3.623 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(Cl)cs1 ZINC000619846224 1021921628 /nfs/dbraw/zinc/92/16/28/1021921628.db2.gz KLFYAROPEGZEMF-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cscc1Cl ZINC000619847291 1021921866 /nfs/dbraw/zinc/92/18/66/1021921866.db2.gz OLISVWNUZZTSFD-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cscc1Cl ZINC000619847291 1021921871 /nfs/dbraw/zinc/92/18/71/1021921871.db2.gz OLISVWNUZZTSFD-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ccccn3)C2)cc1F ZINC000852084138 1022070589 /nfs/dbraw/zinc/07/05/89/1022070589.db2.gz QEPGTZLQJKCLBA-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO COc1ccccc1C(C)(C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000103484440 1022076412 /nfs/dbraw/zinc/07/64/12/1022076412.db2.gz YPWGIAZXQBMFHK-UHFFFAOYSA-N 1 1 300.358 3.628 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](CC2CC2)C2CCCCC2)cc1 ZINC000776582464 1022095722 /nfs/dbraw/zinc/09/57/22/1022095722.db2.gz URSLYDHYYDCTIF-SFHVURJKSA-N 1 1 318.417 3.673 20 5 DHBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CCCCCCC1 ZINC000776581371 1022099137 /nfs/dbraw/zinc/09/91/37/1022099137.db2.gz IEKMQPQOBYHCPX-QGZVFWFLSA-N 1 1 306.406 3.673 20 5 DHBDMO CCCCC[C@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587920 1022103414 /nfs/dbraw/zinc/10/34/14/1022103414.db2.gz ZMYPCGMBHYZMJH-DOTOQJQBSA-N 1 1 306.406 3.673 20 5 DHBDMO CC(C)CC[C@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587603 1022103522 /nfs/dbraw/zinc/10/35/22/1022103522.db2.gz XHCKMDUGYZMPJM-NVXWUHKLSA-N 1 1 306.406 3.529 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)cc1F ZINC000852594141 1022146233 /nfs/dbraw/zinc/14/62/33/1022146233.db2.gz AASVSGBRFSWOGE-RHSMWYFYSA-N 1 1 322.380 3.515 20 5 DHBDMO CC(C)(C)C1=CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC001168933682 1022186287 /nfs/dbraw/zinc/18/62/87/1022186287.db2.gz PVXHCLOCAJBHHT-UHFFFAOYSA-N 1 1 304.390 3.652 20 5 DHBDMO C[N@@H+](Cc1cccc(Cl)c1Cl)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035289 1022221203 /nfs/dbraw/zinc/22/12/03/1022221203.db2.gz KARLPOILWUESCC-JQWIXIFHSA-N 1 1 317.216 3.871 20 5 DHBDMO C[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035643 1022221675 /nfs/dbraw/zinc/22/16/75/1022221675.db2.gz KYSYWMBIJLOKLQ-TZMCWYRMSA-N 1 1 316.323 3.583 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+](Cc2ccccn2)C2CCCCC2)C1 ZINC001169039130 1022222075 /nfs/dbraw/zinc/22/20/75/1022222075.db2.gz NMNXDPBJGSETAA-QAPCUYQASA-N 1 1 317.433 3.662 20 5 DHBDMO C[Si](C)(C)C[N@@H+](Cc1ccccc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169036763 1022222303 /nfs/dbraw/zinc/22/23/03/1022222303.db2.gz PWTVAZATLCAKBH-IAGOWNOFSA-N 1 1 320.509 3.811 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3cocn3)s2)cc1 ZINC000609354012 1022268781 /nfs/dbraw/zinc/26/87/81/1022268781.db2.gz JEQQAWOZTLMUAA-UHFFFAOYSA-N 1 1 315.354 3.601 20 5 DHBDMO CCC(CC)[N@@H+](CCOC)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705100 1022334925 /nfs/dbraw/zinc/33/49/25/1022334925.db2.gz PUKSMRASZVLYMV-UHFFFAOYSA-N 1 1 314.813 3.885 20 5 DHBDMO CC[C@]1(CO)CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000190211335 1022341628 /nfs/dbraw/zinc/34/16/28/1022341628.db2.gz AWTVZYAOKCBTQL-SFHVURJKSA-N 1 1 320.433 3.703 20 5 DHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000610133445 1022424733 /nfs/dbraw/zinc/42/47/33/1022424733.db2.gz PBDRAJSKEBUNMU-GVDBMIGSSA-N 1 1 318.417 3.620 20 5 DHBDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000616123417 1022647771 /nfs/dbraw/zinc/64/77/71/1022647771.db2.gz GCXDAYOQMNJFAX-IJLUTSLNSA-N 1 1 303.362 3.602 20 5 DHBDMO CCc1ncc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000417351214 1022694501 /nfs/dbraw/zinc/69/45/01/1022694501.db2.gz RJUPNXJPDJIWOT-MRXNPFEDSA-N 1 1 315.373 3.703 20 5 DHBDMO CCCOc1ncccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173352498 1022877747 /nfs/dbraw/zinc/87/77/47/1022877747.db2.gz AMGIBECYLQXVGB-ZDUSSCGKSA-N 1 1 315.373 3.629 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CC(Cc3ccsc3)C2)cc1Cl ZINC000857067842 1022940365 /nfs/dbraw/zinc/94/03/65/1022940365.db2.gz GYUXQFMKWSXEOM-UHFFFAOYSA-N 1 1 322.817 3.984 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3ccco3)C2)ccc1Cl ZINC000768541921 1022985194 /nfs/dbraw/zinc/98/51/94/1022985194.db2.gz MYMVPNOLFNHZPL-GFCCVEGCSA-N 1 1 306.749 3.831 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCc2c(F)cccc2C1 ZINC000769388626 1023139730 /nfs/dbraw/zinc/13/97/30/1023139730.db2.gz VHUXCQRGUZIKLA-QPJJXVBHSA-N 1 1 312.344 3.805 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCc2c(F)cccc2C1 ZINC000769388626 1023139734 /nfs/dbraw/zinc/13/97/34/1023139734.db2.gz VHUXCQRGUZIKLA-QPJJXVBHSA-N 1 1 312.344 3.805 20 5 DHBDMO C[N@@H+](CCc1cccs1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746675333 1023784521 /nfs/dbraw/zinc/78/45/21/1023784521.db2.gz TWULBPLVZAPXQI-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCc2ccccc21 ZINC000788010954 1023836290 /nfs/dbraw/zinc/83/62/90/1023836290.db2.gz UQQCFUYZOQFSAJ-MRXNPFEDSA-N 1 1 300.333 3.853 20 5 DHBDMO CC[C@@H](C)[N@@H+](C)CCNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000314051077 1023846228 /nfs/dbraw/zinc/84/62/28/1023846228.db2.gz BPDVGWHMYRWHAE-SNVBAGLBSA-N 1 1 301.337 3.675 20 5 DHBDMO CC[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1nc(C)cs1 ZINC000788485066 1023893945 /nfs/dbraw/zinc/89/39/45/1023893945.db2.gz HMFQISDOKULCQP-HNNXBMFYSA-N 1 1 323.393 3.914 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)cc1 ZINC000053814911 1023928210 /nfs/dbraw/zinc/92/82/10/1023928210.db2.gz NOOVQORHYNDTNH-UHFFFAOYSA-N 1 1 310.353 3.590 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)C[N@@H+]1CCC[C@@H](C)C1 ZINC000531697436 1024272048 /nfs/dbraw/zinc/27/20/48/1024272048.db2.gz RALLRBHMZQZYLA-KBMXLJTQSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC000531697436 1024272064 /nfs/dbraw/zinc/27/20/64/1024272064.db2.gz RALLRBHMZQZYLA-KBMXLJTQSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C ZINC000531714647 1024279835 /nfs/dbraw/zinc/27/98/35/1024279835.db2.gz ZVLHAFHTVLNTFV-PBHICJAKSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C ZINC000531714647 1024279847 /nfs/dbraw/zinc/27/98/47/1024279847.db2.gz ZVLHAFHTVLNTFV-PBHICJAKSA-N 1 1 321.465 3.920 20 5 DHBDMO CCCO[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000108396908 1024639283 /nfs/dbraw/zinc/63/92/83/1024639283.db2.gz CMHLSUQVZIMHFM-MRXNPFEDSA-N 1 1 306.406 3.684 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000348931365 1024650668 /nfs/dbraw/zinc/65/06/68/1024650668.db2.gz AWHSAAVBERRQFX-RLXIPRIJSA-N 1 1 309.369 3.840 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170341246 1024757835 /nfs/dbraw/zinc/75/78/35/1024757835.db2.gz HMXRWBNEBKFGBN-KBPBESRZSA-N 1 1 306.406 3.799 20 5 DHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)C12CCC2 ZINC000349959750 1024771640 /nfs/dbraw/zinc/77/16/40/1024771640.db2.gz DMTSALHYHWJQHS-IAGOWNOFSA-N 1 1 318.417 3.683 20 5 DHBDMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792880197 1024819471 /nfs/dbraw/zinc/81/94/71/1024819471.db2.gz BEUYCAUUZKOQKH-LBPRGKRZSA-N 1 1 321.377 3.904 20 5 DHBDMO CC(C)[C@@H]1CCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899547 1024838173 /nfs/dbraw/zinc/83/81/73/1024838173.db2.gz WQDSYCMAGLFOBR-KRWDZBQOSA-N 1 1 314.389 3.536 20 5 DHBDMO CC(C)[N@H+]1CC[C@H](CNc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000319064532 1025148350 /nfs/dbraw/zinc/14/83/50/1025148350.db2.gz XOUJMPOHWSXBHY-LLVKDONJSA-N 1 1 313.348 3.675 20 5 DHBDMO CC(C)n1nccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000279713982 1025177865 /nfs/dbraw/zinc/17/78/65/1025177865.db2.gz TZZLPSQULUCNSN-UHFFFAOYSA-N 1 1 316.405 3.783 20 5 DHBDMO CC(C)n1nccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000279713982 1025177878 /nfs/dbraw/zinc/17/78/78/1025177878.db2.gz TZZLPSQULUCNSN-UHFFFAOYSA-N 1 1 316.405 3.783 20 5 DHBDMO CSC[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000178566369 1025233816 /nfs/dbraw/zinc/23/38/16/1025233816.db2.gz VGXPXXOKZJEFCQ-GFCCVEGCSA-N 1 1 300.811 3.576 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1sccc1C ZINC000015311879 1025387794 /nfs/dbraw/zinc/38/77/94/1025387794.db2.gz IXOVVEVDNMMGBS-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1sccc1C ZINC000015311879 1025387806 /nfs/dbraw/zinc/38/78/06/1025387806.db2.gz IXOVVEVDNMMGBS-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886023500 1025443699 /nfs/dbraw/zinc/44/36/99/1025443699.db2.gz QLMUQDPOJAQZBP-MLGOLLRUSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886023500 1025443704 /nfs/dbraw/zinc/44/37/04/1025443704.db2.gz QLMUQDPOJAQZBP-MLGOLLRUSA-N 1 1 315.348 3.712 20 5 DHBDMO Cc1cc(N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(Cl)cc1[N+](=O)[O-] ZINC000804815142 1025485878 /nfs/dbraw/zinc/48/58/78/1025485878.db2.gz OSGTZMRZXFWQHL-FUNVUKJBSA-N 1 1 323.824 3.618 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3c2cccc3F)c(F)c1 ZINC000886363770 1025602139 /nfs/dbraw/zinc/60/21/39/1025602139.db2.gz CQWDAQZFYXNEKM-MRXNPFEDSA-N 1 1 304.296 3.650 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000084137634 1025993312 /nfs/dbraw/zinc/99/33/12/1025993312.db2.gz YLRGISLDVBBOCH-UHFFFAOYSA-N 1 1 308.325 3.821 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000084137634 1025993321 /nfs/dbraw/zinc/99/33/21/1025993321.db2.gz YLRGISLDVBBOCH-UHFFFAOYSA-N 1 1 308.325 3.821 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cnc(C)s1 ZINC000347365902 1026031065 /nfs/dbraw/zinc/03/10/65/1026031065.db2.gz MHNGKLNDYODTRB-GHXNOFRVSA-N 1 1 317.414 3.895 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000289652363 1026114223 /nfs/dbraw/zinc/11/42/23/1026114223.db2.gz TWFCIOPFHZVQDF-XYPHTWIQSA-N 1 1 316.401 3.689 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(C)s1 ZINC000513438582 1026506688 /nfs/dbraw/zinc/50/66/88/1026506688.db2.gz KQULTTVTUMHFJU-UHFFFAOYSA-N 1 1 320.414 3.995 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(C)s1 ZINC000513438582 1026506692 /nfs/dbraw/zinc/50/66/92/1026506692.db2.gz KQULTTVTUMHFJU-UHFFFAOYSA-N 1 1 320.414 3.995 20 5 DHBDMO CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C[C@H]1CCCCO1 ZINC000513446855 1026511131 /nfs/dbraw/zinc/51/11/31/1026511131.db2.gz JGWNPKJNLYGZIY-MRXNPFEDSA-N 1 1 306.406 3.684 20 5 DHBDMO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809717822 1026603049 /nfs/dbraw/zinc/60/30/49/1026603049.db2.gz BKKNPJSGBCQZQB-UHFFFAOYSA-N 1 1 323.780 3.878 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420941912 1026898306 /nfs/dbraw/zinc/89/83/06/1026898306.db2.gz GFPHBYXHFCSAKG-JTQLQIEISA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420941912 1026898313 /nfs/dbraw/zinc/89/83/13/1026898313.db2.gz GFPHBYXHFCSAKG-JTQLQIEISA-N 1 1 320.286 3.898 20 5 DHBDMO Cc1cc(N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000811812193 1027091270 /nfs/dbraw/zinc/09/12/70/1027091270.db2.gz OFERYRMZHDYSHT-QWRGUYRKSA-N 1 1 309.797 3.594 20 5 DHBDMO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cs1 ZINC000293746573 1027112376 /nfs/dbraw/zinc/11/23/76/1027112376.db2.gz NVTKPNHDCRSTJM-UWVGGRQHSA-N 1 1 320.418 3.608 20 5 DHBDMO C[N@H+]1CCC[C@H](CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000228849185 1027128956 /nfs/dbraw/zinc/12/89/56/1027128956.db2.gz UWKHJWJUKFTHCL-SECBINFHSA-N 1 1 318.204 3.655 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000362385009 1027175415 /nfs/dbraw/zinc/17/54/15/1027175415.db2.gz QBJWFJJNCJYKLM-ZFWWWQNUSA-N 1 1 324.446 3.709 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000362385008 1027176066 /nfs/dbraw/zinc/17/60/66/1027176066.db2.gz QBJWFJJNCJYKLM-UKRRQHHQSA-N 1 1 324.446 3.709 20 5 DHBDMO CSC1(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCC1 ZINC000356047328 1027280728 /nfs/dbraw/zinc/28/07/28/1027280728.db2.gz ADSQAOBDLZWMPT-UHFFFAOYSA-N 1 1 306.431 3.845 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ccncc3)C2)cc1F ZINC000296001363 1027515431 /nfs/dbraw/zinc/51/54/31/1027515431.db2.gz PUVGTIPZMGCORW-OAHLLOKOSA-N 1 1 315.348 3.509 20 5 DHBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000747839370 1027532930 /nfs/dbraw/zinc/53/29/30/1027532930.db2.gz FRDXJGYXPDMVOO-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO CCc1ccccc1[C@@H](N)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423499720 1027563244 /nfs/dbraw/zinc/56/32/44/1027563244.db2.gz JLHJVPFZOBZUNB-UGSOOPFHSA-N 1 1 313.401 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000778172925 1027737371 /nfs/dbraw/zinc/73/73/71/1027737371.db2.gz FIBOZQBWXYWHTM-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000778172925 1027737389 /nfs/dbraw/zinc/73/73/89/1027737389.db2.gz FIBOZQBWXYWHTM-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](OCC3CC3)C2)ccc1Cl ZINC000778173301 1027740684 /nfs/dbraw/zinc/74/06/84/1027740684.db2.gz RVHCELZRBGKIAJ-AWEZNQCLSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](OCC3CC3)C2)ccc1Cl ZINC000778173301 1027740702 /nfs/dbraw/zinc/74/07/02/1027740702.db2.gz RVHCELZRBGKIAJ-AWEZNQCLSA-N 1 1 324.808 3.639 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1C ZINC000933491957 1027746332 /nfs/dbraw/zinc/74/63/32/1027746332.db2.gz RKRZOHCAMNKVLZ-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO CC(C)c1ccc(C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)cc1[N+](=O)[O-] ZINC000448361123 1027755667 /nfs/dbraw/zinc/75/56/67/1027755667.db2.gz VWWGJIGLTGOWPT-GDBMZVCRSA-N 1 1 320.433 3.844 20 5 DHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000297056726 1027787334 /nfs/dbraw/zinc/78/73/34/1027787334.db2.gz VTSMXCZZRDQEOE-QWHCGFSZSA-N 1 1 302.378 3.531 20 5 DHBDMO Cc1cc([C@H]2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)[nH]n1 ZINC000364017062 1027797445 /nfs/dbraw/zinc/79/74/45/1027797445.db2.gz ZFTSMRXURVFKBI-HIFRSBDPSA-N 1 1 314.389 3.567 20 5 DHBDMO Cc1cc([C@H]2CCC[N@@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n[nH]1 ZINC000364017062 1027797457 /nfs/dbraw/zinc/79/74/57/1027797457.db2.gz ZFTSMRXURVFKBI-HIFRSBDPSA-N 1 1 314.389 3.567 20 5 DHBDMO Cc1cc([C@H]2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n[nH]1 ZINC000364017062 1027797474 /nfs/dbraw/zinc/79/74/74/1027797474.db2.gz ZFTSMRXURVFKBI-HIFRSBDPSA-N 1 1 314.389 3.567 20 5 DHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H](c2ccncc2)C2CC2)c(F)c1 ZINC000934698274 1028077318 /nfs/dbraw/zinc/07/73/18/1028077318.db2.gz KXDCIPXJKPBHCJ-INIZCTEOSA-N 1 1 319.311 3.509 20 5 DHBDMO C[C@@H](C[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000578285700 1028109768 /nfs/dbraw/zinc/10/97/68/1028109768.db2.gz ROZJEHWLGMWOOQ-AWEZNQCLSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000934836993 1028122961 /nfs/dbraw/zinc/12/29/61/1028122961.db2.gz QHVVXEJQXOOQKY-PMPSAXMXSA-N 1 1 318.417 3.794 20 5 DHBDMO C[C@@H]1[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CCC12CCOCC2 ZINC000368832567 1028413938 /nfs/dbraw/zinc/41/39/38/1028413938.db2.gz FQCIBVOVQQVLDG-LBPRGKRZSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1c(C[N@H+](C)[C@H]2CCCc3cccnc32)cccc1[N+](=O)[O-] ZINC000369035331 1028436250 /nfs/dbraw/zinc/43/62/50/1028436250.db2.gz LOHWGBYLIZLBLS-KRWDZBQOSA-N 1 1 311.385 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)cc1 ZINC000449220728 1028463893 /nfs/dbraw/zinc/46/38/93/1028463893.db2.gz RBLIHMCREZFVQT-ZDUSSCGKSA-N 1 1 322.286 3.789 20 5 DHBDMO C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccs1 ZINC000369560532 1028503137 /nfs/dbraw/zinc/50/31/37/1028503137.db2.gz HIUHLWRCURRBFA-MLGOLLRUSA-N 1 1 317.414 3.761 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000564916335 1028517986 /nfs/dbraw/zinc/51/79/86/1028517986.db2.gz LRKYBUUPGYLJSY-FZMZJTMJSA-N 1 1 308.353 3.507 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC(C)(C)C1 ZINC000565425268 1028586137 /nfs/dbraw/zinc/58/61/37/1028586137.db2.gz DDINIMYSXUCEIS-NSHDSACASA-N 1 1 303.362 3.604 20 5 DHBDMO Cc1ccncc1C1=CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000371478097 1028722000 /nfs/dbraw/zinc/72/20/00/1028722000.db2.gz SSIPQEZOYNUBHS-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO Cc1ccncc1C1=CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000371478097 1028722018 /nfs/dbraw/zinc/72/20/18/1028722018.db2.gz SSIPQEZOYNUBHS-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1(C)C ZINC000449504823 1028725415 /nfs/dbraw/zinc/72/54/15/1028725415.db2.gz WFAOSLZAKIBFGA-KRWDZBQOSA-N 1 1 320.433 3.965 20 5 DHBDMO CCO[C@@H]1CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000449510317 1028736143 /nfs/dbraw/zinc/73/61/43/1028736143.db2.gz XCGNAKACWQWIKY-QAEGFZEYSA-N 1 1 318.417 3.745 20 5 DHBDMO CCn1c2ccccc2nc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000567189475 1028852664 /nfs/dbraw/zinc/85/26/64/1028852664.db2.gz YXURZZDYCOIPAT-ZDUSSCGKSA-N 1 1 324.384 3.815 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000449687606 1028924976 /nfs/dbraw/zinc/92/49/76/1028924976.db2.gz QFHNHABNWFNPIM-SFHVURJKSA-N 1 1 318.417 3.721 20 5 DHBDMO CC(=O)N[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000817412022 1029153247 /nfs/dbraw/zinc/15/32/47/1029153247.db2.gz BJEIAOCUWLQOME-GOSISDBHSA-N 1 1 318.420 3.703 20 5 DHBDMO CCC(CC)[N@@H+](CC)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000570546314 1029383835 /nfs/dbraw/zinc/38/38/35/1029383835.db2.gz KIXHINBMBSXKEO-UHFFFAOYSA-N 1 1 318.377 3.655 20 5 DHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]3CCC[C@H]32)cc1 ZINC000441444732 1029732806 /nfs/dbraw/zinc/73/28/06/1029732806.db2.gz HLBKOJPJUIIWPR-WMLDXEAASA-N 1 1 304.390 3.628 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCCC1(F)F ZINC000450932770 1029736646 /nfs/dbraw/zinc/73/66/46/1029736646.db2.gz COFZDCMDWYTXOC-AWEZNQCLSA-N 1 1 312.360 3.895 20 5 DHBDMO Cc1cnc([C@@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451545912 1029906206 /nfs/dbraw/zinc/90/62/06/1029906206.db2.gz HVDKQKGEEXJSRT-UKRRQHHQSA-N 1 1 315.373 3.832 20 5 DHBDMO Cc1[nH+]ccn1CCCNc1ccc([N+](=O)[O-])cc1C(F)F ZINC000865554901 1029912714 /nfs/dbraw/zinc/91/27/14/1029912714.db2.gz OQLZQZPGRCMJOM-UHFFFAOYSA-N 1 1 310.304 3.540 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCSC[C@@H]1C1CC1 ZINC000451646325 1029951468 /nfs/dbraw/zinc/95/14/68/1029951468.db2.gz IINKZJIEXTXISM-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCSC[C@@H]1C1CC1 ZINC000451646325 1029951474 /nfs/dbraw/zinc/95/14/74/1029951474.db2.gz IINKZJIEXTXISM-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCSC[C@H]1C1CC1 ZINC000451646457 1029951698 /nfs/dbraw/zinc/95/16/98/1029951698.db2.gz FNZAEAXEZXLFMC-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCSC[C@H]1C1CC1 ZINC000451646457 1029951708 /nfs/dbraw/zinc/95/17/08/1029951708.db2.gz FNZAEAXEZXLFMC-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCSC3(CCCCC3)C2)c1 ZINC000530710821 1029971088 /nfs/dbraw/zinc/97/10/88/1029971088.db2.gz NWRPPYPCLSNWGX-UHFFFAOYSA-N 1 1 306.431 3.847 20 5 DHBDMO C[N@H+]1CCCC[C@@H](CNc2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865968181 1030097624 /nfs/dbraw/zinc/09/76/24/1030097624.db2.gz OKMVUKLEIUOFGI-NSHDSACASA-N 1 1 313.348 3.676 20 5 DHBDMO Cc1c(C[NH2+][C@@H](C)c2nc3c(s2)CCC3)cccc1[N+](=O)[O-] ZINC000358343827 1030448459 /nfs/dbraw/zinc/44/84/59/1030448459.db2.gz YEDCZXHXTXUQPR-NSHDSACASA-N 1 1 317.414 3.699 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1cccc2c1OCO2 ZINC000925696279 1030456004 /nfs/dbraw/zinc/45/60/04/1030456004.db2.gz YXYMRHARWZQTCY-VXGBXAGGSA-N 1 1 314.341 3.735 20 5 DHBDMO CC(C)([NH2+]Cc1cc(F)cc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000291651784 1030583776 /nfs/dbraw/zinc/58/37/76/1030583776.db2.gz CSZCCDQGCKETTH-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCSC[C@H]2C2CC2)c1 ZINC000824914391 1030663553 /nfs/dbraw/zinc/66/35/53/1030663553.db2.gz RVYQEKDMONBEJM-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCSC[C@H]2C2CC2)c1 ZINC000824914391 1030663562 /nfs/dbraw/zinc/66/35/62/1030663562.db2.gz RVYQEKDMONBEJM-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO COc1ccnc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000925495194 1031261505 /nfs/dbraw/zinc/26/15/05/1031261505.db2.gz MHAPNYMPRIGEDJ-STQMWFEESA-N 1 1 315.373 3.719 20 5 DHBDMO CCCn1cc[nH+]c1CCCN(C)c1cc(C)ccc1[N+](=O)[O-] ZINC000428671391 1031324390 /nfs/dbraw/zinc/32/43/90/1031324390.db2.gz JLUVIPABZPBCEM-UHFFFAOYSA-N 1 1 316.405 3.579 20 5 DHBDMO CNc1ccc([N+](=O)[O-])cc1NCc1c(C)cc(C)[nH+]c1C ZINC000871838790 1031338520 /nfs/dbraw/zinc/33/85/20/1031338520.db2.gz GBUPVWIYSPOVHB-UHFFFAOYSA-N 1 1 300.362 3.569 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872016266 1031397006 /nfs/dbraw/zinc/39/70/06/1031397006.db2.gz HEUCWQDATPQTBF-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO COc1ccc(CNc2cc[nH+]c3ccsc32)cc1[N+](=O)[O-] ZINC000360535276 1031464810 /nfs/dbraw/zinc/46/48/10/1031464810.db2.gz OLVIFLMWUWLJRP-UHFFFAOYSA-N 1 1 315.354 3.825 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1cc(O)ccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000872073502 1031469159 /nfs/dbraw/zinc/46/91/59/1031469159.db2.gz QGMFZITUHZMCOZ-QWRGUYRKSA-N 1 1 304.321 3.851 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccnc(F)c1 ZINC000872093037 1031490250 /nfs/dbraw/zinc/49/02/50/1031490250.db2.gz SRDRPEFMAUOXBS-SNVBAGLBSA-N 1 1 321.377 3.702 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872278117 1031572351 /nfs/dbraw/zinc/57/23/51/1031572351.db2.gz GYIRMDNQMFRHMN-CQSZACIVSA-N 1 1 322.380 3.658 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872282454 1031576589 /nfs/dbraw/zinc/57/65/89/1031576589.db2.gz KWGBRLDKVKDYFE-MRXNPFEDSA-N 1 1 322.380 3.658 20 5 DHBDMO Cc1cc(Cl)nc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000873122961 1031716495 /nfs/dbraw/zinc/71/64/95/1031716495.db2.gz XNBXYRSBFZBAFT-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO C[C@H]([NH2+]Cc1cnc(C2CC2)s1)c1ccccc1[N+](=O)[O-] ZINC000873183390 1031744371 /nfs/dbraw/zinc/74/43/71/1031744371.db2.gz JSWUCNVYPOHCTC-JTQLQIEISA-N 1 1 303.387 3.780 20 5 DHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H]1CC[C@H](C)C1 ZINC000361639572 1032026741 /nfs/dbraw/zinc/02/67/41/1032026741.db2.gz PIDQTGAZIPKYDX-XJKSGUPXSA-N 1 1 306.406 3.540 20 5 DHBDMO C[C@H]1CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172903281 1033437882 /nfs/dbraw/zinc/43/78/82/1033437882.db2.gz GJXOYQUVZNYNLE-WMLDXEAASA-N 1 1 302.418 3.964 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1C[C@@H]3CCC[C@@H]3C1)CC2 ZINC001172903912 1033438040 /nfs/dbraw/zinc/43/80/40/1033438040.db2.gz JLVLFRDRWXXMHU-BBWFWOEESA-N 1 1 300.402 3.574 20 5 DHBDMO C[C@]1(F)CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C[C@@H]1F ZINC001172905818 1033438212 /nfs/dbraw/zinc/43/82/12/1033438212.db2.gz UUHYVNNSNZLTPG-XIRDDKMYSA-N 1 1 324.371 3.614 20 5 DHBDMO C[N@@H+](CC1CC(F)(F)C1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172917628 1033464844 /nfs/dbraw/zinc/46/48/44/1033464844.db2.gz WDMUUWQCPIJRPC-OAHLLOKOSA-N 1 1 324.371 3.819 20 5 DHBDMO C[N@@H+](CC1CCCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921803 1033469979 /nfs/dbraw/zinc/46/99/79/1033469979.db2.gz UBADTACTPARCPY-KRWDZBQOSA-N 1 1 302.418 3.964 20 5 DHBDMO CC(C)C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)C ZINC000877966934 1033535316 /nfs/dbraw/zinc/53/53/16/1033535316.db2.gz ZOAMQWVQRUGSBO-UHFFFAOYSA-N 1 1 318.377 3.511 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC[C@@H](C)C2)c1F ZINC001173181795 1033583126 /nfs/dbraw/zinc/58/31/26/1033583126.db2.gz PVANRUZOZKPSFH-OLZOCXBDSA-N 1 1 324.396 3.796 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001173221456 1033603149 /nfs/dbraw/zinc/60/31/49/1033603149.db2.gz IPYVWLRVNVHDRA-BXUZGUMPSA-N 1 1 316.323 3.595 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001173221456 1033603157 /nfs/dbraw/zinc/60/31/57/1033603157.db2.gz IPYVWLRVNVHDRA-BXUZGUMPSA-N 1 1 316.323 3.595 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001173221459 1033603627 /nfs/dbraw/zinc/60/36/27/1033603627.db2.gz IPYVWLRVNVHDRA-RISCZKNCSA-N 1 1 316.323 3.595 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001173221459 1033603637 /nfs/dbraw/zinc/60/36/37/1033603637.db2.gz IPYVWLRVNVHDRA-RISCZKNCSA-N 1 1 316.323 3.595 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC2(CCCCC2)C1 ZINC001173231381 1033605279 /nfs/dbraw/zinc/60/52/79/1033605279.db2.gz BYJCYMIIEDHRPR-HNNXBMFYSA-N 1 1 318.417 3.561 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000878755602 1033817346 /nfs/dbraw/zinc/81/73/46/1033817346.db2.gz VWBGVCDDHIDXNC-QGZVFWFLSA-N 1 1 311.385 3.678 20 5 DHBDMO C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(C)(C)C ZINC000878768258 1033824569 /nfs/dbraw/zinc/82/45/69/1033824569.db2.gz DCAQZVMIHIJJHD-UHFFFAOYSA-N 1 1 324.768 3.529 20 5 DHBDMO Cc1c([C@@H](C)NCC(C)(C)[NH+]2CCCCC2)cccc1[N+](=O)[O-] ZINC000479857105 1033920749 /nfs/dbraw/zinc/92/07/49/1033920749.db2.gz ARFKKQWXPGHDAA-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000880000209 1034173063 /nfs/dbraw/zinc/17/30/63/1034173063.db2.gz KBAHXDTWSCWXLQ-GFCCVEGCSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000880000209 1034173076 /nfs/dbraw/zinc/17/30/76/1034173076.db2.gz KBAHXDTWSCWXLQ-GFCCVEGCSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000880003496 1034177655 /nfs/dbraw/zinc/17/76/55/1034177655.db2.gz HYELYMOJNWWAIG-LBPRGKRZSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000880003496 1034177649 /nfs/dbraw/zinc/17/76/49/1034177649.db2.gz HYELYMOJNWWAIG-LBPRGKRZSA-N 1 1 306.259 3.508 20 5 DHBDMO Cc1c(C[NH2+]Cc2cnc(-c3ccccc3)[nH]2)cccc1[N+](=O)[O-] ZINC000480473984 1034266592 /nfs/dbraw/zinc/26/65/92/1034266592.db2.gz BIHXOOJGYJAHHG-UHFFFAOYSA-N 1 1 322.368 3.583 20 5 DHBDMO Cc1c(C[NH2+]Cc2c[nH]c(-c3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000480473984 1034266618 /nfs/dbraw/zinc/26/66/18/1034266618.db2.gz BIHXOOJGYJAHHG-UHFFFAOYSA-N 1 1 322.368 3.583 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3nccs3)C2)c(Cl)c1 ZINC000880320470 1034296121 /nfs/dbraw/zinc/29/61/21/1034296121.db2.gz TUXYVZXFICFQJJ-NSHDSACASA-N 1 1 323.805 3.694 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880319658 1034296361 /nfs/dbraw/zinc/29/63/61/1034296361.db2.gz IFYUWWKOHPKTSL-OLZOCXBDSA-N 1 1 317.414 3.910 20 5 DHBDMO Cc1ncsc1C[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000179426101 1034307228 /nfs/dbraw/zinc/30/72/28/1034307228.db2.gz SXSCXLIKWRKWQZ-FNORWQNLSA-N 1 1 303.387 3.505 20 5 DHBDMO Cc1ncsc1C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000179426101 1034307235 /nfs/dbraw/zinc/30/72/35/1034307235.db2.gz SXSCXLIKWRKWQZ-FNORWQNLSA-N 1 1 303.387 3.505 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000481017637 1034552501 /nfs/dbraw/zinc/55/25/01/1034552501.db2.gz RGSCUWYZOKERGD-MRXNPFEDSA-N 1 1 324.446 3.581 20 5 DHBDMO Cc1cn(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])c(C)[nH+]1 ZINC000865361719 1034608757 /nfs/dbraw/zinc/60/87/57/1034608757.db2.gz WLRSVNDISBVDGP-UHFFFAOYSA-N 1 1 300.145 3.763 20 5 DHBDMO Cc1cccc(C)c1[C@@H](C)NCc1cc([O-])ccc1[N+](=O)[O-] ZINC000555427992 1034698719 /nfs/dbraw/zinc/69/87/19/1034698719.db2.gz ZSPQQFWWASCOKM-CYBMUJFWSA-N 1 1 300.358 3.768 20 5 DHBDMO CCC(CC)CCC[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001174949145 1034702279 /nfs/dbraw/zinc/70/22/79/1034702279.db2.gz UAKJIGJGRPUFAE-UHFFFAOYSA-N 1 1 321.421 3.682 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H]2C2CCOCC2)c1 ZINC000777438762 1034741777 /nfs/dbraw/zinc/74/17/77/1034741777.db2.gz DHAAOVAMASMMPF-INIZCTEOSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)s1 ZINC000600188315 1034789418 /nfs/dbraw/zinc/78/94/18/1034789418.db2.gz AANLFRNOLDTNNT-TXEJJXNPSA-N 1 1 300.383 3.775 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC(C)(C)[C@H]2CCC[C@@H]21 ZINC000555720957 1034875144 /nfs/dbraw/zinc/87/51/44/1034875144.db2.gz BLMYKAZIUQMOAA-GJZGRUSLSA-N 1 1 304.390 3.614 20 5 DHBDMO C[C@]1(c2ccc(F)cc2)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000482574743 1035138083 /nfs/dbraw/zinc/13/80/83/1035138083.db2.gz GHLZZICUEXSDCX-SFHVURJKSA-N 1 1 314.360 3.898 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1CCN[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000482947472 1035204359 /nfs/dbraw/zinc/20/43/59/1035204359.db2.gz KGSNXVDEYXTLQE-NVXWUHKLSA-N 1 1 319.449 3.818 20 5 DHBDMO CC[C@@H]1CCCCN1CC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000482947472 1035204363 /nfs/dbraw/zinc/20/43/63/1035204363.db2.gz KGSNXVDEYXTLQE-NVXWUHKLSA-N 1 1 319.449 3.818 20 5 DHBDMO COC1(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCCC1 ZINC000483174518 1035235590 /nfs/dbraw/zinc/23/55/90/1035235590.db2.gz GAZHFNCHSGMEKY-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000483242730 1035244142 /nfs/dbraw/zinc/24/41/42/1035244142.db2.gz CFWRHEAMLCUVPJ-GFCCVEGCSA-N 1 1 316.405 3.729 20 5 DHBDMO CCN(CC)C[C@@H](C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC001177733860 1035390333 /nfs/dbraw/zinc/39/03/33/1035390333.db2.gz VGVUIZUGTMZKNS-CQSZACIVSA-N 1 1 307.438 3.538 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(O)c(F)c1)C1CC1 ZINC001179914318 1035546927 /nfs/dbraw/zinc/54/69/27/1035546927.db2.gz UKQPIZCXJIZQBL-UHFFFAOYSA-N 1 1 316.332 3.604 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(O)c(F)c1)C1CC1 ZINC001179914318 1035546941 /nfs/dbraw/zinc/54/69/41/1035546941.db2.gz UKQPIZCXJIZQBL-UHFFFAOYSA-N 1 1 316.332 3.604 20 5 DHBDMO CO[C@](C)(C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C)C1CC1 ZINC001180177946 1035605654 /nfs/dbraw/zinc/60/56/54/1035605654.db2.gz JFTLBZMEQNDAFM-QGZVFWFLSA-N 1 1 306.406 3.620 20 5 DHBDMO C[C@@H](C1CCCCC1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001193808516 1035744048 /nfs/dbraw/zinc/74/40/48/1035744048.db2.gz VIHJZKQZRHQZRP-AWEZNQCLSA-N 1 1 306.406 3.874 20 5 DHBDMO CC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)CC(C)C ZINC000089885683 1035763855 /nfs/dbraw/zinc/76/38/55/1035763855.db2.gz OLSBLLQDBSELIE-UHFFFAOYSA-N 1 1 303.362 3.728 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494705576 1035772151 /nfs/dbraw/zinc/77/21/51/1035772151.db2.gz XKWCTTWERMYXRU-CXAGYDPISA-N 1 1 304.390 3.547 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000485707590 1035883316 /nfs/dbraw/zinc/88/33/16/1035883316.db2.gz KKLBEQVHBKYBSK-GJZGRUSLSA-N 1 1 304.390 3.758 20 5 DHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000539826818 1035886554 /nfs/dbraw/zinc/88/65/54/1035886554.db2.gz ZKSBCIAYXQQCLG-AWEZNQCLSA-N 1 1 318.398 3.544 20 5 DHBDMO COC(C)(C)C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000539927153 1035933556 /nfs/dbraw/zinc/93/35/56/1035933556.db2.gz JHHOJJUQPFUTSY-UHFFFAOYSA-N 1 1 318.373 3.712 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)cc1 ZINC000152911964 1036024716 /nfs/dbraw/zinc/02/47/16/1036024716.db2.gz WXUAQOKSOHRWMV-QGZVFWFLSA-N 1 1 304.390 3.518 20 5 DHBDMO CC(C)C[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)C1CC1 ZINC000914566602 1036118667 /nfs/dbraw/zinc/11/86/67/1036118667.db2.gz DDNPUYIWQSSDGX-UHFFFAOYSA-N 1 1 321.402 3.950 20 5 DHBDMO Cc1ccc(C[N@H+](C)C2CC(OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001195256909 1036193385 /nfs/dbraw/zinc/19/33/85/1036193385.db2.gz DNBXAONBRDQTAW-UHFFFAOYSA-N 1 1 306.406 3.681 20 5 DHBDMO CC[C@@H]1C[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C[C@H](CC)O1 ZINC001195298596 1036210411 /nfs/dbraw/zinc/21/04/11/1036210411.db2.gz FDEUJKBCDVNRCT-CWRNSKLLSA-N 1 1 306.406 3.854 20 5 DHBDMO CC[C@@H]1C[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C[C@H](CC)O1 ZINC001195298596 1036210428 /nfs/dbraw/zinc/21/04/28/1036210428.db2.gz FDEUJKBCDVNRCT-CWRNSKLLSA-N 1 1 306.406 3.854 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C/C=C/c2ccncc2)C2CC2)c1 ZINC000495067466 1036212011 /nfs/dbraw/zinc/21/20/11/1036212011.db2.gz OESUPFANTKUNPG-DUXPYHPUSA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C/C=C\c2ccncc2)C2CC2)cc1 ZINC000495062299 1036215234 /nfs/dbraw/zinc/21/52/34/1036215234.db2.gz FBNRNEUZFSJRIR-UPHRSURJSA-N 1 1 309.369 3.668 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000464770173 1036446846 /nfs/dbraw/zinc/44/68/46/1036446846.db2.gz FKZWSYVGCWKDEI-CJNGLKHVSA-N 1 1 324.446 3.580 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000464770174 1036446957 /nfs/dbraw/zinc/44/69/57/1036446957.db2.gz FKZWSYVGCWKDEI-CZUORRHYSA-N 1 1 324.446 3.580 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000542053487 1036501630 /nfs/dbraw/zinc/50/16/30/1036501630.db2.gz URIMHSUVFAEPFD-AEGPPILISA-N 1 1 304.390 3.614 20 5 DHBDMO COC[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 ZINC000271790995 1036539870 /nfs/dbraw/zinc/53/98/70/1036539870.db2.gz KBASDSRZKXBTBI-OAHLLOKOSA-N 1 1 320.776 3.726 20 5 DHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000774625065 1036585165 /nfs/dbraw/zinc/58/51/65/1036585165.db2.gz OIEITSTXHLNXRQ-CXAGYDPISA-N 1 1 314.389 3.536 20 5 DHBDMO CC[C@@H](C)C[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774628354 1036594863 /nfs/dbraw/zinc/59/48/63/1036594863.db2.gz UIKWATOKDMYMNT-SNVBAGLBSA-N 1 1 310.785 3.533 20 5 DHBDMO CCOc1cc(NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC001184839584 1036961073 /nfs/dbraw/zinc/96/10/73/1036961073.db2.gz MAXXGZVVCRLRAV-UONOGXRCSA-N 1 1 321.421 3.526 20 5 DHBDMO CCOc1cc(NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC001184839585 1036962907 /nfs/dbraw/zinc/96/29/07/1036962907.db2.gz MAXXGZVVCRLRAV-ZIAGYGMSSA-N 1 1 321.421 3.526 20 5 DHBDMO C[C@]12C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC001198252319 1036985787 /nfs/dbraw/zinc/98/57/87/1036985787.db2.gz RBZCIZXFJMIQIB-CIRFHOKZSA-N 1 1 300.402 3.505 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCOCC3(CCCC3)C2)c1 ZINC000775852286 1037028716 /nfs/dbraw/zinc/02/87/16/1037028716.db2.gz YACFTZMCSCVQRE-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCOCC3(CCCC3)C2)c1 ZINC000775852286 1037028732 /nfs/dbraw/zinc/02/87/32/1037028732.db2.gz YACFTZMCSCVQRE-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774831942 1037046838 /nfs/dbraw/zinc/04/68/38/1037046838.db2.gz FZVDHJKLLCUIEB-ZDUSSCGKSA-N 1 1 307.350 3.514 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000774854542 1037104300 /nfs/dbraw/zinc/10/43/00/1037104300.db2.gz WQKZNRWRWWJOFW-OAHLLOKOSA-N 1 1 319.361 3.658 20 5 DHBDMO COc1cc(C[N@@H+](C)C[C@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000489206262 1037308456 /nfs/dbraw/zinc/30/84/56/1037308456.db2.gz NZOVOZXHRMPTEW-AWEZNQCLSA-N 1 1 314.385 3.839 20 5 DHBDMO CC(C)[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CCS1 ZINC000761515161 1037342563 /nfs/dbraw/zinc/34/25/63/1037342563.db2.gz QQTOTKHFFAQLKL-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CCS1 ZINC000761515161 1037342576 /nfs/dbraw/zinc/34/25/76/1037342576.db2.gz QQTOTKHFFAQLKL-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)cc1 ZINC000609234550 1037462289 /nfs/dbraw/zinc/46/22/89/1037462289.db2.gz URXXKOBTEJKUKB-SFHVURJKSA-N 1 1 312.369 3.558 20 5 DHBDMO COc1cc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000490063139 1037599464 /nfs/dbraw/zinc/59/94/64/1037599464.db2.gz XBCYTPAXEXURNH-UGSOOPFHSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000490063139 1037599477 /nfs/dbraw/zinc/59/94/77/1037599477.db2.gz XBCYTPAXEXURNH-UGSOOPFHSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000490093176 1037612544 /nfs/dbraw/zinc/61/25/44/1037612544.db2.gz XMDHOOOMNOHTDF-YUELXQCFSA-N 1 1 304.390 3.756 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c(F)c1 ZINC000490406350 1037710251 /nfs/dbraw/zinc/71/02/51/1037710251.db2.gz YTGBQXDDRJSTJA-GJZGRUSLSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c(F)c1 ZINC000490406350 1037710269 /nfs/dbraw/zinc/71/02/69/1037710269.db2.gz YTGBQXDDRJSTJA-GJZGRUSLSA-N 1 1 310.394 3.594 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000125851176 1037973346 /nfs/dbraw/zinc/97/33/46/1037973346.db2.gz LXTLLSJXQJDQMC-CVEARBPZSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](C)C(C)(C)C ZINC000164537272 1038205880 /nfs/dbraw/zinc/20/58/80/1038205880.db2.gz PDUVHFKJXHGTLO-CYBMUJFWSA-N 1 1 321.421 3.598 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1nccn1CC(C)C ZINC000164802056 1038307392 /nfs/dbraw/zinc/30/73/92/1038307392.db2.gz RXCLCBWLZGWNJI-AWEZNQCLSA-N 1 1 316.405 3.607 20 5 DHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001190590205 1038349477 /nfs/dbraw/zinc/34/94/77/1038349477.db2.gz WOWUEVCRUYTVFV-GOEBONIOSA-N 1 1 306.406 3.874 20 5 DHBDMO COc1ccc(C2([NH2+]Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 ZINC000775410281 1038382520 /nfs/dbraw/zinc/38/25/20/1038382520.db2.gz IUGCCUIAPJTJSV-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO CC[C@H](C)[C@@H](C)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001190911987 1038407633 /nfs/dbraw/zinc/40/76/33/1038407633.db2.gz AFPQGVUBKJXXKZ-UONOGXRCSA-N 1 1 306.406 3.873 20 5 DHBDMO C[C@@H]1CCC[N@@H+](CCNc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000589107414 1038432616 /nfs/dbraw/zinc/43/26/16/1038432616.db2.gz SNLZPLKPGZXLIU-LLVKDONJSA-N 1 1 313.348 3.676 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(C2CC2)s1 ZINC000589184925 1038445295 /nfs/dbraw/zinc/44/52/95/1038445295.db2.gz AYEDQBMKBXKAIL-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000589192461 1038448010 /nfs/dbraw/zinc/44/80/10/1038448010.db2.gz CAXXHQPQAZVGGY-GPCFVJJQSA-N 1 1 309.369 3.840 20 5 DHBDMO C[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001191486910 1038509919 /nfs/dbraw/zinc/50/99/19/1038509919.db2.gz VSMNLAFFFNOAPH-VHSXEESVSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001191486910 1038509923 /nfs/dbraw/zinc/50/99/23/1038509923.db2.gz VSMNLAFFFNOAPH-VHSXEESVSA-N 1 1 313.195 3.588 20 5 DHBDMO CC(C)c1ccc(CNC[C@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000598994379 1038984580 /nfs/dbraw/zinc/98/45/80/1038984580.db2.gz LPZPJJBUMBOWGB-MRXNPFEDSA-N 1 1 319.449 3.540 20 5 DHBDMO C[C@@H](NC[C@H]1CC[N@@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000599064141 1039019839 /nfs/dbraw/zinc/01/98/39/1039019839.db2.gz KHLGSEVHASXTMG-RDTXWAMCSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@@H](NC[C@H]1CC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000599064141 1039019861 /nfs/dbraw/zinc/01/98/61/1039019861.db2.gz KHLGSEVHASXTMG-RDTXWAMCSA-N 1 1 317.433 3.652 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H]2CC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599075009 1039028824 /nfs/dbraw/zinc/02/88/24/1039028824.db2.gz ZNASPFKFWVYSRR-YOEHRIQHSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599075009 1039028841 /nfs/dbraw/zinc/02/88/41/1039028841.db2.gz ZNASPFKFWVYSRR-YOEHRIQHSA-N 1 1 317.433 3.571 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592181776 1039162209 /nfs/dbraw/zinc/16/22/09/1039162209.db2.gz HUXBUABTYYJEOY-ZIAGYGMSSA-N 1 1 304.390 3.547 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ccc([N+](=O)[O-])cc2F)C1 ZINC000603860461 1039193950 /nfs/dbraw/zinc/19/39/50/1039193950.db2.gz BADZJUSZRNQMMK-OKILXGFUSA-N 1 1 323.412 3.904 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCc2c(O)cccc2C1 ZINC000599645889 1039246062 /nfs/dbraw/zinc/24/60/62/1039246062.db2.gz HCBWMPJXOGFGMT-ZDUSSCGKSA-N 1 1 312.369 3.728 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCc2c(O)cccc2C1 ZINC000599645889 1039246066 /nfs/dbraw/zinc/24/60/66/1039246066.db2.gz HCBWMPJXOGFGMT-ZDUSSCGKSA-N 1 1 312.369 3.728 20 5 DHBDMO CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1cccs1 ZINC000604012421 1039279948 /nfs/dbraw/zinc/27/99/48/1039279948.db2.gz CIDHBTFIFIZHNP-UHFFFAOYSA-N 1 1 320.414 3.947 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000604013231 1039280896 /nfs/dbraw/zinc/28/08/96/1039280896.db2.gz URWZRMBDNFQVDE-INIZCTEOSA-N 1 1 304.390 3.758 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000157723922 1039408074 /nfs/dbraw/zinc/40/80/74/1039408074.db2.gz ZTMAEMCYXLUWRT-AEFFLSMTSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000157723922 1039408082 /nfs/dbraw/zinc/40/80/82/1039408082.db2.gz ZTMAEMCYXLUWRT-AEFFLSMTSA-N 1 1 317.433 3.510 20 5 DHBDMO Cc1noc(C[N@H+](Cc2ccccc2)[C@H](C)C2CC2)c1[N+](=O)[O-] ZINC000595291892 1040091068 /nfs/dbraw/zinc/09/10/68/1040091068.db2.gz WTJURONWAPABPL-CYBMUJFWSA-N 1 1 315.373 3.692 20 5 DHBDMO Cc1noc(C[N@@H+](Cc2ccccc2)[C@H](C)C2CC2)c1[N+](=O)[O-] ZINC000595291892 1040091081 /nfs/dbraw/zinc/09/10/81/1040091081.db2.gz WTJURONWAPABPL-CYBMUJFWSA-N 1 1 315.373 3.692 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2c2cccc(C)c2C)c1[N+](=O)[O-] ZINC000595327690 1040100463 /nfs/dbraw/zinc/10/04/63/1040100463.db2.gz QLAKABYTJFVNND-OAHLLOKOSA-N 1 1 315.373 3.845 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000595327811 1040100724 /nfs/dbraw/zinc/10/07/24/1040100724.db2.gz SGESCYQOHABNGJ-INIZCTEOSA-N 1 1 322.380 3.658 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2c2cc(C)ccc2C)c1[N+](=O)[O-] ZINC000595348923 1040105759 /nfs/dbraw/zinc/10/57/59/1040105759.db2.gz WMZCJRUHFLCPSJ-OAHLLOKOSA-N 1 1 315.373 3.845 20 5 DHBDMO Cc1noc(C[NH+]2CCC(c3ccccc3C)CC2)c1[N+](=O)[O-] ZINC000595309639 1040105963 /nfs/dbraw/zinc/10/59/63/1040105963.db2.gz ANTRGISWNCKZJO-UHFFFAOYSA-N 1 1 315.373 3.579 20 5 DHBDMO COc1ccccc1C(C)(C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595365132 1040127383 /nfs/dbraw/zinc/12/73/83/1040127383.db2.gz XNLRCZRFUGXFOL-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595412941 1040131561 /nfs/dbraw/zinc/13/15/61/1040131561.db2.gz PLMPVVHDSDOJOI-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](CC(C)C)c2cccs2)c1[N+](=O)[O-] ZINC000595423051 1040133286 /nfs/dbraw/zinc/13/32/86/1040133286.db2.gz DLBBAXOMCOVHMC-NSHDSACASA-N 1 1 309.391 3.830 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000595432531 1040136287 /nfs/dbraw/zinc/13/62/87/1040136287.db2.gz WMCHXWVUXWZGRN-BOLDSZDNSA-N 1 1 313.357 3.569 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000595432531 1040136292 /nfs/dbraw/zinc/13/62/92/1040136292.db2.gz WMCHXWVUXWZGRN-BOLDSZDNSA-N 1 1 313.357 3.569 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@H](C)CC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595482098 1040137955 /nfs/dbraw/zinc/13/79/55/1040137955.db2.gz HMOBUXUOCJMIAR-IUODEOHRSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1noc(C[N@H+]2C[C@H](C)CC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595482098 1040137958 /nfs/dbraw/zinc/13/79/58/1040137958.db2.gz HMOBUXUOCJMIAR-IUODEOHRSA-N 1 1 315.373 3.864 20 5 DHBDMO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595400781 1040139477 /nfs/dbraw/zinc/13/94/77/1040139477.db2.gz LMMCMDLITWTYBM-OAHLLOKOSA-N 1 1 303.337 3.712 20 5 DHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595400781 1040139484 /nfs/dbraw/zinc/13/94/84/1040139484.db2.gz LMMCMDLITWTYBM-OAHLLOKOSA-N 1 1 303.337 3.712 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(c2ccncc2)CC1 ZINC000595458623 1040145124 /nfs/dbraw/zinc/14/51/24/1040145124.db2.gz JILIRDGYZPIXRR-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO CC[C@H](CC(F)F)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000595478126 1040150458 /nfs/dbraw/zinc/15/04/58/1040150458.db2.gz XRURMONNYSQFNX-GFCCVEGCSA-N 1 1 300.349 3.751 20 5 DHBDMO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000595491300 1040152043 /nfs/dbraw/zinc/15/20/43/1040152043.db2.gz VFCYZBJMPSCCMI-AWEZNQCLSA-N 1 1 310.369 3.513 20 5 DHBDMO Cc1noc(C[N@H+]2[C@H](C)C[C@H](c3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000595507088 1040156111 /nfs/dbraw/zinc/15/61/11/1040156111.db2.gz JVWOEXZJMKVCGG-ZLDLUXBVSA-N 1 1 315.373 3.658 20 5 DHBDMO Cc1noc(C[N@H+]2[C@H](C)C[C@@H](c3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000595507086 1040156176 /nfs/dbraw/zinc/15/61/76/1040156176.db2.gz JVWOEXZJMKVCGG-OSAQELSMSA-N 1 1 315.373 3.658 20 5 DHBDMO Nc1cccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000595525190 1040160681 /nfs/dbraw/zinc/16/06/81/1040160681.db2.gz PMHKNDUFSKQQFF-INIZCTEOSA-N 1 1 311.385 3.557 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC000595830128 1040267009 /nfs/dbraw/zinc/26/70/09/1040267009.db2.gz BAACLPXHTLUFST-KBXCAEBGSA-N 1 1 312.369 3.809 20 5 DHBDMO Cc1ncc(-c2cccc(C[N@@H+]3CCC[C@H]3C)c2)cc1[N+](=O)[O-] ZINC000596630360 1040529689 /nfs/dbraw/zinc/52/96/89/1040529689.db2.gz PWYGDDZUNSYXKO-CYBMUJFWSA-N 1 1 311.385 3.950 20 5 DHBDMO C[N@@H+](CCCOc1ccccc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000059403220 184138468 /nfs/dbraw/zinc/13/84/68/184138468.db2.gz LQHUNHDWGRGSAV-UHFFFAOYSA-N 1 1 314.385 3.538 20 5 DHBDMO CSCc1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000285437893 131168451 /nfs/dbraw/zinc/16/84/51/131168451.db2.gz HWLYXDKCODGLKX-UHFFFAOYSA-N 1 1 308.428 3.809 20 5 DHBDMO C[N@@H+](CCCCC(F)(F)F)CCc1ccccc1[N+](=O)[O-] ZINC000285462781 131170609 /nfs/dbraw/zinc/17/06/09/131170609.db2.gz ZJVXLSNCRHIHDR-UHFFFAOYSA-N 1 1 304.312 3.802 20 5 DHBDMO Cc1ccc(C[NH2+][C@H]2c3ccc(F)cc3O[C@H]2C)cc1[N+](=O)[O-] ZINC000570546980 332771124 /nfs/dbraw/zinc/77/11/24/332771124.db2.gz SJGSTOAVFMBQAB-APPDUMDISA-N 1 1 316.332 3.654 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H](CC(C)C)[NH+](C)C)cc1[N+](=O)[O-] ZINC000314069987 333085641 /nfs/dbraw/zinc/08/56/41/333085641.db2.gz SSYCSSRLIDMEQJ-GOEBONIOSA-N 1 1 307.438 3.530 20 5 DHBDMO CCC(CC)[C@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)N(C)C ZINC000314289398 333098690 /nfs/dbraw/zinc/09/86/90/333098690.db2.gz XIISTHCKZGQOQZ-DYVFJYSZSA-N 1 1 307.438 3.612 20 5 DHBDMO COc1ccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000525787621 333313578 /nfs/dbraw/zinc/31/35/78/333313578.db2.gz FUWIRZNOSSYMKD-BPLDGKMQSA-N 1 1 304.390 3.756 20 5 DHBDMO CC1=C[C@@H](C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000430265067 334042039 /nfs/dbraw/zinc/04/20/39/334042039.db2.gz UGUQMDUBHDPBAI-GFCCVEGCSA-N 1 1 313.357 3.648 20 5 DHBDMO C[C@]12CC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C[C@H]1C2(F)F ZINC000298416960 334248591 /nfs/dbraw/zinc/24/85/91/334248591.db2.gz XJOCWBFVLSEPMJ-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@]12CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C[C@H]1C2(F)F ZINC000298416960 334248592 /nfs/dbraw/zinc/24/85/92/334248592.db2.gz XJOCWBFVLSEPMJ-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000388773367 334269992 /nfs/dbraw/zinc/26/99/92/334269992.db2.gz GFWUWAVVRHWXPO-KOLCDFICSA-N 1 1 317.311 3.508 20 5 DHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534841851 334339448 /nfs/dbraw/zinc/33/94/48/334339448.db2.gz GAINNTTUHMWVAK-DOMZBBRYSA-N 1 1 315.373 3.870 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cscn1)CCCC2 ZINC000417344159 334705999 /nfs/dbraw/zinc/70/59/99/334705999.db2.gz RWXNSUKUNMFTFY-HNNXBMFYSA-N 1 1 303.387 3.609 20 5 DHBDMO COCC[C@H]1CCCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000332338741 336169052 /nfs/dbraw/zinc/16/90/52/336169052.db2.gz QMVVWIOVHSQNFN-LSDHHAIUSA-N 1 1 306.406 3.794 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC2(CC2)C1 ZINC000352264034 336208432 /nfs/dbraw/zinc/20/84/32/336208432.db2.gz AOSHSVCWZOSDSH-UHFFFAOYSA-N 1 1 304.390 3.758 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC2(CC2)C1 ZINC000352264034 336208433 /nfs/dbraw/zinc/20/84/33/336208433.db2.gz AOSHSVCWZOSDSH-UHFFFAOYSA-N 1 1 304.390 3.758 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)cs1 ZINC000352332139 336212856 /nfs/dbraw/zinc/21/28/56/336212856.db2.gz SRAUMTZDZPCRHR-OAHLLOKOSA-N 1 1 318.398 3.700 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)cs1 ZINC000352332139 336212857 /nfs/dbraw/zinc/21/28/57/336212857.db2.gz SRAUMTZDZPCRHR-OAHLLOKOSA-N 1 1 318.398 3.700 20 5 DHBDMO CC1(C)CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)CCS1 ZINC000352408019 336216608 /nfs/dbraw/zinc/21/66/08/336216608.db2.gz SZAKFJHKKKKKLZ-UHFFFAOYSA-N 1 1 316.373 3.591 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)CCS1 ZINC000352408019 336216609 /nfs/dbraw/zinc/21/66/09/336216609.db2.gz SZAKFJHKKKKKLZ-UHFFFAOYSA-N 1 1 316.373 3.591 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000103471349 336240968 /nfs/dbraw/zinc/24/09/68/336240968.db2.gz DJSXPVPCIMUJLE-CQSZACIVSA-N 1 1 300.333 3.723 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)[NH+]1CCC(C)CC1 ZINC000532492294 336250439 /nfs/dbraw/zinc/25/04/39/336250439.db2.gz LSMXOJFWMVQYSV-HOTGVXAUSA-N 1 1 319.449 3.674 20 5 DHBDMO C[C@@H]1C[C@@H](C)[NH+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000526989544 336278720 /nfs/dbraw/zinc/27/87/20/336278720.db2.gz OTDRKQDEJPVAMT-GHMZBOCLSA-N 1 1 303.387 3.701 20 5 DHBDMO Cc1cc(N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000302058278 336346116 /nfs/dbraw/zinc/34/61/16/336346116.db2.gz RMHVQGVPKOCZMR-HUUCEWRRSA-N 1 1 317.433 3.968 20 5 DHBDMO CSc1cccc(F)c1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000352914494 336376825 /nfs/dbraw/zinc/37/68/25/336376825.db2.gz LXAIBVULWJUEBS-UHFFFAOYSA-N 1 1 306.362 3.746 20 5 DHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2CCCC2)cc1OC ZINC000359590255 336679328 /nfs/dbraw/zinc/67/93/28/336679328.db2.gz SLRTVJNQBQGGMC-CYBMUJFWSA-N 1 1 322.405 3.624 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H]4CCC[C@@H]43)co2)cc1 ZINC000426473122 338033178 /nfs/dbraw/zinc/03/31/78/338033178.db2.gz QNAQDRQHPIIIJQ-LRDDRELGSA-N 1 1 313.357 3.624 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429137312 338071521 /nfs/dbraw/zinc/07/15/21/338071521.db2.gz SANBMMFFUGSSTJ-UONOGXRCSA-N 1 1 312.369 3.939 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429137312 338071522 /nfs/dbraw/zinc/07/15/22/338071522.db2.gz SANBMMFFUGSSTJ-UONOGXRCSA-N 1 1 312.369 3.939 20 5 DHBDMO CCN(CC)C[C@@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433163669 338183508 /nfs/dbraw/zinc/18/35/08/338183508.db2.gz CBTQTUBXLNLGCO-DYVFJYSZSA-N 1 1 319.449 3.637 20 5 DHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000435066932 338231585 /nfs/dbraw/zinc/23/15/85/338231585.db2.gz XDWMOAKVIZGHPO-ZDUSSCGKSA-N 1 1 317.389 3.994 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+]2C2CCCCC2)n1 ZINC000435583693 338242812 /nfs/dbraw/zinc/24/28/12/338242812.db2.gz HRGKAHGPFIVCAO-OAHLLOKOSA-N 1 1 318.421 3.507 20 5 DHBDMO Cc1ccnc(NC[C@@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000435593641 338243099 /nfs/dbraw/zinc/24/30/99/338243099.db2.gz RZYHRHTXYOUUBI-HNNXBMFYSA-N 1 1 318.421 3.507 20 5 DHBDMO C[C@@H](C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)cc1 ZINC000438121196 338333486 /nfs/dbraw/zinc/33/34/86/338333486.db2.gz YAJCAHXARNPGKI-ZDUSSCGKSA-N 1 1 314.360 3.896 20 5 DHBDMO COc1cc(C[N@H+]2CCCCC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000438353673 338340819 /nfs/dbraw/zinc/34/08/19/338340819.db2.gz KITADUUFEGGLMX-UHFFFAOYSA-N 1 1 322.405 3.624 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000463493449 339119570 /nfs/dbraw/zinc/11/95/70/339119570.db2.gz LJJWIVSKZOWCLO-AAEUAGOBSA-N 1 1 310.369 3.753 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000463493453 339119586 /nfs/dbraw/zinc/11/95/86/339119586.db2.gz LJJWIVSKZOWCLO-WCQYABFASA-N 1 1 310.369 3.753 20 5 DHBDMO C[C@H](NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467836860 339247309 /nfs/dbraw/zinc/24/73/09/339247309.db2.gz TUCXCLVKMDNFII-XHSDSOJGSA-N 1 1 319.449 3.613 20 5 DHBDMO COCC[C@H]1CCCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000468692170 339268828 /nfs/dbraw/zinc/26/88/28/339268828.db2.gz ZZEZSZSFDZWVFN-YXMGTMDOSA-N 1 1 318.417 3.747 20 5 DHBDMO CCOC[C@H]1CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470174962 339312785 /nfs/dbraw/zinc/31/27/85/339312785.db2.gz OIAINSPEFDPKPC-OBHPCNEJSA-N 1 1 318.417 3.747 20 5 DHBDMO COC[C@H]1CCCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000470209062 339314251 /nfs/dbraw/zinc/31/42/51/339314251.db2.gz XDWUXCRIXQEFPE-MJSCBBHESA-N 1 1 318.417 3.747 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000471029993 339335022 /nfs/dbraw/zinc/33/50/22/339335022.db2.gz JBYLSIUDVLGBTB-SCLBCKFNSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000471029993 339335023 /nfs/dbraw/zinc/33/50/23/339335023.db2.gz JBYLSIUDVLGBTB-SCLBCKFNSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc(C[NH2+][C@@H](C)c2cccc(F)c2F)ccc1[N+](=O)[O-] ZINC000492878001 339911380 /nfs/dbraw/zinc/91/13/80/339911380.db2.gz OWLLIZUIVXZBAW-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1N(C)C ZINC000506727325 340200193 /nfs/dbraw/zinc/20/01/93/340200193.db2.gz BBXGEYULVYPTES-AWEZNQCLSA-N 1 1 313.401 3.854 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506994103 340204921 /nfs/dbraw/zinc/20/49/21/340204921.db2.gz CGSPSXKDQYKJNC-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc2c(c1)CCO2)C1CC1 ZINC000507170142 340210988 /nfs/dbraw/zinc/21/09/88/340210988.db2.gz ZJJBYIFOPJITIC-UHFFFAOYSA-N 1 1 324.380 3.694 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc2c(c1)CCO2)C1CC1 ZINC000507170142 340210989 /nfs/dbraw/zinc/21/09/89/340210989.db2.gz ZJJBYIFOPJITIC-UHFFFAOYSA-N 1 1 324.380 3.694 20 5 DHBDMO Cc1ccccc1[C@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000507181022 340211503 /nfs/dbraw/zinc/21/15/03/340211503.db2.gz MXGYNLUCTDSEQE-KRWDZBQOSA-N 1 1 310.397 3.935 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2cc(F)ccc2C1 ZINC000509418811 340268863 /nfs/dbraw/zinc/26/88/63/340268863.db2.gz SSJXTBVYJHORPI-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2cc(F)ccc2C1 ZINC000509418811 340268864 /nfs/dbraw/zinc/26/88/64/340268864.db2.gz SSJXTBVYJHORPI-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO COC[C@H](C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000510434725 340299220 /nfs/dbraw/zinc/29/92/20/340299220.db2.gz GBCQNVBJIXBXJF-LBPRGKRZSA-N 1 1 320.414 3.790 20 5 DHBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511081492 340320275 /nfs/dbraw/zinc/32/02/75/340320275.db2.gz NPPJFICVILRWRU-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(F)c1F ZINC000511124024 340321507 /nfs/dbraw/zinc/32/15/07/340321507.db2.gz KDTZHVYTICYOCH-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCCC(F)(F)C1 ZINC000511145639 340322313 /nfs/dbraw/zinc/32/23/13/340322313.db2.gz WNUIITSIWDQOKV-ZDUSSCGKSA-N 1 1 312.360 3.895 20 5 DHBDMO C[C@H](N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173453376 340365381 /nfs/dbraw/zinc/36/53/81/340365381.db2.gz UIWWGICLQYDETC-YOEHRIQHSA-N 1 1 317.433 3.510 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCN(CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173453376 340365382 /nfs/dbraw/zinc/36/53/82/340365382.db2.gz UIWWGICLQYDETC-YOEHRIQHSA-N 1 1 317.433 3.510 20 5 DHBDMO CCOc1ccccc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000543629241 341051919 /nfs/dbraw/zinc/05/19/19/341051919.db2.gz KLBSTSWQHWOOIZ-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO CCOc1ccccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000543629241 341051920 /nfs/dbraw/zinc/05/19/20/341051920.db2.gz KLBSTSWQHWOOIZ-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000544608139 341088612 /nfs/dbraw/zinc/08/86/12/341088612.db2.gz LAAMMXFHYDXIBO-LRDDRELGSA-N 1 1 300.358 3.909 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1COc2ccc(F)cc21 ZINC000546649189 341177200 /nfs/dbraw/zinc/17/72/00/341177200.db2.gz MLMNJYXIZHDAAR-BZNIZROVSA-N 1 1 316.332 3.827 20 5 DHBDMO COc1cccc([C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549172130 341287924 /nfs/dbraw/zinc/28/79/24/341287924.db2.gz RJBPRYONHXADCN-CQSZACIVSA-N 1 1 314.385 3.839 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCC(F)(F)C2)C2CC2)cc1 ZINC000551094321 341331464 /nfs/dbraw/zinc/33/14/64/341331464.db2.gz XYOGIUQVWDMZQC-ZDUSSCGKSA-N 1 1 310.344 3.995 20 5 DHBDMO COCCc1cc[nH+]c(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000552317561 341386009 /nfs/dbraw/zinc/38/60/09/341386009.db2.gz CVLJWNBSMUSOQX-CYBMUJFWSA-N 1 1 315.373 3.660 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000552922939 341408758 /nfs/dbraw/zinc/40/87/58/341408758.db2.gz ATUICLHXZSJWAV-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO CC(C)c1nc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cs1 ZINC000338348859 519861839 /nfs/dbraw/zinc/86/18/39/519861839.db2.gz MEHPYPWXVZYXES-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO CC(C)c1nc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cs1 ZINC000338348859 519861841 /nfs/dbraw/zinc/86/18/41/519861841.db2.gz MEHPYPWXVZYXES-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO COC[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(C)o1 ZINC000156444841 522370039 /nfs/dbraw/zinc/37/00/39/522370039.db2.gz PBGKTDJGJQTBNZ-XJKSGUPXSA-N 1 1 318.373 3.843 20 5 DHBDMO COc1ccccc1C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000267021400 524365386 /nfs/dbraw/zinc/36/53/86/524365386.db2.gz REKGXGMWEQJQKI-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nccn2C(C)C)cc1[N+](=O)[O-] ZINC000181823852 525737528 /nfs/dbraw/zinc/73/75/28/525737528.db2.gz PZCJMWJNHXEGME-CYBMUJFWSA-N 1 1 302.378 3.531 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1ccncc1F ZINC000338016706 526089881 /nfs/dbraw/zinc/08/98/81/526089881.db2.gz VFHKNDCWOSBNKO-NWDGAFQWSA-N 1 1 303.337 3.849 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000266563107 526107101 /nfs/dbraw/zinc/10/71/01/526107101.db2.gz YMXGZKTYIDCWTF-QWRGUYRKSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000266563107 526107105 /nfs/dbraw/zinc/10/71/05/526107105.db2.gz YMXGZKTYIDCWTF-QWRGUYRKSA-N 1 1 302.296 3.930 20 5 DHBDMO Cc1csc([C@@H]2CCC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)n1 ZINC000156959692 526420887 /nfs/dbraw/zinc/42/08/87/526420887.db2.gz FRVSOZYMGUMJQW-GFCCVEGCSA-N 1 1 323.443 3.801 20 5 DHBDMO Cc1csc([C@@H]2CCC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)n1 ZINC000156959692 526420894 /nfs/dbraw/zinc/42/08/94/526420894.db2.gz FRVSOZYMGUMJQW-GFCCVEGCSA-N 1 1 323.443 3.801 20 5 DHBDMO CCC[N@H+](CC)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000725263853 563570175 /nfs/dbraw/zinc/57/01/75/563570175.db2.gz RCYCCNAJUPBMQB-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO CCC[N@@H+](CC)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000725263853 563570177 /nfs/dbraw/zinc/57/01/77/563570177.db2.gz RCYCCNAJUPBMQB-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(Cl)cc1 ZINC000140067313 1013184128 /nfs/dbraw/zinc/18/41/28/1013184128.db2.gz KXGLICKVIISXAY-UHFFFAOYSA-N 1 1 304.777 3.923 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)c1ccccc1 ZINC000015372026 1013517381 /nfs/dbraw/zinc/51/73/81/1013517381.db2.gz XBKLULBOOYBKAA-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)c1ccccc1 ZINC000015372026 1013517390 /nfs/dbraw/zinc/51/73/90/1013517390.db2.gz XBKLULBOOYBKAA-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCCC1 ZINC000052873692 1013640103 /nfs/dbraw/zinc/64/01/03/1013640103.db2.gz UNHPTMVTFGSGLL-UHFFFAOYSA-N 1 1 320.389 3.616 20 5 DHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)C(C)C ZINC000118833252 1013708966 /nfs/dbraw/zinc/70/89/66/1013708966.db2.gz MXQAPOMDPXKKRM-CQSZACIVSA-N 1 1 321.421 3.598 20 5 DHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083168463 1013781920 /nfs/dbraw/zinc/78/19/20/1013781920.db2.gz WHRIBPWQLLWVLB-RYUDHWBXSA-N 1 1 303.362 3.747 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1C1CC1 ZINC000609195607 1013850036 /nfs/dbraw/zinc/85/00/36/1013850036.db2.gz RZFHFKTWGCHWFM-INIZCTEOSA-N 1 1 304.390 3.756 20 5 DHBDMO Cc1ccc([C@H](C)NCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000319920785 1014278799 /nfs/dbraw/zinc/27/87/99/1014278799.db2.gz BQSAQRMLLZGHBV-HOTGVXAUSA-N 1 1 319.449 3.818 20 5 DHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000025942600 1014465218 /nfs/dbraw/zinc/46/52/18/1014465218.db2.gz NOOFFUZQHJEROU-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCc3sccc3C2)c(F)c1 ZINC000610476375 1014539449 /nfs/dbraw/zinc/53/94/49/1014539449.db2.gz CDBYXTPPSMPMCN-UHFFFAOYSA-N 1 1 306.362 3.744 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCc3sccc3C2)c(F)c1 ZINC000610476375 1014539466 /nfs/dbraw/zinc/53/94/66/1014539466.db2.gz CDBYXTPPSMPMCN-UHFFFAOYSA-N 1 1 306.362 3.744 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895585929 1015213564 /nfs/dbraw/zinc/21/35/64/1015213564.db2.gz ZVWWJOBIELDJAY-CYBMUJFWSA-N 1 1 317.414 3.658 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000051180654 1015255124 /nfs/dbraw/zinc/25/51/24/1015255124.db2.gz ILDUWGZKNMYVID-MRXNPFEDSA-N 1 1 312.369 3.811 20 5 DHBDMO Cc1c([C@H]2CCC[N@@H+]2[C@H](C)c2cccc([N+](=O)[O-])c2)cnn1C ZINC000367336645 1015419290 /nfs/dbraw/zinc/41/92/90/1015419290.db2.gz WKFCDNREJGLJBM-SJKOYZFVSA-N 1 1 314.389 3.535 20 5 DHBDMO COc1c(O)ccc(C[N@H+](C)[C@@H](C)c2cccs2)c1[N+](=O)[O-] ZINC000891639904 1015475902 /nfs/dbraw/zinc/47/59/02/1015475902.db2.gz JUBAZBCAZDMWRU-JTQLQIEISA-N 1 1 322.386 3.564 20 5 DHBDMO COc1c(O)ccc(C[N@@H+](C)[C@@H](C)c2cccs2)c1[N+](=O)[O-] ZINC000891639904 1015475906 /nfs/dbraw/zinc/47/59/06/1015475906.db2.gz JUBAZBCAZDMWRU-JTQLQIEISA-N 1 1 322.386 3.564 20 5 DHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581547 1015627340 /nfs/dbraw/zinc/62/73/40/1015627340.db2.gz SAZDPSXXUYQCOX-GFCCVEGCSA-N 1 1 303.362 3.747 20 5 DHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580877 1015629312 /nfs/dbraw/zinc/62/93/12/1015629312.db2.gz SGITVHRMFHEWHL-GFCCVEGCSA-N 1 1 311.341 3.929 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3C3CCC3)nc2c1 ZINC000610581334 1015629753 /nfs/dbraw/zinc/62/97/53/1015629753.db2.gz AOAOEWZVJDKQPT-CQSZACIVSA-N 1 1 301.346 3.501 20 5 DHBDMO CSc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000247827812 1016064296 /nfs/dbraw/zinc/06/42/96/1016064296.db2.gz JZIBCAJZHRSKRO-UHFFFAOYSA-N 1 1 302.399 3.949 20 5 DHBDMO CSc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000247827812 1016064303 /nfs/dbraw/zinc/06/43/03/1016064303.db2.gz JZIBCAJZHRSKRO-UHFFFAOYSA-N 1 1 302.399 3.949 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3ccncc3)C2)ccc1Cl ZINC000846908853 1032144148 /nfs/dbraw/zinc/14/41/48/1032144148.db2.gz WTTCGMXLSWSTNJ-AWEZNQCLSA-N 1 1 317.776 3.633 20 5 DHBDMO Cc1c(C[N@@H+](C)CCCOc2ccccc2)cccc1[N+](=O)[O-] ZINC000071950589 1016269268 /nfs/dbraw/zinc/26/92/68/1016269268.db2.gz XRAXVOWZKXDKOY-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCC[C@@H](C)C1 ZINC000071954211 1016278298 /nfs/dbraw/zinc/27/82/98/1016278298.db2.gz WASVFEWCECDWBE-NEPJUHHUSA-N 1 1 311.813 3.781 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCSC[C@@H]1C1CC1 ZINC000451646458 1016544731 /nfs/dbraw/zinc/54/47/31/1016544731.db2.gz FNZAEAXEZXLFMC-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCSC[C@@H]1C1CC1 ZINC000451646458 1016544758 /nfs/dbraw/zinc/54/47/58/1016544758.db2.gz FNZAEAXEZXLFMC-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000051650474 1016694879 /nfs/dbraw/zinc/69/48/79/1016694879.db2.gz BCJVNCXYNFBALQ-MRXNPFEDSA-N 1 1 312.369 3.593 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1cccc(O)c1 ZINC000537606526 1032216749 /nfs/dbraw/zinc/21/67/49/1032216749.db2.gz OXXNGRIUFCDKDQ-ZDUSSCGKSA-N 1 1 300.358 3.802 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H]1CC[C@@H](C2CC2)O1)C1CC1 ZINC001168317351 1032230084 /nfs/dbraw/zinc/23/00/84/1032230084.db2.gz MYQKTLKZCWNHFW-WMZOPIPTSA-N 1 1 316.401 3.517 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H]1CC[C@@H](C2CC2)O1)C1CC1 ZINC001168317351 1032230098 /nfs/dbraw/zinc/23/00/98/1032230098.db2.gz MYQKTLKZCWNHFW-WMZOPIPTSA-N 1 1 316.401 3.517 20 5 DHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H]1CC[C@H](C)C1 ZINC000362160754 1032254513 /nfs/dbraw/zinc/25/45/13/1032254513.db2.gz YMLDXURRYRPCIQ-BBRMVZONSA-N 1 1 306.406 3.540 20 5 DHBDMO Cc1ncc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000773041976 1032537148 /nfs/dbraw/zinc/53/71/48/1032537148.db2.gz UWZLDKHSQUOWDW-MRVPVSSYSA-N 1 1 311.794 3.864 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)CCc2nccs2)cc1[N+](=O)[O-] ZINC000093843939 1032561077 /nfs/dbraw/zinc/56/10/77/1032561077.db2.gz SPGZRXRXYLXVMV-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO CC(C)c1ccc(CNC[C@H]2CC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000577634697 1012062267 /nfs/dbraw/zinc/06/22/67/1012062267.db2.gz VBWXJISNIJBNIJ-MRXNPFEDSA-N 1 1 319.449 3.538 20 5 DHBDMO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000537659804 1032617689 /nfs/dbraw/zinc/61/76/89/1032617689.db2.gz MOFRBMHJCCJNMQ-QGZVFWFLSA-N 1 1 313.401 3.969 20 5 DHBDMO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000537659804 1032617697 /nfs/dbraw/zinc/61/76/97/1032617697.db2.gz MOFRBMHJCCJNMQ-QGZVFWFLSA-N 1 1 313.401 3.969 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1cccs1 ZINC000430200977 1012329302 /nfs/dbraw/zinc/32/93/02/1012329302.db2.gz IPBYUJKRIJPWCA-NSHDSACASA-N 1 1 306.387 3.858 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1cccs1 ZINC000430200977 1012329319 /nfs/dbraw/zinc/32/93/19/1012329319.db2.gz IPBYUJKRIJPWCA-NSHDSACASA-N 1 1 306.387 3.858 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000610214985 1012423073 /nfs/dbraw/zinc/42/30/73/1012423073.db2.gz GXEVZIVCHWFJOQ-OAHLLOKOSA-N 1 1 314.360 3.799 20 5 DHBDMO CC1CCC([N@@H+](Cc2cc([O-])ccc2[N+](=O)[O-])C2CC2)CC1 ZINC001167071379 1012453279 /nfs/dbraw/zinc/45/32/79/1012453279.db2.gz LIKLQUVFHBCRLC-UHFFFAOYSA-N 1 1 304.390 3.844 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000515379582 1012615030 /nfs/dbraw/zinc/61/50/30/1012615030.db2.gz HJQOIASGPZGEKD-HIFRSBDPSA-N 1 1 324.808 3.639 20 5 DHBDMO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000165296188 1013038458 /nfs/dbraw/zinc/03/84/58/1013038458.db2.gz UFANZTXFAYBVDH-BLLLJJGKSA-N 1 1 318.373 3.789 20 5 DHBDMO CC[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000125801741 1032720281 /nfs/dbraw/zinc/72/02/81/1032720281.db2.gz SAXOTCJPMIEJDW-ZDUSSCGKSA-N 1 1 315.373 3.524 20 5 DHBDMO COc1cccc([C@@H](C)[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088605518 1017780979 /nfs/dbraw/zinc/78/09/79/1017780979.db2.gz PCLWXBOOEWAIND-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc([C@@H](C)[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088605518 1017780999 /nfs/dbraw/zinc/78/09/99/1017780999.db2.gz PCLWXBOOEWAIND-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000052039476 1017933061 /nfs/dbraw/zinc/93/30/61/1017933061.db2.gz WAPLKTPNTKFTTK-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO COc1ccccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000052183241 1018186244 /nfs/dbraw/zinc/18/62/44/1018186244.db2.gz DCCBHOMRTMDMIX-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO COc1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000052183241 1018186249 /nfs/dbraw/zinc/18/62/49/1018186249.db2.gz DCCBHOMRTMDMIX-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000446724412 1018229032 /nfs/dbraw/zinc/22/90/32/1018229032.db2.gz ZYJOZWNTQXFJNV-SFHVURJKSA-N 1 1 314.360 3.898 20 5 DHBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000447068312 1018322017 /nfs/dbraw/zinc/32/20/17/1018322017.db2.gz OIRNWJRHMBVTTN-INIZCTEOSA-N 1 1 310.369 3.515 20 5 DHBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000447384594 1018382965 /nfs/dbraw/zinc/38/29/65/1018382965.db2.gz MTVKUALTZMREIY-INIZCTEOSA-N 1 1 310.369 3.515 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764884233 1018416785 /nfs/dbraw/zinc/41/67/85/1018416785.db2.gz YLYWZQJJVBJQAI-OCCSQVGLSA-N 1 1 316.405 3.721 20 5 DHBDMO CC[N@@H+](Cn1nc(C)c2cc([N+](=O)[O-])ccc21)[C@H](C)C(C)C ZINC000764927075 1018429264 /nfs/dbraw/zinc/42/92/64/1018429264.db2.gz XAUVHWURUGDKJI-CYBMUJFWSA-N 1 1 304.394 3.577 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c1 ZINC000526007966 1018429772 /nfs/dbraw/zinc/42/97/72/1018429772.db2.gz MYCOZEKCRKHVNC-OAHLLOKOSA-N 1 1 300.333 3.723 20 5 DHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC000246310879 1018448733 /nfs/dbraw/zinc/44/87/33/1018448733.db2.gz QSYQACRTTJGJDV-GJZGRUSLSA-N 1 1 318.398 3.527 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)c1cnc(C)s1 ZINC000601299931 1019198878 /nfs/dbraw/zinc/19/88/78/1019198878.db2.gz RLVRTFBIZYUKDQ-NXEZZACHSA-N 1 1 321.402 3.780 20 5 DHBDMO Cc1[nH+]ccn1CCCCSCc1ccc([N+](=O)[O-])cc1 ZINC000158819992 1019242392 /nfs/dbraw/zinc/24/23/92/1019242392.db2.gz FUAACQKMSBMJGK-UHFFFAOYSA-N 1 1 305.403 3.813 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCOc2ccccc2C1 ZINC000611262836 1019424886 /nfs/dbraw/zinc/42/48/86/1019424886.db2.gz MOVOKDFSABWOKW-VMPITWQZSA-N 1 1 310.353 3.503 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCOc2ccccc2C1 ZINC000611262836 1019424887 /nfs/dbraw/zinc/42/48/87/1019424887.db2.gz MOVOKDFSABWOKW-VMPITWQZSA-N 1 1 310.353 3.503 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)CCOC(C)(C)C)cc1[N+](=O)[O-] ZINC000611274761 1019430434 /nfs/dbraw/zinc/43/04/34/1019430434.db2.gz XBXQONBAVJEMCB-UHFFFAOYSA-N 1 1 308.422 3.965 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000611350314 1019450641 /nfs/dbraw/zinc/45/06/41/1019450641.db2.gz ICCQPDDBOPEGOT-HZPDHXFCSA-N 1 1 318.417 3.542 20 5 DHBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000611555043 1019518388 /nfs/dbraw/zinc/51/83/88/1019518388.db2.gz KJEPFHNUOFOWTF-DGCLKSJQSA-N 1 1 316.323 3.800 20 5 DHBDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000611554551 1019520633 /nfs/dbraw/zinc/52/06/33/1019520633.db2.gz UWXURUAAAXVQAR-JQWIXIFHSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000611554551 1019520642 /nfs/dbraw/zinc/52/06/42/1019520642.db2.gz UWXURUAAAXVQAR-JQWIXIFHSA-N 1 1 302.296 3.758 20 5 DHBDMO CCCn1c2ccccc2nc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000080145805 1019829593 /nfs/dbraw/zinc/82/95/93/1019829593.db2.gz IPDVCKUUSLNZAF-UHFFFAOYSA-N 1 1 324.384 3.644 20 5 DHBDMO Cc1ccncc1[C@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000611939304 1019906557 /nfs/dbraw/zinc/90/65/57/1019906557.db2.gz HRGZPTMMODSVTF-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO COc1cccc(Cl)c1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000318159358 1020029092 /nfs/dbraw/zinc/02/90/92/1020029092.db2.gz JEVSYBUDLUDSTG-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000534331858 1020033937 /nfs/dbraw/zinc/03/39/37/1020033937.db2.gz AZGVTRZSXPUFEC-GNJLHFKMSA-N 1 1 309.369 3.840 20 5 DHBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2cccc(O)c2)cc1[N+](=O)[O-] ZINC000093315550 1020147527 /nfs/dbraw/zinc/14/75/27/1020147527.db2.gz CJVGCFNVSYNNAX-CYBMUJFWSA-N 1 1 300.358 3.802 20 5 DHBDMO CC(C)c1ccc(CN(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000093644435 1020164797 /nfs/dbraw/zinc/16/47/97/1020164797.db2.gz RCEWKEZYHNIZFD-GDBMZVCRSA-N 1 1 319.449 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@H+](C)[C@@H]2CCN(C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000093644435 1020164803 /nfs/dbraw/zinc/16/48/03/1020164803.db2.gz RCEWKEZYHNIZFD-GDBMZVCRSA-N 1 1 319.449 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)[C@@H]2CCN(C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000093644435 1020164810 /nfs/dbraw/zinc/16/48/10/1020164810.db2.gz RCEWKEZYHNIZFD-GDBMZVCRSA-N 1 1 319.449 3.633 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000155077690 1020187525 /nfs/dbraw/zinc/18/75/25/1020187525.db2.gz SYHLQFOIDYNBGW-KRWDZBQOSA-N 1 1 311.385 3.671 20 5 DHBDMO COc1ccccc1/C=C/C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000179315907 1020250684 /nfs/dbraw/zinc/25/06/84/1020250684.db2.gz IGUUJJXNKZZQSO-JXMROGBWSA-N 1 1 312.369 3.749 20 5 DHBDMO COc1ccccc1/C=C/C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000179315907 1020250697 /nfs/dbraw/zinc/25/06/97/1020250697.db2.gz IGUUJJXNKZZQSO-JXMROGBWSA-N 1 1 312.369 3.749 20 5 DHBDMO CC[C@@H](C)[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000179322590 1020251495 /nfs/dbraw/zinc/25/14/95/1020251495.db2.gz DHHFQIOPUBKELL-LLVKDONJSA-N 1 1 305.403 3.949 20 5 DHBDMO C[N@H+]1CCC[C@@H](CNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000553387658 1020285650 /nfs/dbraw/zinc/28/56/50/1020285650.db2.gz HGVWPWQBYYKFEF-VIFPVBQESA-N 1 1 318.204 3.655 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC(C)(C)[C@@H]2CCC[C@@H]21 ZINC000555720956 1020368144 /nfs/dbraw/zinc/36/81/44/1020368144.db2.gz BLMYKAZIUQMOAA-CABCVRRESA-N 1 1 304.390 3.614 20 5 DHBDMO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000179676063 1020432249 /nfs/dbraw/zinc/43/22/49/1020432249.db2.gz QANDXBBDVHVCBX-NSHDSACASA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000179676063 1020432253 /nfs/dbraw/zinc/43/22/53/1020432253.db2.gz QANDXBBDVHVCBX-NSHDSACASA-N 1 1 305.765 3.836 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000303498786 1020493243 /nfs/dbraw/zinc/49/32/43/1020493243.db2.gz XXIOMAARIXKLIY-HNNXBMFYSA-N 1 1 324.446 3.711 20 5 DHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000738052958 1020859108 /nfs/dbraw/zinc/85/91/08/1020859108.db2.gz FZALQAWPUPFYBG-XJKSGUPXSA-N 1 1 316.405 3.803 20 5 DHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000738052050 1020860147 /nfs/dbraw/zinc/86/01/47/1020860147.db2.gz BWTUXHQVBYZTPL-XJKSGUPXSA-N 1 1 316.405 3.803 20 5 DHBDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000120127899 1021044061 /nfs/dbraw/zinc/04/40/61/1021044061.db2.gz KQYJASOECKAQJK-MRXNPFEDSA-N 1 1 312.369 3.593 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccns2)cc1[N+](=O)[O-] ZINC000858578677 1032955477 /nfs/dbraw/zinc/95/54/77/1032955477.db2.gz XETNQKAEJUCXGC-QWRGUYRKSA-N 1 1 321.402 3.862 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000176984384 1021192353 /nfs/dbraw/zinc/19/23/53/1021192353.db2.gz JVXINPUIVYJPRS-UHFFFAOYSA-N 1 1 311.341 3.676 20 5 DHBDMO Cc1ccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000176984384 1021192360 /nfs/dbraw/zinc/19/23/60/1021192360.db2.gz JVXINPUIVYJPRS-UHFFFAOYSA-N 1 1 311.341 3.676 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2c2ccsc2)cc1 ZINC000776273853 1021215221 /nfs/dbraw/zinc/21/52/21/1021215221.db2.gz AZCGGTHKQWXVTC-HZPDHXFCSA-N 1 1 318.398 3.527 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2C2CCCCC2)cc1 ZINC000776276463 1021219447 /nfs/dbraw/zinc/21/94/47/1021219447.db2.gz KAIJZDXKITWLEX-ROUUACIJSA-N 1 1 318.417 3.673 20 5 DHBDMO CC[N@H+](Cc1occc1C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000412032522 1021241297 /nfs/dbraw/zinc/24/12/97/1021241297.db2.gz ZCKNUGVDZVYVMI-UHFFFAOYSA-N 1 1 304.346 3.527 20 5 DHBDMO CC[N@@H+](Cc1occc1C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000412032522 1021241309 /nfs/dbraw/zinc/24/13/09/1021241309.db2.gz ZCKNUGVDZVYVMI-UHFFFAOYSA-N 1 1 304.346 3.527 20 5 DHBDMO CC(C)C1C[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000619431173 1021760080 /nfs/dbraw/zinc/76/00/80/1021760080.db2.gz VONLPTIVLBLQKT-UHFFFAOYSA-N 1 1 317.414 3.806 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000556609944 1021794963 /nfs/dbraw/zinc/79/49/63/1021794963.db2.gz WGQUYCFRBSGNBI-FGCJYXMVSA-N 1 1 316.401 3.642 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc2ccccc2n1)c1ccccc1[N+](=O)[O-] ZINC000341256554 1022067871 /nfs/dbraw/zinc/06/78/71/1022067871.db2.gz JEHJFJXWCWONDJ-CYBMUJFWSA-N 1 1 307.353 3.994 20 5 DHBDMO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000290546512 1022070553 /nfs/dbraw/zinc/07/05/53/1022070553.db2.gz CUQXKUDKXGLVQD-NWDGAFQWSA-N 1 1 316.357 3.721 20 5 DHBDMO Cc1nn(C(C)C)cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000341360847 1022103741 /nfs/dbraw/zinc/10/37/41/1022103741.db2.gz CNFZUOPJFAJOLB-UHFFFAOYSA-N 1 1 322.796 3.624 20 5 DHBDMO CCC1CCC([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776593476 1022117965 /nfs/dbraw/zinc/11/79/65/1022117965.db2.gz WUBUDNIUMHNDDR-PUJMQQBBSA-N 1 1 306.406 3.529 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cnn(C2CCCC2)c1 ZINC000337496988 1033032715 /nfs/dbraw/zinc/03/27/15/1033032715.db2.gz YUSRESFZENOYCR-CYBMUJFWSA-N 1 1 314.389 3.757 20 5 DHBDMO CC1(C)CCC[C@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)O1 ZINC001168847666 1022161692 /nfs/dbraw/zinc/16/16/92/1022161692.db2.gz FVFBEODMOOFGQT-QGZVFWFLSA-N 1 1 318.417 3.907 20 5 DHBDMO C[C@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CCc2ccc(Cl)cc21 ZINC001169038871 1022221805 /nfs/dbraw/zinc/22/18/05/1022221805.db2.gz LBVKWXQNSWXWCB-WOSRLPQWSA-N 1 1 322.836 3.747 20 5 DHBDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169036173 1022221838 /nfs/dbraw/zinc/22/18/38/1022221838.db2.gz FPELEXPEHUVXPF-OCCSQVGLSA-N 1 1 316.323 3.583 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCC[C@@H](Cc3ccc(F)cc3)C2)C1 ZINC001169039252 1022222600 /nfs/dbraw/zinc/22/26/00/1022222600.db2.gz OPOQLNQEQRNXCK-BQFCYCMXSA-N 1 1 320.408 3.526 20 5 DHBDMO CCCC[N@@H+](CC)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104667110 1022222797 /nfs/dbraw/zinc/22/27/97/1022222797.db2.gz NZCKVGIIUKJVRT-UHFFFAOYSA-N 1 1 317.389 3.914 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC001169025499 1022228807 /nfs/dbraw/zinc/22/88/07/1022228807.db2.gz JQUTUPUUFOVXSQ-DVOMOZLQSA-N 1 1 308.809 3.922 20 5 DHBDMO CCCc1[nH+]ccn1Cc1cccc([N+](=O)[O-])c1Br ZINC000233396908 1022329308 /nfs/dbraw/zinc/32/93/08/1022329308.db2.gz JFBRRIGVMFIYNJ-UHFFFAOYSA-N 1 1 324.178 3.555 20 5 DHBDMO COc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000609704778 1022335572 /nfs/dbraw/zinc/33/55/72/1022335572.db2.gz KFKRPRUSLYYGRE-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000609704778 1022335587 /nfs/dbraw/zinc/33/55/87/1022335587.db2.gz KFKRPRUSLYYGRE-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO Cc1ccc(C)c(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000801551505 1022839449 /nfs/dbraw/zinc/83/94/49/1022839449.db2.gz MKZYTDAHPZUYQN-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO O=[N+]([O-])c1cccc(Br)c1C[NH+]1CCCCCC1 ZINC000768139472 1022903458 /nfs/dbraw/zinc/90/34/58/1022903458.db2.gz PPFPQJWXZITMQW-UHFFFAOYSA-N 1 1 313.195 3.733 20 5 DHBDMO CC[N@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C(C)C ZINC000876560195 1033092403 /nfs/dbraw/zinc/09/24/03/1033092403.db2.gz FLRXZUGHFIMNRR-UHFFFAOYSA-N 1 1 307.213 3.649 20 5 DHBDMO CC[N@@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C(C)C ZINC000876560195 1033092413 /nfs/dbraw/zinc/09/24/13/1033092413.db2.gz FLRXZUGHFIMNRR-UHFFFAOYSA-N 1 1 307.213 3.649 20 5 DHBDMO CC[N@@H+](CC(=O)N(C)C)Cc1c2ccccc2cc2ccccc21 ZINC000768307110 1022944563 /nfs/dbraw/zinc/94/45/63/1022944563.db2.gz GSNOIOYUXJMCRS-UHFFFAOYSA-N 1 1 320.436 3.903 20 5 DHBDMO C[C@@H](C1CC1)[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768420899 1022970664 /nfs/dbraw/zinc/97/06/64/1022970664.db2.gz IUNZUCJMXRQBEZ-VIFPVBQESA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@@H](C1CC1)[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768420899 1022970675 /nfs/dbraw/zinc/97/06/75/1022970675.db2.gz IUNZUCJMXRQBEZ-VIFPVBQESA-N 1 1 313.195 3.588 20 5 DHBDMO CC[C@H](C)C[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768772548 1023025324 /nfs/dbraw/zinc/02/53/24/1023025324.db2.gz ZRURZPLFBSMLKS-JTQLQIEISA-N 1 1 315.211 3.835 20 5 DHBDMO CC[C@H](C)C[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768772548 1023025336 /nfs/dbraw/zinc/02/53/36/1023025336.db2.gz ZRURZPLFBSMLKS-JTQLQIEISA-N 1 1 315.211 3.835 20 5 DHBDMO C[N@@H+](CCc1cccs1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000093268074 1023591413 /nfs/dbraw/zinc/59/14/13/1023591413.db2.gz FAZGWZMTPHJMQL-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO COc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000746655132 1023766741 /nfs/dbraw/zinc/76/67/41/1023766741.db2.gz UDRLLIQBZBAWCJ-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000746655132 1023766746 /nfs/dbraw/zinc/76/67/46/1023766746.db2.gz UDRLLIQBZBAWCJ-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO CC(C)[C@H]1C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CCS1 ZINC000746675985 1023784557 /nfs/dbraw/zinc/78/45/57/1023784557.db2.gz WSWXXAAMHYIWIK-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@H]1C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CCS1 ZINC000746675985 1023784561 /nfs/dbraw/zinc/78/45/61/1023784561.db2.gz WSWXXAAMHYIWIK-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO Cc1cnc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)s1 ZINC000788023909 1023839386 /nfs/dbraw/zinc/83/93/86/1023839386.db2.gz NKPGWVXXGYIHDI-CQSZACIVSA-N 1 1 321.377 3.740 20 5 DHBDMO CC[C@H](C)[N@@H+](C)CCNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000314051076 1023845731 /nfs/dbraw/zinc/84/57/31/1023845731.db2.gz BPDVGWHMYRWHAE-JTQLQIEISA-N 1 1 301.337 3.675 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)cc1F ZINC000788468101 1023888828 /nfs/dbraw/zinc/88/88/28/1023888828.db2.gz DPCUOBNXFNDZFW-MRXNPFEDSA-N 1 1 314.360 3.941 20 5 DHBDMO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cn1 ZINC000266767094 1024043835 /nfs/dbraw/zinc/04/38/35/1024043835.db2.gz IKOFYDZSJXCUGS-STQMWFEESA-N 1 1 302.378 3.784 20 5 DHBDMO CCc1[nH+]ccn1[C@@H]1CCCN(c2cc(C)ccc2[N+](=O)[O-])C1 ZINC000268053071 1024060938 /nfs/dbraw/zinc/06/09/38/1024060938.db2.gz UOWQQDFZNQDAGL-CQSZACIVSA-N 1 1 314.389 3.504 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2cccnc2Cl)cc1[N+](=O)[O-] ZINC000268804730 1024166192 /nfs/dbraw/zinc/16/61/92/1024166192.db2.gz HDJNTCSZPXBOSY-JTQLQIEISA-N 1 1 321.764 3.503 20 5 DHBDMO CC[C@H]([NH2+]Cc1cn2ccc(C)cc2n1)c1cccc([N+](=O)[O-])c1 ZINC000268956046 1024204768 /nfs/dbraw/zinc/20/47/68/1024204768.db2.gz YSIVDZDSGWYUSQ-KRWDZBQOSA-N 1 1 324.384 3.792 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCOC3(C2)CCCCCC3)c1 ZINC000531661529 1024262107 /nfs/dbraw/zinc/26/21/07/1024262107.db2.gz VYIZQVLQFDAPET-UHFFFAOYSA-N 1 1 304.390 3.520 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCOC3(C2)CCCCCC3)c1 ZINC000531661529 1024262112 /nfs/dbraw/zinc/26/21/12/1024262112.db2.gz VYIZQVLQFDAPET-UHFFFAOYSA-N 1 1 304.390 3.520 20 5 DHBDMO COc1ccc(C2CC2)cc1C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000883258498 1024330061 /nfs/dbraw/zinc/33/00/61/1024330061.db2.gz DRYFFGGNTMLNEN-UHFFFAOYSA-N 1 1 318.398 3.832 20 5 DHBDMO COc1cc(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])ccc1O ZINC000270704663 1024422285 /nfs/dbraw/zinc/42/22/85/1024422285.db2.gz GKOGTWGAJXLKFI-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])ccc1O ZINC000270704663 1024422291 /nfs/dbraw/zinc/42/22/91/1024422291.db2.gz GKOGTWGAJXLKFI-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO Cc1ncsc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000271067809 1024453235 /nfs/dbraw/zinc/45/32/35/1024453235.db2.gz KCAXKVNURCXBEM-UHFFFAOYSA-N 1 1 303.387 3.524 20 5 DHBDMO Cc1ncsc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000271067809 1024453241 /nfs/dbraw/zinc/45/32/41/1024453241.db2.gz KCAXKVNURCXBEM-UHFFFAOYSA-N 1 1 303.387 3.524 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000569047159 1024466614 /nfs/dbraw/zinc/46/66/14/1024466614.db2.gz RRTLXFQEGNMFHR-CYBMUJFWSA-N 1 1 316.405 3.675 20 5 DHBDMO CCC[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000453353454 1024478973 /nfs/dbraw/zinc/47/89/73/1024478973.db2.gz HXTGUJQWPTWRLS-ZWKOTPCHSA-N 1 1 318.417 3.939 20 5 DHBDMO CC[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000453367962 1024491599 /nfs/dbraw/zinc/49/15/99/1024491599.db2.gz MOZJWUTUGVYFCW-SJORKVTESA-N 1 1 304.390 3.548 20 5 DHBDMO Cc1ncc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(C)n1 ZINC000271432388 1024503996 /nfs/dbraw/zinc/50/39/96/1024503996.db2.gz CEUARXLQZIYTRD-VIFPVBQESA-N 1 1 320.780 3.506 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCC[N@H+]1CCCC[C@@H]1C ZINC000532188089 1024570887 /nfs/dbraw/zinc/57/08/87/1024570887.db2.gz AKRCRWMPHOMCKJ-HOTGVXAUSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](CC(C)C)[NH+](C)C ZINC000532202577 1024575189 /nfs/dbraw/zinc/57/51/89/1024575189.db2.gz XHFZFRTXRXKGFH-GDBMZVCRSA-N 1 1 307.438 3.530 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC23CCCCC3)c([N+](=O)[O-])c1 ZINC001170334353 1024746374 /nfs/dbraw/zinc/74/63/74/1024746374.db2.gz CLAWGVRYVTUTPB-CQSZACIVSA-N 1 1 318.417 3.943 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H]3CCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC001170334434 1024746695 /nfs/dbraw/zinc/74/66/95/1024746695.db2.gz DSLFKUGPLGOYSP-DZKIICNBSA-N 1 1 318.417 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC23CCCCC3)c([N+](=O)[O-])c1 ZINC001170334352 1024747236 /nfs/dbraw/zinc/74/72/36/1024747236.db2.gz CLAWGVRYVTUTPB-AWEZNQCLSA-N 1 1 318.417 3.943 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+]C2(c3nccs3)CCCC2)c1 ZINC000116374190 1024858203 /nfs/dbraw/zinc/85/82/03/1024858203.db2.gz YVJRYHLLOOQPMX-UHFFFAOYSA-N 1 1 303.387 3.610 20 5 DHBDMO C[C@]1(C(N)=O)CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000793388746 1025032746 /nfs/dbraw/zinc/03/27/46/1025032746.db2.gz FWCADIKGMUMRHI-NRFANRHFSA-N 1 1 318.420 3.690 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000539058733 1033258793 /nfs/dbraw/zinc/25/87/93/1033258793.db2.gz TVCGUAGANZZOBB-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO Cc1cn2cc(Nc3ccc([N+](=O)[O-])c4cnccc34)ccc2[nH+]1 ZINC000354093375 1025348778 /nfs/dbraw/zinc/34/87/78/1025348778.db2.gz YUCIGEJOWXTGES-UHFFFAOYSA-N 1 1 319.324 3.843 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000886020646 1025443376 /nfs/dbraw/zinc/44/33/76/1025443376.db2.gz FIIZWAPMVLHYGW-RHSMWYFYSA-N 1 1 311.385 3.615 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(c2cccc(F)c2)CC1 ZINC000886032632 1025445567 /nfs/dbraw/zinc/44/55/67/1025445567.db2.gz KFCMFPHRFDIZNK-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO CC[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000886125402 1025519649 /nfs/dbraw/zinc/51/96/49/1025519649.db2.gz QMNQYQKPHNVRIL-JTQLQIEISA-N 1 1 311.794 3.946 20 5 DHBDMO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886236499 1025567110 /nfs/dbraw/zinc/56/71/10/1025567110.db2.gz JIIZNPGEJIMEPC-MRXNPFEDSA-N 1 1 315.348 3.774 20 5 DHBDMO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886236499 1025567121 /nfs/dbraw/zinc/56/71/21/1025567121.db2.gz JIIZNPGEJIMEPC-MRXNPFEDSA-N 1 1 315.348 3.774 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCOc3ccccc32)c(Cl)c1 ZINC000237813683 1025788258 /nfs/dbraw/zinc/78/82/58/1025788258.db2.gz SOBSOVWKCNPTGO-HNNXBMFYSA-N 1 1 318.760 3.862 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCc2sccc2C1 ZINC000124275141 1026316792 /nfs/dbraw/zinc/31/67/92/1026316792.db2.gz GOIOWNANWCBTEN-HWKANZROSA-N 1 1 300.383 3.728 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCc2sccc2C1 ZINC000124275141 1026316808 /nfs/dbraw/zinc/31/68/08/1026316808.db2.gz GOIOWNANWCBTEN-HWKANZROSA-N 1 1 300.383 3.728 20 5 DHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513490096 1026520571 /nfs/dbraw/zinc/52/05/71/1026520571.db2.gz LZXCMSDPIUCHOL-AWEZNQCLSA-N 1 1 314.385 3.666 20 5 DHBDMO COCC1([N@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809967676 1026646570 /nfs/dbraw/zinc/64/65/70/1026646570.db2.gz GMHVVFFANYFSMN-UHFFFAOYSA-N 1 1 319.188 3.512 20 5 DHBDMO COCC1([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809967676 1026646577 /nfs/dbraw/zinc/64/65/77/1026646577.db2.gz GMHVVFFANYFSMN-UHFFFAOYSA-N 1 1 319.188 3.512 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000072599967 1026781207 /nfs/dbraw/zinc/78/12/07/1026781207.db2.gz GNEIPZHGBJTYTN-HOCLYGCPSA-N 1 1 311.385 3.842 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420941913 1026896994 /nfs/dbraw/zinc/89/69/94/1026896994.db2.gz GFPHBYXHFCSAKG-SNVBAGLBSA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420941913 1026897003 /nfs/dbraw/zinc/89/70/03/1026897003.db2.gz GFPHBYXHFCSAKG-SNVBAGLBSA-N 1 1 320.286 3.898 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)c1cccs1 ZINC000016434730 1027005065 /nfs/dbraw/zinc/00/50/65/1027005065.db2.gz XMTUHEPLXGKGBS-NSHDSACASA-N 1 1 306.387 3.858 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)c1cccs1 ZINC000016434730 1027005076 /nfs/dbraw/zinc/00/50/76/1027005076.db2.gz XMTUHEPLXGKGBS-NSHDSACASA-N 1 1 306.387 3.858 20 5 DHBDMO Cc1c(C[NH2+]Cc2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000231885423 1027140038 /nfs/dbraw/zinc/14/00/38/1027140038.db2.gz BHDRCMBUUMJRLV-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cc(C3CC3)ccc2F)cs1 ZINC000295202730 1027141724 /nfs/dbraw/zinc/14/17/24/1027141724.db2.gz YWPUWXFIOBMIBI-UHFFFAOYSA-N 1 1 306.362 3.963 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000362385006 1027175985 /nfs/dbraw/zinc/17/59/85/1027175985.db2.gz QBJWFJJNCJYKLM-DZGCQCFKSA-N 1 1 324.446 3.709 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)c1 ZINC000932207074 1027414233 /nfs/dbraw/zinc/41/42/33/1027414233.db2.gz QVFHZZHKGNTHNZ-AWEZNQCLSA-N 1 1 317.414 3.506 20 5 DHBDMO CCc1ccccc1[C@@H](N)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423499717 1027565242 /nfs/dbraw/zinc/56/52/42/1027565242.db2.gz JLHJVPFZOBZUNB-ACJLOTCBSA-N 1 1 313.401 3.508 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000576201028 1027582755 /nfs/dbraw/zinc/58/27/55/1027582755.db2.gz HYEKKYWOHNIUGJ-CYBMUJFWSA-N 1 1 316.405 3.675 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000778949882 1027633961 /nfs/dbraw/zinc/63/39/61/1027633961.db2.gz DFQFQJNWURGQOX-GHMZBOCLSA-N 1 1 302.296 3.848 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000576805950 1027663365 /nfs/dbraw/zinc/66/33/65/1027663365.db2.gz WNFJIWBVGOZDFW-VHSXEESVSA-N 1 1 302.296 3.844 20 5 DHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000023004780 1027765765 /nfs/dbraw/zinc/76/57/65/1027765765.db2.gz IEBBABXYRSAXNB-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO C[C@]12CC[N@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C[C@H]1C2(F)F ZINC000814170302 1027925606 /nfs/dbraw/zinc/92/56/06/1027925606.db2.gz UVTRGVRYILFFGB-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@]12CC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C[C@H]1C2(F)F ZINC000814170302 1027925625 /nfs/dbraw/zinc/92/56/25/1027925625.db2.gz UVTRGVRYILFFGB-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC4(CC4(F)F)CC3)c2c1 ZINC000601183826 1028015708 /nfs/dbraw/zinc/01/57/08/1028015708.db2.gz FRKBDLUADIPLEP-UHFFFAOYSA-N 1 1 319.311 3.769 20 5 DHBDMO C[C@H]1CC(F)(F)CCN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000601204080 1028024581 /nfs/dbraw/zinc/02/45/81/1028024581.db2.gz ZGAAPLDFDLREPM-JTQLQIEISA-N 1 1 307.300 3.767 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000601310457 1028075318 /nfs/dbraw/zinc/07/53/18/1028075318.db2.gz OZKALVRIOZRRIN-ZDUSSCGKSA-N 1 1 324.384 3.641 20 5 DHBDMO Cc1cnccc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000578953671 1028284640 /nfs/dbraw/zinc/28/46/40/1028284640.db2.gz OINYDNXQNFDNEX-QGZVFWFLSA-N 1 1 311.385 3.678 20 5 DHBDMO COc1cccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000009902463 1028525352 /nfs/dbraw/zinc/52/53/52/1028525352.db2.gz ZMALESNVUFBESL-GOSISDBHSA-N 1 1 312.369 3.941 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000565860961 1028644579 /nfs/dbraw/zinc/64/45/79/1028644579.db2.gz IJPXJAOXQHCCQJ-LJQANCHMSA-N 1 1 324.380 3.565 20 5 DHBDMO C[C@@H]1C[C@@H](C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449498902 1028714684 /nfs/dbraw/zinc/71/46/84/1028714684.db2.gz LKGWUYYGIUIHBI-HLLBOEOZSA-N 1 1 318.417 3.589 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3cccnc3)C2)c(Cl)c1 ZINC000570088385 1029311015 /nfs/dbraw/zinc/31/10/15/1029311015.db2.gz FLMLGWOGQQZFAQ-ZDUSSCGKSA-N 1 1 317.776 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)cc1[N+](=O)[O-] ZINC000129987370 1029719037 /nfs/dbraw/zinc/71/90/37/1029719037.db2.gz HHWVTDWRFZFMFB-HNNXBMFYSA-N 1 1 318.417 3.719 20 5 DHBDMO CCC[N@H+]1CC[C@H](CNc2cc(Cl)c(F)cc2[N+](=O)[O-])C1 ZINC000820633205 1029749065 /nfs/dbraw/zinc/74/90/65/1029749065.db2.gz ABJRXGVBARNZGC-SNVBAGLBSA-N 1 1 315.776 3.531 20 5 DHBDMO CC(C)[N@@H+]1CCCC[C@H]1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451101744 1029795573 /nfs/dbraw/zinc/79/55/73/1029795573.db2.gz FVAFFHPQAIBSCP-YOEHRIQHSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)[N@H+]1CCCC[C@H]1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451101744 1029795579 /nfs/dbraw/zinc/79/55/79/1029795579.db2.gz FVAFFHPQAIBSCP-YOEHRIQHSA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1cccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451548795 1029911760 /nfs/dbraw/zinc/91/17/60/1029911760.db2.gz OLHXVDVICNBMIW-INIZCTEOSA-N 1 1 311.385 3.678 20 5 DHBDMO C[C@H](c1cccnc1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451547179 1029912704 /nfs/dbraw/zinc/91/27/04/1029912704.db2.gz KMHICDFBWBYUJH-RHSMWYFYSA-N 1 1 311.385 3.930 20 5 DHBDMO C[C@@H](NCC(C)(C)[N@H+]1CCC[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467839113 1029975297 /nfs/dbraw/zinc/97/52/97/1029975297.db2.gz MXKNJYRWWLRGKE-LSDHHAIUSA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@@H]([NH2+]CC(C)(C)N1CCC[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467839113 1029975313 /nfs/dbraw/zinc/97/53/13/1029975313.db2.gz MXKNJYRWWLRGKE-LSDHHAIUSA-N 1 1 319.449 3.756 20 5 DHBDMO CCn1nc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c2ccccc21 ZINC000865787461 1030025700 /nfs/dbraw/zinc/02/57/00/1030025700.db2.gz NJUNSSOPLWFEKG-UHFFFAOYSA-N 1 1 324.384 3.563 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451966816 1030074157 /nfs/dbraw/zinc/07/41/57/1030074157.db2.gz POUKIVDFJDMIJO-XJKSGUPXSA-N 1 1 306.431 3.875 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCCc3ncccc32)c1 ZINC000866305072 1030213691 /nfs/dbraw/zinc/21/36/91/1030213691.db2.gz NCHTVTUIJVQMCX-MRXNPFEDSA-N 1 1 317.776 3.810 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000866581961 1030387709 /nfs/dbraw/zinc/38/77/09/1030387709.db2.gz FSVRMSWERXEPSO-IHRRRGAJSA-N 1 1 306.431 3.649 20 5 DHBDMO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805839043 1030395346 /nfs/dbraw/zinc/39/53/46/1030395346.db2.gz NGTCJWRPZMQRKN-FRFSOERESA-N 1 1 320.433 3.775 20 5 DHBDMO CC[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc(OC)n1 ZINC000925693134 1030455559 /nfs/dbraw/zinc/45/55/59/1030455559.db2.gz OOWLJBFNTCKOJI-GXTWGEPZSA-N 1 1 315.373 3.800 20 5 DHBDMO Cc1nn(C(C)C)cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291664795 1030589761 /nfs/dbraw/zinc/58/97/61/1030589761.db2.gz FOWGQSFTBIZEAP-UHFFFAOYSA-N 1 1 316.405 3.706 20 5 DHBDMO CCOc1ccccc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558735330 1030758294 /nfs/dbraw/zinc/75/82/94/1030758294.db2.gz LVUCVHQEDVVQFQ-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO CC[C@@H](NCC(C)(C)[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000359369841 1030933191 /nfs/dbraw/zinc/93/31/91/1030933191.db2.gz LHAFVNKUROZSCK-QGZVFWFLSA-N 1 1 319.449 3.900 20 5 DHBDMO CC[C@@H](C)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000122991036 1030937291 /nfs/dbraw/zinc/93/72/91/1030937291.db2.gz JKJQMXTXUCHYKX-SECBINFHSA-N 1 1 301.184 3.588 20 5 DHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2CCCC2)cc1OC ZINC000359590260 1031051136 /nfs/dbraw/zinc/05/11/36/1031051136.db2.gz SLRTVJNQBQGGMC-ZDUSSCGKSA-N 1 1 322.405 3.624 20 5 DHBDMO CCc1onc(C)c1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000927143463 1031116741 /nfs/dbraw/zinc/11/67/41/1031116741.db2.gz ZQDKKCZPRLNTHO-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844434521 1031138752 /nfs/dbraw/zinc/13/87/52/1031138752.db2.gz ADMFSCKEVWJIRG-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844434521 1031138755 /nfs/dbraw/zinc/13/87/55/1031138755.db2.gz ADMFSCKEVWJIRG-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844440170 1031142719 /nfs/dbraw/zinc/14/27/19/1031142719.db2.gz QXTGTXOJVWDMJH-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844440170 1031142726 /nfs/dbraw/zinc/14/27/26/1031142726.db2.gz QXTGTXOJVWDMJH-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO COc1ccnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000925495190 1031275680 /nfs/dbraw/zinc/27/56/80/1031275680.db2.gz MHAPNYMPRIGEDJ-QWHCGFSZSA-N 1 1 315.373 3.719 20 5 DHBDMO CC(C)(NCc1cccc([O-])c1Cl)c1ccccc1[N+](=O)[O-] ZINC000293083690 1031317719 /nfs/dbraw/zinc/31/77/19/1031317719.db2.gz WMIHKZHKMLMLSD-UHFFFAOYSA-N 1 1 320.776 3.979 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1C[C@@H]1c1ccccc1)CC2 ZINC000536677282 1031385628 /nfs/dbraw/zinc/38/56/28/1031385628.db2.gz IKIBCHOMUBJWHX-PKOBYXMFSA-N 1 1 308.381 3.757 20 5 DHBDMO CCOc1cccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872024199 1031407548 /nfs/dbraw/zinc/40/75/48/1031407548.db2.gz YMKHIQOKULJCTP-GFCCVEGCSA-N 1 1 318.348 3.983 20 5 DHBDMO Cc1c(C[NH2+][C@H](C)c2cccc(O)c2F)cccc1[N+](=O)[O-] ZINC000872067222 1031463260 /nfs/dbraw/zinc/46/32/60/1031463260.db2.gz VTBQVZQKNFFCOU-LLVKDONJSA-N 1 1 304.321 3.599 20 5 DHBDMO COCc1csc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872085432 1031481095 /nfs/dbraw/zinc/48/10/95/1031481095.db2.gz NJHYNMOKKWTUJK-SNVBAGLBSA-N 1 1 324.377 3.793 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000872260148 1031565658 /nfs/dbraw/zinc/56/56/58/1031565658.db2.gz JJTMQFUQFCBHEN-QGZVFWFLSA-N 1 1 318.417 3.827 20 5 DHBDMO CC[C@H](CSC)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000124328068 1031685785 /nfs/dbraw/zinc/68/57/85/1031685785.db2.gz WCCGJGJBUJUTGZ-LLVKDONJSA-N 1 1 302.827 3.822 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)cc1Cl ZINC000846104655 1031874667 /nfs/dbraw/zinc/87/46/67/1031874667.db2.gz JRQZLYAVSZRKGT-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)cc1Cl ZINC000846104655 1031874676 /nfs/dbraw/zinc/87/46/76/1031874676.db2.gz JRQZLYAVSZRKGT-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H]1CC[C@@H](C)C1 ZINC000361639570 1032027818 /nfs/dbraw/zinc/02/78/18/1032027818.db2.gz PIDQTGAZIPKYDX-CZUORRHYSA-N 1 1 306.406 3.540 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294542494 1032054348 /nfs/dbraw/zinc/05/43/48/1032054348.db2.gz AKXVODXPDHUNTK-UWVGGRQHSA-N 1 1 321.327 3.867 20 5 DHBDMO C[C@]1(F)CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C[C@H]1F ZINC001172905816 1033438012 /nfs/dbraw/zinc/43/80/12/1033438012.db2.gz UUHYVNNSNZLTPG-UAGQMJEPSA-N 1 1 324.371 3.614 20 5 DHBDMO C[C@]1(CF)CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172906703 1033438142 /nfs/dbraw/zinc/43/81/42/1033438142.db2.gz YAYJPEFNKBWDMG-NVXWUHKLSA-N 1 1 306.381 3.524 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCCC(F)(F)CC1)CC2 ZINC001172907699 1033440057 /nfs/dbraw/zinc/44/00/57/1033440057.db2.gz HQSYPYZTDKKNEK-OAHLLOKOSA-N 1 1 324.371 3.963 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+](CC1CC1)C1CC1)CC2 ZINC001172913945 1033462495 /nfs/dbraw/zinc/46/24/95/1033462495.db2.gz WIUJJGBDNZILAJ-MRXNPFEDSA-N 1 1 300.402 3.717 20 5 DHBDMO C[N@@H+](C[C@@H]1CC1(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172919235 1033466208 /nfs/dbraw/zinc/46/62/08/1033466208.db2.gz FJXYRRBBRXOCFG-JKSUJKDBSA-N 1 1 302.418 3.820 20 5 DHBDMO C[C@H]1C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C2(CC2)C1 ZINC001172918753 1033466423 /nfs/dbraw/zinc/46/64/23/1033466423.db2.gz CGCMWBQZKUWBKF-CJNGLKHVSA-N 1 1 300.402 3.717 20 5 DHBDMO C[C@@H]1C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C2(CC2)C1 ZINC001172918752 1033467320 /nfs/dbraw/zinc/46/73/20/1033467320.db2.gz CGCMWBQZKUWBKF-BBRMVZONSA-N 1 1 300.402 3.717 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2F)cc1[N+](=O)[O-] ZINC000152569040 1033528417 /nfs/dbraw/zinc/52/84/17/1033528417.db2.gz DEKUPBTXHVGLTM-GFCCVEGCSA-N 1 1 318.348 3.983 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC23CCCC3)c1F ZINC001173183011 1033585173 /nfs/dbraw/zinc/58/51/73/1033585173.db2.gz VPSYYGLQDONURR-LBPRGKRZSA-N 1 1 322.380 3.692 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)CC2CCCC2)c1F ZINC001173195931 1033587643 /nfs/dbraw/zinc/58/76/43/1033587643.db2.gz KDHSCSSIUBPEMY-GFCCVEGCSA-N 1 1 324.396 3.796 20 5 DHBDMO CC[C@H]1CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173197364 1033590546 /nfs/dbraw/zinc/59/05/46/1033590546.db2.gz UNLUWAYDNLZKMY-OLZOCXBDSA-N 1 1 324.396 3.796 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](F)C(F)(F)CC1 ZINC001173224249 1033602271 /nfs/dbraw/zinc/60/22/71/1033602271.db2.gz DDMOHYXSQJCQOK-FZMZJTMJSA-N 1 1 316.323 3.595 20 5 DHBDMO Cc1cccc2c1CC[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173230410 1033606077 /nfs/dbraw/zinc/60/60/77/1033606077.db2.gz XXJZBFWGCWHQLH-HNNXBMFYSA-N 1 1 310.397 3.893 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCc2ccccc2C1 ZINC001173226816 1033606113 /nfs/dbraw/zinc/60/61/13/1033606113.db2.gz LQWOXPBKSWVTPW-OAHLLOKOSA-N 1 1 310.397 3.974 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1nccs1 ZINC001173233979 1033609051 /nfs/dbraw/zinc/60/90/51/1033609051.db2.gz NLKLRRSGGCZPCX-IUODEOHRSA-N 1 1 317.414 3.819 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccccc1F ZINC001173232665 1033609112 /nfs/dbraw/zinc/60/91/12/1033609112.db2.gz SEKRMFMHRYHEOM-CQSZACIVSA-N 1 1 316.376 3.839 20 5 DHBDMO CCC(CC)[N@@H+](CC)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878623409 1033774244 /nfs/dbraw/zinc/77/42/44/1033774244.db2.gz MVRGYCBDWVKSGX-UHFFFAOYSA-N 1 1 318.377 3.655 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)nc1Cl ZINC000878659527 1033786521 /nfs/dbraw/zinc/78/65/21/1033786521.db2.gz DJKOMTBKDPEHIB-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC2(CCOCC2)C1 ZINC000266041293 1033906614 /nfs/dbraw/zinc/90/66/14/1033906614.db2.gz VYCLQCGVLDEYIU-CQSZACIVSA-N 1 1 304.390 3.548 20 5 DHBDMO Cc1ncc([C@H](C)[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])s1 ZINC000879251033 1033965302 /nfs/dbraw/zinc/96/53/02/1033965302.db2.gz BRMLVDWUFXABAS-QMMMGPOBSA-N 1 1 311.794 3.864 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880313431 1034291157 /nfs/dbraw/zinc/29/11/57/1034291157.db2.gz AOTWRBKIPQUURG-WCQYABFASA-N 1 1 303.387 3.602 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CCCCO3)CC2)c(Cl)c1 ZINC000880458390 1034335858 /nfs/dbraw/zinc/33/58/58/1034335858.db2.gz QKRJTGZFDMOCJH-UHFFFAOYSA-N 1 1 324.808 3.783 20 5 DHBDMO CC[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1C)c1nccs1 ZINC000183481033 1034389629 /nfs/dbraw/zinc/38/96/29/1034389629.db2.gz OSYORYXWXNCERA-HNNXBMFYSA-N 1 1 305.403 3.775 20 5 DHBDMO C[C@@H](CN1CCCCCC1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000480699959 1034412046 /nfs/dbraw/zinc/41/20/46/1034412046.db2.gz QEMKHQOXWYIYNX-GJZGRUSLSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1cc([C@@H]2CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)no1 ZINC000865432878 1034643907 /nfs/dbraw/zinc/64/39/07/1034643907.db2.gz UTJJQGXSRMLBNH-KRWDZBQOSA-N 1 1 324.340 3.781 20 5 DHBDMO CCOc1cc(F)cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000865521140 1034688457 /nfs/dbraw/zinc/68/84/57/1034688457.db2.gz LSYVYRDCVXQAOO-GFCCVEGCSA-N 1 1 318.348 3.983 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000600189670 1034797326 /nfs/dbraw/zinc/79/73/26/1034797326.db2.gz LWLWAPRZANXMAK-SUXDSQMHSA-N 1 1 304.415 3.578 20 5 DHBDMO Cc1c([C@@H](C)NCC[N@@H+](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000481408872 1034820728 /nfs/dbraw/zinc/82/07/28/1034820728.db2.gz VIWSLCMCWMVAJE-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]CCN(C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000481408872 1034820741 /nfs/dbraw/zinc/82/07/41/1034820741.db2.gz VIWSLCMCWMVAJE-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000481756592 1034962008 /nfs/dbraw/zinc/96/20/08/1034962008.db2.gz OIFYGEQFAFZSBW-GWCFXTLKSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000481756592 1034962015 /nfs/dbraw/zinc/96/20/15/1034962015.db2.gz OIFYGEQFAFZSBW-GWCFXTLKSA-N 1 1 302.296 3.758 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCCCCC2)ccc1Br ZINC000159412889 1035048619 /nfs/dbraw/zinc/04/86/19/1035048619.db2.gz NYBONLGXLIIKAC-UHFFFAOYSA-N 1 1 313.195 3.733 20 5 DHBDMO Cc1c([C@@H](C)NCC[N@H+]2[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000482627045 1035149055 /nfs/dbraw/zinc/14/90/55/1035149055.db2.gz GRGBGVUPQOVPRP-IJEWVQPXSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1c([C@@H](C)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000482627045 1035149058 /nfs/dbraw/zinc/14/90/58/1035149058.db2.gz GRGBGVUPQOVPRP-IJEWVQPXSA-N 1 1 319.449 3.817 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCSCC[C@@H]1C ZINC000483424817 1035268144 /nfs/dbraw/zinc/26/81/44/1035268144.db2.gz GEYUGRNJRNYPMM-ZVHGMHCTSA-N 1 1 306.431 3.826 20 5 DHBDMO CC[C@@H](CSC)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000773707369 1035391398 /nfs/dbraw/zinc/39/13/98/1035391398.db2.gz NYNFYGCXMDFTRS-LBPRGKRZSA-N 1 1 302.827 3.822 20 5 DHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@H]1C ZINC001193413513 1035632279 /nfs/dbraw/zinc/63/22/79/1035632279.db2.gz OBXDTOQRCIHZPM-PBHICJAKSA-N 1 1 306.406 3.874 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494704450 1035772099 /nfs/dbraw/zinc/77/20/99/1035772099.db2.gz SEGYXWUZEQTRMZ-RHSMWYFYSA-N 1 1 318.417 3.855 20 5 DHBDMO Cn1c(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc2ccccc21 ZINC001181154906 1035853260 /nfs/dbraw/zinc/85/32/60/1035853260.db2.gz WQQORDITKOEFRE-UHFFFAOYSA-N 1 1 323.396 3.761 20 5 DHBDMO CCCC[N@@H+](CC)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000914567231 1036117999 /nfs/dbraw/zinc/11/79/99/1036117999.db2.gz KNTOMTWYBDGTQX-UHFFFAOYSA-N 1 1 309.391 3.951 20 5 DHBDMO Cc1c(C[N@H+]2C[C@@H](C)OC3(CCCCC3)C2)cccc1[N+](=O)[O-] ZINC001195650010 1036308996 /nfs/dbraw/zinc/30/89/96/1036308996.db2.gz MFKAHLLSUOKZTA-CQSZACIVSA-N 1 1 318.417 3.827 20 5 DHBDMO Cc1c(C[N@@H+]2C[C@@H](C)OC3(CCCCC3)C2)cccc1[N+](=O)[O-] ZINC001195650010 1036309014 /nfs/dbraw/zinc/30/90/14/1036309014.db2.gz MFKAHLLSUOKZTA-CQSZACIVSA-N 1 1 318.417 3.827 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2cccc(F)c2[N+](=O)[O-])C1 ZINC000774520038 1036394188 /nfs/dbraw/zinc/39/41/88/1036394188.db2.gz YGHDFOMULAJOAR-MJBXVCDLSA-N 1 1 321.396 3.576 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCOc1ccc(F)cc1 ZINC000541773867 1036428458 /nfs/dbraw/zinc/42/84/58/1036428458.db2.gz DHODOVRYEFDBCQ-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+](C2CC2)C2CCCC2)cc1 ZINC000609144545 1036502964 /nfs/dbraw/zinc/50/29/64/1036502964.db2.gz JFQWKUDIAAWXBL-UHFFFAOYSA-N 1 1 304.390 3.771 20 5 DHBDMO CC[N@@H+](CC(C)C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636713 1036600918 /nfs/dbraw/zinc/60/09/18/1036600918.db2.gz XLUZTKFGLSOLEB-UHFFFAOYSA-N 1 1 310.785 3.533 20 5 DHBDMO C[N@@H+](CCCc1cccnc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000929863182 1036669314 /nfs/dbraw/zinc/66/93/14/1036669314.db2.gz IBWMSJPLECUTPT-UHFFFAOYSA-N 1 1 319.792 3.708 20 5 DHBDMO CCOc1cc(NC[C@H](C)[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC001184839582 1036962600 /nfs/dbraw/zinc/96/26/00/1036962600.db2.gz MAXXGZVVCRLRAV-KBPBESRZSA-N 1 1 321.421 3.526 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000316898508 1037164155 /nfs/dbraw/zinc/16/41/55/1037164155.db2.gz ZBNBRYCPECSUDZ-KMFMINBZSA-N 1 1 305.422 3.508 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000316898508 1037164160 /nfs/dbraw/zinc/16/41/60/1037164160.db2.gz ZBNBRYCPECSUDZ-KMFMINBZSA-N 1 1 305.422 3.508 20 5 DHBDMO CC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000774903865 1037195134 /nfs/dbraw/zinc/19/51/34/1037195134.db2.gz ALRZYGQEBMYCJX-LBPRGKRZSA-N 1 1 307.350 3.515 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000153741373 1037219337 /nfs/dbraw/zinc/21/93/37/1037219337.db2.gz OGVIVYYEYMFGSL-CABCVRRESA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCN(C2CCCC2)C1 ZINC000153741373 1037219350 /nfs/dbraw/zinc/21/93/50/1037219350.db2.gz OGVIVYYEYMFGSL-CABCVRRESA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1cccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)n1 ZINC000761511071 1037340212 /nfs/dbraw/zinc/34/02/12/1037340212.db2.gz JDAUXMCWFZSWNP-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO Cc1cccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)n1 ZINC000761511071 1037340229 /nfs/dbraw/zinc/34/02/29/1037340229.db2.gz JDAUXMCWFZSWNP-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(F)cc2F)cc1Cl ZINC000761523084 1037342964 /nfs/dbraw/zinc/34/29/64/1037342964.db2.gz RHDJWLBMLUXQJX-UHFFFAOYSA-N 1 1 312.703 3.816 20 5 DHBDMO O=[N+]([O-])c1ccsc1NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001186285578 1037355186 /nfs/dbraw/zinc/35/51/86/1037355186.db2.gz UOCYKTWKERHTDP-CYBMUJFWSA-N 1 1 309.435 3.865 20 5 DHBDMO O=[N+]([O-])c1ccsc1NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001186285579 1037356797 /nfs/dbraw/zinc/35/67/97/1037356797.db2.gz UOCYKTWKERHTDP-ZDUSSCGKSA-N 1 1 309.435 3.865 20 5 DHBDMO COC1CCC([N@@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000493333105 1037405121 /nfs/dbraw/zinc/40/51/21/1037405121.db2.gz FABPDRQVUAWPCU-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(C(F)F)CC1 ZINC000493393456 1037422356 /nfs/dbraw/zinc/42/23/56/1037422356.db2.gz ZCMDNKDFCYDJLS-UHFFFAOYSA-N 1 1 304.724 3.725 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1NC[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001187361129 1037619967 /nfs/dbraw/zinc/61/99/67/1037619967.db2.gz GGQCIOSTDGAGJJ-OAHLLOKOSA-N 1 1 321.396 3.943 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@H](C)CC1 ZINC000494137763 1037652046 /nfs/dbraw/zinc/65/20/46/1037652046.db2.gz UCUFPOTZAXICNN-CYBMUJFWSA-N 1 1 324.446 3.709 20 5 DHBDMO COc1ccc(C[NH2+]Cc2cscc2Cl)cc1[N+](=O)[O-] ZINC000776173656 1037678866 /nfs/dbraw/zinc/67/88/66/1037678866.db2.gz CMGKWBZHBNFQIG-UHFFFAOYSA-N 1 1 312.778 3.608 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916152454 1037705409 /nfs/dbraw/zinc/70/54/09/1037705409.db2.gz RRASUSUCVDBURE-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916152454 1037705424 /nfs/dbraw/zinc/70/54/24/1037705424.db2.gz RRASUSUCVDBURE-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO C[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000917040883 1038124742 /nfs/dbraw/zinc/12/47/42/1038124742.db2.gz WJTHIFYHYLLKPJ-AWEZNQCLSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@@H]1[C@H](Nc2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000588854693 1038386675 /nfs/dbraw/zinc/38/66/75/1038386675.db2.gz AMPDOGPEJFXCEI-TZMCWYRMSA-N 1 1 317.414 3.731 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000588960895 1038412798 /nfs/dbraw/zinc/41/27/98/1038412798.db2.gz NTGFRWDHSIVWFG-DZGCQCFKSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000588960895 1038412804 /nfs/dbraw/zinc/41/28/04/1038412804.db2.gz NTGFRWDHSIVWFG-DZGCQCFKSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCC[C@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000589310114 1038462771 /nfs/dbraw/zinc/46/27/71/1038462771.db2.gz LJLPPATWGAPZDO-ZDUSSCGKSA-N 1 1 321.421 3.742 20 5 DHBDMO CCC1(CC)[C@H]([N@@H+](C)Cc2ccccc2[N+](=O)[O-])C[C@@H]1OC ZINC001191743971 1038540606 /nfs/dbraw/zinc/54/06/06/1038540606.db2.gz XSWAZFNWUIJSAQ-CVEARBPZSA-N 1 1 306.406 3.620 20 5 DHBDMO C[N@H+]1Cc2ccccc2[C@@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000590082311 1038577788 /nfs/dbraw/zinc/57/77/88/1038577788.db2.gz DZEKYDXVBDMKNB-AWEZNQCLSA-N 1 1 317.776 3.847 20 5 DHBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000590082311 1038577793 /nfs/dbraw/zinc/57/77/93/1038577793.db2.gz DZEKYDXVBDMKNB-AWEZNQCLSA-N 1 1 317.776 3.847 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000590601794 1038675669 /nfs/dbraw/zinc/67/56/69/1038675669.db2.gz QMHUTOLJWFFCFN-GJZGRUSLSA-N 1 1 311.385 3.930 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000598676823 1038832894 /nfs/dbraw/zinc/83/28/94/1038832894.db2.gz LNULSZUGIWRANB-MRXNPFEDSA-N 1 1 316.332 3.520 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCCc2scnc21)c1cccc([N+](=O)[O-])c1 ZINC000599023753 1038989551 /nfs/dbraw/zinc/98/95/51/1038989551.db2.gz LGWVYMXYPINZKZ-GXFFZTMASA-N 1 1 303.387 3.780 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593696020 1039085154 /nfs/dbraw/zinc/08/51/54/1039085154.db2.gz ATZGKNJDOWPEGX-XCHKQJEOSA-N 1 1 308.328 3.729 20 5 DHBDMO CC(C)C[C@@H](CNCc1ccc(C(C)C)c([N+](=O)[O-])c1)[NH+](C)C ZINC000603633473 1039095321 /nfs/dbraw/zinc/09/53/21/1039095321.db2.gz NUPUPSYBZYACAO-INIZCTEOSA-N 1 1 321.465 3.784 20 5 DHBDMO CC(C)CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000760921294 1039098729 /nfs/dbraw/zinc/09/87/29/1039098729.db2.gz QYWSYAZCKPLHII-UHFFFAOYSA-N 1 1 317.389 3.994 20 5 DHBDMO CCCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130987 1039124043 /nfs/dbraw/zinc/12/40/43/1039124043.db2.gz NVOSZHOKUCZZHO-WKILWMFISA-N 1 1 306.406 3.500 20 5 DHBDMO COc1ccccc1C1([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000592393105 1039175522 /nfs/dbraw/zinc/17/55/22/1039175522.db2.gz DIJVKQICWXZPAU-ZDUSSCGKSA-N 1 1 312.369 3.943 20 5 DHBDMO Cc1ccc(OCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000603842317 1039178958 /nfs/dbraw/zinc/17/89/58/1039178958.db2.gz RXPIUNOYRMJOHU-UHFFFAOYSA-N 1 1 314.385 3.722 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553334 1039213568 /nfs/dbraw/zinc/21/35/68/1039213568.db2.gz PPLGZHNDBKFBIE-OLZOCXBDSA-N 1 1 312.822 3.718 20 5 DHBDMO CCc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000061760776 1039545999 /nfs/dbraw/zinc/54/59/99/1039545999.db2.gz IGNSAUAGOHOJCD-UHFFFAOYSA-N 1 1 314.385 3.798 20 5 DHBDMO CCc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000061760776 1039546057 /nfs/dbraw/zinc/54/60/57/1039546057.db2.gz IGNSAUAGOHOJCD-UHFFFAOYSA-N 1 1 314.385 3.798 20 5 DHBDMO COc1ccccc1C(C)(C)[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000171672792 1039577960 /nfs/dbraw/zinc/57/79/60/1039577960.db2.gz RZVPIVUZANXOSS-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595285410 1040094176 /nfs/dbraw/zinc/09/41/76/1040094176.db2.gz WTKPDKKBEVBSRL-AWEZNQCLSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595285410 1040094193 /nfs/dbraw/zinc/09/41/93/1040094193.db2.gz WTKPDKKBEVBSRL-AWEZNQCLSA-N 1 1 301.346 3.537 20 5 DHBDMO CCC[N@H+](Cc1onc(C)c1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000595297322 1040096753 /nfs/dbraw/zinc/09/67/53/1040096753.db2.gz RCAKGTNGNDLQNG-HNNXBMFYSA-N 1 1 315.373 3.791 20 5 DHBDMO CCC[N@@H+](Cc1onc(C)c1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000595297322 1040096771 /nfs/dbraw/zinc/09/67/71/1040096771.db2.gz RCAKGTNGNDLQNG-HNNXBMFYSA-N 1 1 315.373 3.791 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595326435 1040100207 /nfs/dbraw/zinc/10/02/07/1040100207.db2.gz KDNWGQLGICJBRS-QMTHXVAHSA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595326435 1040100219 /nfs/dbraw/zinc/10/02/19/1040100219.db2.gz KDNWGQLGICJBRS-QMTHXVAHSA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@H+](Cc2ccccc2)CC(C)(C)C)c1[N+](=O)[O-] ZINC000595303197 1040105131 /nfs/dbraw/zinc/10/51/31/1040105131.db2.gz NEWFGQAGQXVROV-UHFFFAOYSA-N 1 1 317.389 3.940 20 5 DHBDMO Cc1noc(C[N@@H+](Cc2ccccc2)CC(C)(C)C)c1[N+](=O)[O-] ZINC000595303197 1040105137 /nfs/dbraw/zinc/10/51/37/1040105137.db2.gz NEWFGQAGQXVROV-UHFFFAOYSA-N 1 1 317.389 3.940 20 5 DHBDMO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595423551 1040133696 /nfs/dbraw/zinc/13/36/96/1040133696.db2.gz ALENEUNLIVJWDA-NSHDSACASA-N 1 1 303.337 3.542 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](CCF)C1 ZINC000595756838 1040244247 /nfs/dbraw/zinc/24/42/47/1040244247.db2.gz XTAPUBCHJNWAGF-LLVKDONJSA-N 1 1 300.761 3.820 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC([C@@H]2CCCCO2)CC1 ZINC000595787982 1040251442 /nfs/dbraw/zinc/25/14/42/1040251442.db2.gz LNZSSAMBRVGFBT-KRWDZBQOSA-N 1 1 322.380 3.515 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000174350050 1040630291 /nfs/dbraw/zinc/63/02/91/1040630291.db2.gz GIGGLRIVAARAGA-KBPBESRZSA-N 1 1 312.410 3.840 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000597224045 1040702711 /nfs/dbraw/zinc/70/27/11/1040702711.db2.gz CNHXEGLQNZRTQK-AEFFLSMTSA-N 1 1 318.417 3.684 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000597224047 1040704128 /nfs/dbraw/zinc/70/41/28/1040704128.db2.gz CNHXEGLQNZRTQK-SJLPKXTDSA-N 1 1 318.417 3.684 20 5 DHBDMO Cc1ncc([C@@H](C)[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(C)n1 ZINC000602675220 1041142907 /nfs/dbraw/zinc/14/29/07/1041142907.db2.gz ZMPKPMVZBMXDSU-GFCCVEGCSA-N 1 1 314.389 3.588 20 5 DHBDMO COCC1(C2CC2)C[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000602733106 1041188170 /nfs/dbraw/zinc/18/81/70/1041188170.db2.gz UBQMTYRLJFVZQU-UHFFFAOYSA-N 1 1 318.417 3.577 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2cccnc2)C1 ZINC000602857967 1041263315 /nfs/dbraw/zinc/26/33/15/1041263315.db2.gz ZNAXGOMQBLNQQG-YOEHRIQHSA-N 1 1 311.385 3.930 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](OCC(C)C)C1 ZINC000182845566 335003934 /nfs/dbraw/zinc/00/39/34/335003934.db2.gz VVNHUCHFPWARAM-ZBFHGGJFSA-N 1 1 306.406 3.711 20 5 DHBDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000093317016 193229629 /nfs/dbraw/zinc/22/96/29/193229629.db2.gz PZWYHAGZBCAPGU-MRXNPFEDSA-N 1 1 306.406 3.684 20 5 DHBDMO C[C@@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104661270 194023187 /nfs/dbraw/zinc/02/31/87/194023187.db2.gz KMYSCWHONTVEED-CYBMUJFWSA-N 1 1 315.373 3.524 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000281047491 130834411 /nfs/dbraw/zinc/83/44/11/130834411.db2.gz QPMUBEDPWJTLDT-CGTJXYLNSA-N 1 1 318.417 3.500 20 5 DHBDMO COC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000288502548 131327973 /nfs/dbraw/zinc/32/79/73/131327973.db2.gz IEGNMCTVURLXQR-INIZCTEOSA-N 1 1 320.776 3.726 20 5 DHBDMO CCOC1(C)CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000298218809 132051224 /nfs/dbraw/zinc/05/12/24/132051224.db2.gz FPLSQTFOXYBINL-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO CCC(CC)[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000314114297 333087515 /nfs/dbraw/zinc/08/75/15/333087515.db2.gz NYOZKBZHQZXBNZ-DYVFJYSZSA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccnn1-c1ccccc1 ZINC000343462941 335166781 /nfs/dbraw/zinc/16/67/81/335166781.db2.gz BLVGJJAAFKTNKT-CQSZACIVSA-N 1 1 322.368 3.631 20 5 DHBDMO CC(C)c1ccc([C@@H](N)C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000414843140 334113206 /nfs/dbraw/zinc/11/32/06/334113206.db2.gz JLOXYGKLBFACGP-SFHVURJKSA-N 1 1 313.401 3.508 20 5 DHBDMO CC[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000297509407 334242030 /nfs/dbraw/zinc/24/20/30/334242030.db2.gz CKWPXJIRMYRIDV-TUKIKUTGSA-N 1 1 300.362 3.538 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)[N@@H+]1CCC[C@@H](C)C1 ZINC000531937942 334295762 /nfs/dbraw/zinc/29/57/62/334295762.db2.gz ZFLMOJVPHOXSIH-BMFZPTHFSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000531937942 334295763 /nfs/dbraw/zinc/29/57/63/334295763.db2.gz ZFLMOJVPHOXSIH-BMFZPTHFSA-N 1 1 319.449 3.674 20 5 DHBDMO CCC[C@H]([NH2+]Cc1cc(CC)no1)c1cccc([N+](=O)[O-])c1 ZINC000531976925 334347964 /nfs/dbraw/zinc/34/79/64/334347964.db2.gz RJCSIQUFJNATGS-INIZCTEOSA-N 1 1 303.362 3.776 20 5 DHBDMO CCOc1cc(C[N@@H+]2CCCc3occc3C2)ccc1[N+](=O)[O-] ZINC000344290421 335237020 /nfs/dbraw/zinc/23/70/20/335237020.db2.gz NRTYVYABYLRVMQ-UHFFFAOYSA-N 1 1 316.357 3.535 20 5 DHBDMO CCOc1cc(C[N@H+]2CCCc3occc3C2)ccc1[N+](=O)[O-] ZINC000344290421 335237022 /nfs/dbraw/zinc/23/70/22/335237022.db2.gz NRTYVYABYLRVMQ-UHFFFAOYSA-N 1 1 316.357 3.535 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CN(Cc1cccc([O-])c1Cl)CC2 ZINC000351567062 336045037 /nfs/dbraw/zinc/04/50/37/336045037.db2.gz GUDYAMSFBKTGDE-UHFFFAOYSA-N 1 1 318.760 3.512 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000332317057 336167972 /nfs/dbraw/zinc/16/79/72/336167972.db2.gz MWTWDSWNRDVVPW-OLZOCXBDSA-N 1 1 317.414 3.992 20 5 DHBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC000352432037 336218228 /nfs/dbraw/zinc/21/82/28/336218228.db2.gz OISCTEXTLIJNHY-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC000352432037 336218229 /nfs/dbraw/zinc/21/82/29/336218229.db2.gz OISCTEXTLIJNHY-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000352533928 336223115 /nfs/dbraw/zinc/22/31/15/336223115.db2.gz BEQLEUHSDJSFPJ-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCOC2(C1)CCCCCC2 ZINC000532429155 336246843 /nfs/dbraw/zinc/24/68/43/336246843.db2.gz UHQAMACQZWACPQ-UHFFFAOYSA-N 1 1 304.390 3.520 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCOC2(C1)CCCCCC2 ZINC000532429155 336246844 /nfs/dbraw/zinc/24/68/44/336246844.db2.gz UHQAMACQZWACPQ-UHFFFAOYSA-N 1 1 304.390 3.520 20 5 DHBDMO CC[C@H](N[C@@H](C)C[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000192846498 336268508 /nfs/dbraw/zinc/26/85/08/336268508.db2.gz NGKQJCIICVKLCV-YOEHRIQHSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@@H]1C[C@H](C)[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000526989545 336278750 /nfs/dbraw/zinc/27/87/50/336278750.db2.gz OTDRKQDEJPVAMT-PHIMTYICSA-N 1 1 303.387 3.701 20 5 DHBDMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000526989545 336278751 /nfs/dbraw/zinc/27/87/51/336278751.db2.gz OTDRKQDEJPVAMT-PHIMTYICSA-N 1 1 303.387 3.701 20 5 DHBDMO CCC[C@H]([NH2+]C1CCN(C(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000192950573 336285741 /nfs/dbraw/zinc/28/57/41/336285741.db2.gz KOKKACHJHREXPW-SFHVURJKSA-N 1 1 319.449 3.898 20 5 DHBDMO Cc1[nH+]c2cc(Nc3ccc(F)cc3[N+](=O)[O-])ccc2n1C ZINC000301449309 336307484 /nfs/dbraw/zinc/30/74/84/336307484.db2.gz PIQJVCSCOOYHCK-UHFFFAOYSA-N 1 1 300.293 3.673 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3ncccc3c2)c(F)c1 ZINC000355293652 336502971 /nfs/dbraw/zinc/50/29/71/336502971.db2.gz PCOMMKNGKVKKPN-UHFFFAOYSA-N 1 1 311.316 3.572 20 5 DHBDMO CCC[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000361971894 336780594 /nfs/dbraw/zinc/78/05/94/336780594.db2.gz NWTDHFHPPIUYJL-NUJGCVRESA-N 1 1 319.449 3.898 20 5 DHBDMO CC(C)c1[nH+]ccn1[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 ZINC000373086894 336948083 /nfs/dbraw/zinc/94/80/83/336948083.db2.gz GWXLKYAHMLIWKP-MRXNPFEDSA-N 1 1 314.389 3.756 20 5 DHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000376558921 337036735 /nfs/dbraw/zinc/03/67/35/337036735.db2.gz RDGBGHDTSGKXCR-SJCJKPOMSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000376558921 337036736 /nfs/dbraw/zinc/03/67/36/337036736.db2.gz RDGBGHDTSGKXCR-SJCJKPOMSA-N 1 1 315.348 3.712 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000377239256 337049143 /nfs/dbraw/zinc/04/91/43/337049143.db2.gz MGISCYHPZNYCJZ-JKSUJKDBSA-N 1 1 318.417 3.577 20 5 DHBDMO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000194243213 337086409 /nfs/dbraw/zinc/08/64/09/337086409.db2.gz ANPSWIGKEBRXPI-CYBMUJFWSA-N 1 1 322.368 3.836 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(OCC3CCCC3)CC2)cs1 ZINC000177499324 337156314 /nfs/dbraw/zinc/15/63/14/337156314.db2.gz SUHXNXGUJULYGK-UHFFFAOYSA-N 1 1 324.446 3.828 20 5 DHBDMO CSC[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182242056 337187574 /nfs/dbraw/zinc/18/75/74/337187574.db2.gz QUZYIYYMLUHLLJ-GFCCVEGCSA-N 1 1 300.811 3.576 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CCOCC1 ZINC000182341526 337187992 /nfs/dbraw/zinc/18/79/92/337187992.db2.gz CEHKNBJKXZWPGD-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO CC[N@@H+](CCc1nccs1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182931507 337190776 /nfs/dbraw/zinc/19/07/76/337190776.db2.gz NHDWDIRKVJTFCU-ZDUSSCGKSA-N 1 1 319.430 3.985 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(Cl)s1 ZINC000070941028 337581918 /nfs/dbraw/zinc/58/19/18/337581918.db2.gz MMXPIPOCHRSENP-UHFFFAOYSA-N 1 1 312.778 3.608 20 5 DHBDMO Cc1cccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1C ZINC000428756778 338060543 /nfs/dbraw/zinc/06/05/43/338060543.db2.gz GZYYQOWDXMMJSC-UHFFFAOYSA-N 1 1 324.384 3.720 20 5 DHBDMO Cc1cccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1C ZINC000428756778 338060544 /nfs/dbraw/zinc/06/05/44/338060544.db2.gz GZYYQOWDXMMJSC-UHFFFAOYSA-N 1 1 324.384 3.720 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429116017 338071053 /nfs/dbraw/zinc/07/10/53/338071053.db2.gz PTZNSPFJBHNFPP-ZIAGYGMSSA-N 1 1 312.369 3.939 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429116017 338071054 /nfs/dbraw/zinc/07/10/54/338071054.db2.gz PTZNSPFJBHNFPP-ZIAGYGMSSA-N 1 1 312.369 3.939 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000430207392 338101451 /nfs/dbraw/zinc/10/14/51/338101451.db2.gz ZJOMXDWVEPRCRE-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000430207392 338101452 /nfs/dbraw/zinc/10/14/52/338101452.db2.gz ZJOMXDWVEPRCRE-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)CC1CC1 ZINC000435235372 338234987 /nfs/dbraw/zinc/23/49/87/338234987.db2.gz DKSPVGGAMFIHGT-UHFFFAOYSA-N 1 1 314.332 3.818 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCN(C)c2ccccc2C1 ZINC000436102915 338258404 /nfs/dbraw/zinc/25/84/04/338258404.db2.gz RTUWQRBWXMNOKS-CQSZACIVSA-N 1 1 311.385 3.608 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC1CCC(F)(F)CC1 ZINC000459431949 339028888 /nfs/dbraw/zinc/02/88/88/339028888.db2.gz GCVVTUATXZCOOI-UHFFFAOYSA-N 1 1 312.360 3.895 20 5 DHBDMO CC(C)OC1CC([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000459524962 339034136 /nfs/dbraw/zinc/03/41/36/339034136.db2.gz XANUNLYLRGTSFI-ZLPCBKJTSA-N 1 1 318.417 3.730 20 5 DHBDMO COc1cc(C[N@@H+](C(C)C)C2CCCC2)c([N+](=O)[O-])cc1F ZINC000464689296 339148903 /nfs/dbraw/zinc/14/89/03/339148903.db2.gz JPYYVVFZVAQWAX-UHFFFAOYSA-N 1 1 310.369 3.896 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000466995861 339223998 /nfs/dbraw/zinc/22/39/98/339223998.db2.gz GAGOIJXTOGDLQH-MEBBXXQBSA-N 1 1 302.305 3.518 20 5 DHBDMO CO[C@@H]1C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC[C@H]1C ZINC000467386257 339235946 /nfs/dbraw/zinc/23/59/46/339235946.db2.gz UWHIITPQOGRUDO-CXAGYDPISA-N 1 1 306.406 3.575 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@@H](CC(C)C)[NH+](C)C ZINC000468654866 339268097 /nfs/dbraw/zinc/26/80/97/339268097.db2.gz CTAVHUDVAAZDOV-QWSHFYNQSA-N 1 1 319.449 3.564 20 5 DHBDMO COCC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)CC(C)C ZINC000470174077 339312800 /nfs/dbraw/zinc/31/28/00/339312800.db2.gz PXEKYJXQOIJOHA-GDNBJRDFSA-N 1 1 306.406 3.603 20 5 DHBDMO COCC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)CC(C)C ZINC000470174078 339312882 /nfs/dbraw/zinc/31/28/82/339312882.db2.gz PXEKYJXQOIJOHA-XNTDXEJSSA-N 1 1 306.406 3.603 20 5 DHBDMO CC[C@H]1C[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CCS1 ZINC000470183905 339313303 /nfs/dbraw/zinc/31/33/03/339313303.db2.gz SVOCJPFCNZDDLI-WQMJKPAKSA-N 1 1 306.431 3.826 20 5 DHBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000470931337 339331461 /nfs/dbraw/zinc/33/14/61/339331461.db2.gz NJLYBHNUIPOGAL-KWQFWETISA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000470931337 339331462 /nfs/dbraw/zinc/33/14/62/339331462.db2.gz NJLYBHNUIPOGAL-KWQFWETISA-N 1 1 306.259 3.507 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)C1CCCCC1 ZINC000473736237 339391018 /nfs/dbraw/zinc/39/10/18/339391018.db2.gz PBSQPVWEXQZQBX-GOSISDBHSA-N 1 1 320.433 3.746 20 5 DHBDMO C[C@@H]1CCCC[C@H]1OCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000501861399 340089954 /nfs/dbraw/zinc/08/99/54/340089954.db2.gz JFPMBJFBMHLSOO-RHSMWYFYSA-N 1 1 306.406 3.622 20 5 DHBDMO C[C@@H]1CCCC[C@H]1OCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000501861399 340089955 /nfs/dbraw/zinc/08/99/55/340089955.db2.gz JFPMBJFBMHLSOO-RHSMWYFYSA-N 1 1 306.406 3.622 20 5 DHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000508530250 340245854 /nfs/dbraw/zinc/24/58/54/340245854.db2.gz GOQHSVBUYXKIQY-OAHLLOKOSA-N 1 1 314.385 3.804 20 5 DHBDMO Cc1ccc2c(c1)C[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CCO2 ZINC000512251509 340354208 /nfs/dbraw/zinc/35/42/08/340354208.db2.gz HDJXDPALMDGMEP-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CCO2 ZINC000512251509 340354209 /nfs/dbraw/zinc/35/42/09/340354209.db2.gz HDJXDPALMDGMEP-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO C[N@@H+](CCc1ccc(Cl)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000512683564 340372970 /nfs/dbraw/zinc/37/29/70/340372970.db2.gz UPLARFXGRKBUKI-UHFFFAOYSA-N 1 1 304.777 3.923 20 5 DHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(O)c1 ZINC000174620999 340393189 /nfs/dbraw/zinc/39/31/89/340393189.db2.gz CCFMIJQEXDBDNT-CQSZACIVSA-N 1 1 314.385 3.926 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000539058730 340869020 /nfs/dbraw/zinc/86/90/20/340869020.db2.gz TVCGUAGANZZOBB-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO CC(C)OC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000541071333 340958400 /nfs/dbraw/zinc/95/84/00/340958400.db2.gz UIWNRMICPCEYID-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO CCc1cnc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000130529059 341026752 /nfs/dbraw/zinc/02/67/52/341026752.db2.gz SGLBFEDDGHLEPA-NSHDSACASA-N 1 1 305.403 3.773 20 5 DHBDMO Cc1ccc([C@@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000543248330 341038304 /nfs/dbraw/zinc/03/83/04/341038304.db2.gz XKCVIVXWUVFMEF-GOSISDBHSA-N 1 1 310.397 3.935 20 5 DHBDMO Cc1[nH+]c2cc(Nc3nc(C)cc(C)c3[N+](=O)[O-])ccc2n1C ZINC000543791131 341058972 /nfs/dbraw/zinc/05/89/72/341058972.db2.gz CHWDFHXJDIPXKT-UHFFFAOYSA-N 1 1 311.345 3.545 20 5 DHBDMO C[N@@H+](CCc1cccs1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543860353 341061682 /nfs/dbraw/zinc/06/16/82/341061682.db2.gz WTBLXOZTLTXQSU-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1c1cccn1C ZINC000544611465 341088842 /nfs/dbraw/zinc/08/88/42/341088842.db2.gz RRHOLYSYUHQLAT-GOSISDBHSA-N 1 1 313.401 3.969 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)c1cccc(O)c1 ZINC000080932464 341276841 /nfs/dbraw/zinc/27/68/41/341276841.db2.gz VTOADBOMGCLJDB-CYBMUJFWSA-N 1 1 300.358 3.884 20 5 DHBDMO Cc1csc([C@@H](C)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000565213459 341520309 /nfs/dbraw/zinc/52/03/09/341520309.db2.gz AOYWSMJCQMDXLR-MFKMUULPSA-N 1 1 303.387 3.698 20 5 DHBDMO C[C@@H](O)[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000567358546 341598455 /nfs/dbraw/zinc/59/84/55/341598455.db2.gz VQXBNQYIIHZNEL-XWCIJXRUSA-N 1 1 318.348 3.507 20 5 DHBDMO COC[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccco1 ZINC000156631941 522370335 /nfs/dbraw/zinc/37/03/35/522370335.db2.gz MAGGORXIKRUPSJ-SWLSCSKDSA-N 1 1 304.346 3.535 20 5 DHBDMO COC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccco1 ZINC000156631561 522765132 /nfs/dbraw/zinc/76/51/32/522765132.db2.gz MAGGORXIKRUPSJ-DOMZBBRYSA-N 1 1 304.346 3.535 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccncc2F)cc1[N+](=O)[O-] ZINC000338007979 525943543 /nfs/dbraw/zinc/94/35/43/525943543.db2.gz LDCWYGUUHWSZMP-NWDGAFQWSA-N 1 1 303.337 3.849 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](OCC(C)C)C1 ZINC000245534023 526090680 /nfs/dbraw/zinc/09/06/80/526090680.db2.gz VVNHUCHFPWARAM-GOEBONIOSA-N 1 1 306.406 3.711 20 5 DHBDMO C[C@H](c1cccnc1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000180806775 526132652 /nfs/dbraw/zinc/13/26/52/526132652.db2.gz GPSVFMKLSYMLCV-LLVKDONJSA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000180806775 526132659 /nfs/dbraw/zinc/13/26/59/526132659.db2.gz GPSVFMKLSYMLCV-LLVKDONJSA-N 1 1 305.765 3.836 20 5 DHBDMO Cc1csc(C2([NH2+]Cc3cccc([N+](=O)[O-])c3C)CCC2)n1 ZINC000265510079 526325963 /nfs/dbraw/zinc/32/59/63/526325963.db2.gz QYAGHEAWZCITNE-UHFFFAOYSA-N 1 1 317.414 3.837 20 5 DHBDMO Cc1csc([C@H]2CCC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)n1 ZINC000156959843 526443840 /nfs/dbraw/zinc/44/38/40/526443840.db2.gz FRVSOZYMGUMJQW-LBPRGKRZSA-N 1 1 323.443 3.801 20 5 DHBDMO Cc1csc([C@H]2CCC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)n1 ZINC000156959843 526443844 /nfs/dbraw/zinc/44/38/44/526443844.db2.gz FRVSOZYMGUMJQW-LBPRGKRZSA-N 1 1 323.443 3.801 20 5 DHBDMO CCOC1CC2(C1)CC[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000285638708 535397827 /nfs/dbraw/zinc/39/78/27/535397827.db2.gz ZELVNJXGBQDDBP-IGEOTXOUSA-N 1 1 304.390 3.547 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000441462428 1013909802 /nfs/dbraw/zinc/90/98/02/1013909802.db2.gz IAWUHPUHBMWIPP-XJKCOSOUSA-N 1 1 304.390 3.756 20 5 DHBDMO CC[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000083198534 1013993057 /nfs/dbraw/zinc/99/30/57/1013993057.db2.gz CPHOHQJSXOUOGW-LBPRGKRZSA-N 1 1 303.362 3.748 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000580629842 1014260672 /nfs/dbraw/zinc/26/06/72/1014260672.db2.gz GIHGDOFASLYVNA-AOOOYVTPSA-N 1 1 302.296 3.986 20 5 DHBDMO Cn1cc(Cl)cc1C[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255670214 1014276232 /nfs/dbraw/zinc/27/62/32/1014276232.db2.gz XYGHCHQWPPLTJU-ALCCZGGFSA-N 1 1 319.792 3.732 20 5 DHBDMO Cn1cc(Cl)cc1C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255670214 1014276242 /nfs/dbraw/zinc/27/62/42/1014276242.db2.gz XYGHCHQWPPLTJU-ALCCZGGFSA-N 1 1 319.792 3.732 20 5 DHBDMO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000537978290 1014948581 /nfs/dbraw/zinc/94/85/81/1014948581.db2.gz OIKJJFKRCIQQLZ-DYVFJYSZSA-N 1 1 312.369 3.996 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)nc2c1 ZINC000361809977 1032107649 /nfs/dbraw/zinc/10/76/49/1032107649.db2.gz BGZQRPQUUDHIRI-GFCCVEGCSA-N 1 1 310.357 3.630 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)[nH]c2c1 ZINC000361809977 1032107658 /nfs/dbraw/zinc/10/76/58/1032107658.db2.gz BGZQRPQUUDHIRI-GFCCVEGCSA-N 1 1 310.357 3.630 20 5 DHBDMO CC[N@@H+](CCc1nccs1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000121123080 1015031730 /nfs/dbraw/zinc/03/17/30/1015031730.db2.gz FQRQUJMHAWMPKQ-LBPRGKRZSA-N 1 1 305.403 3.677 20 5 DHBDMO CC(C)[N@@H+](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000320195617 1015052888 /nfs/dbraw/zinc/05/28/88/1015052888.db2.gz QFSHKMBGLHXUIK-JTQLQIEISA-N 1 1 319.327 3.754 20 5 DHBDMO CN(C)c1cc[nH+]c(CNc2ccc(C(F)F)cc2[N+](=O)[O-])c1 ZINC000895471202 1015170790 /nfs/dbraw/zinc/17/07/90/1015170790.db2.gz KTKDDWJVGUJQNN-UHFFFAOYSA-N 1 1 322.315 3.606 20 5 DHBDMO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000127262898 1015256911 /nfs/dbraw/zinc/25/69/11/1015256911.db2.gz YJRIKRLDZAWVPY-VXGBXAGGSA-N 1 1 303.362 3.604 20 5 DHBDMO C[N@H+](CCCF)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000895898467 1015354029 /nfs/dbraw/zinc/35/40/29/1015354029.db2.gz SWPMTWSAWLUHPL-UHFFFAOYSA-N 1 1 309.366 3.510 20 5 DHBDMO C[N@@H+](CCCF)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000895898467 1015354036 /nfs/dbraw/zinc/35/40/36/1015354036.db2.gz SWPMTWSAWLUHPL-UHFFFAOYSA-N 1 1 309.366 3.510 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]C3(c4ccccc4)CC3)nc2c1 ZINC000610581392 1015629892 /nfs/dbraw/zinc/62/98/92/1015629892.db2.gz QFJPPKARLLKBTI-UHFFFAOYSA-N 1 1 309.325 3.515 20 5 DHBDMO C[C@@H]([NH2+]C[C@]1(N(C)C)CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000320290608 1016076442 /nfs/dbraw/zinc/07/64/42/1016076442.db2.gz YOUKQHJLCQKCGT-RKVPGOIHSA-N 1 1 319.449 3.756 20 5 DHBDMO CSC[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000135476513 1016236033 /nfs/dbraw/zinc/23/60/33/1016236033.db2.gz QXUCJECJGQITSH-GFCCVEGCSA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@@H](Nc1sccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000611583548 1016512178 /nfs/dbraw/zinc/51/21/78/1016512178.db2.gz NYBOUXLFJQEEIB-NEPJUHHUSA-N 1 1 309.435 3.721 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000072557462 1016577286 /nfs/dbraw/zinc/57/72/86/1016577286.db2.gz SDJHJGUSYOSLSD-GFCCVEGCSA-N 1 1 314.341 3.517 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000072557462 1016577301 /nfs/dbraw/zinc/57/73/01/1016577301.db2.gz SDJHJGUSYOSLSD-GFCCVEGCSA-N 1 1 314.341 3.517 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000582340054 1016600038 /nfs/dbraw/zinc/60/00/38/1016600038.db2.gz ANFQAIBVOWXCJX-KTLBGCOUSA-N 1 1 314.307 3.882 20 5 DHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1sccc1[N+](=O)[O-] ZINC000611412638 1016610513 /nfs/dbraw/zinc/61/05/13/1016610513.db2.gz XWZYOVBSCWRBIF-UHFFFAOYSA-N 1 1 314.370 3.763 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc(F)cc1)Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000338936035 1016763837 /nfs/dbraw/zinc/76/38/37/1016763837.db2.gz MBPADLWKOSESHP-UHFFFAOYSA-N 1 1 318.348 3.850 20 5 DHBDMO CCOc1ccc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000537623967 1032328008 /nfs/dbraw/zinc/32/80/08/1032328008.db2.gz CXTYQUNWPGIYSC-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCOc1ccc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000537623967 1032328018 /nfs/dbraw/zinc/32/80/18/1032328018.db2.gz CXTYQUNWPGIYSC-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000368218127 1032447856 /nfs/dbraw/zinc/44/78/56/1032447856.db2.gz DTCOTJDZMMIRGK-KBPBESRZSA-N 1 1 304.390 3.547 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCc1cccs1 ZINC000537649116 1032586437 /nfs/dbraw/zinc/58/64/37/1032586437.db2.gz GCKZBPNOVQGFQO-UHFFFAOYSA-N 1 1 320.414 3.730 20 5 DHBDMO CCc1ccc([C@@H]([NH2+][C@H]2CC23CC3)c2ccc([N+](=O)[O-])cc2)o1 ZINC000424318797 1011979713 /nfs/dbraw/zinc/97/97/13/1011979713.db2.gz HSVGJSZKNAHKOT-IRXDYDNUSA-N 1 1 312.369 3.982 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1C[C@@H]1c1ccccc1 ZINC000559073706 1012357737 /nfs/dbraw/zinc/35/77/37/1012357737.db2.gz UXEFMSXGIPIONL-IEBWSBKVSA-N 1 1 310.397 3.873 20 5 DHBDMO CCC[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001167959718 1012598834 /nfs/dbraw/zinc/59/88/34/1012598834.db2.gz PKVDSHSHQLSLDP-HNNXBMFYSA-N 1 1 306.406 3.876 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000515379584 1012613579 /nfs/dbraw/zinc/61/35/79/1012613579.db2.gz HJQOIASGPZGEKD-ZFWWWQNUSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1cc(NCCCC[N@@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000515550352 1012657783 /nfs/dbraw/zinc/65/77/83/1012657783.db2.gz LSCDKYAGBPQIDA-OAHLLOKOSA-N 1 1 305.422 3.970 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)cc1[N+](=O)[O-] ZINC000537689253 1032643217 /nfs/dbraw/zinc/64/32/17/1032643217.db2.gz JQEHYCODTUAPJO-NVXWUHKLSA-N 1 1 318.417 3.719 20 5 DHBDMO CC[N@H+]1CCC[C@@H]1CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000137538816 1017174388 /nfs/dbraw/zinc/17/43/88/1017174388.db2.gz ZCSCDEMMJVQLHT-LLVKDONJSA-N 1 1 317.311 3.510 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+](Cc3ccccc3)C3CC3)nc2c1 ZINC000083133540 1017568518 /nfs/dbraw/zinc/56/85/18/1017568518.db2.gz SRPGNSCKEKVQTJ-UHFFFAOYSA-N 1 1 323.352 3.901 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](Cc3ccccc3)C3CC3)nc2c1 ZINC000083133540 1017568527 /nfs/dbraw/zinc/56/85/27/1017568527.db2.gz SRPGNSCKEKVQTJ-UHFFFAOYSA-N 1 1 323.352 3.901 20 5 DHBDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000444609441 1017588607 /nfs/dbraw/zinc/58/86/07/1017588607.db2.gz NCQPGHHXESBWSV-NEPJUHHUSA-N 1 1 316.405 3.870 20 5 DHBDMO C[N@@H+](CCC1CCCCC1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444619721 1017594806 /nfs/dbraw/zinc/59/48/06/1017594806.db2.gz LCORZMIFDQNGEW-UHFFFAOYSA-N 1 1 316.405 3.873 20 5 DHBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444686862 1017615356 /nfs/dbraw/zinc/61/53/56/1017615356.db2.gz UHSZBRBWSILBPI-WBMJQRKESA-N 1 1 316.405 3.872 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCc2ccc(Cl)nc21)c1ccccc1[N+](=O)[O-] ZINC000857905954 1032712159 /nfs/dbraw/zinc/71/21/59/1032712159.db2.gz AGRHPFIZNPRGHS-GXFFZTMASA-N 1 1 317.776 3.981 20 5 DHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083216458 1017637392 /nfs/dbraw/zinc/63/73/92/1017637392.db2.gz VPGMBJAGZAWQAF-NSHDSACASA-N 1 1 323.418 3.700 20 5 DHBDMO CC[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000125801516 1032722084 /nfs/dbraw/zinc/72/20/84/1032722084.db2.gz SAXOTCJPMIEJDW-CYBMUJFWSA-N 1 1 315.373 3.524 20 5 DHBDMO CC(C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000059384668 1017781731 /nfs/dbraw/zinc/78/17/31/1017781731.db2.gz AFXCUEPSNTWSSW-UHFFFAOYSA-N 1 1 314.385 3.884 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000524425722 1017991609 /nfs/dbraw/zinc/99/16/09/1017991609.db2.gz BVBHQURVZXBBKX-IBGZPJMESA-N 1 1 310.397 3.844 20 5 DHBDMO CC(C)N(CC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C(C)C ZINC000447511432 1018407794 /nfs/dbraw/zinc/40/77/94/1018407794.db2.gz UHVXBOBIFMQHCW-GOSISDBHSA-N 1 1 319.449 3.681 20 5 DHBDMO Cc1nn(C[N@@H+](C)Cc2cccc(C)c2)c2ccc([N+](=O)[O-])cc12 ZINC000764909061 1018424575 /nfs/dbraw/zinc/42/45/75/1018424575.db2.gz GWOJMCWISMDTKH-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1nn(C[N@H+](C)Cc2cccc(C)c2)c2ccc([N+](=O)[O-])cc12 ZINC000764909061 1018424583 /nfs/dbraw/zinc/42/45/83/1018424583.db2.gz GWOJMCWISMDTKH-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC000246310895 1018446850 /nfs/dbraw/zinc/44/68/50/1018446850.db2.gz QSYQACRTTJGJDV-LSDHHAIUSA-N 1 1 318.398 3.527 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCC2(CCOCC2)C1 ZINC000611272270 1019429037 /nfs/dbraw/zinc/42/90/37/1019429037.db2.gz UVMGFBMAHYHZIF-UTCJRWHESA-N 1 1 316.401 3.501 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000611272386 1019432413 /nfs/dbraw/zinc/43/24/13/1019432413.db2.gz FOWFAHWGXITTKI-UHFFFAOYSA-N 1 1 306.406 3.719 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccnc(Cl)c1 ZINC000765766435 1019570733 /nfs/dbraw/zinc/57/07/33/1019570733.db2.gz HLTFSYHXPZKVIP-JTQLQIEISA-N 1 1 321.764 3.503 20 5 DHBDMO CC(C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301446597 1019627879 /nfs/dbraw/zinc/62/78/79/1019627879.db2.gz QGMHKRQPMNNMPP-LLVKDONJSA-N 1 1 317.311 3.508 20 5 DHBDMO C[C@@H](C[N@@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000727427989 1019713244 /nfs/dbraw/zinc/71/32/44/1019713244.db2.gz LCBBYBJGAFNRID-AWEZNQCLSA-N 1 1 324.384 3.638 20 5 DHBDMO Cc1ccncc1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000611939303 1019906513 /nfs/dbraw/zinc/90/65/13/1019906513.db2.gz HRGZPTMMODSVTF-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C ZINC000316791930 1019939468 /nfs/dbraw/zinc/93/94/68/1019939468.db2.gz NWIVUCTWTJBQJP-KOLCDFICSA-N 1 1 317.311 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000730934785 1020042416 /nfs/dbraw/zinc/04/24/16/1020042416.db2.gz ZQYPMBMNWNZBLU-UHFFFAOYSA-N 1 1 304.296 3.652 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)CCc2ccccc21 ZINC001171740772 1032877470 /nfs/dbraw/zinc/87/74/70/1032877470.db2.gz GXCJQCVCXWIRDU-LBPRGKRZSA-N 1 1 302.399 3.818 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H](c2ccccn2)C2CC2)c1 ZINC000922586997 1020149685 /nfs/dbraw/zinc/14/96/85/1020149685.db2.gz VEOLAYFBFYUJBL-MRXNPFEDSA-N 1 1 317.776 3.884 20 5 DHBDMO C[C@H](c1cccc(F)c1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445259983 1020466416 /nfs/dbraw/zinc/46/64/16/1020466416.db2.gz PRLYSFJMYULJCL-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H](c1cccc(F)c1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445259983 1020466422 /nfs/dbraw/zinc/46/64/22/1020466422.db2.gz PRLYSFJMYULJCL-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO COCC[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000347995353 1020472258 /nfs/dbraw/zinc/47/22/58/1020472258.db2.gz FSERCDJULVOIRB-CYBMUJFWSA-N 1 1 324.764 3.709 20 5 DHBDMO CCc1ccc([C@@H]([NH2+]CCSC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612405065 1020544885 /nfs/dbraw/zinc/54/48/85/1020544885.db2.gz YRYLGOKHFDCLPV-INIZCTEOSA-N 1 1 320.414 3.792 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000163214587 1020582882 /nfs/dbraw/zinc/58/28/82/1020582882.db2.gz PYMPTJDPWQHANV-CQSZACIVSA-N 1 1 322.368 3.631 20 5 DHBDMO CCC[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000612539153 1020611264 /nfs/dbraw/zinc/61/12/64/1020611264.db2.gz VXNVXUQJPYWWLO-LBPRGKRZSA-N 1 1 303.362 3.891 20 5 DHBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C2CC2)o1 ZINC000612576515 1020626653 /nfs/dbraw/zinc/62/66/53/1020626653.db2.gz STYKFVOPONTCNC-UHFFFAOYSA-N 1 1 300.358 3.969 20 5 DHBDMO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C2CC2)o1 ZINC000612576515 1020626655 /nfs/dbraw/zinc/62/66/55/1020626655.db2.gz STYKFVOPONTCNC-UHFFFAOYSA-N 1 1 300.358 3.969 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H]1c1cccc(F)c1 ZINC000612578846 1020630120 /nfs/dbraw/zinc/63/01/20/1020630120.db2.gz URCXEKKUYXYUBL-KRWDZBQOSA-N 1 1 300.333 3.989 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000612578846 1020630126 /nfs/dbraw/zinc/63/01/26/1020630126.db2.gz URCXEKKUYXYUBL-KRWDZBQOSA-N 1 1 300.333 3.989 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000613184937 1020844497 /nfs/dbraw/zinc/84/44/97/1020844497.db2.gz ZBACJVYBLUDEEV-TZMCWYRMSA-N 1 1 317.414 3.589 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1nc(C2CC2)cs1 ZINC000581499169 1020892265 /nfs/dbraw/zinc/89/22/65/1020892265.db2.gz VTARGGJQSBEYMN-ZDUSSCGKSA-N 1 1 315.398 3.706 20 5 DHBDMO CC[N@H+](Cc1occc1C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000412022837 1021089131 /nfs/dbraw/zinc/08/91/31/1021089131.db2.gz AKZMJYNHLSARJM-UHFFFAOYSA-N 1 1 304.346 3.527 20 5 DHBDMO CC[N@@H+](Cc1occc1C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000412022837 1021089139 /nfs/dbraw/zinc/08/91/39/1021089139.db2.gz AKZMJYNHLSARJM-UHFFFAOYSA-N 1 1 304.346 3.527 20 5 DHBDMO CC(C)C[C@@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277257 1021208065 /nfs/dbraw/zinc/20/80/65/1021208065.db2.gz MDQKKMJOLPDLPC-DLBZAZTESA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776274235 1021218081 /nfs/dbraw/zinc/21/80/81/1021218081.db2.gz CHQRWECPMMJREC-KDOFPFPSSA-N 1 1 314.385 3.630 20 5 DHBDMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776274238 1021218420 /nfs/dbraw/zinc/21/84/20/1021218420.db2.gz CHQRWECPMMJREC-RDTXWAMCSA-N 1 1 314.385 3.630 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2C2CCCCC2)cc1 ZINC000776276465 1021220155 /nfs/dbraw/zinc/22/01/55/1021220155.db2.gz KAIJZDXKITWLEX-ZWKOTPCHSA-N 1 1 318.417 3.673 20 5 DHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776278164 1021227038 /nfs/dbraw/zinc/22/70/38/1021227038.db2.gz RVTFIBQZNPFBSJ-XKQJLSEDSA-N 1 1 306.406 3.529 20 5 DHBDMO CCCC[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)[C@@H](C)CC ZINC000917438489 1021260696 /nfs/dbraw/zinc/26/06/96/1021260696.db2.gz WDDRQUJWJARJSR-ZDUSSCGKSA-N 1 1 304.394 3.803 20 5 DHBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+](C3CC3)C3CCCCC3)c2c1 ZINC000917428586 1021266582 /nfs/dbraw/zinc/26/65/82/1021266582.db2.gz BVJCPYLWEVHAQP-UHFFFAOYSA-N 1 1 314.389 3.699 20 5 DHBDMO CC[N@@H+](CC(C)C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000917454749 1021272145 /nfs/dbraw/zinc/27/21/45/1021272145.db2.gz ZZOKPOKHBVCTMR-UHFFFAOYSA-N 1 1 309.391 3.807 20 5 DHBDMO Cc1nn(C[N@H+]2CCCC3(C2)CCCCCC3)c(C)c1[N+](=O)[O-] ZINC000743385498 1021279233 /nfs/dbraw/zinc/27/92/33/1021279233.db2.gz JVBIIKFCZCRRFD-UHFFFAOYSA-N 1 1 320.437 3.802 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)cc1[N+](=O)[O-] ZINC000069752535 1021346441 /nfs/dbraw/zinc/34/64/41/1021346441.db2.gz WDALJSFOSTYZCY-WFASDCNBSA-N 1 1 300.358 3.909 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(Cl)nc1 ZINC000850423516 1021524688 /nfs/dbraw/zinc/52/46/88/1021524688.db2.gz AVQWUYRSCPSVIT-JTQLQIEISA-N 1 1 321.764 3.503 20 5 DHBDMO COc1ccc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000541117836 1021652883 /nfs/dbraw/zinc/65/28/83/1021652883.db2.gz KGCYKZYAHSVMFI-QEJZJMRPSA-N 1 1 304.390 3.614 20 5 DHBDMO O=C(CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000182488139 1021685882 /nfs/dbraw/zinc/68/58/82/1021685882.db2.gz SFGSELZLSWREMH-UHFFFAOYSA-N 1 1 324.380 3.832 20 5 DHBDMO O=[N+]([O-])c1ccsc1NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000619499431 1021774854 /nfs/dbraw/zinc/77/48/54/1021774854.db2.gz RHMWQXKKUWIFDA-CQSZACIVSA-N 1 1 317.414 3.590 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000556609940 1021795473 /nfs/dbraw/zinc/79/54/73/1021795473.db2.gz WGQUYCFRBSGNBI-DESUXHOBSA-N 1 1 316.401 3.642 20 5 DHBDMO CCc1ccc(C2=CC[N@H+](Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC001168776835 1021947156 /nfs/dbraw/zinc/94/71/56/1021947156.db2.gz XSDNWBNRKJRTQU-UHFFFAOYSA-N 1 1 323.396 3.842 20 5 DHBDMO CCc1ccc(C2=CC[N@@H+](Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC001168776835 1021947173 /nfs/dbraw/zinc/94/71/73/1021947173.db2.gz XSDNWBNRKJRTQU-UHFFFAOYSA-N 1 1 323.396 3.842 20 5 DHBDMO CC[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000556997054 1022006773 /nfs/dbraw/zinc/00/67/73/1022006773.db2.gz IRONBUAIXWQIQQ-NSHDSACASA-N 1 1 302.296 3.988 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1OC ZINC000851898754 1022032482 /nfs/dbraw/zinc/03/24/82/1022032482.db2.gz XKKWGBJWQOZMCK-OAHLLOKOSA-N 1 1 318.348 3.983 20 5 DHBDMO C[Si](C)(C)C[N@@H+](Cc1ccccc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169036765 1022221365 /nfs/dbraw/zinc/22/13/65/1022221365.db2.gz PWTVAZATLCAKBH-IRXDYDNUSA-N 1 1 320.509 3.811 20 5 DHBDMO C[Si](C)(C)C[N@@H+](Cc1ccccc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169036769 1022222346 /nfs/dbraw/zinc/22/23/46/1022222346.db2.gz PWTVAZATLCAKBH-SJORKVTESA-N 1 1 320.509 3.811 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)C1 ZINC001169039794 1022223812 /nfs/dbraw/zinc/22/38/12/1022223812.db2.gz UBDYVHANYWMHCE-XNRPHZJLSA-N 1 1 308.809 3.575 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001169041148 1022224553 /nfs/dbraw/zinc/22/45/53/1022224553.db2.gz BCDHREXMOVGFAQ-UHOFOFEASA-N 1 1 308.809 3.922 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001169041139 1022225261 /nfs/dbraw/zinc/22/52/61/1022225261.db2.gz BCDHREXMOVGFAQ-DAXOMENPSA-N 1 1 308.809 3.922 20 5 DHBDMO CC[N@@H+](CCNc1ccc(C(F)F)cc1[N+](=O)[O-])C(C)C ZINC000853254153 1022245256 /nfs/dbraw/zinc/24/52/56/1022245256.db2.gz WFHLLRDVIYJOAC-UHFFFAOYSA-N 1 1 301.337 3.675 20 5 DHBDMO Cc1[nH+]ccn1CCCN(C)c1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000853454972 1022274307 /nfs/dbraw/zinc/27/43/07/1022274307.db2.gz NGNHSFWFTXUPGX-UHFFFAOYSA-N 1 1 324.331 3.564 20 5 DHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1ccncc1 ZINC000183744514 1022343737 /nfs/dbraw/zinc/34/37/37/1022343737.db2.gz XUYIDIBGRUKILP-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1ccncc1 ZINC000183744514 1022343750 /nfs/dbraw/zinc/34/37/50/1022343750.db2.gz XUYIDIBGRUKILP-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@H+](CCOC1CCCCCC1)Cc1ccccc1[N+](=O)[O-] ZINC000610132283 1022425088 /nfs/dbraw/zinc/42/50/88/1022425088.db2.gz OEORWOBEXPWUEB-UHFFFAOYSA-N 1 1 306.406 3.766 20 5 DHBDMO C[N@@H+](CCOC1CCCCCC1)Cc1ccccc1[N+](=O)[O-] ZINC000610132283 1022425092 /nfs/dbraw/zinc/42/50/92/1022425092.db2.gz OEORWOBEXPWUEB-UHFFFAOYSA-N 1 1 306.406 3.766 20 5 DHBDMO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001169714521 1022515061 /nfs/dbraw/zinc/51/50/61/1022515061.db2.gz BQMYHZAPZNYWQV-GOSISDBHSA-N 1 1 314.360 3.974 20 5 DHBDMO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001169714521 1022515074 /nfs/dbraw/zinc/51/50/74/1022515074.db2.gz BQMYHZAPZNYWQV-GOSISDBHSA-N 1 1 314.360 3.974 20 5 DHBDMO CCN(CC)[C@H](C)C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000236869255 1022807084 /nfs/dbraw/zinc/80/70/84/1022807084.db2.gz WPCKAFAXVHULPP-CQSZACIVSA-N 1 1 307.438 3.538 20 5 DHBDMO Cc1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C)o1 ZINC000768335583 1022947423 /nfs/dbraw/zinc/94/74/23/1022947423.db2.gz YCJRBVRMRCTSDH-UHFFFAOYSA-N 1 1 300.358 3.969 20 5 DHBDMO Cc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C)o1 ZINC000768335583 1022947434 /nfs/dbraw/zinc/94/74/34/1022947434.db2.gz YCJRBVRMRCTSDH-UHFFFAOYSA-N 1 1 300.358 3.969 20 5 DHBDMO C[C@H](C1CC1)[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768420898 1022968936 /nfs/dbraw/zinc/96/89/36/1022968936.db2.gz IUNZUCJMXRQBEZ-SECBINFHSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@H](C1CC1)[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768420898 1022968940 /nfs/dbraw/zinc/96/89/40/1022968940.db2.gz IUNZUCJMXRQBEZ-SECBINFHSA-N 1 1 313.195 3.588 20 5 DHBDMO Cc1c(NCCC[N@@H+]2CCCC[C@H]2C)cc(F)cc1[N+](=O)[O-] ZINC001167750781 1023022860 /nfs/dbraw/zinc/02/28/60/1023022860.db2.gz CDZGNRSJLIUSPR-GFCCVEGCSA-N 1 1 309.385 3.719 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCc2c(F)cccc2C1 ZINC000769388625 1023140118 /nfs/dbraw/zinc/14/01/18/1023140118.db2.gz VHUXCQRGUZIKLA-DAXSKMNVSA-N 1 1 312.344 3.805 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCc2c(F)cccc2C1 ZINC000769388625 1023140122 /nfs/dbraw/zinc/14/01/22/1023140122.db2.gz VHUXCQRGUZIKLA-DAXSKMNVSA-N 1 1 312.344 3.805 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cncc3ccccc31)C2 ZINC000769425423 1023147382 /nfs/dbraw/zinc/14/73/82/1023147382.db2.gz HNCHNDYGIXYYHV-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cncc3ccccc31)C2 ZINC000769425423 1023147388 /nfs/dbraw/zinc/14/73/88/1023147388.db2.gz HNCHNDYGIXYYHV-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO CC[C@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000770306524 1023295031 /nfs/dbraw/zinc/29/50/31/1023295031.db2.gz YFRXDEMENZUEKS-JTQLQIEISA-N 1 1 313.195 3.589 20 5 DHBDMO CC(C)OC1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746666117 1023780026 /nfs/dbraw/zinc/78/00/26/1023780026.db2.gz MWWDBBBFLAQVSG-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cccc(F)c1F ZINC000788488777 1023893285 /nfs/dbraw/zinc/89/32/85/1023893285.db2.gz MBGMXDVJXLXNAJ-SECBINFHSA-N 1 1 310.275 3.863 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000053815129 1023929533 /nfs/dbraw/zinc/92/95/33/1023929533.db2.gz XXMIEIOTZFETNI-UHFFFAOYSA-N 1 1 310.353 3.590 20 5 DHBDMO CC(C)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000538790942 1033190192 /nfs/dbraw/zinc/19/01/92/1033190192.db2.gz YPPJWALXJQXRFF-NSHDSACASA-N 1 1 314.332 3.674 20 5 DHBDMO Cc1nc(CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cs1 ZINC000271286269 1024481531 /nfs/dbraw/zinc/48/15/31/1024481531.db2.gz LOXYCMAAKZLUMV-UHFFFAOYSA-N 1 1 319.430 3.813 20 5 DHBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000791583165 1024519070 /nfs/dbraw/zinc/51/90/70/1024519070.db2.gz LZNAHFPURXKRCD-GZMMTYOYSA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000791583165 1024519073 /nfs/dbraw/zinc/51/90/73/1024519073.db2.gz LZNAHFPURXKRCD-GZMMTYOYSA-N 1 1 306.259 3.507 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCC[N@@H+](C)C1CCCCC1 ZINC000532211989 1024577541 /nfs/dbraw/zinc/57/75/41/1024577541.db2.gz OCLABAYRDHJRKN-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCN(C)C1CCCCC1 ZINC000532211989 1024577546 /nfs/dbraw/zinc/57/75/46/1024577546.db2.gz OCLABAYRDHJRKN-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCC[N@H+]1[C@H](C)CCC[C@@H]1C ZINC000532231291 1024583440 /nfs/dbraw/zinc/58/34/40/1024583440.db2.gz JVWCBXJMUOBKHJ-XHSDSOJGSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000532231291 1024583446 /nfs/dbraw/zinc/58/34/46/1024583446.db2.gz JVWCBXJMUOBKHJ-XHSDSOJGSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)nc2c1 ZINC000532239152 1024586061 /nfs/dbraw/zinc/58/60/61/1024586061.db2.gz SIEJBPOHCMEMHT-ZDUSSCGKSA-N 1 1 324.384 3.939 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)[nH]c2c1 ZINC000532239152 1024586068 /nfs/dbraw/zinc/58/60/68/1024586068.db2.gz SIEJBPOHCMEMHT-ZDUSSCGKSA-N 1 1 324.384 3.939 20 5 DHBDMO CC(C)c1cnc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000348668771 1024602905 /nfs/dbraw/zinc/60/29/05/1024602905.db2.gz FENKCOHSPJOFSC-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO CC(C)c1cnc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000348668771 1024602907 /nfs/dbraw/zinc/60/29/07/1024602907.db2.gz FENKCOHSPJOFSC-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1nc(C)cs1 ZINC000283229302 1024613626 /nfs/dbraw/zinc/61/36/26/1024613626.db2.gz UBUDXWOTEITGAD-GFCCVEGCSA-N 1 1 309.366 3.740 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)c(F)c1 ZINC000278944663 1024630506 /nfs/dbraw/zinc/63/05/06/1024630506.db2.gz YGPKYNHYIYOKJE-VIFPVBQESA-N 1 1 306.259 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c(F)c1 ZINC000278944663 1024630511 /nfs/dbraw/zinc/63/05/11/1024630511.db2.gz YGPKYNHYIYOKJE-VIFPVBQESA-N 1 1 306.259 3.508 20 5 DHBDMO COc1cc(C[N@@H+](C)C2CCC(C)CC2)c([N+](=O)[O-])cc1OC ZINC000349524807 1024724070 /nfs/dbraw/zinc/72/40/70/1024724070.db2.gz SMJDBMUENUPDJX-UHFFFAOYSA-N 1 1 322.405 3.623 20 5 DHBDMO COCC[N@H+](Cc1cccs1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000349543580 1024727367 /nfs/dbraw/zinc/72/73/67/1024727367.db2.gz QPTGATCKZVBQLN-UHFFFAOYSA-N 1 1 320.414 3.613 20 5 DHBDMO COCC[N@@H+](Cc1cccs1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000349543580 1024727379 /nfs/dbraw/zinc/72/73/79/1024727379.db2.gz QPTGATCKZVBQLN-UHFFFAOYSA-N 1 1 320.414 3.613 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@](C)(F)CC2)c([N+](=O)[O-])c1 ZINC001170330048 1024746788 /nfs/dbraw/zinc/74/67/88/1024746788.db2.gz XGVXQWNYIJANST-CXAGYDPISA-N 1 1 324.396 3.749 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170352788 1024748577 /nfs/dbraw/zinc/74/85/77/1024748577.db2.gz QGXPRGNHOOCBNH-HIFRSBDPSA-N 1 1 306.406 3.799 20 5 DHBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111311336 1024754144 /nfs/dbraw/zinc/75/41/44/1024754144.db2.gz WKRPHYXXLJEKBQ-HNNXBMFYSA-N 1 1 317.414 3.869 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]3CCC[C@H]32)c([N+](=O)[O-])c1 ZINC001170348015 1024757180 /nfs/dbraw/zinc/75/71/80/1024757180.db2.gz URYCOZBPIMDGBO-JJRVBVJISA-N 1 1 318.417 3.799 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC001170347993 1024758071 /nfs/dbraw/zinc/75/80/71/1024758071.db2.gz UNJRKOODBWBGKX-MCIONIFRSA-N 1 1 306.406 3.655 20 5 DHBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CC1 ZINC000112983372 1024788768 /nfs/dbraw/zinc/78/87/68/1024788768.db2.gz ZEWCFFFCIBVDMA-UHFFFAOYSA-N 1 1 315.373 3.524 20 5 DHBDMO C[C@H]([N@@H+](C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C(C)(C)C ZINC000728897214 1024790742 /nfs/dbraw/zinc/79/07/42/1024790742.db2.gz LSNPBPAPCCUQJT-ZDUSSCGKSA-N 1 1 316.405 3.782 20 5 DHBDMO CC[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)[C@@H](C)C(C)C ZINC000728899888 1024918411 /nfs/dbraw/zinc/91/84/11/1024918411.db2.gz VCOVTWCXQJXQOE-AWEZNQCLSA-N 1 1 316.405 3.782 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000353698544 1025204199 /nfs/dbraw/zinc/20/41/99/1025204199.db2.gz MZJYZUBQIXJFLC-QGZVFWFLSA-N 1 1 311.385 3.881 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000353698544 1025204228 /nfs/dbraw/zinc/20/42/28/1025204228.db2.gz MZJYZUBQIXJFLC-QGZVFWFLSA-N 1 1 311.385 3.881 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000353884233 1025280043 /nfs/dbraw/zinc/28/00/43/1025280043.db2.gz WIBUCUFZIHWPIH-OLZOCXBDSA-N 1 1 322.405 3.623 20 5 DHBDMO CC(C)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cn1 ZINC000354023053 1025321990 /nfs/dbraw/zinc/32/19/90/1025321990.db2.gz WMBRADMZTAHLKL-MRXNPFEDSA-N 1 1 303.337 3.616 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccccc1OCC(F)F ZINC000885923727 1025405883 /nfs/dbraw/zinc/40/58/83/1025405883.db2.gz BPIHEDIUZHUPPK-UHFFFAOYSA-N 1 1 322.311 3.529 20 5 DHBDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886014616 1025439268 /nfs/dbraw/zinc/43/92/68/1025439268.db2.gz LPEMKDSBRRWEEY-WFASDCNBSA-N 1 1 315.348 3.507 20 5 DHBDMO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886023497 1025444013 /nfs/dbraw/zinc/44/40/13/1025444013.db2.gz QLMUQDPOJAQZBP-BLLLJJGKSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886023497 1025444017 /nfs/dbraw/zinc/44/40/17/1025444017.db2.gz QLMUQDPOJAQZBP-BLLLJJGKSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886021504 1025444023 /nfs/dbraw/zinc/44/40/23/1025444023.db2.gz XWTCUEALKGTQKS-LRDDRELGSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886021504 1025444027 /nfs/dbraw/zinc/44/40/27/1025444027.db2.gz XWTCUEALKGTQKS-LRDDRELGSA-N 1 1 315.348 3.712 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccns1 ZINC000860053379 1033290056 /nfs/dbraw/zinc/29/00/56/1033290056.db2.gz BXICRXMSBIUWSF-NSHDSACASA-N 1 1 321.402 3.689 20 5 DHBDMO CC(C)(C)[N@H+](Cc1ccsc1)Cc1cccnc1[N+](=O)[O-] ZINC000886273950 1025576872 /nfs/dbraw/zinc/57/68/72/1025576872.db2.gz JOXLTIVXPLFCDT-UHFFFAOYSA-N 1 1 305.403 3.852 20 5 DHBDMO CC(C)(C)[N@@H+](Cc1ccsc1)Cc1cccnc1[N+](=O)[O-] ZINC000886273950 1025576882 /nfs/dbraw/zinc/57/68/82/1025576882.db2.gz JOXLTIVXPLFCDT-UHFFFAOYSA-N 1 1 305.403 3.852 20 5 DHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)C12CCC2 ZINC000355156787 1025617642 /nfs/dbraw/zinc/61/76/42/1025617642.db2.gz DPLFDNMEIDNVHM-IRXDYDNUSA-N 1 1 318.417 3.683 20 5 DHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)C12CCC2 ZINC000355156786 1025619565 /nfs/dbraw/zinc/61/95/65/1025619565.db2.gz DPLFDNMEIDNVHM-IAGOWNOFSA-N 1 1 318.417 3.683 20 5 DHBDMO COc1cc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)ccn1 ZINC000805835483 1025678797 /nfs/dbraw/zinc/67/87/97/1025678797.db2.gz NIJUBXHCUDVRKN-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]Cc2cc(C3CC3)no2)cccc1[N+](=O)[O-] ZINC000886682189 1025783386 /nfs/dbraw/zinc/78/33/86/1025783386.db2.gz BJOFRHNPXGVZNN-LLVKDONJSA-N 1 1 301.346 3.619 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cc(C3CC3)no1)CCC2 ZINC000886684176 1025786070 /nfs/dbraw/zinc/78/60/70/1025786070.db2.gz GPKXTOOSGWZEHZ-MRXNPFEDSA-N 1 1 313.357 3.627 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCOCC2(CCCC2)C1 ZINC000614222693 1025954514 /nfs/dbraw/zinc/95/45/14/1025954514.db2.gz ZQACSUXEEIIVGY-AWEZNQCLSA-N 1 1 304.390 3.548 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1N(C)C ZINC000089512276 1026053499 /nfs/dbraw/zinc/05/34/99/1026053499.db2.gz HNLFFWNDSXGUME-GFCCVEGCSA-N 1 1 317.364 3.651 20 5 DHBDMO C[C@@]1(c2ccc(F)cc2)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000482574742 1026092922 /nfs/dbraw/zinc/09/29/22/1026092922.db2.gz GHLZZICUEXSDCX-GOSISDBHSA-N 1 1 314.360 3.898 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000289853382 1026201085 /nfs/dbraw/zinc/20/10/85/1026201085.db2.gz QKURNTJARZUOOC-WQVCFCJDSA-N 1 1 304.390 3.545 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@]3(CCCOC3)C2)c1 ZINC000747532732 1026417726 /nfs/dbraw/zinc/41/77/26/1026417726.db2.gz RPPNXDQHCXYVBG-MRXNPFEDSA-N 1 1 324.808 3.641 20 5 DHBDMO CCCCC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(C)C ZINC000047628010 1026485785 /nfs/dbraw/zinc/48/57/85/1026485785.db2.gz STWJYHRDGNNCRW-UHFFFAOYSA-N 1 1 322.405 3.862 20 5 DHBDMO COC(C)(C)C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809953948 1026650610 /nfs/dbraw/zinc/65/06/10/1026650610.db2.gz OAXLOAVEFBPYTE-UHFFFAOYSA-N 1 1 321.204 3.758 20 5 DHBDMO CO[C@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000810014954 1026664462 /nfs/dbraw/zinc/66/44/62/1026664462.db2.gz GJGVMSVSWSTWTM-PHIMTYICSA-N 1 1 319.188 3.511 20 5 DHBDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000810014954 1026664469 /nfs/dbraw/zinc/66/44/69/1026664469.db2.gz GJGVMSVSWSTWTM-PHIMTYICSA-N 1 1 319.188 3.511 20 5 DHBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000810015860 1026665227 /nfs/dbraw/zinc/66/52/27/1026665227.db2.gz RMFVADBMPAJYPQ-LLVKDONJSA-N 1 1 319.188 3.512 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000810015860 1026665228 /nfs/dbraw/zinc/66/52/28/1026665228.db2.gz RMFVADBMPAJYPQ-LLVKDONJSA-N 1 1 319.188 3.512 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](C4CCCC4)C3)nc2c1 ZINC000420959937 1026893080 /nfs/dbraw/zinc/89/30/80/1026893080.db2.gz FZQNHKZPBSXMGI-ZDUSSCGKSA-N 1 1 315.373 3.748 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](CCO)CC2)cc1[N+](=O)[O-] ZINC000421391211 1026978196 /nfs/dbraw/zinc/97/81/96/1026978196.db2.gz ABIAIUFDYORVJN-OAHLLOKOSA-N 1 1 320.433 3.703 20 5 DHBDMO CC(C)[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CCS1 ZINC000687932812 1027009302 /nfs/dbraw/zinc/00/93/02/1027009302.db2.gz IUAPVMMRHHZSOK-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CCS1 ZINC000687932812 1027009308 /nfs/dbraw/zinc/00/93/08/1027009308.db2.gz IUAPVMMRHHZSOK-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](CC(C)C)C(C)C ZINC000063495997 1027026833 /nfs/dbraw/zinc/02/68/33/1027026833.db2.gz TVWJYMMXDSTODI-UHFFFAOYSA-N 1 1 321.421 3.598 20 5 DHBDMO Cc1c(C[NH2+]Cc2cccc(Cl)c2F)cccc1[N+](=O)[O-] ZINC000231884348 1027139928 /nfs/dbraw/zinc/13/99/28/1027139928.db2.gz XZZLOQGNHNZQPW-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)nc1Cl ZINC000932176420 1027395008 /nfs/dbraw/zinc/39/50/08/1027395008.db2.gz DJKOMTBKDPEHIB-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)cc1 ZINC000932197071 1027409908 /nfs/dbraw/zinc/40/99/08/1027409908.db2.gz CLEPZLVZCAKYQM-AWEZNQCLSA-N 1 1 317.414 3.506 20 5 DHBDMO Cc1c(C[NH2+]Cc2nc(-c3ccccc3)c[nH]2)cccc1[N+](=O)[O-] ZINC000574716812 1027420615 /nfs/dbraw/zinc/42/06/15/1027420615.db2.gz RIOXYJIGLGYTRE-UHFFFAOYSA-N 1 1 322.368 3.583 20 5 DHBDMO Cc1ccc(F)c(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000576130211 1027569317 /nfs/dbraw/zinc/56/93/17/1027569317.db2.gz JLKSOUPMJOQZBW-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](C3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000933089327 1027674597 /nfs/dbraw/zinc/67/45/97/1027674597.db2.gz QTGQHRZYLMDPLD-QGZVFWFLSA-N 1 1 318.417 3.542 20 5 DHBDMO C[C@@H]1CN(c2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000813630507 1027691039 /nfs/dbraw/zinc/69/10/39/1027691039.db2.gz NCARCIUDKRDENY-LBPRGKRZSA-N 1 1 323.824 3.559 20 5 DHBDMO C[N@@H+](CCCCOC(C)(C)C)CCc1cccc([N+](=O)[O-])c1 ZINC000577194569 1027724391 /nfs/dbraw/zinc/72/43/91/1027724391.db2.gz GRUZPGRFTPTARU-UHFFFAOYSA-N 1 1 308.422 3.664 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC=C(c2cccnc2)CC1 ZINC000365388479 1027936394 /nfs/dbraw/zinc/93/63/94/1027936394.db2.gz HGIOWYLPXZZERG-AWEZNQCLSA-N 1 1 309.369 3.840 20 5 DHBDMO CSC[C@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601168084 1028009048 /nfs/dbraw/zinc/00/90/48/1028009048.db2.gz OCELOIQQMVMWSS-LBPRGKRZSA-N 1 1 317.414 3.722 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C)o2)cc1[N+](=O)[O-] ZINC000601304080 1028066637 /nfs/dbraw/zinc/06/66/37/1028066637.db2.gz LOKWCAMHRJFLTC-GFCCVEGCSA-N 1 1 304.346 3.746 20 5 DHBDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000217005692 1028068709 /nfs/dbraw/zinc/06/87/09/1028068709.db2.gz KEEDMOIZCTYQEY-OAHLLOKOSA-N 1 1 310.369 3.515 20 5 DHBDMO C[C@H](C[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000578285701 1028111101 /nfs/dbraw/zinc/11/11/01/1028111101.db2.gz ROZJEHWLGMWOOQ-CQSZACIVSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@H]([NH2+][C@H]1c2ccc(F)cc2O[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000367575449 1028208695 /nfs/dbraw/zinc/20/86/95/1028208695.db2.gz KUHVYQINEZDXEC-PSVSLLHZSA-N 1 1 316.332 3.907 20 5 DHBDMO CC(C)([NH2+]Cc1cnc(C2CC2)s1)c1ccccc1[N+](=O)[O-] ZINC000578705003 1028219268 /nfs/dbraw/zinc/21/92/68/1028219268.db2.gz QAMGFMIMXBPWAX-UHFFFAOYSA-N 1 1 317.414 3.954 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000010087131 1028555853 /nfs/dbraw/zinc/55/58/53/1028555853.db2.gz DVLFELKAXKUBPD-KRWDZBQOSA-N 1 1 312.369 3.941 20 5 DHBDMO C[C@H]([NH2+][C@H]1c2cccc(F)c2O[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000370573371 1028621259 /nfs/dbraw/zinc/62/12/59/1028621259.db2.gz DHBGNHOVFFVBQM-LYOVBCGYSA-N 1 1 316.332 3.907 20 5 DHBDMO Cc1cnc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449499374 1028713424 /nfs/dbraw/zinc/71/34/24/1028713424.db2.gz MAERECMROZRPRW-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO Cc1cnc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449499378 1028715240 /nfs/dbraw/zinc/71/52/40/1028715240.db2.gz MAERECMROZRPRW-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO CCO[C@@H]1CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000449510313 1028735627 /nfs/dbraw/zinc/73/56/27/1028735627.db2.gz XCGNAKACWQWIKY-DJDSVLOFSA-N 1 1 318.417 3.745 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2ncoc2-c2ccccc2)c1 ZINC000372785701 1028902200 /nfs/dbraw/zinc/90/22/00/1028902200.db2.gz HODQFVUKPDYSPP-UHFFFAOYSA-N 1 1 309.325 3.540 20 5 DHBDMO C[C@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000816649566 1028974579 /nfs/dbraw/zinc/97/45/79/1028974579.db2.gz CPVDBFHDEJGXLT-QWRGUYRKSA-N 1 1 303.387 3.559 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000816649566 1028974591 /nfs/dbraw/zinc/97/45/91/1028974591.db2.gz CPVDBFHDEJGXLT-QWRGUYRKSA-N 1 1 303.387 3.559 20 5 DHBDMO CC(=O)N[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000817412023 1029152087 /nfs/dbraw/zinc/15/20/87/1029152087.db2.gz BJEIAOCUWLQOME-SFHVURJKSA-N 1 1 318.420 3.703 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCSC2(CCC2)CC1 ZINC000411863393 1029225358 /nfs/dbraw/zinc/22/53/58/1029225358.db2.gz CHKGGNGCWFRNHQ-UHFFFAOYSA-N 1 1 310.394 3.596 20 5 DHBDMO C[NH+](C)CC[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(C)C ZINC000569941397 1029287773 /nfs/dbraw/zinc/28/77/73/1029287773.db2.gz OLYOXWWGQTXGPW-DOTOQJQBSA-N 1 1 319.449 3.538 20 5 DHBDMO CN(C)CC[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(C)C ZINC000569941397 1029287791 /nfs/dbraw/zinc/28/77/91/1029287791.db2.gz OLYOXWWGQTXGPW-DOTOQJQBSA-N 1 1 319.449 3.538 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)Nc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000570443304 1029367070 /nfs/dbraw/zinc/36/70/70/1029367070.db2.gz XBPBEBXIVXPWLA-ZDUSSCGKSA-N 1 1 309.410 3.526 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C[C@H]2CCOC2)C2CC2)cc1[N+](=O)[O-] ZINC000129987593 1029718188 /nfs/dbraw/zinc/71/81/88/1029718188.db2.gz HHWVTDWRFZFMFB-OAHLLOKOSA-N 1 1 318.417 3.719 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451332985 1029850776 /nfs/dbraw/zinc/85/07/76/1029850776.db2.gz ADZADYBRGRVGJP-GFOCRRMGSA-N 1 1 318.417 3.671 20 5 DHBDMO COCCCCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550862 1029911499 /nfs/dbraw/zinc/91/14/99/1029911499.db2.gz SQNOGYDBDISTJR-MRXNPFEDSA-N 1 1 306.406 3.591 20 5 DHBDMO CCCn1cc[nH+]c1CCCN(C)c1c(C)cccc1[N+](=O)[O-] ZINC000357683163 1030150320 /nfs/dbraw/zinc/15/03/20/1030150320.db2.gz HEDPKIXLVNGRAO-UHFFFAOYSA-N 1 1 316.405 3.579 20 5 DHBDMO C[C@H]1C[C@@H](Nc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000557589815 1030203692 /nfs/dbraw/zinc/20/36/92/1030203692.db2.gz ZHLJVTIAUDQWAM-WPRPVWTQSA-N 1 1 318.204 3.796 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000866539221 1030358932 /nfs/dbraw/zinc/35/89/32/1030358932.db2.gz JAUJGAWRDAAGCI-LBPRGKRZSA-N 1 1 315.329 3.662 20 5 DHBDMO CCCC[N@@H+](CCCO)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000558421884 1030570452 /nfs/dbraw/zinc/57/04/52/1030570452.db2.gz JURRDQVTBGLWDG-UHFFFAOYSA-N 1 1 308.422 3.703 20 5 DHBDMO Cc1c(C[N@H+]2C[C@@H](C)C[C@H]2c2cccnc2)cccc1[N+](=O)[O-] ZINC000358824931 1030638196 /nfs/dbraw/zinc/63/81/96/1030638196.db2.gz NXZZQYULPRKJTD-UGSOOPFHSA-N 1 1 311.385 3.881 20 5 DHBDMO COc1ccccc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291809938 1030652823 /nfs/dbraw/zinc/65/28/23/1030652823.db2.gz YAGCQLAWUAVHOV-UHFFFAOYSA-N 1 1 300.358 3.628 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCCC3(CC3)C2)c1 ZINC000339096091 1030888955 /nfs/dbraw/zinc/88/89/55/1030888955.db2.gz HXXOYWAQXYTGGA-UHFFFAOYSA-N 1 1 314.307 3.990 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000339096091 1030888975 /nfs/dbraw/zinc/88/89/75/1030888975.db2.gz HXXOYWAQXYTGGA-UHFFFAOYSA-N 1 1 314.307 3.990 20 5 DHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC1CCC1 ZINC000559094453 1031120009 /nfs/dbraw/zinc/12/00/09/1031120009.db2.gz IZYMGBIXVPCURL-UHFFFAOYSA-N 1 1 302.296 3.846 20 5 DHBDMO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042879 1031427794 /nfs/dbraw/zinc/42/77/94/1031427794.db2.gz DXZGSZLNFGMNMG-VXGBXAGGSA-N 1 1 303.337 3.849 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c(C)c1 ZINC000872050017 1031439021 /nfs/dbraw/zinc/43/90/21/1031439021.db2.gz XVNUSYLCOXKCNM-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000293601687 1031534405 /nfs/dbraw/zinc/53/44/05/1031534405.db2.gz OYKWYDHUNXVQIB-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+]Cc3c(C)ccc([N+](=O)[O-])c3C)nc2c1 ZINC000873066902 1031700186 /nfs/dbraw/zinc/70/01/86/1031700186.db2.gz LBGIRIQMTCEESA-UHFFFAOYSA-N 1 1 324.384 3.686 20 5 DHBDMO Cc1ccc2nc(C[NH2+]Cc3c(C)ccc([N+](=O)[O-])c3C)[nH]c2c1 ZINC000873066902 1031700190 /nfs/dbraw/zinc/70/01/90/1031700190.db2.gz LBGIRIQMTCEESA-UHFFFAOYSA-N 1 1 324.384 3.686 20 5 DHBDMO CC(C)c1ccc(C[N@H+](C(C)C)[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000361080792 1031716428 /nfs/dbraw/zinc/71/64/28/1031716428.db2.gz MCJNBPSTCIVIFD-HNNXBMFYSA-N 1 1 306.406 3.718 20 5 DHBDMO CC[N@@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1CCCC1 ZINC000777955126 1032034278 /nfs/dbraw/zinc/03/42/78/1032034278.db2.gz MXJLZXDDBXXCAX-UHFFFAOYSA-N 1 1 314.389 3.680 20 5 DHBDMO C[C@@H]1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C[C@H]1F ZINC001172907468 1033440441 /nfs/dbraw/zinc/44/04/41/1033440441.db2.gz FGHGFYTVXVOZCM-SRCQZFHVSA-N 1 1 306.381 3.522 20 5 DHBDMO CC(C)[C@@H]1CCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922622 1033469310 /nfs/dbraw/zinc/46/93/10/1033469310.db2.gz ZIZJOKBTVUSWIQ-AEFFLSMTSA-N 1 1 302.418 3.963 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000152554122 1033527822 /nfs/dbraw/zinc/52/78/22/1033527822.db2.gz SZPOJHHVZSJORF-OLZOCXBDSA-N 1 1 315.373 3.800 20 5 DHBDMO CC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H](C)C(C)C ZINC000878000021 1033547983 /nfs/dbraw/zinc/54/79/83/1033547983.db2.gz BVXGCYNXTOYLKC-GFCCVEGCSA-N 1 1 318.377 3.511 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(F)(F)C(C)(C)C1 ZINC001173220778 1033600254 /nfs/dbraw/zinc/60/02/54/1033600254.db2.gz CISAEKWDGMPUDT-LBPRGKRZSA-N 1 1 312.360 3.893 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](F)C(F)(F)CC1 ZINC001173224251 1033603689 /nfs/dbraw/zinc/60/36/89/1033603689.db2.gz DDMOHYXSQJCQOK-RISCZKNCSA-N 1 1 316.323 3.595 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1nccs1 ZINC001173233978 1033607947 /nfs/dbraw/zinc/60/79/47/1033607947.db2.gz NLKLRRSGGCZPCX-DOMZBBRYSA-N 1 1 317.414 3.819 20 5 DHBDMO Cc1cc(F)c(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(F)c1 ZINC000927094385 1033671857 /nfs/dbraw/zinc/67/18/57/1033671857.db2.gz SZMFBZVZNWRMQO-JTQLQIEISA-N 1 1 321.327 3.614 20 5 DHBDMO CC[C@H]([NH2+]Cc1cn2ccsc2n1)c1cccc([N+](=O)[O-])c1 ZINC000177760685 1034180024 /nfs/dbraw/zinc/18/00/24/1034180024.db2.gz ARWUYSJEZMTPPZ-AWEZNQCLSA-N 1 1 316.386 3.545 20 5 DHBDMO CC[C@H](C)C[N@@H+](CC)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000177860970 1034188801 /nfs/dbraw/zinc/18/88/01/1034188801.db2.gz FEOVSKLSEAFZDW-LBPRGKRZSA-N 1 1 318.377 3.513 20 5 DHBDMO C[C@H](Nc1[nH+]c2ccc(F)cc2n1C)c1ccc([N+](=O)[O-])cc1 ZINC000864019143 1034258250 /nfs/dbraw/zinc/25/82/50/1034258250.db2.gz POZYEAPQPWTYLQ-JTQLQIEISA-N 1 1 314.320 3.794 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]C[C@H](C(C)C)N2CCCC2)cccc1[N+](=O)[O-] ZINC000480552808 1034306147 /nfs/dbraw/zinc/30/61/47/1034306147.db2.gz KLYOJVRHFOVQPI-CRAIPNDOSA-N 1 1 319.449 3.674 20 5 DHBDMO CC[N@@H+](CC1CCC1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000794687429 1034339653 /nfs/dbraw/zinc/33/96/53/1034339653.db2.gz INVKLNKYGOURNE-UHFFFAOYSA-N 1 1 314.389 3.538 20 5 DHBDMO C[N@@H+](CCSc1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000554834510 1034366710 /nfs/dbraw/zinc/36/67/10/1034366710.db2.gz FLMFTPWMBWRGQU-UHFFFAOYSA-N 1 1 316.426 3.861 20 5 DHBDMO C[C@H](CN1CCCCCC1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000480699960 1034412539 /nfs/dbraw/zinc/41/25/39/1034412539.db2.gz QEMKHQOXWYIYNX-HUUCEWRRSA-N 1 1 305.422 3.510 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000480853346 1034475109 /nfs/dbraw/zinc/47/51/09/1034475109.db2.gz DVCHYYTVEYZPCS-LBPRGKRZSA-N 1 1 312.410 3.842 20 5 DHBDMO C[C@H](NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000481028072 1034560422 /nfs/dbraw/zinc/56/04/22/1034560422.db2.gz XRUSFRYQSBPRCU-CABCVRRESA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@H]([NH2+]CC(C)(C)N1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000481028072 1034560432 /nfs/dbraw/zinc/56/04/32/1034560432.db2.gz XRUSFRYQSBPRCU-CABCVRRESA-N 1 1 319.449 3.756 20 5 DHBDMO CC1(C)CCC(C)(C)[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001174724949 1034582389 /nfs/dbraw/zinc/58/23/89/1034582389.db2.gz LJENLZPIBBOTOC-HNNXBMFYSA-N 1 1 306.406 3.529 20 5 DHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCC1 ZINC000555364674 1034654930 /nfs/dbraw/zinc/65/49/30/1034654930.db2.gz NJHVQJAESUXUFN-UHFFFAOYSA-N 1 1 302.296 3.988 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](C3CC3)C2)c1 ZINC000555417916 1034695708 /nfs/dbraw/zinc/69/57/08/1034695708.db2.gz VMLZDILGZXBVKP-LLVKDONJSA-N 1 1 314.307 3.846 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000481756594 1034961123 /nfs/dbraw/zinc/96/11/23/1034961123.db2.gz OIFYGEQFAFZSBW-MFKMUULPSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000481756594 1034961135 /nfs/dbraw/zinc/96/11/35/1034961135.db2.gz OIFYGEQFAFZSBW-MFKMUULPSA-N 1 1 302.296 3.758 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H]2CCC(C)(C)C2)c([N+](=O)[O-])cc1F ZINC000483109287 1035228179 /nfs/dbraw/zinc/22/81/79/1035228179.db2.gz LOSSHSZYSOJUIR-LBPRGKRZSA-N 1 1 310.369 3.753 20 5 DHBDMO Cc1c([C@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000483195231 1035238672 /nfs/dbraw/zinc/23/86/72/1035238672.db2.gz JMEGLCSUBKEEFX-WMLDXEAASA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1c([C@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000483195231 1035238676 /nfs/dbraw/zinc/23/86/76/1035238676.db2.gz JMEGLCSUBKEEFX-WMLDXEAASA-N 1 1 321.465 3.920 20 5 DHBDMO CC[C@H](C)[C@H](C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)OC ZINC001179945669 1035542076 /nfs/dbraw/zinc/54/20/76/1035542076.db2.gz IXNVZORFTFACAG-NHYWBVRUSA-N 1 1 314.813 3.741 20 5 DHBDMO CC[C@H](C)[C@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)OC ZINC001179945669 1035542088 /nfs/dbraw/zinc/54/20/88/1035542088.db2.gz IXNVZORFTFACAG-NHYWBVRUSA-N 1 1 314.813 3.741 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000485719825 1035902434 /nfs/dbraw/zinc/90/24/34/1035902434.db2.gz WDQPEQSUGZTLBH-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000595359856 1036099756 /nfs/dbraw/zinc/09/97/56/1036099756.db2.gz WCRIREXKONPYHZ-INIZCTEOSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000595359856 1036099768 /nfs/dbraw/zinc/09/97/68/1036099768.db2.gz WCRIREXKONPYHZ-INIZCTEOSA-N 1 1 316.332 3.777 20 5 DHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@H]1CC=CCC1 ZINC000541320537 1036293937 /nfs/dbraw/zinc/29/39/37/1036293937.db2.gz SXWMFZHHXAUCID-LBPRGKRZSA-N 1 1 301.346 3.524 20 5 DHBDMO COc1ccccc1C[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000487858313 1036330431 /nfs/dbraw/zinc/33/04/31/1036330431.db2.gz MMYRCXWZWQUZSF-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1ccccc1C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000487858313 1036330451 /nfs/dbraw/zinc/33/04/51/1036330451.db2.gz MMYRCXWZWQUZSF-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1N1CCC[C@@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000774516706 1036389562 /nfs/dbraw/zinc/38/95/62/1036389562.db2.gz BDZCBYZZKYZZKV-HLLBOEOZSA-N 1 1 317.433 3.745 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000464782368 1036453971 /nfs/dbraw/zinc/45/39/71/1036453971.db2.gz YLYJJKHJEXRBGA-ZBFHGGJFSA-N 1 1 324.446 3.580 20 5 DHBDMO C[C@@H]1c2ccccc2OCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000609145423 1036507494 /nfs/dbraw/zinc/50/74/94/1036507494.db2.gz BRNZMCFMEQKGGS-CQSZACIVSA-N 1 1 312.369 3.593 20 5 DHBDMO CC[N@@H+](CCNc1ccc(C)cc1[N+](=O)[O-])CCC(F)(F)F ZINC000491602158 1036612832 /nfs/dbraw/zinc/61/28/32/1036612832.db2.gz RMPHRWOIAKTBDP-UHFFFAOYSA-N 1 1 319.327 3.589 20 5 DHBDMO COc1ccc(C[N@H+]2CCSC[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC001197295456 1036726307 /nfs/dbraw/zinc/72/63/07/1036726307.db2.gz GPUDSWVWCFEHES-HNNXBMFYSA-N 1 1 324.446 3.567 20 5 DHBDMO C[C@]1(c2ccccc2)CCC[N@H+]1Cc1cc([O-])ccc1[N+](=O)[O-] ZINC001197343499 1036744341 /nfs/dbraw/zinc/74/43/41/1036744341.db2.gz SYGAAGZPZROAKG-GOSISDBHSA-N 1 1 312.369 3.812 20 5 DHBDMO CCOc1cc(C[N@H+](C)Cc2ccc(C)o2)ccc1[N+](=O)[O-] ZINC000492373058 1036851319 /nfs/dbraw/zinc/85/13/19/1036851319.db2.gz DQKNDQZKLIWFHQ-UHFFFAOYSA-N 1 1 304.346 3.527 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2ccc(C)o2)ccc1[N+](=O)[O-] ZINC000492373058 1036851333 /nfs/dbraw/zinc/85/13/33/1036851333.db2.gz DQKNDQZKLIWFHQ-UHFFFAOYSA-N 1 1 304.346 3.527 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCSC[C@H](C)C1 ZINC000488229282 1036913771 /nfs/dbraw/zinc/91/37/71/1036913771.db2.gz GWXDQKJFZOFCFT-CYBMUJFWSA-N 1 1 324.446 3.567 20 5 DHBDMO CCCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C ZINC000774834075 1037036394 /nfs/dbraw/zinc/03/63/94/1037036394.db2.gz UDDWZJVOXMFDKA-UHFFFAOYSA-N 1 1 309.366 3.904 20 5 DHBDMO CCC(CC)C[N@@H+](CC)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774839224 1037060532 /nfs/dbraw/zinc/06/05/32/1037060532.db2.gz HPHYNZHKEWVJGH-UHFFFAOYSA-N 1 1 309.366 3.761 20 5 DHBDMO C[C@@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000488710676 1037113173 /nfs/dbraw/zinc/11/31/73/1037113173.db2.gz GDKSCJUBLHCDOK-LBPRGKRZSA-N 1 1 323.824 3.559 20 5 DHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774906712 1037196071 /nfs/dbraw/zinc/19/60/71/1037196071.db2.gz YEAXUJGGECHDKG-NEPJUHHUSA-N 1 1 307.350 3.514 20 5 DHBDMO CC(C)[C@@H]1C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000493133435 1037204624 /nfs/dbraw/zinc/20/46/24/1037204624.db2.gz PLDBMZPOLLWTKO-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000493133435 1037204640 /nfs/dbraw/zinc/20/46/40/1037204640.db2.gz PLDBMZPOLLWTKO-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO Cc1cc(F)ccc1C[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000488031967 1037297626 /nfs/dbraw/zinc/29/76/26/1037297626.db2.gz FMERXRMQRNXEPL-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO C[N@@H+](CCc1cccs1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761515242 1037341243 /nfs/dbraw/zinc/34/12/43/1037341243.db2.gz SCIZXNXNPKMRIJ-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO CC[C@@H](C)C[N@@H+](CC)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000489353375 1037369619 /nfs/dbraw/zinc/36/96/19/1037369619.db2.gz GXLFBDGEEKHZCT-OCCSQVGLSA-N 1 1 321.421 3.598 20 5 DHBDMO CC(C)C[N@@H+](C)CCCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC001186914608 1037529188 /nfs/dbraw/zinc/52/91/88/1037529188.db2.gz NOYXNMFOQKBQNX-UHFFFAOYSA-N 1 1 316.405 3.533 20 5 DHBDMO Cc1ccc(C[NH2+][C@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC001201373449 1037617573 /nfs/dbraw/zinc/61/75/73/1037617573.db2.gz WTCKRPKVIJCURT-AWEZNQCLSA-N 1 1 318.760 3.780 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]2Cc2ccccc2)c(F)c1 ZINC000490402605 1037708828 /nfs/dbraw/zinc/70/88/28/1037708828.db2.gz QTJPXDCYPJEEOG-OAHLLOKOSA-N 1 1 300.333 3.551 20 5 DHBDMO CC[N@@H+](CCc1cccs1)Cc1ccc([N+](=O)[O-])cc1F ZINC000491150101 1037925841 /nfs/dbraw/zinc/92/58/41/1037925841.db2.gz UYOWGBKPYXJPSB-UHFFFAOYSA-N 1 1 308.378 3.860 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC(C)(C)CO1 ZINC001190529405 1038336386 /nfs/dbraw/zinc/33/63/86/1038336386.db2.gz SIMBGNOFZYJTCM-MRXNPFEDSA-N 1 1 306.406 3.620 20 5 DHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C2CCCCCC2)c1 ZINC000589495092 1038486157 /nfs/dbraw/zinc/48/61/57/1038486157.db2.gz YLRATCSETVUFOE-UHFFFAOYSA-N 1 1 320.389 3.536 20 5 DHBDMO CCC(CC)[N@@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])C1CC1 ZINC000589494948 1038486607 /nfs/dbraw/zinc/48/66/07/1038486607.db2.gz BFOHTZIELFTTHT-UHFFFAOYSA-N 1 1 320.389 3.534 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CC1CCC(F)(F)CC1)CC2 ZINC001191520195 1038512749 /nfs/dbraw/zinc/51/27/49/1038512749.db2.gz FDZLWPYMSOACKQ-UHFFFAOYSA-N 1 1 310.344 3.778 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC001192626862 1038687647 /nfs/dbraw/zinc/68/76/47/1038687647.db2.gz QQBANDDFJZILQK-ZDUSSCGKSA-N 1 1 324.384 3.641 20 5 DHBDMO CCO[C@H](C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C)C1CC1 ZINC000599270525 1039110394 /nfs/dbraw/zinc/11/03/94/1039110394.db2.gz NHMSZEMTGQVETN-QGZVFWFLSA-N 1 1 306.406 3.620 20 5 DHBDMO Cc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])CC2CC2)cn1 ZINC000592144946 1039131263 /nfs/dbraw/zinc/13/12/63/1039131263.db2.gz KOZOPASHOCSNIH-UHFFFAOYSA-N 1 1 311.385 3.710 20 5 DHBDMO Cc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])CC2CC2)cn1 ZINC000592144946 1039131271 /nfs/dbraw/zinc/13/12/71/1039131271.db2.gz KOZOPASHOCSNIH-UHFFFAOYSA-N 1 1 311.385 3.710 20 5 DHBDMO C[N@@H+](CCC(C)(C)C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000592144540 1039138163 /nfs/dbraw/zinc/13/81/63/1039138163.db2.gz MBZSPZIPEVCXKU-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO Cc1ccccc1OCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000603836974 1039178584 /nfs/dbraw/zinc/17/85/84/1039178584.db2.gz NGJMWXUHKRMYQI-UHFFFAOYSA-N 1 1 314.385 3.722 20 5 DHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCc1ccccc1 ZINC000603852206 1039187075 /nfs/dbraw/zinc/18/70/75/1039187075.db2.gz JDXWJJDXAKUMRO-UHFFFAOYSA-N 1 1 314.385 3.538 20 5 DHBDMO CCc1ccc(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603840046 1039195402 /nfs/dbraw/zinc/19/54/02/1039195402.db2.gz UKOCWCKDALPULC-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO Cc1ccccc1C[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012430 1039281178 /nfs/dbraw/zinc/28/11/78/1039281178.db2.gz MRIAMJGERLPCRN-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO CCCC[C@@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000574085325 1039389793 /nfs/dbraw/zinc/38/97/93/1039389793.db2.gz ZKOCWFBLPZZSAO-CQSZACIVSA-N 1 1 321.421 3.742 20 5 DHBDMO C[C@@H]([NH2+][C@@H](CCO)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000592402894 1039463530 /nfs/dbraw/zinc/46/35/30/1039463530.db2.gz LNCQNVKYFFKMGD-PXAZEXFGSA-N 1 1 318.348 3.508 20 5 DHBDMO CC(C)c1ccc(CNCC[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000604532766 1039496830 /nfs/dbraw/zinc/49/68/30/1039496830.db2.gz FIYKOMAXFPSIDB-UHFFFAOYSA-N 1 1 319.449 3.540 20 5 DHBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000058789706 1039555938 /nfs/dbraw/zinc/55/59/38/1039555938.db2.gz XIKZPZCPEKNJKS-UHFFFAOYSA-N 1 1 309.385 3.800 20 5 DHBDMO CCC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000574532578 1039738354 /nfs/dbraw/zinc/73/83/54/1039738354.db2.gz OEDVMGQLTWIKBU-UHFFFAOYSA-N 1 1 316.405 3.616 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)c1c(C)noc1C ZINC000595008382 1040019950 /nfs/dbraw/zinc/01/99/50/1040019950.db2.gz OISLSHXWZMBNJA-VHSXEESVSA-N 1 1 319.361 3.620 20 5 DHBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000595288972 1040092281 /nfs/dbraw/zinc/09/22/81/1040092281.db2.gz CTTUMZNBQGIQSC-INIZCTEOSA-N 1 1 300.333 3.853 20 5 DHBDMO Cc1noc(C[N@H+](CCc2ccccc2)CC(C)C)c1[N+](=O)[O-] ZINC000595293730 1040093109 /nfs/dbraw/zinc/09/31/09/1040093109.db2.gz FPOQQZIZUNUEDJ-UHFFFAOYSA-N 1 1 317.389 3.592 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2c2cc(C)ccc2C)c1[N+](=O)[O-] ZINC000595348922 1040104314 /nfs/dbraw/zinc/10/43/14/1040104314.db2.gz WMZCJRUHFLCPSJ-HNNXBMFYSA-N 1 1 315.373 3.845 20 5 DHBDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595312950 1040105609 /nfs/dbraw/zinc/10/56/09/1040105609.db2.gz QAEHWMVQNSIZAK-HNNXBMFYSA-N 1 1 310.369 3.515 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](c2ccc(F)c(C)c2)C2CC2)c1[N+](=O)[O-] ZINC000595425586 1040135951 /nfs/dbraw/zinc/13/59/51/1040135951.db2.gz UKXUKGPILGRTQA-OAHLLOKOSA-N 1 1 319.336 3.580 20 5 DHBDMO CC[C@@H](C[N@@H+](CC)Cc1onc(C)c1[N+](=O)[O-])c1ccccc1 ZINC000595448152 1040140976 /nfs/dbraw/zinc/14/09/76/1040140976.db2.gz JQIQTMKHPFREQC-AWEZNQCLSA-N 1 1 317.389 3.907 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H](c2ccncc2)C1 ZINC000595488989 1040142575 /nfs/dbraw/zinc/14/25/75/1040142575.db2.gz MTNVHUDPMWSPOD-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO Cc1noc(C[N@@H+]2CC(C)(C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595554054 1040174345 /nfs/dbraw/zinc/17/43/45/1040174345.db2.gz QWRIOHMOSWXBFX-AWEZNQCLSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1noc(C[N@H+]2CC(C)(C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595554054 1040174355 /nfs/dbraw/zinc/17/43/55/1040174355.db2.gz QWRIOHMOSWXBFX-AWEZNQCLSA-N 1 1 315.373 3.864 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000595788270 1040253171 /nfs/dbraw/zinc/25/31/71/1040253171.db2.gz HXAVPYIEVWQWRP-UWWQBHOKSA-N 1 1 318.417 3.937 20 5 DHBDMO Cc1nn(C[C@H]2CCCC[N@@H+]2C(C)C)c2ccc([N+](=O)[O-])cc12 ZINC000596266729 1040350725 /nfs/dbraw/zinc/35/07/25/1040350725.db2.gz UWXQEKHZXJKLAL-OAHLLOKOSA-N 1 1 316.405 3.516 20 5 DHBDMO C[C@@H](C[N@@H+](C)CCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000608976593 1040655946 /nfs/dbraw/zinc/65/59/46/1040655946.db2.gz BULFQECIDYXZJR-HNNXBMFYSA-N 1 1 314.385 3.709 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000608976692 1040657081 /nfs/dbraw/zinc/65/70/81/1040657081.db2.gz IKHZGWPKXVKARN-AWEZNQCLSA-N 1 1 314.385 3.839 20 5 DHBDMO C[N@@H+](Cc1ccnc2ccccc12)Cc1ccccc1[N+](=O)[O-] ZINC000534341858 1040811036 /nfs/dbraw/zinc/81/10/36/1040811036.db2.gz CKFODCUDAIULNW-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO C[N@H+](Cc1ccnc2ccccc12)Cc1ccccc1[N+](=O)[O-] ZINC000534341858 1040811045 /nfs/dbraw/zinc/81/10/45/1040811045.db2.gz CKFODCUDAIULNW-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]1CCSC1 ZINC000602441528 1041036295 /nfs/dbraw/zinc/03/62/95/1041036295.db2.gz OMLGSKAZLPCIFO-NSHDSACASA-N 1 1 320.336 3.551 20 5 DHBDMO C[C@@H](C1CC1)[N@@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602444231 1041037241 /nfs/dbraw/zinc/03/72/41/1041037241.db2.gz ZLXZGMBCRKKJJQ-ZETCQYMHSA-N 1 1 319.224 3.649 20 5 DHBDMO Cc1ncc([C@H](C)[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(C)n1 ZINC000602675221 1041142312 /nfs/dbraw/zinc/14/23/12/1041142312.db2.gz ZMPKPMVZBMXDSU-LBPRGKRZSA-N 1 1 314.389 3.588 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2cccnc2)C1 ZINC000602852126 1041259551 /nfs/dbraw/zinc/25/95/51/1041259551.db2.gz CPMDOLVEWLGXOS-GDBMZVCRSA-N 1 1 311.385 3.930 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761280105 1041282424 /nfs/dbraw/zinc/28/24/24/1041282424.db2.gz LTTZCOYXJQZQJK-OCCSQVGLSA-N 1 1 316.405 3.721 20 5 DHBDMO COc1cc(C[NH2+]C2(c3ccccc3)CC2)c([N+](=O)[O-])cc1F ZINC000274310114 130226062 /nfs/dbraw/zinc/22/60/62/130226062.db2.gz MCMBVXCYQIHERQ-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)N[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353480649 131109363 /nfs/dbraw/zinc/10/93/63/131109363.db2.gz CGWRCWGYHYDUQA-RHSMWYFYSA-N 1 1 307.438 3.756 20 5 DHBDMO CCCN(CC)C[C@@H](C)[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353480649 131109364 /nfs/dbraw/zinc/10/93/64/131109364.db2.gz CGWRCWGYHYDUQA-RHSMWYFYSA-N 1 1 307.438 3.756 20 5 DHBDMO COC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000288502551 131327678 /nfs/dbraw/zinc/32/76/78/131327678.db2.gz IEGNMCTVURLXQR-MRXNPFEDSA-N 1 1 320.776 3.726 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000298723252 132075377 /nfs/dbraw/zinc/07/53/77/132075377.db2.gz LVRJRXSRYMKTOD-LBPRGKRZSA-N 1 1 302.296 3.678 20 5 DHBDMO CCC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC(C)C ZINC000299363894 132101260 /nfs/dbraw/zinc/10/12/60/132101260.db2.gz FBFKZSNDMYNDQA-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H](C)C1 ZINC000089903679 332079739 /nfs/dbraw/zinc/07/97/39/332079739.db2.gz IQUVDWSOQOFVKT-CHWSQXEVSA-N 1 1 315.373 3.870 20 5 DHBDMO C[C@H]1COCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000091814857 332112447 /nfs/dbraw/zinc/11/24/47/332112447.db2.gz PYYJHNBDHXZZDT-LBPRGKRZSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@H]1COCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000091814857 332112448 /nfs/dbraw/zinc/11/24/48/332112448.db2.gz PYYJHNBDHXZZDT-LBPRGKRZSA-N 1 1 318.398 3.544 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccn(C(C)C)n1 ZINC000584284685 332211248 /nfs/dbraw/zinc/21/12/48/332211248.db2.gz PHBIXXZGCMDHSY-ZDUSSCGKSA-N 1 1 302.378 3.531 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cn3ccccc3n2)cc1[N+](=O)[O-] ZINC000559918133 332292642 /nfs/dbraw/zinc/29/26/42/332292642.db2.gz RSZINSUYMFYSHX-KGLIPLIRSA-N 1 1 324.384 3.963 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000182850845 333048260 /nfs/dbraw/zinc/04/82/60/333048260.db2.gz FZQDLUUTFKHVGV-HDMKZQKVSA-N 1 1 318.417 3.591 20 5 DHBDMO CCC(CC)[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])C1CC1 ZINC000525787541 333313676 /nfs/dbraw/zinc/31/36/76/333313676.db2.gz VRKCIICLULJJPS-UHFFFAOYSA-N 1 1 322.405 3.635 20 5 DHBDMO CCN(Cc1ccc(C(C)C)c([N+](=O)[O-])c1)[C@@H]1CCC[NH2+]CC1 ZINC000414709947 334072153 /nfs/dbraw/zinc/07/21/53/334072153.db2.gz FPSDWKNZYJPWBI-MRXNPFEDSA-N 1 1 319.449 3.682 20 5 DHBDMO CC[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000297509387 334242020 /nfs/dbraw/zinc/24/20/20/334242020.db2.gz CKWPXJIRMYRIDV-BYCMXARLSA-N 1 1 300.362 3.538 20 5 DHBDMO CC(C)c1ccc(C[NH2+]Cc2ccc(F)cn2)cc1[N+](=O)[O-] ZINC000344910787 335284915 /nfs/dbraw/zinc/28/49/15/335284915.db2.gz WKFCBDOAFGDDLW-UHFFFAOYSA-N 1 1 303.337 3.542 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2ccccc2N(C)C)cc1[N+](=O)[O-] ZINC000583661267 336035395 /nfs/dbraw/zinc/03/53/95/336035395.db2.gz IIHXMMPNMXXSDW-UHFFFAOYSA-N 1 1 313.401 3.601 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2C)ccc1[N+](=O)[O-] ZINC000351978405 336185124 /nfs/dbraw/zinc/18/51/24/336185124.db2.gz SDICGDRMRDMFQX-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO CC[N@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C[C@@H]1CCCO1 ZINC000352652412 336228838 /nfs/dbraw/zinc/22/88/38/336228838.db2.gz NPZCYSZSCZHWMN-HNNXBMFYSA-N 1 1 306.406 3.719 20 5 DHBDMO Cc1ccn2cc(C[NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)nc2c1 ZINC000532484608 336251698 /nfs/dbraw/zinc/25/16/98/336251698.db2.gz FINWLEVXAZPLGF-AWEZNQCLSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1ccn2cc(C[NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)nc2c1 ZINC000532484609 336251715 /nfs/dbraw/zinc/25/17/15/336251715.db2.gz FINWLEVXAZPLGF-CQSZACIVSA-N 1 1 324.384 3.710 20 5 DHBDMO CC[C@@H](N[C@@H](C)C[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000192846511 336268502 /nfs/dbraw/zinc/26/85/02/336268502.db2.gz NGKQJCIICVKLCV-WMLDXEAASA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1cccc(F)c1[N+](=O)[O-] ZINC000301097883 336289914 /nfs/dbraw/zinc/28/99/14/336289914.db2.gz NQTNNWNYYAKNLD-ZDUSSCGKSA-N 1 1 309.385 3.800 20 5 DHBDMO Cc1ccc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000302824079 336370735 /nfs/dbraw/zinc/37/07/35/336370735.db2.gz LMHXOIKUNXEMFB-AEFFLSMTSA-N 1 1 311.385 3.761 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000375238526 337006358 /nfs/dbraw/zinc/00/63/58/337006358.db2.gz RIKMZOBGOGPGAT-GJZGRUSLSA-N 1 1 318.417 3.855 20 5 DHBDMO COC[C@H]1CCCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000376389883 337032433 /nfs/dbraw/zinc/03/24/33/337032433.db2.gz YKZFMFOGKPUCRN-CABCVRRESA-N 1 1 306.406 3.713 20 5 DHBDMO COc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1C ZINC000193701602 337079133 /nfs/dbraw/zinc/07/91/33/337079133.db2.gz MKMDMFRKTKPERT-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1C ZINC000193701602 337079134 /nfs/dbraw/zinc/07/91/34/337079134.db2.gz MKMDMFRKTKPERT-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000174353506 337141045 /nfs/dbraw/zinc/14/10/45/337141045.db2.gz RWMRJIVZRWSEPX-ZIAGYGMSSA-N 1 1 324.446 3.709 20 5 DHBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000185489344 337205732 /nfs/dbraw/zinc/20/57/32/337205732.db2.gz ZJSLOTYTFGBWER-CYBMUJFWSA-N 1 1 317.414 3.540 20 5 DHBDMO CCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(C)C ZINC000532927650 337393346 /nfs/dbraw/zinc/39/33/46/337393346.db2.gz IDPKOCRAYLXWFJ-UHFFFAOYSA-N 1 1 321.421 3.600 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@@H]3CCC[C@@H]32)c1 ZINC000428452089 338052303 /nfs/dbraw/zinc/05/23/03/338052303.db2.gz JDEOBPAFFYHDKW-GWCFXTLKSA-N 1 1 312.316 3.571 20 5 DHBDMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000429583816 338085295 /nfs/dbraw/zinc/08/52/95/338085295.db2.gz BWBKOAWUTVGRNN-WBMJQRKESA-N 1 1 315.373 3.870 20 5 DHBDMO COCC(C)(C)[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000430112214 338097583 /nfs/dbraw/zinc/09/75/83/338097583.db2.gz BZTAANFSYCTCJK-UHFFFAOYSA-N 1 1 318.373 3.712 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000430226574 338102204 /nfs/dbraw/zinc/10/22/04/338102204.db2.gz OXUIXRRVRNAKDL-OAHLLOKOSA-N 1 1 312.369 3.593 20 5 DHBDMO Cc1cnc(SCC[N@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000432923278 338173320 /nfs/dbraw/zinc/17/33/20/338173320.db2.gz RRSWXPGKMZLWKI-UHFFFAOYSA-N 1 1 317.414 3.522 20 5 DHBDMO Cc1c(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC000437531576 338312786 /nfs/dbraw/zinc/31/27/86/338312786.db2.gz AORXFTOLMLNDDK-HZPDHXFCSA-N 1 1 306.431 3.763 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459813085 339049472 /nfs/dbraw/zinc/04/94/72/339049472.db2.gz WFVPJASTTIPGTG-RPVQJOFSSA-N 1 1 318.417 3.529 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@H](CC(C)C)[NH+](C)C ZINC000468654864 339268162 /nfs/dbraw/zinc/26/81/62/339268162.db2.gz CTAVHUDVAAZDOV-BXBOZWQASA-N 1 1 319.449 3.564 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)cc1 ZINC000469449356 339289796 /nfs/dbraw/zinc/28/97/96/339289796.db2.gz AZLVPTVLYHUOTH-CYBMUJFWSA-N 1 1 318.323 3.863 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](OCC(C)C)C1 ZINC000470184662 339313433 /nfs/dbraw/zinc/31/34/33/339313433.db2.gz SUFOFGUUVUGPAH-DWCFMXGVSA-N 1 1 318.417 3.745 20 5 DHBDMO Cc1c(C[N@@H+]2CCCC[C@H]2c2cccn2C)cccc1[N+](=O)[O-] ZINC000472341820 339370318 /nfs/dbraw/zinc/37/03/18/339370318.db2.gz SCEIHLHKVDZLRC-SFHVURJKSA-N 1 1 313.401 3.969 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000473162740 339383320 /nfs/dbraw/zinc/38/33/20/339383320.db2.gz QAALWRSBNJFNHL-IFXJQAMLSA-N 1 1 324.380 3.787 20 5 DHBDMO CCc1nc(C)c(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)o1 ZINC000494341014 339946872 /nfs/dbraw/zinc/94/68/72/339946872.db2.gz MWQJILDMTSBIFB-UHFFFAOYSA-N 1 1 317.389 3.867 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCc2ccccc2C1 ZINC000498923648 340026174 /nfs/dbraw/zinc/02/61/74/340026174.db2.gz QQJHNZDCDIYNSB-UHFFFAOYSA-N 1 1 300.333 3.682 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCc2ccccc2C1 ZINC000498923648 340026175 /nfs/dbraw/zinc/02/61/75/340026175.db2.gz QQJHNZDCDIYNSB-UHFFFAOYSA-N 1 1 300.333 3.682 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCc2cc(F)ccc2C1 ZINC000500783486 340067172 /nfs/dbraw/zinc/06/71/72/340067172.db2.gz KEWPTQMKXIZHGP-HWKANZROSA-N 1 1 312.344 3.805 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCc2cc(F)ccc2C1 ZINC000500783486 340067173 /nfs/dbraw/zinc/06/71/73/340067173.db2.gz KEWPTQMKXIZHGP-HWKANZROSA-N 1 1 312.344 3.805 20 5 DHBDMO CCC[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501026542 340072502 /nfs/dbraw/zinc/07/25/02/340072502.db2.gz BWHYDNPCLMEVNI-AWEZNQCLSA-N 1 1 319.405 3.578 20 5 DHBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000505608361 340172793 /nfs/dbraw/zinc/17/27/93/340172793.db2.gz LAKQYZSDNGLSIT-NWDGAFQWSA-N 1 1 311.813 3.781 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000505705633 340175342 /nfs/dbraw/zinc/17/53/42/340175342.db2.gz KFADAHDMPRVHNO-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO COc1ccc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1 ZINC000505770868 340177369 /nfs/dbraw/zinc/17/73/69/340177369.db2.gz ISKWAFGUHGCLHB-ALCCZGGFSA-N 1 1 312.369 3.749 20 5 DHBDMO Cc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc(C)c1O ZINC000506018003 340183520 /nfs/dbraw/zinc/18/35/20/340183520.db2.gz QWFLNTXULJCDFO-UHFFFAOYSA-N 1 1 300.358 3.549 20 5 DHBDMO Cc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc(C)c1O ZINC000506018003 340183521 /nfs/dbraw/zinc/18/35/21/340183521.db2.gz QWFLNTXULJCDFO-UHFFFAOYSA-N 1 1 300.358 3.549 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000506758049 340201117 /nfs/dbraw/zinc/20/11/17/340201117.db2.gz JFFDNPINKQCZBI-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000506758049 340201118 /nfs/dbraw/zinc/20/11/18/340201118.db2.gz JFFDNPINKQCZBI-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)cs1 ZINC000507668109 340227896 /nfs/dbraw/zinc/22/78/96/340227896.db2.gz GNKSLJBKYWDIRK-CQSZACIVSA-N 1 1 302.399 3.721 20 5 DHBDMO O=[N+]([O-])c1ccccc1N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000302862708 340284605 /nfs/dbraw/zinc/28/46/05/340284605.db2.gz SGWIYRSFEUFQPU-MRXNPFEDSA-N 1 1 311.385 3.671 20 5 DHBDMO Cc1c(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)cccc1[N+](=O)[O-] ZINC000237661534 340672959 /nfs/dbraw/zinc/67/29/59/340672959.db2.gz XVCCQGCXLAQSSC-XHDPSFHLSA-N 1 1 300.358 3.909 20 5 DHBDMO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)CO2 ZINC000539058201 340868943 /nfs/dbraw/zinc/86/89/43/340868943.db2.gz HUJRHISOGLLIDT-SUMWQHHRSA-N 1 1 312.369 3.996 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCSC1 ZINC000130530803 341026721 /nfs/dbraw/zinc/02/67/21/341026721.db2.gz PMIFKISZZHYTCW-CQSZACIVSA-N 1 1 318.398 3.792 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1Cc2ccccc2OC[C@@H]1C ZINC000544599326 341087900 /nfs/dbraw/zinc/08/79/00/341087900.db2.gz BFGHFPQNSPTXIC-AWEZNQCLSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1Cc2ccccc2OC[C@@H]1C ZINC000544599326 341087901 /nfs/dbraw/zinc/08/79/01/341087901.db2.gz BFGHFPQNSPTXIC-AWEZNQCLSA-N 1 1 312.369 3.686 20 5 DHBDMO C[N@@H+](CCCOCc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000545985878 341149772 /nfs/dbraw/zinc/14/97/72/341149772.db2.gz WVSDRUWITQGCST-UHFFFAOYSA-N 1 1 314.385 3.634 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1COc2ccc(F)cc21 ZINC000546649190 341177205 /nfs/dbraw/zinc/17/72/05/341177205.db2.gz MLMNJYXIZHDAAR-MEDUHNTESA-N 1 1 316.332 3.827 20 5 DHBDMO CC(C)C[N@H+]1CCC[C@@H](CN[C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000246415842 341348014 /nfs/dbraw/zinc/34/80/14/341348014.db2.gz MWEQXBYTKOBGDY-CVEARBPZSA-N 1 1 319.449 3.613 20 5 DHBDMO Cc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc(C)c1O ZINC000564383433 341352898 /nfs/dbraw/zinc/35/28/98/341352898.db2.gz XINXPLMIRPXHSY-UHFFFAOYSA-N 1 1 314.385 3.592 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCO[C@@H](C(C)C)C1 ZINC000552443816 341394088 /nfs/dbraw/zinc/39/40/88/341394088.db2.gz AWMQZGFNFKSRTE-QWSHFYNQSA-N 1 1 318.417 3.745 20 5 DHBDMO CC(C)c1[nH+]ccn1C[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1 ZINC000364910869 519879348 /nfs/dbraw/zinc/87/93/48/519879348.db2.gz SOJMUNJDUDUXSJ-INIZCTEOSA-N 1 1 314.389 3.584 20 5 DHBDMO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000265853742 521692980 /nfs/dbraw/zinc/69/29/80/521692980.db2.gz ITWIHJJQQVSGNB-CFVMTHIKSA-N 1 1 324.446 3.682 20 5 DHBDMO COC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)o1 ZINC000156492587 522378419 /nfs/dbraw/zinc/37/84/19/522378419.db2.gz DHSWUCMOXSAIFP-IUODEOHRSA-N 1 1 304.346 3.535 20 5 DHBDMO C[C@@H]1CCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000124289343 524260524 /nfs/dbraw/zinc/26/05/24/524260524.db2.gz CMTQVPUHGJHWAY-LLVKDONJSA-N 1 1 303.387 3.703 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(Cl)nc1 ZINC000181413105 525463971 /nfs/dbraw/zinc/46/39/71/525463971.db2.gz BYCWYDOUYIOAHH-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccncc2F)cc1[N+](=O)[O-] ZINC000338007978 525741385 /nfs/dbraw/zinc/74/13/85/525741385.db2.gz LDCWYGUUHWSZMP-NEPJUHHUSA-N 1 1 303.337 3.849 20 5 DHBDMO Cc1nc([C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000189786255 527079998 /nfs/dbraw/zinc/07/99/98/527079998.db2.gz OGPDRCLLAIQKFT-MRXNPFEDSA-N 1 1 317.414 3.739 20 5 DHBDMO CCCO[C@@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000247107432 1013364582 /nfs/dbraw/zinc/36/45/82/1013364582.db2.gz KIWBZVKDVHLPJV-RHSMWYFYSA-N 1 1 306.406 3.937 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1N(C)C ZINC000519666799 1013590010 /nfs/dbraw/zinc/59/00/10/1013590010.db2.gz JWPVXMSBYIRAOH-CQSZACIVSA-N 1 1 313.401 3.854 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1N(C)C ZINC000519666799 1013590017 /nfs/dbraw/zinc/59/00/17/1013590017.db2.gz JWPVXMSBYIRAOH-CQSZACIVSA-N 1 1 313.401 3.854 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)cs1 ZINC000340444118 1013801427 /nfs/dbraw/zinc/80/14/27/1013801427.db2.gz KAWJUSDFTQWLCW-CYBMUJFWSA-N 1 1 322.361 3.799 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1Nc1cccn2c(C)c(C)[nH+]c12 ZINC001210445030 1013857729 /nfs/dbraw/zinc/85/77/29/1013857729.db2.gz TXWPTUOLCXYQTL-UHFFFAOYSA-N 1 1 312.329 3.612 20 5 DHBDMO C[C@@H]1CC[C@@H](C)[NH+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000706476946 1014042666 /nfs/dbraw/zinc/04/26/66/1014042666.db2.gz OHBJBYRKTMJXQM-NXEZZACHSA-N 1 1 313.195 3.730 20 5 DHBDMO Cc1c([C@H](C)[NH2+]Cc2ccn(C(C)C)n2)cccc1[N+](=O)[O-] ZINC000579543847 1014087737 /nfs/dbraw/zinc/08/77/37/1014087737.db2.gz SHEQDGHMVAOXNO-ZDUSSCGKSA-N 1 1 302.378 3.531 20 5 DHBDMO CCCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)c1ccc(C)o1 ZINC000610447520 1014233964 /nfs/dbraw/zinc/23/39/64/1014233964.db2.gz GKICPCWYUJWPDB-AWEZNQCLSA-N 1 1 320.393 3.556 20 5 DHBDMO Cc1ccc([C@H](C)NCCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000319920783 1014277705 /nfs/dbraw/zinc/27/77/05/1014277705.db2.gz BQSAQRMLLZGHBV-CVEARBPZSA-N 1 1 319.449 3.818 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000320030443 1014374907 /nfs/dbraw/zinc/37/49/07/1014374907.db2.gz JNRYDSWFPIODPT-OKZBNKHCSA-N 1 1 317.433 3.652 20 5 DHBDMO CCC[C@H]([NH2+][C@H]1CCN2CCCC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000320030443 1014374920 /nfs/dbraw/zinc/37/49/20/1014374920.db2.gz JNRYDSWFPIODPT-OKZBNKHCSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@@H](c1cccs1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000520845275 1014598148 /nfs/dbraw/zinc/59/81/48/1014598148.db2.gz YISZBGWNSOYSDH-LBPRGKRZSA-N 1 1 306.387 3.728 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000520908475 1014611467 /nfs/dbraw/zinc/61/14/67/1014611467.db2.gz RRTLXFQEGNMFHR-ZDUSSCGKSA-N 1 1 316.405 3.675 20 5 DHBDMO CC(C)[N@@H+](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000521129508 1014650149 /nfs/dbraw/zinc/65/01/49/1014650149.db2.gz ZGHBDCCBSWHSHD-CYBMUJFWSA-N 1 1 323.437 3.913 20 5 DHBDMO CC[N@@H+](CCc1cccs1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000521194297 1014660272 /nfs/dbraw/zinc/66/02/72/1014660272.db2.gz GONSHTOCXDJXIS-UHFFFAOYSA-N 1 1 320.414 3.730 20 5 DHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001167457842 1014771709 /nfs/dbraw/zinc/77/17/09/1014771709.db2.gz LYIOMEUPFNRSAJ-WMLDXEAASA-N 1 1 306.406 3.874 20 5 DHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000443069030 1014800370 /nfs/dbraw/zinc/80/03/70/1014800370.db2.gz ODUUIMRBRLJJDU-ZFWWWQNUSA-N 1 1 306.406 3.718 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1C[C@@H](O)c2ccccc21 ZINC000895369986 1015105682 /nfs/dbraw/zinc/10/56/82/1015105682.db2.gz ZCTQNDVCQGNXCO-GDBMZVCRSA-N 1 1 318.760 3.516 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3nccs3)C2)cc1Cl ZINC000895580062 1015215264 /nfs/dbraw/zinc/21/52/64/1015215264.db2.gz FBQKVOYPGCYEDS-NSHDSACASA-N 1 1 323.805 3.694 20 5 DHBDMO Cc1nc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)s1 ZINC000090888582 1015229938 /nfs/dbraw/zinc/22/99/38/1015229938.db2.gz HYXUWRVNRKTLGM-SNVBAGLBSA-N 1 1 305.403 3.827 20 5 DHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000185644513 1015606809 /nfs/dbraw/zinc/60/68/09/1015606809.db2.gz VJKYQOQMLLSHCO-BLLLJJGKSA-N 1 1 315.373 3.870 20 5 DHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581135 1015628932 /nfs/dbraw/zinc/62/89/32/1015628932.db2.gz PVCCMVRWQAUVMG-FZMZJTMJSA-N 1 1 303.362 3.747 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccncc3)CC2)c(F)c1 ZINC000277128996 1015902081 /nfs/dbraw/zinc/90/20/81/1015902081.db2.gz IHZTZTFYEKSXAZ-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO CCO[C@@H]1CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000610930438 1015944659 /nfs/dbraw/zinc/94/46/59/1015944659.db2.gz CHCOCWDBVVIWGB-OAHLLOKOSA-N 1 1 306.406 3.719 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccc(F)c(F)c1 ZINC000084439945 1016137291 /nfs/dbraw/zinc/13/72/91/1016137291.db2.gz RIVPFTLEWZONKB-UHFFFAOYSA-N 1 1 312.703 3.816 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCCC1CCOCC1)C1CC1 ZINC000346870498 1016618585 /nfs/dbraw/zinc/61/85/85/1016618585.db2.gz MIAAFTAPNJKGRO-UHFFFAOYSA-N 1 1 318.417 3.766 20 5 DHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCc2ccccc21 ZINC000347141936 1016757191 /nfs/dbraw/zinc/75/71/91/1016757191.db2.gz ICJSPZPIDITPTE-KRWDZBQOSA-N 1 1 322.368 3.590 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCc2ccccc21 ZINC000347141936 1016757210 /nfs/dbraw/zinc/75/72/10/1016757210.db2.gz ICJSPZPIDITPTE-KRWDZBQOSA-N 1 1 322.368 3.590 20 5 DHBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cnn(CC2CCC2)c1 ZINC000934554209 1017039573 /nfs/dbraw/zinc/03/95/73/1017039573.db2.gz BNMVGTUQDOVFGQ-LLVKDONJSA-N 1 1 320.418 3.504 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@]3(CC[C@H](C)C3)C2)c([N+](=O)[O-])cc1F ZINC000362190313 1032267324 /nfs/dbraw/zinc/26/73/24/1032267324.db2.gz LPHUUJBJZBXHEI-YVEFUNNKSA-N 1 1 322.380 3.755 20 5 DHBDMO Cc1ccc([C@H](C)NCC(C)(C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000479859869 1017102218 /nfs/dbraw/zinc/10/22/18/1017102218.db2.gz MRMXJMCCYINAIB-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO CCCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H]1CCC[C@@H](C)C1 ZINC000339646869 1012721331 /nfs/dbraw/zinc/72/13/31/1012721331.db2.gz LCOIFOWSGSQSEA-KGLIPLIRSA-N 1 1 308.426 3.509 20 5 DHBDMO CCC(CC)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000515802078 1012726573 /nfs/dbraw/zinc/72/65/73/1012726573.db2.gz UGNZQRMLKTTWRX-UHFFFAOYSA-N 1 1 319.405 3.576 20 5 DHBDMO Cc1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)cc1[N+](=O)[O-] ZINC000475287028 1017118322 /nfs/dbraw/zinc/11/83/22/1017118322.db2.gz MMVJRIWNPFXZTI-CMPLNLGQSA-N 1 1 302.296 3.676 20 5 DHBDMO COc1cccc(NCCCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000475357720 1017169499 /nfs/dbraw/zinc/16/94/99/1017169499.db2.gz XFBVZIIOEFATLD-AWEZNQCLSA-N 1 1 321.421 3.670 20 5 DHBDMO CC[N@@H+](CCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444583313 1017583945 /nfs/dbraw/zinc/58/39/45/1017583945.db2.gz NJJVVQDECIHSHW-UHFFFAOYSA-N 1 1 324.384 3.536 20 5 DHBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444657202 1017609771 /nfs/dbraw/zinc/60/97/71/1017609771.db2.gz BOTHTCMKHXKLKU-HNNXBMFYSA-N 1 1 316.405 3.872 20 5 DHBDMO C[C@H]1c2ccccc2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001167622867 1017673596 /nfs/dbraw/zinc/67/35/96/1017673596.db2.gz ZVVKVNRYUCNTAF-AWEZNQCLSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@@H](c1cccc(F)c1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445259984 1017812666 /nfs/dbraw/zinc/81/26/66/1017812666.db2.gz PRLYSFJMYULJCL-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H](c1cccc(F)c1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445259984 1017812686 /nfs/dbraw/zinc/81/26/86/1017812686.db2.gz PRLYSFJMYULJCL-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO Cc1c([C@@H](C)N[C@@H]2CC[N@H+](C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000153741594 1018003729 /nfs/dbraw/zinc/00/37/29/1018003729.db2.gz MVCPBLKVTCSHHM-HUUCEWRRSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c([C@@H](C)[NH2+][C@@H]2CCN(C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000153741594 1018003745 /nfs/dbraw/zinc/00/37/45/1018003745.db2.gz MVCPBLKVTCSHHM-HUUCEWRRSA-N 1 1 317.433 3.571 20 5 DHBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])C1CCCCC1 ZINC000441177050 1018313115 /nfs/dbraw/zinc/31/31/15/1018313115.db2.gz IGOIGLAYQKDOCW-UHFFFAOYSA-N 1 1 322.405 3.637 20 5 DHBDMO CCC[C@H]([NH2+]Cc1csc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000041010474 1018348458 /nfs/dbraw/zinc/34/84/58/1018348458.db2.gz QMDBMKWEWPDDSI-HNNXBMFYSA-N 1 1 305.403 3.991 20 5 DHBDMO C[C@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCOc2ccccc21 ZINC000923026308 1018990221 /nfs/dbraw/zinc/99/02/21/1018990221.db2.gz RZEZWJHLWJEXGC-KRWDZBQOSA-N 1 1 316.332 3.521 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2scnc2C2CC2)c1 ZINC000785484204 1019201116 /nfs/dbraw/zinc/20/11/16/1019201116.db2.gz ISMLBNRHSBCIGK-UHFFFAOYSA-N 1 1 323.805 3.872 20 5 DHBDMO COc1ccccc1/C=C\C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000255045808 1019250709 /nfs/dbraw/zinc/25/07/09/1019250709.db2.gz IGUUJJXNKZZQSO-YFHOEESVSA-N 1 1 312.369 3.749 20 5 DHBDMO COc1ccccc1/C=C\C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000255045808 1019250716 /nfs/dbraw/zinc/25/07/16/1019250716.db2.gz IGUUJJXNKZZQSO-YFHOEESVSA-N 1 1 312.369 3.749 20 5 DHBDMO CC[N@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C[C@H]1CCOC1 ZINC000611256776 1019423760 /nfs/dbraw/zinc/42/37/60/1019423760.db2.gz YIJINCIRTFSABV-OAHLLOKOSA-N 1 1 306.406 3.577 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCOc2ccccc2C1 ZINC000611515323 1019507645 /nfs/dbraw/zinc/50/76/45/1019507645.db2.gz IUXTZWRTMOOQRA-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCOc2ccccc2C1 ZINC000611515323 1019507666 /nfs/dbraw/zinc/50/76/66/1019507666.db2.gz IUXTZWRTMOOQRA-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1cc(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000611519636 1019509359 /nfs/dbraw/zinc/50/93/59/1019509359.db2.gz DGZDEVZUYBIOJM-GOSISDBHSA-N 1 1 322.368 3.506 20 5 DHBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000611554735 1019513651 /nfs/dbraw/zinc/51/36/51/1019513651.db2.gz XEZLUECIXDSFET-ZYHUDNBSSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000611554735 1019513664 /nfs/dbraw/zinc/51/36/64/1019513664.db2.gz XEZLUECIXDSFET-ZYHUDNBSSA-N 1 1 302.296 3.758 20 5 DHBDMO CCC[C@@]1(C)CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000750069684 1019633381 /nfs/dbraw/zinc/63/33/81/1019633381.db2.gz FANQXWFRQTXJQJ-IRXDYDNUSA-N 1 1 306.406 3.530 20 5 DHBDMO COc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1Cl ZINC000179187578 1019823525 /nfs/dbraw/zinc/82/35/25/1019823525.db2.gz JVSTXWFHRFNMCO-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1Cl ZINC000179187578 1019823540 /nfs/dbraw/zinc/82/35/40/1019823540.db2.gz JVSTXWFHRFNMCO-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1cc(C[N@@H+](CCC(C)C)C2CC2)c([N+](=O)[O-])cc1OC ZINC000349942593 1019865044 /nfs/dbraw/zinc/86/50/44/1019865044.db2.gz BCCMVLGJFNYPNJ-UHFFFAOYSA-N 1 1 322.405 3.623 20 5 DHBDMO C[C@H](c1ccco1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000069065266 1019948970 /nfs/dbraw/zinc/94/89/70/1019948970.db2.gz JQLODCHDDGFDDC-CYBMUJFWSA-N 1 1 304.346 3.650 20 5 DHBDMO Cc1cnc(Cl)c(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000922316542 1019993964 /nfs/dbraw/zinc/99/39/64/1019993964.db2.gz PRUWIJGWLGHCSJ-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO CC(C)c1ccc(C[N@H+](C)Cc2cccn2C)cc1[N+](=O)[O-] ZINC000093584625 1020162495 /nfs/dbraw/zinc/16/24/95/1020162495.db2.gz RJBJWTCXDMDFTI-UHFFFAOYSA-N 1 1 301.390 3.689 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)Cc2cccn2C)cc1[N+](=O)[O-] ZINC000093584625 1020162503 /nfs/dbraw/zinc/16/25/03/1020162503.db2.gz RJBJWTCXDMDFTI-UHFFFAOYSA-N 1 1 301.390 3.689 20 5 DHBDMO CC(C)c1ccc(CN(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000093644438 1020164672 /nfs/dbraw/zinc/16/46/72/1020164672.db2.gz RCEWKEZYHNIZFD-HOCLYGCPSA-N 1 1 319.449 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@H+](C)[C@H]2CCN(C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000093644438 1020164679 /nfs/dbraw/zinc/16/46/79/1020164679.db2.gz RCEWKEZYHNIZFD-HOCLYGCPSA-N 1 1 319.449 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)[C@H]2CCN(C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000093644438 1020164682 /nfs/dbraw/zinc/16/46/82/1020164682.db2.gz RCEWKEZYHNIZFD-HOCLYGCPSA-N 1 1 319.449 3.633 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000155077581 1020186941 /nfs/dbraw/zinc/18/69/41/1020186941.db2.gz SYHLQFOIDYNBGW-QGZVFWFLSA-N 1 1 311.385 3.671 20 5 DHBDMO CC(C)[N@@H+]1CCCC[C@H]1CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000330658671 1020237543 /nfs/dbraw/zinc/23/75/43/1020237543.db2.gz QULQXDXQWNYAEB-YOEHRIQHSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)[N@H+]1CCCC[C@H]1CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000330658671 1020237553 /nfs/dbraw/zinc/23/75/53/1020237553.db2.gz QULQXDXQWNYAEB-YOEHRIQHSA-N 1 1 305.422 3.508 20 5 DHBDMO COC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(C)o1 ZINC000156445086 1020350998 /nfs/dbraw/zinc/35/09/98/1020350998.db2.gz ZJSZFVQMVRCHLT-ZFWWWQNUSA-N 1 1 318.373 3.843 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000303446684 1020489382 /nfs/dbraw/zinc/48/93/82/1020489382.db2.gz JCRBKKMGVUEUJA-AWEZNQCLSA-N 1 1 324.446 3.711 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC3(CCC3)CC2)c(F)c1 ZINC000411869577 1020624015 /nfs/dbraw/zinc/62/40/15/1020624015.db2.gz NBUQKZDNUAKHSN-UHFFFAOYSA-N 1 1 310.394 3.596 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@H](c3ccco3)C2)c1 ZINC000735493847 1020744280 /nfs/dbraw/zinc/74/42/80/1020744280.db2.gz RNQUILNTESNGAC-NSHDSACASA-N 1 1 306.749 3.831 20 5 DHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccc(Cl)nc1 ZINC000125712934 1032936719 /nfs/dbraw/zinc/93/67/19/1032936719.db2.gz LNDXSKIUWWCVKI-GQCTYLIASA-N 1 1 317.776 3.788 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000738309694 1020872243 /nfs/dbraw/zinc/87/22/43/1020872243.db2.gz QGXKPIARTFGFJC-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO CCC[C@@H]([NH2+][C@H](C)c1ccn(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000414168294 1020956248 /nfs/dbraw/zinc/95/62/48/1020956248.db2.gz ABDBTURCCCRODU-MLGOLLRUSA-N 1 1 302.378 3.520 20 5 DHBDMO Cc1nc2ccccc2nc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180426958 1021113365 /nfs/dbraw/zinc/11/33/65/1021113365.db2.gz LWYNHYGRSYREIA-GFCCVEGCSA-N 1 1 322.368 3.697 20 5 DHBDMO CCOc1cccc([C@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000180684735 1021143990 /nfs/dbraw/zinc/14/39/90/1021143990.db2.gz WHDYMSUPUAQQLR-LBPRGKRZSA-N 1 1 318.348 3.983 20 5 DHBDMO Cc1[nH+]ccn1CCCCNc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000080648869 1021221057 /nfs/dbraw/zinc/22/10/57/1021221057.db2.gz PMJJPMUPDVGXSA-UHFFFAOYSA-N 1 1 322.796 3.954 20 5 DHBDMO C[C@@H]1CC(C)(C)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000412033162 1021250300 /nfs/dbraw/zinc/25/03/00/1021250300.db2.gz CMSQOYLNZNGMSL-GFCCVEGCSA-N 1 1 315.373 3.870 20 5 DHBDMO Cc1cccc([C@@H]2CCCC[N@@H+]2Cn2nccc2[N+](=O)[O-])c1C ZINC000743387169 1021279057 /nfs/dbraw/zinc/27/90/57/1021279057.db2.gz DQBREVZALBNSCA-INIZCTEOSA-N 1 1 314.389 3.593 20 5 DHBDMO Cc1cccc([C@@H]2CCCC[N@H+]2Cn2nccc2[N+](=O)[O-])c1C ZINC000743387169 1021279065 /nfs/dbraw/zinc/27/90/65/1021279065.db2.gz DQBREVZALBNSCA-INIZCTEOSA-N 1 1 314.389 3.593 20 5 DHBDMO Cc1c([C@@H](C)[NH2+][C@@H](C)CN2CCCCCC2)cccc1[N+](=O)[O-] ZINC000480700325 1021469170 /nfs/dbraw/zinc/46/91/70/1021469170.db2.gz QPTSYBMXRUUJET-GOEBONIOSA-N 1 1 319.449 3.818 20 5 DHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])s2)[C@@H]1c1ccccc1 ZINC000618679581 1021484707 /nfs/dbraw/zinc/48/47/07/1021484707.db2.gz VOFOSCJTMOMLFG-DOMZBBRYSA-N 1 1 303.387 3.514 20 5 DHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000174868515 1021624528 /nfs/dbraw/zinc/62/45/28/1021624528.db2.gz LLBJAWHLRZSHEX-SNVBAGLBSA-N 1 1 302.827 3.822 20 5 DHBDMO Cc1cnc(C(C)(C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000182452302 1021656501 /nfs/dbraw/zinc/65/65/01/1021656501.db2.gz RMISSLJIPAYTHG-LLVKDONJSA-N 1 1 305.403 3.946 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H](C)S1 ZINC000070383162 1021657987 /nfs/dbraw/zinc/65/79/87/1021657987.db2.gz INXDYHGTNLWNBF-AOOOYVTPSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H](C)S1 ZINC000070383162 1021657993 /nfs/dbraw/zinc/65/79/93/1021657993.db2.gz INXDYHGTNLWNBF-AOOOYVTPSA-N 1 1 300.811 3.574 20 5 DHBDMO CC[C@@H](CSC)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541119777 1021659750 /nfs/dbraw/zinc/65/97/50/1021659750.db2.gz GVUARSCNRJHOOM-NSHDSACASA-N 1 1 302.827 3.822 20 5 DHBDMO CCOc1ccc([C@@H](C)Nc2cc(C)cc[nH+]2)cc1[N+](=O)[O-] ZINC000182637754 1021754188 /nfs/dbraw/zinc/75/41/88/1021754188.db2.gz XTYUBANVTIYJCS-GFCCVEGCSA-N 1 1 301.346 3.870 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)cc1 ZINC000070755088 1021808725 /nfs/dbraw/zinc/80/87/25/1021808725.db2.gz KQZPLZGFFDJXIS-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc2cnccc2c1 ZINC000619847271 1021922058 /nfs/dbraw/zinc/92/20/58/1021922058.db2.gz LKAIUGIQNUWPBB-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122664551 1021926692 /nfs/dbraw/zinc/92/66/92/1021926692.db2.gz GARCYVSVLRVCKD-SNVBAGLBSA-N 1 1 302.827 3.822 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000480949333 1022049393 /nfs/dbraw/zinc/04/93/93/1022049393.db2.gz BWMMBBZDCXAYBT-INIZCTEOSA-N 1 1 324.446 3.581 20 5 DHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580131 1022097377 /nfs/dbraw/zinc/09/73/77/1022097377.db2.gz RKSMMOGEFRYPMQ-HOTGVXAUSA-N 1 1 306.406 3.529 20 5 DHBDMO C[N@@H+](CCC1CCCCC1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581897 1022100608 /nfs/dbraw/zinc/10/06/08/1022100608.db2.gz OKVJRQNDYYIEOH-QGZVFWFLSA-N 1 1 306.406 3.530 20 5 DHBDMO Cc1cc(C)c(CN2CCc3cc(C)c([N+](=O)[O-])cc32)c(C)[nH+]1 ZINC001168785661 1022106709 /nfs/dbraw/zinc/10/67/09/1022106709.db2.gz PPCJBHMOCAXGBX-UHFFFAOYSA-N 1 1 311.385 3.786 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC2CC1(c1ccccc1)C2 ZINC000852760807 1022174591 /nfs/dbraw/zinc/17/45/91/1022174591.db2.gz BOCZFWBTTDWFJV-UHFFFAOYSA-N 1 1 312.344 3.855 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC2CC1(c1ccccc1)C2 ZINC000852760807 1022174597 /nfs/dbraw/zinc/17/45/97/1022174597.db2.gz BOCZFWBTTDWFJV-UHFFFAOYSA-N 1 1 312.344 3.855 20 5 DHBDMO Cc1nn(C[N@H+](C)C2CCC(C(C)(C)C)CC2)c(C)c1[N+](=O)[O-] ZINC000921045946 1022208521 /nfs/dbraw/zinc/20/85/21/1022208521.db2.gz JPGMYOJCIDFXTO-UHFFFAOYSA-N 1 1 322.453 3.902 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)C1 ZINC001169005673 1022213288 /nfs/dbraw/zinc/21/32/88/1022213288.db2.gz BYMNTSNFZQRQBX-CXAGYDPISA-N 1 1 320.820 3.875 20 5 DHBDMO CCOc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169032926 1022218566 /nfs/dbraw/zinc/21/85/66/1022218566.db2.gz AAAJEVDIHUXJMO-KYJSFNMBSA-N 1 1 318.417 3.668 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)C1 ZINC001169039792 1022222829 /nfs/dbraw/zinc/22/28/29/1022222829.db2.gz UBDYVHANYWMHCE-INWMFGNUSA-N 1 1 308.809 3.575 20 5 DHBDMO CC[C@@H]1CO[C@](C)(CCC(C)C)[N@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169038913 1022223120 /nfs/dbraw/zinc/22/31/20/1022223120.db2.gz LGCIPCDGLCNJGR-YLFCFFPRSA-N 1 1 312.454 3.695 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H]2c2c(F)cccc2F)C1 ZINC001169046329 1022228392 /nfs/dbraw/zinc/22/83/92/1022228392.db2.gz KNNAMVYTQGFPSI-XUJVJEKNSA-N 1 1 310.344 3.547 20 5 DHBDMO CC(C)c1cnc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)s1 ZINC000338956448 1022283566 /nfs/dbraw/zinc/28/35/66/1022283566.db2.gz SVWZFWRAXXAUEO-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO CC(C)c1cnc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)s1 ZINC000338956448 1022283571 /nfs/dbraw/zinc/28/35/71/1022283571.db2.gz SVWZFWRAXXAUEO-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C12CCC2 ZINC000763453597 1022290575 /nfs/dbraw/zinc/29/05/75/1022290575.db2.gz PMQAWMMXZNEKEC-CVEARBPZSA-N 1 1 322.380 3.513 20 5 DHBDMO CCc1nc(N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc(C)[nH+]1 ZINC000804338734 1022535441 /nfs/dbraw/zinc/53/54/41/1022535441.db2.gz BMBDRSAGDZCGGN-UHFFFAOYSA-N 1 1 320.780 3.545 20 5 DHBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001169780239 1022541399 /nfs/dbraw/zinc/54/13/99/1022541399.db2.gz JYBBOONRGXHKBR-INIZCTEOSA-N 1 1 310.369 3.515 20 5 DHBDMO CCOc1cc(C[N@H+](CC)Cc2ccoc2)ccc1[N+](=O)[O-] ZINC000617196436 1022887245 /nfs/dbraw/zinc/88/72/45/1022887245.db2.gz JIECYBOFAPWALX-UHFFFAOYSA-N 1 1 304.346 3.609 20 5 DHBDMO CCOc1cc(C[N@@H+](CC)Cc2ccoc2)ccc1[N+](=O)[O-] ZINC000617196436 1022887259 /nfs/dbraw/zinc/88/72/59/1022887259.db2.gz JIECYBOFAPWALX-UHFFFAOYSA-N 1 1 304.346 3.609 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1Cc2ccccc2C1 ZINC000768540935 1022985070 /nfs/dbraw/zinc/98/50/70/1022985070.db2.gz CHRXYGBZDUKNDW-UHFFFAOYSA-N 1 1 316.788 3.847 20 5 DHBDMO CSC[C@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000312726428 1023132718 /nfs/dbraw/zinc/13/27/18/1023132718.db2.gz RSFDPLAJZCNIAL-LBPRGKRZSA-N 1 1 314.838 3.823 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1CCOc3ccccc31)C2 ZINC000769425126 1023147421 /nfs/dbraw/zinc/14/74/21/1023147421.db2.gz DMDJJHUFWQQSKA-HNNXBMFYSA-N 1 1 324.380 3.519 20 5 DHBDMO CC(C)CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000769732748 1023195892 /nfs/dbraw/zinc/19/58/92/1023195892.db2.gz JJZRQWSROOOACA-UHFFFAOYSA-N 1 1 316.405 3.729 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@H]1C ZINC000770281763 1023289874 /nfs/dbraw/zinc/28/98/74/1023289874.db2.gz ADCYFHGBLUXXPR-UWVGGRQHSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@H]1C[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H](C)C1(F)F ZINC000859413450 1033136470 /nfs/dbraw/zinc/13/64/70/1033136470.db2.gz IEFRRTFEFWCJSW-UWVGGRQHSA-N 1 1 318.751 3.971 20 5 DHBDMO CC(C)[C@@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CCS1 ZINC000538728387 1033150299 /nfs/dbraw/zinc/15/02/99/1033150299.db2.gz QPSOXRQIFXOILV-WRLNGNIRSA-N 1 1 306.431 3.681 20 5 DHBDMO CC(C)[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCOCC1 ZINC000746674089 1023783965 /nfs/dbraw/zinc/78/39/65/1023783965.db2.gz NHYWLJCZDCWZPY-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000859561505 1033167083 /nfs/dbraw/zinc/16/70/83/1033167083.db2.gz FQSIJZBHRVELKL-QGZVFWFLSA-N 1 1 315.348 3.760 20 5 DHBDMO C[N@H+](CCOc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000788462669 1023888380 /nfs/dbraw/zinc/88/83/80/1023888380.db2.gz IVJVHAIOHTWZEC-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000788462669 1023888382 /nfs/dbraw/zinc/88/83/82/1023888382.db2.gz IVJVHAIOHTWZEC-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788481844 1023891838 /nfs/dbraw/zinc/89/18/38/1023891838.db2.gz JNMRUESFQDZGHO-OLZOCXBDSA-N 1 1 312.410 3.840 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)cc1F ZINC000788487018 1023893959 /nfs/dbraw/zinc/89/39/59/1023893959.db2.gz BCFCSAIJRVFGET-CABCVRRESA-N 1 1 310.394 3.594 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000051428232 1024047887 /nfs/dbraw/zinc/04/78/87/1024047887.db2.gz IZGQGWFVGWSXIQ-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000270129358 1024354169 /nfs/dbraw/zinc/35/41/69/1024354169.db2.gz BBBAOWUHYYRMCO-JTQLQIEISA-N 1 1 300.280 3.850 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000270129358 1024354185 /nfs/dbraw/zinc/35/41/85/1024354185.db2.gz BBBAOWUHYYRMCO-JTQLQIEISA-N 1 1 300.280 3.850 20 5 DHBDMO C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](CC[N+](=O)[O-])C1CC1 ZINC000791053646 1024434958 /nfs/dbraw/zinc/43/49/58/1024434958.db2.gz UYONJSAFQOLINA-SNVBAGLBSA-N 1 1 302.296 3.508 20 5 DHBDMO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](CC[N+](=O)[O-])C1CC1 ZINC000791053646 1024434965 /nfs/dbraw/zinc/43/49/65/1024434965.db2.gz UYONJSAFQOLINA-SNVBAGLBSA-N 1 1 302.296 3.508 20 5 DHBDMO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000883462798 1024441007 /nfs/dbraw/zinc/44/10/07/1024441007.db2.gz AIAVOXATJUJYRJ-CQSZACIVSA-N 1 1 303.387 3.691 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cnc(C3CC3)o2)cc1[N+](=O)[O-] ZINC000453349127 1024474697 /nfs/dbraw/zinc/47/46/97/1024474697.db2.gz JEGLNAJSSXSCCV-NSHDSACASA-N 1 1 301.346 3.619 20 5 DHBDMO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453359676 1024481163 /nfs/dbraw/zinc/48/11/63/1024481163.db2.gz QEYKLAWEDQELLA-OLZOCXBDSA-N 1 1 302.378 3.531 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])cc1F ZINC000182003381 1024551935 /nfs/dbraw/zinc/55/19/35/1024551935.db2.gz PZPGVKXAYYPMHV-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCC[NH+]1[C@H](C)CCC[C@H]1C ZINC000532231289 1024582327 /nfs/dbraw/zinc/58/23/27/1024582327.db2.gz JVWCBXJMUOBKHJ-OAGGEKHMSA-N 1 1 319.449 3.817 20 5 DHBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000532293401 1024595093 /nfs/dbraw/zinc/59/50/93/1024595093.db2.gz UJARBAZKABICRI-INIZCTEOSA-N 1 1 302.399 3.820 20 5 DHBDMO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000106877050 1024606849 /nfs/dbraw/zinc/60/68/49/1024606849.db2.gz JKJIBTJQNVXPKG-LLVKDONJSA-N 1 1 305.403 3.861 20 5 DHBDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000106877050 1024606855 /nfs/dbraw/zinc/60/68/55/1024606855.db2.gz JKJIBTJQNVXPKG-LLVKDONJSA-N 1 1 305.403 3.861 20 5 DHBDMO Cc1nc(C)c([C@H](C)[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000106878380 1024607347 /nfs/dbraw/zinc/60/73/47/1024607347.db2.gz RVZSRYBOGZCTPX-LBPRGKRZSA-N 1 1 319.430 3.904 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC=C(c2ccncc2)C1 ZINC000348834877 1024627072 /nfs/dbraw/zinc/62/70/72/1024627072.db2.gz RDSOHOQBQAHDTG-UTCJRWHESA-N 1 1 321.380 3.792 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC=C(c2ccncc2)C1 ZINC000348834877 1024627076 /nfs/dbraw/zinc/62/70/76/1024627076.db2.gz RDSOHOQBQAHDTG-UTCJRWHESA-N 1 1 321.380 3.792 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000348931363 1024651372 /nfs/dbraw/zinc/65/13/72/1024651372.db2.gz AWHSAAVBERRQFX-IOMDMTNGSA-N 1 1 309.369 3.840 20 5 DHBDMO CCc1noc(CC)c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000166922845 1024658593 /nfs/dbraw/zinc/65/85/93/1024658593.db2.gz ZKTIZNYNGNFJBH-NSHDSACASA-N 1 1 303.362 3.558 20 5 DHBDMO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000283505577 1024678148 /nfs/dbraw/zinc/67/81/48/1024678148.db2.gz MAMLUCWPRGLSND-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCCC23CC3)c([N+](=O)[O-])c1 ZINC001170353108 1024749471 /nfs/dbraw/zinc/74/94/71/1024749471.db2.gz VXFDTYMGWCEIOO-ZDUSSCGKSA-N 1 1 304.390 3.553 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)C[C@H]2CC2(C)C)c([N+](=O)[O-])c1 ZINC001170352349 1024749687 /nfs/dbraw/zinc/74/96/87/1024749687.db2.gz MCYSSMPEVIBKEP-TZMCWYRMSA-N 1 1 306.406 3.512 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCC3(CCC3)C2)c([N+](=O)[O-])c1 ZINC001170355328 1024750131 /nfs/dbraw/zinc/75/01/31/1024750131.db2.gz ZVAILUVBFUIHQE-CQSZACIVSA-N 1 1 318.417 3.801 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H]2C(C)C)c([N+](=O)[O-])c1 ZINC001170354508 1024750552 /nfs/dbraw/zinc/75/05/52/1024750552.db2.gz MLSJOLTUOUYIPX-CZUORRHYSA-N 1 1 306.406 3.655 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC001170341247 1024756957 /nfs/dbraw/zinc/75/69/57/1024756957.db2.gz HMXRWBNEBKFGBN-KGLIPLIRSA-N 1 1 306.406 3.799 20 5 DHBDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2C)on1 ZINC000350006075 1024779742 /nfs/dbraw/zinc/77/97/42/1024779742.db2.gz FTXUGDCJXSEYIX-OAHLLOKOSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2C)on1 ZINC000350006075 1024779756 /nfs/dbraw/zinc/77/97/56/1024779756.db2.gz FTXUGDCJXSEYIX-OAHLLOKOSA-N 1 1 301.346 3.537 20 5 DHBDMO CC[C@@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728895903 1024780122 /nfs/dbraw/zinc/78/01/22/1024780122.db2.gz DEBDONZSPJQAFX-CQSZACIVSA-N 1 1 314.389 3.538 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000051315981 1024942450 /nfs/dbraw/zinc/94/24/50/1024942450.db2.gz SAUAUWYHXTXFIX-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO CC(C)c1ccc(CN[C@H](C)C[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000353089137 1024943679 /nfs/dbraw/zinc/94/36/79/1024943679.db2.gz DOKUFPJLCQGJDA-CQSZACIVSA-N 1 1 307.438 3.537 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@H](C)CN(C)C(C)C)cc1[N+](=O)[O-] ZINC000353089137 1024943695 /nfs/dbraw/zinc/94/36/95/1024943695.db2.gz DOKUFPJLCQGJDA-CQSZACIVSA-N 1 1 307.438 3.537 20 5 DHBDMO Cc1cc(F)ccc1C[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000753787060 1025277697 /nfs/dbraw/zinc/27/76/97/1025277697.db2.gz UUEXBICVQUGHMV-UHFFFAOYSA-N 1 1 306.312 3.813 20 5 DHBDMO Cc1cc(F)ccc1C[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000753787060 1025277711 /nfs/dbraw/zinc/27/77/11/1025277711.db2.gz UUEXBICVQUGHMV-UHFFFAOYSA-N 1 1 306.312 3.813 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cccc(Cl)c1 ZINC000015298450 1025373279 /nfs/dbraw/zinc/37/32/79/1025373279.db2.gz DUEMPNLLAAEDEE-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc(Cl)c1 ZINC000015298450 1025373293 /nfs/dbraw/zinc/37/32/93/1025373293.db2.gz DUEMPNLLAAEDEE-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000886052462 1025453461 /nfs/dbraw/zinc/45/34/61/1025453461.db2.gz QZTLKCWIIOBSML-QGZVFWFLSA-N 1 1 309.369 3.642 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000886052462 1025453466 /nfs/dbraw/zinc/45/34/66/1025453466.db2.gz QZTLKCWIIOBSML-QGZVFWFLSA-N 1 1 309.369 3.642 20 5 DHBDMO CCSc1ccc([C@@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1 ZINC000886109606 1025508572 /nfs/dbraw/zinc/50/85/72/1025508572.db2.gz OMUAYGQTEKIRGP-GFCCVEGCSA-N 1 1 317.414 3.953 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000886120797 1025516290 /nfs/dbraw/zinc/51/62/90/1025516290.db2.gz NXVZWORDIFWZLQ-MQNTZWLQSA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000886120797 1025516293 /nfs/dbraw/zinc/51/62/93/1025516293.db2.gz NXVZWORDIFWZLQ-MQNTZWLQSA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000886120798 1025517849 /nfs/dbraw/zinc/51/78/49/1025517849.db2.gz NXVZWORDIFWZLQ-QXPKXGMISA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000886120798 1025517850 /nfs/dbraw/zinc/51/78/50/1025517850.db2.gz NXVZWORDIFWZLQ-QXPKXGMISA-N 1 1 309.369 3.668 20 5 DHBDMO Cc1ccc([C@H]2CC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)c(C)c1 ZINC000886181722 1025551548 /nfs/dbraw/zinc/55/15/48/1025551548.db2.gz RYPGEPFXSCRLAU-HNNXBMFYSA-N 1 1 311.385 3.596 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000886202000 1025556134 /nfs/dbraw/zinc/55/61/34/1025556134.db2.gz YVCRVUBAOWDSLP-RCCFBDPRSA-N 1 1 323.396 3.758 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000886201997 1025556303 /nfs/dbraw/zinc/55/63/03/1025556303.db2.gz YVCRVUBAOWDSLP-KSZLIROESA-N 1 1 323.396 3.758 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccns1 ZINC000860053378 1033290654 /nfs/dbraw/zinc/29/06/54/1033290654.db2.gz BXICRXMSBIUWSF-LLVKDONJSA-N 1 1 321.402 3.689 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000355788057 1025837429 /nfs/dbraw/zinc/83/74/29/1025837429.db2.gz UIWBPCWOYSPRKM-INIZCTEOSA-N 1 1 324.808 3.641 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000289640450 1026111042 /nfs/dbraw/zinc/11/10/42/1026111042.db2.gz FOLGJPBOHMPOJX-UHOFOFEASA-N 1 1 304.390 3.545 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000289649514 1026114437 /nfs/dbraw/zinc/11/44/37/1026114437.db2.gz CAXXHQPQAZVGGY-ZVVFDCPKSA-N 1 1 309.369 3.840 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)cc1 ZINC000513472607 1026519314 /nfs/dbraw/zinc/51/93/14/1026519314.db2.gz IBNFULHKRKNJBK-HNNXBMFYSA-N 1 1 300.333 3.723 20 5 DHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000280423434 1026648589 /nfs/dbraw/zinc/64/85/89/1026648589.db2.gz ZHGJWGMBIMWOJV-HNNXBMFYSA-N 1 1 312.797 3.639 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000420944729 1026886383 /nfs/dbraw/zinc/88/63/83/1026886383.db2.gz JVRYGNFIVPZKOF-LBPRGKRZSA-N 1 1 302.296 3.759 20 5 DHBDMO CCCc1nc(C)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000293761510 1027265960 /nfs/dbraw/zinc/26/59/60/1027265960.db2.gz SBQBMYSQEZHHTN-NSHDSACASA-N 1 1 303.362 3.695 20 5 DHBDMO CC(C)[N@@H+](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000562237409 1027322174 /nfs/dbraw/zinc/32/21/74/1027322174.db2.gz ZGHBDCCBSWHSHD-ZDUSSCGKSA-N 1 1 323.437 3.913 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812850524 1027445173 /nfs/dbraw/zinc/44/51/73/1027445173.db2.gz UTBAIRUGXXAXPI-KDOFPFPSSA-N 1 1 314.385 3.539 20 5 DHBDMO CSC[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000362947644 1027457361 /nfs/dbraw/zinc/45/73/61/1027457361.db2.gz BQHCRGIFLASDKK-OAHLLOKOSA-N 1 1 324.446 3.709 20 5 DHBDMO CO[C@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1(C)C ZINC000295976622 1027507110 /nfs/dbraw/zinc/50/71/10/1027507110.db2.gz KTZUACCISLNTRM-BBRMVZONSA-N 1 1 306.406 3.711 20 5 DHBDMO Cc1c(C[N@H+]2CCC=C(c3ccccn3)C2)cccc1[N+](=O)[O-] ZINC000575822499 1027510459 /nfs/dbraw/zinc/51/04/59/1027510459.db2.gz ATCJCAIVVFDGEG-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO CCc1ccccc1[C@H](N)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423499719 1027564495 /nfs/dbraw/zinc/56/44/95/1027564495.db2.gz JLHJVPFZOBZUNB-SCLBCKFNSA-N 1 1 313.401 3.508 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000576554751 1027632552 /nfs/dbraw/zinc/63/25/52/1027632552.db2.gz AIZIGWPYFPKUKC-UKRRQHHQSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000576554751 1027632558 /nfs/dbraw/zinc/63/25/58/1027632558.db2.gz AIZIGWPYFPKUKC-UKRRQHHQSA-N 1 1 307.438 3.674 20 5 DHBDMO Cc1noc(C[N@H+]2C[C@@H](c3ccccc3)CC2(C)C)c1[N+](=O)[O-] ZINC000932899406 1027645264 /nfs/dbraw/zinc/64/52/64/1027645264.db2.gz UHYQDWBUXRMXTI-AWEZNQCLSA-N 1 1 315.373 3.659 20 5 DHBDMO C[C@H]1C[C@H](C)[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000576805949 1027663252 /nfs/dbraw/zinc/66/32/52/1027663252.db2.gz WNFJIWBVGOZDFW-UWVGGRQHSA-N 1 1 302.296 3.844 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccccn3)C2)c(Cl)c1 ZINC000798965146 1027667553 /nfs/dbraw/zinc/66/75/53/1027667553.db2.gz OWGTUDJUBQNFBH-ZDUSSCGKSA-N 1 1 317.776 3.633 20 5 DHBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+](C2CCC2)C1 ZINC000813630199 1027680112 /nfs/dbraw/zinc/68/01/12/1027680112.db2.gz JDGSDYRJDXVYAN-LBPRGKRZSA-N 1 1 323.824 3.559 20 5 DHBDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000449458874 1028660670 /nfs/dbraw/zinc/66/06/70/1028660670.db2.gz JIRJHFSIADFWBU-MWLCHTKSSA-N 1 1 320.286 3.897 20 5 DHBDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000449458874 1028660673 /nfs/dbraw/zinc/66/06/73/1028660673.db2.gz JIRJHFSIADFWBU-MWLCHTKSSA-N 1 1 320.286 3.897 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCC[C@@H]2C)CC1 ZINC000372169029 1028818910 /nfs/dbraw/zinc/81/89/10/1028818910.db2.gz COSYOLHEBYMCOA-LSDHHAIUSA-N 1 1 317.433 3.605 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000449681477 1028907676 /nfs/dbraw/zinc/90/76/76/1028907676.db2.gz LXXQWNBIWMHBAH-BXBOZWQASA-N 1 1 316.401 3.501 20 5 DHBDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000373019690 1028938261 /nfs/dbraw/zinc/93/82/61/1028938261.db2.gz ORLNJQRBWUETDA-LLVKDONJSA-N 1 1 301.346 3.501 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@]3(CCSC3)C2)cc1[N+](=O)[O-] ZINC000449733554 1028950847 /nfs/dbraw/zinc/95/08/47/1028950847.db2.gz PAZCCYOXVCWOOU-MRXNPFEDSA-N 1 1 306.431 3.622 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000569973215 1029295486 /nfs/dbraw/zinc/29/54/86/1029295486.db2.gz AIZIGWPYFPKUKC-DZGCQCFKSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000569973215 1029295502 /nfs/dbraw/zinc/29/55/02/1029295502.db2.gz AIZIGWPYFPKUKC-DZGCQCFKSA-N 1 1 307.438 3.674 20 5 DHBDMO CC[C@@H]([NH2+][C@@H]1COc2cccc(F)c21)c1cccc([N+](=O)[O-])c1 ZINC000374679704 1029429680 /nfs/dbraw/zinc/42/96/80/1029429680.db2.gz NXNGXEWSKXCGFG-HUUCEWRRSA-N 1 1 316.332 3.908 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nccs3)C2)cc1F ZINC000374774949 1029458180 /nfs/dbraw/zinc/45/81/80/1029458180.db2.gz HHKMCOBAMRXPPY-LBPRGKRZSA-N 1 1 321.377 3.570 20 5 DHBDMO COCCCCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550861 1029912548 /nfs/dbraw/zinc/91/25/48/1029912548.db2.gz SQNOGYDBDISTJR-INIZCTEOSA-N 1 1 306.406 3.591 20 5 DHBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)F)C[N@H+]1C1CC1 ZINC000865600422 1029933949 /nfs/dbraw/zinc/93/39/49/1029933949.db2.gz MSSCZHZOJOBLPH-UWVGGRQHSA-N 1 1 311.332 3.570 20 5 DHBDMO C[N@@H+](CC[C@H]1CC1(Cl)Cl)Cc1ccccc1[N+](=O)[O-] ZINC000822570944 1030063837 /nfs/dbraw/zinc/06/38/37/1030063837.db2.gz SPZWHJBXPSKGJZ-NSHDSACASA-N 1 1 303.189 3.611 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@@]4(CC4(F)F)C3)c2c1 ZINC000865911983 1030081587 /nfs/dbraw/zinc/08/15/87/1030081587.db2.gz XTPHNUOKSUIQKX-OAHLLOKOSA-N 1 1 319.311 3.769 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2cccnc2Cl)cc1[N+](=O)[O-] ZINC000866539784 1030360162 /nfs/dbraw/zinc/36/01/62/1030360162.db2.gz GOOZYRBOPJSRKW-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO CC[C@@H]([NH2+]Cc1nn(C)cc1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000866563965 1030374925 /nfs/dbraw/zinc/37/49/25/1030374925.db2.gz TZPIEJQFKMXVIP-CYBMUJFWSA-N 1 1 324.331 3.507 20 5 DHBDMO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805840044 1030399147 /nfs/dbraw/zinc/39/91/47/1030399147.db2.gz WIRFSFKJFBBARA-FRFSOERESA-N 1 1 320.433 3.775 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccnn1C1CCC1)c1ccccc1[N+](=O)[O-] ZINC000925692535 1030455020 /nfs/dbraw/zinc/45/50/20/1030455020.db2.gz MGHITRXAPBIGHB-OLZOCXBDSA-N 1 1 314.389 3.928 20 5 DHBDMO COc1ccc(F)cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291630703 1030575774 /nfs/dbraw/zinc/57/57/74/1030575774.db2.gz AMKOEUISOHKAAK-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccc(F)nc3)C2)cc1 ZINC000824820613 1030649227 /nfs/dbraw/zinc/64/92/27/1030649227.db2.gz JFPITPJTIZCBGZ-HNNXBMFYSA-N 1 1 315.348 3.509 20 5 DHBDMO CC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C(C)C ZINC000122990483 1030935560 /nfs/dbraw/zinc/93/55/60/1030935560.db2.gz CNJZTPFLZWIEKM-UHFFFAOYSA-N 1 1 301.184 3.588 20 5 DHBDMO CC[C@H](NCC[N@@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000359927190 1031202080 /nfs/dbraw/zinc/20/20/80/1031202080.db2.gz UPWRNUVFJUFGDL-PBHICJAKSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@H](NCC[N@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000359927190 1031202091 /nfs/dbraw/zinc/20/20/91/1031202091.db2.gz UPWRNUVFJUFGDL-PBHICJAKSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@H]1SCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H]1C ZINC000360018561 1031242090 /nfs/dbraw/zinc/24/20/90/1031242090.db2.gz UTQPKRIXQDBESG-NXEZZACHSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@H]1SCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H]1C ZINC000360018561 1031242102 /nfs/dbraw/zinc/24/21/02/1031242102.db2.gz UTQPKRIXQDBESG-NXEZZACHSA-N 1 1 300.811 3.574 20 5 DHBDMO Cc1cc(F)ccc1C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536669599 1031369850 /nfs/dbraw/zinc/36/98/50/1031369850.db2.gz UATBOUKJSVYVPR-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cc(F)ccc1C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536669599 1031369856 /nfs/dbraw/zinc/36/98/56/1031369856.db2.gz UATBOUKJSVYVPR-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO C[C@H]([NH2+]Cc1cccc(N(C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872031731 1031416237 /nfs/dbraw/zinc/41/62/37/1031416237.db2.gz LXWXZBCSTDSCIN-LBPRGKRZSA-N 1 1 317.364 3.651 20 5 DHBDMO C[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872039562 1031423533 /nfs/dbraw/zinc/42/35/33/1031423533.db2.gz SYEPIEZXZHWAGX-IUODEOHRSA-N 1 1 318.348 3.508 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccccc1N(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872044900 1031431140 /nfs/dbraw/zinc/43/11/40/1031431140.db2.gz HFJBQIJOFGIYLM-GFCCVEGCSA-N 1 1 317.364 3.651 20 5 DHBDMO CCc1nocc1C[N@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000293544868 1031512083 /nfs/dbraw/zinc/51/20/83/1031512083.db2.gz YLJCMWRWFLUJFZ-LBPRGKRZSA-N 1 1 303.362 3.647 20 5 DHBDMO CCc1nocc1C[N@@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000293544868 1031512092 /nfs/dbraw/zinc/51/20/92/1031512092.db2.gz YLJCMWRWFLUJFZ-LBPRGKRZSA-N 1 1 303.362 3.647 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872276901 1031572551 /nfs/dbraw/zinc/57/25/51/1031572551.db2.gz UCFMFSKICSDRQA-INIZCTEOSA-N 1 1 322.380 3.658 20 5 DHBDMO COc1cc(NCCCC[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000360972734 1031652341 /nfs/dbraw/zinc/65/23/41/1031652341.db2.gz CRQDFVFOQJOKFA-AWEZNQCLSA-N 1 1 321.421 3.527 20 5 DHBDMO C[C@@H]([NH2+]Cc1cnc(C2CC2)s1)c1ccccc1[N+](=O)[O-] ZINC000873184282 1031746664 /nfs/dbraw/zinc/74/66/64/1031746664.db2.gz JSWUCNVYPOHCTC-SNVBAGLBSA-N 1 1 303.387 3.780 20 5 DHBDMO Cc1nccnc1[C@@H](C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000873189456 1031749658 /nfs/dbraw/zinc/74/96/58/1031749658.db2.gz PHNPCZACXJAMBL-CYBMUJFWSA-N 1 1 314.389 3.667 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1C[C@@H]3CCC[C@@H]3C1)CC2 ZINC001172903913 1033436888 /nfs/dbraw/zinc/43/68/88/1033436888.db2.gz JLVLFRDRWXXMHU-IXDOHACOSA-N 1 1 300.402 3.574 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1C[C@@H]3CCCC[C@@H]3C1)CC2 ZINC001172908738 1033440751 /nfs/dbraw/zinc/44/07/51/1033440751.db2.gz NDOBHGNAYSJWSW-FGTMMUONSA-N 1 1 314.429 3.964 20 5 DHBDMO C[C@@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001172909719 1033482496 /nfs/dbraw/zinc/48/24/96/1033482496.db2.gz VFHYIQSCOHAMFA-IUODEOHRSA-N 1 1 324.371 3.819 20 5 DHBDMO COc1ccc2c(c1)C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173225174 1033603366 /nfs/dbraw/zinc/60/33/66/1033603366.db2.gz BVPQHZBUWPQNQY-CYBMUJFWSA-N 1 1 312.369 3.550 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1cccs1 ZINC001173224987 1033603407 /nfs/dbraw/zinc/60/34/07/1033603407.db2.gz AIBGPFBMRHYORB-ZDUSSCGKSA-N 1 1 304.415 3.762 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1cccnc1 ZINC001173226619 1033605982 /nfs/dbraw/zinc/60/59/82/1033605982.db2.gz MWOPDRQJOKNQIQ-KDOFPFPSSA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@H](Nc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000553184240 1033623097 /nfs/dbraw/zinc/62/30/97/1033623097.db2.gz ADWKBELWAFWDBU-QWHCGFSZSA-N 1 1 321.396 3.799 20 5 DHBDMO Cc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])nc1Cl ZINC000878643678 1033782725 /nfs/dbraw/zinc/78/27/25/1033782725.db2.gz MRBPHKOBCDXSRI-UHFFFAOYSA-N 1 1 319.792 3.977 20 5 DHBDMO C[C@]1(C(F)(F)F)CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000880000210 1034173440 /nfs/dbraw/zinc/17/34/40/1034173440.db2.gz KBAHXDTWSCWXLQ-LBPRGKRZSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000880000210 1034173443 /nfs/dbraw/zinc/17/34/43/1034173443.db2.gz KBAHXDTWSCWXLQ-LBPRGKRZSA-N 1 1 306.259 3.508 20 5 DHBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCC1 ZINC000179156090 1034287268 /nfs/dbraw/zinc/28/72/68/1034287268.db2.gz JAZHDTFSLRNQTF-UHFFFAOYSA-N 1 1 301.346 3.624 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880313433 1034293457 /nfs/dbraw/zinc/29/34/57/1034293457.db2.gz AOTWRBKIPQUURG-YPMHNXCESA-N 1 1 303.387 3.602 20 5 DHBDMO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000179709617 1034328422 /nfs/dbraw/zinc/32/84/22/1034328422.db2.gz LSOCKSIBQZIGRY-INIZCTEOSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000179709617 1034328436 /nfs/dbraw/zinc/32/84/36/1034328436.db2.gz LSOCKSIBQZIGRY-INIZCTEOSA-N 1 1 315.373 3.582 20 5 DHBDMO C[C@H](NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000480604624 1034345633 /nfs/dbraw/zinc/34/56/33/1034345633.db2.gz YXNJAZOZIUIHLF-XHSDSOJGSA-N 1 1 319.449 3.613 20 5 DHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2C[C@@H]3CC[C@H]2c2ccccc23)c1 ZINC000880538483 1034354437 /nfs/dbraw/zinc/35/44/37/1034354437.db2.gz LLNHHYJEIZNYIR-JVPBZIDWSA-N 1 1 324.380 3.563 20 5 DHBDMO C[C@@H](C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000183256090 1034368439 /nfs/dbraw/zinc/36/84/39/1034368439.db2.gz CLGXYRZNAVMVEP-IYNGYCSASA-N 1 1 317.414 3.800 20 5 DHBDMO C[C@H](c1cccc(F)c1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554848574 1034372255 /nfs/dbraw/zinc/37/22/55/1034372255.db2.gz NQDQWDDHXVBSGR-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@@H](C)c1nccs1 ZINC000183701248 1034414430 /nfs/dbraw/zinc/41/44/30/1034414430.db2.gz ZPXQWFDKMCCGLT-GFCCVEGCSA-N 1 1 305.403 3.595 20 5 DHBDMO Cc1cnc(C(C)(C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000183955943 1034431346 /nfs/dbraw/zinc/43/13/46/1034431346.db2.gz JVNJYGABQLSRKQ-UHFFFAOYSA-N 1 1 305.403 3.693 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@H](c2ccc(O)cc2)C1 ZINC000600213444 1034810155 /nfs/dbraw/zinc/81/01/55/1034810155.db2.gz FSTCMECIOWSGJD-IVZVJUQRSA-N 1 1 324.380 3.803 20 5 DHBDMO CC(C)([NH2+]Cc1ccc(Cl)cn1)c1ccccc1[N+](=O)[O-] ZINC000555660196 1034854951 /nfs/dbraw/zinc/85/49/51/1034854951.db2.gz WFDKNVMPCCVHDC-UHFFFAOYSA-N 1 1 305.765 3.668 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCO[C@@H](C(C)C)C1 ZINC000555794056 1034903734 /nfs/dbraw/zinc/90/37/34/1034903734.db2.gz QVVJIILTNXTOCL-WMLDXEAASA-N 1 1 306.406 3.711 20 5 DHBDMO O=[N+]([O-])c1ccc(Cn2cc[nH+]c2C2CC2)c(C(F)(F)F)c1 ZINC000600611149 1035006223 /nfs/dbraw/zinc/00/62/23/1035006223.db2.gz NENBJBRPOXOQNX-UHFFFAOYSA-N 1 1 311.263 3.736 20 5 DHBDMO CC(C)[N@@H+](CCc1nccs1)Cc1ccc([N+](=O)[O-])cc1F ZINC000159906274 1035108687 /nfs/dbraw/zinc/10/86/87/1035108687.db2.gz LWQSGOCOSSCOAF-UHFFFAOYSA-N 1 1 323.393 3.644 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1 ZINC000483108411 1035227421 /nfs/dbraw/zinc/22/74/21/1035227421.db2.gz YPNJHWDDRSIECE-INIZCTEOSA-N 1 1 314.360 3.766 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000483108412 1035227625 /nfs/dbraw/zinc/22/76/25/1035227625.db2.gz YPNJHWDDRSIECE-MRXNPFEDSA-N 1 1 314.360 3.766 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC(C)(C)C2)c([N+](=O)[O-])cc1F ZINC000483109281 1035228800 /nfs/dbraw/zinc/22/88/00/1035228800.db2.gz LOSSHSZYSOJUIR-GFCCVEGCSA-N 1 1 310.369 3.753 20 5 DHBDMO COCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CC[C@@H](C)C1 ZINC000483422675 1035268272 /nfs/dbraw/zinc/26/82/72/1035268272.db2.gz YBFHSKZARULJME-OZLAXVTRSA-N 1 1 318.417 3.745 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3cc(Cl)ccc3C2)cc1 ZINC000484026274 1035313910 /nfs/dbraw/zinc/31/39/10/1035313910.db2.gz YTZUFSUGHDRMTI-UHFFFAOYSA-N 1 1 316.788 3.849 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cn2c(n1)CCCC2 ZINC000924798986 1035419961 /nfs/dbraw/zinc/41/99/61/1035419961.db2.gz QKTGQZNKVMXVGD-QWHCGFSZSA-N 1 1 314.389 3.539 20 5 DHBDMO C[N@@H+](CCCc1ccccc1)CCOc1ccccc1[N+](=O)[O-] ZINC000535330847 1035573015 /nfs/dbraw/zinc/57/30/15/1035573015.db2.gz YPTLZNRTJJYNTA-UHFFFAOYSA-N 1 1 314.385 3.538 20 5 DHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[C@@H]1C ZINC001193413516 1035632812 /nfs/dbraw/zinc/63/28/12/1035632812.db2.gz OBXDTOQRCIHZPM-WMLDXEAASA-N 1 1 306.406 3.874 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC[C@@H]1CCCC1(F)F ZINC001193742444 1035714711 /nfs/dbraw/zinc/71/47/11/1035714711.db2.gz BTPJUMZERXVRRE-AWEZNQCLSA-N 1 1 312.360 3.895 20 5 DHBDMO C[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1ccccc1 ZINC000089883435 1035764798 /nfs/dbraw/zinc/76/47/98/1035764798.db2.gz QKHTZAOYNMMNED-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1ccccc1 ZINC000089883435 1035764811 /nfs/dbraw/zinc/76/48/11/1035764811.db2.gz QKHTZAOYNMMNED-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494688008 1035771849 /nfs/dbraw/zinc/77/18/49/1035771849.db2.gz GQOKTLIDHIAWHX-ZDUSSCGKSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494688008 1035771864 /nfs/dbraw/zinc/77/18/64/1035771864.db2.gz GQOKTLIDHIAWHX-ZDUSSCGKSA-N 1 1 324.808 3.639 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000485707589 1035883057 /nfs/dbraw/zinc/88/30/57/1035883057.db2.gz KKLBEQVHBKYBSK-CABCVRRESA-N 1 1 304.390 3.758 20 5 DHBDMO COc1cc(C[N@@H+]2CCc3sccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000485719360 1035902723 /nfs/dbraw/zinc/90/27/23/1035902723.db2.gz VQBRAKWIEFBHLB-NSHDSACASA-N 1 1 318.398 3.784 20 5 DHBDMO COc1cc(C[N@H+]2CCc3sccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000485719360 1035902733 /nfs/dbraw/zinc/90/27/33/1035902733.db2.gz VQBRAKWIEFBHLB-NSHDSACASA-N 1 1 318.398 3.784 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H](C)c2cccs2)ccc1[N+](=O)[O-] ZINC000485741571 1035929059 /nfs/dbraw/zinc/92/90/59/1035929059.db2.gz CQNHWZRLTZZNGI-LLVKDONJSA-N 1 1 306.387 3.858 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000485748448 1035938931 /nfs/dbraw/zinc/93/89/31/1035938931.db2.gz XDLPWHMJYLIFAE-INIZCTEOSA-N 1 1 312.369 3.941 20 5 DHBDMO COC[C@@H](C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C(C)C ZINC001194478415 1035943461 /nfs/dbraw/zinc/94/34/61/1035943461.db2.gz VEUNVNARSUSKII-IAGOWNOFSA-N 1 1 320.433 3.693 20 5 DHBDMO COc1cc(C[N@@H+](C)CCCc2ccccc2)ccc1[N+](=O)[O-] ZINC000485792252 1035957727 /nfs/dbraw/zinc/95/77/27/1035957727.db2.gz NCHQVUSHHJRPEY-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)c1[N+](=O)[O-] ZINC000595359601 1036099156 /nfs/dbraw/zinc/09/91/56/1036099156.db2.gz NWQXHLFWUMEBFX-HNNXBMFYSA-N 1 1 321.352 3.907 20 5 DHBDMO CCOC[C@@H]1CCCC[N@H+]1Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001182283601 1036180286 /nfs/dbraw/zinc/18/02/86/1036180286.db2.gz BOADMHLMOQRSGI-HNNXBMFYSA-N 1 1 306.406 3.603 20 5 DHBDMO CC[C@@H]1C[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C[C@H](CC)O1 ZINC001195298595 1036211367 /nfs/dbraw/zinc/21/13/67/1036211367.db2.gz FDEUJKBCDVNRCT-BMFZPTHFSA-N 1 1 306.406 3.854 20 5 DHBDMO CC[C@@H]1C[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C[C@H](CC)O1 ZINC001195298595 1036211383 /nfs/dbraw/zinc/21/13/83/1036211383.db2.gz FDEUJKBCDVNRCT-BMFZPTHFSA-N 1 1 306.406 3.854 20 5 DHBDMO CC[C@@H]1C[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C[C@@H](CC)O1 ZINC001195298597 1036212777 /nfs/dbraw/zinc/21/27/77/1036212777.db2.gz FDEUJKBCDVNRCT-FVQBIDKESA-N 1 1 306.406 3.854 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCCc1ccsc1)CC2 ZINC000542104256 1036508718 /nfs/dbraw/zinc/50/87/18/1036508718.db2.gz CZUWHKBJYPKSSX-UHFFFAOYSA-N 1 1 302.399 3.647 20 5 DHBDMO CCc1noc(C)c1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000271801463 1036538212 /nfs/dbraw/zinc/53/82/12/1036538212.db2.gz PHINSRWRZCKTBU-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO Cc1ccc(OCC[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000487546553 1036669247 /nfs/dbraw/zinc/66/92/47/1036669247.db2.gz DBEGYPLWJZNXSF-OAHLLOKOSA-N 1 1 314.385 3.975 20 5 DHBDMO CC[C@@H](C[N@@H+](CC)Cn1cc([N+](=O)[O-])c(C)n1)c1ccccc1 ZINC000774701466 1036715329 /nfs/dbraw/zinc/71/53/29/1036715329.db2.gz JDQRCXSVRABTNR-HNNXBMFYSA-N 1 1 316.405 3.573 20 5 DHBDMO CC(C)([NH2+]Cc1scnc1C1CC1)c1ccccc1[N+](=O)[O-] ZINC000492049151 1036723543 /nfs/dbraw/zinc/72/35/43/1036723543.db2.gz RDQORDUMBBCOEP-UHFFFAOYSA-N 1 1 317.414 3.954 20 5 DHBDMO CC(C)(C)[C@H]1CSCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC001197298247 1036727243 /nfs/dbraw/zinc/72/72/43/1036727243.db2.gz VPONWYWJEPLJQX-CQSZACIVSA-N 1 1 312.410 3.697 20 5 DHBDMO CC(C)(C)[C@H]1CSCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC001197298247 1036727257 /nfs/dbraw/zinc/72/72/57/1036727257.db2.gz VPONWYWJEPLJQX-CQSZACIVSA-N 1 1 312.410 3.697 20 5 DHBDMO CC[C@@H](CSC)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492259923 1036801070 /nfs/dbraw/zinc/80/10/70/1036801070.db2.gz QQFKRQGRGGIQGP-JTQLQIEISA-N 1 1 302.827 3.822 20 5 DHBDMO CC[C@@H](CSC)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492259923 1036801097 /nfs/dbraw/zinc/80/10/97/1036801097.db2.gz QQFKRQGRGGIQGP-JTQLQIEISA-N 1 1 302.827 3.822 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2ccccc2C)ccc1[N+](=O)[O-] ZINC000492357576 1036846637 /nfs/dbraw/zinc/84/66/37/1036846637.db2.gz OEESHIIKTWDEGA-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CCC[C@@H]1C ZINC000487967900 1036885215 /nfs/dbraw/zinc/88/52/15/1036885215.db2.gz CAWMKWPJMPMOCK-XJKSGUPXSA-N 1 1 306.406 3.540 20 5 DHBDMO Cc1cccc(C)c1C[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001198194506 1036975293 /nfs/dbraw/zinc/97/52/93/1036975293.db2.gz FPDXXISABRSMFF-UHFFFAOYSA-N 1 1 314.385 3.722 20 5 DHBDMO C[C@@H](Cc1ccsc1)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000081599058 1036990268 /nfs/dbraw/zinc/99/02/68/1036990268.db2.gz VUDHRSXNSMYWQF-NSHDSACASA-N 1 1 308.378 3.858 20 5 DHBDMO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000081599058 1036990277 /nfs/dbraw/zinc/99/02/77/1036990277.db2.gz VUDHRSXNSMYWQF-NSHDSACASA-N 1 1 308.378 3.858 20 5 DHBDMO Cc1ccc(N(C)CC[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001185046506 1037015763 /nfs/dbraw/zinc/01/57/63/1037015763.db2.gz NWEWBIDDRTWSEU-UHFFFAOYSA-N 1 1 305.422 3.604 20 5 DHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774831941 1037046084 /nfs/dbraw/zinc/04/60/84/1037046084.db2.gz FZVDHJKLLCUIEB-CYBMUJFWSA-N 1 1 307.350 3.514 20 5 DHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774906720 1037199589 /nfs/dbraw/zinc/19/95/89/1037199589.db2.gz YEAXUJGGECHDKG-VXGBXAGGSA-N 1 1 307.350 3.514 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)cc1[N+](=O)[O-] ZINC000597224010 1037244532 /nfs/dbraw/zinc/24/45/32/1037244532.db2.gz ARRNSUAXFAXBFG-FUHWJXTLSA-N 1 1 318.417 3.684 20 5 DHBDMO COc1ccc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000489145979 1037277692 /nfs/dbraw/zinc/27/76/92/1037277692.db2.gz DSOWSCKMTKTZEH-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO C[C@H](Nc1ccsc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001186071114 1037300961 /nfs/dbraw/zinc/30/09/61/1037300961.db2.gz VMWJDWNEVSMWRH-NWDGAFQWSA-N 1 1 309.435 3.721 20 5 DHBDMO COc1cc(C[N@H+]2CCC3(C2)CCCCC3)ccc1[N+](=O)[O-] ZINC000490091284 1037613249 /nfs/dbraw/zinc/61/32/49/1037613249.db2.gz WOWHZDRVLUSZFT-UHFFFAOYSA-N 1 1 304.390 3.760 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@@H](C)CC1 ZINC000494137764 1037651549 /nfs/dbraw/zinc/65/15/49/1037651549.db2.gz UCUFPOTZAXICNN-ZDUSSCGKSA-N 1 1 324.446 3.709 20 5 DHBDMO C[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1Cc2ccccc2C1 ZINC000494197566 1037673595 /nfs/dbraw/zinc/67/35/95/1037673595.db2.gz GMOQUHIJEKTEQS-UHFFFAOYSA-N 1 1 316.788 3.847 20 5 DHBDMO C[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1Cc2ccccc2C1 ZINC000494197566 1037673607 /nfs/dbraw/zinc/67/36/07/1037673607.db2.gz GMOQUHIJEKTEQS-UHFFFAOYSA-N 1 1 316.788 3.847 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCC(F)(F)F)CC2CC2)c(F)c1 ZINC000490566493 1037744083 /nfs/dbraw/zinc/74/40/83/1037744083.db2.gz KFEVDBTUIUWVAM-UHFFFAOYSA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCC(F)(F)F)CC2CC2)c(F)c1 ZINC000490566493 1037744095 /nfs/dbraw/zinc/74/40/95/1037744095.db2.gz KFEVDBTUIUWVAM-UHFFFAOYSA-N 1 1 320.286 3.898 20 5 DHBDMO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490593060 1037746642 /nfs/dbraw/zinc/74/66/42/1037746642.db2.gz UGSGRGZLLOGJPK-GFCCVEGCSA-N 1 1 300.333 3.681 20 5 DHBDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490593060 1037746656 /nfs/dbraw/zinc/74/66/56/1037746656.db2.gz UGSGRGZLLOGJPK-GFCCVEGCSA-N 1 1 300.333 3.681 20 5 DHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@H]1CCCCO1 ZINC000491079263 1037896902 /nfs/dbraw/zinc/89/69/02/1037896902.db2.gz SJYOIOYJGIQSTJ-OAHLLOKOSA-N 1 1 310.369 3.515 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000570983713 1038063991 /nfs/dbraw/zinc/06/39/91/1038063991.db2.gz PAQAVJHPJODWLG-KRWDZBQOSA-N 1 1 316.401 3.758 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000570983713 1038064013 /nfs/dbraw/zinc/06/40/13/1038064013.db2.gz PAQAVJHPJODWLG-KRWDZBQOSA-N 1 1 316.401 3.758 20 5 DHBDMO C[N@@H+](CCCc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917053705 1038133408 /nfs/dbraw/zinc/13/34/08/1038133408.db2.gz APFBBTXMJVAMRM-UHFFFAOYSA-N 1 1 302.349 3.799 20 5 DHBDMO CCC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@H](CC)c1ccccc1 ZINC001190582075 1038350038 /nfs/dbraw/zinc/35/00/38/1038350038.db2.gz OIJWXVREOSOORV-MRXNPFEDSA-N 1 1 316.405 3.692 20 5 DHBDMO C[C@H](CF)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000588930874 1038408986 /nfs/dbraw/zinc/40/89/86/1038408986.db2.gz XHAOXROOQWPWIV-SECBINFHSA-N 1 1 312.728 3.956 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H]1CCCC13CCOCC3)C2 ZINC001191350306 1038487423 /nfs/dbraw/zinc/48/74/23/1038487423.db2.gz JKQOXWOOMQHUGH-MRXNPFEDSA-N 1 1 316.401 3.507 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC000057621042 1038691944 /nfs/dbraw/zinc/69/19/44/1038691944.db2.gz IXJABCJJCCIJEV-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000057621042 1038691950 /nfs/dbraw/zinc/69/19/50/1038691950.db2.gz IXJABCJJCCIJEV-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO C[C@@H](c1ccncc1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590757330 1038699454 /nfs/dbraw/zinc/69/94/54/1038699454.db2.gz PXFPTEAHWGEMIS-WMLDXEAASA-N 1 1 311.385 3.930 20 5 DHBDMO CCc1noc(CC)c1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000166964627 1039037695 /nfs/dbraw/zinc/03/76/95/1039037695.db2.gz BAFJIVBMCZUQPZ-LBPRGKRZSA-N 1 1 317.389 3.867 20 5 DHBDMO C[C@@H](CCO)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000593694248 1039079693 /nfs/dbraw/zinc/07/96/93/1039079693.db2.gz LHGZSEQDIMMEFE-LBPRGKRZSA-N 1 1 320.414 3.526 20 5 DHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)CCC(C)(C)C)cccc1[N+](=O)[O-] ZINC000592144791 1039139002 /nfs/dbraw/zinc/13/90/02/1039139002.db2.gz IVVRZKUHLBLNBC-CYBMUJFWSA-N 1 1 321.421 3.598 20 5 DHBDMO COc1ccccc1C1([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000592395297 1039178683 /nfs/dbraw/zinc/17/86/83/1039178683.db2.gz VYACFKULKPBGHA-ZDUSSCGKSA-N 1 1 312.369 3.943 20 5 DHBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000603859745 1039194938 /nfs/dbraw/zinc/19/49/38/1039194938.db2.gz OYMYCJWOCHWAOQ-ZDUSSCGKSA-N 1 1 309.385 3.658 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ccc([N+](=O)[O-])cc2F)C1 ZINC000603859669 1039194989 /nfs/dbraw/zinc/19/49/89/1039194989.db2.gz QOHSVNPFYYXICG-BETUJISGSA-N 1 1 309.385 3.514 20 5 DHBDMO CCOc1cc(C[N@H+]2CCCC(F)(F)CC2)ccc1[N+](=O)[O-] ZINC000599551899 1039209722 /nfs/dbraw/zinc/20/97/22/1039209722.db2.gz CFLAZDXWLIERKO-UHFFFAOYSA-N 1 1 314.332 3.615 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC(F)(F)CC1 ZINC000599550733 1039209872 /nfs/dbraw/zinc/20/98/72/1039209872.db2.gz AKPHGBIRTJRPPN-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCC(F)(F)CC1 ZINC000599550733 1039209887 /nfs/dbraw/zinc/20/98/87/1039209887.db2.gz AKPHGBIRTJRPPN-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO C/C=C\C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000599691856 1039259347 /nfs/dbraw/zinc/25/93/47/1039259347.db2.gz UAGJPOMHWDABDF-ZRMMWKCHSA-N 1 1 315.373 3.914 20 5 DHBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000059371394 1039956161 /nfs/dbraw/zinc/95/61/61/1039956161.db2.gz WACIPWGESQXCRD-CYBMUJFWSA-N 1 1 318.348 3.806 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCCc2occc21 ZINC000595006826 1040017859 /nfs/dbraw/zinc/01/78/59/1040017859.db2.gz JSJLNWCKLQXPQQ-ABAIWWIYSA-N 1 1 316.357 3.925 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000595296824 1040091574 /nfs/dbraw/zinc/09/15/74/1040091574.db2.gz LJJZLKMCIOVZNR-CQSZACIVSA-N 1 1 300.333 3.723 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595285411 1040096464 /nfs/dbraw/zinc/09/64/64/1040096464.db2.gz WTKPDKKBEVBSRL-CQSZACIVSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595285411 1040096484 /nfs/dbraw/zinc/09/64/84/1040096484.db2.gz WTKPDKKBEVBSRL-CQSZACIVSA-N 1 1 301.346 3.537 20 5 DHBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)Cc1onc(C)c1[N+](=O)[O-] ZINC000595328611 1040100181 /nfs/dbraw/zinc/10/01/81/1040100181.db2.gz WOZAEHJDJIQOOQ-HNNXBMFYSA-N 1 1 317.389 3.653 20 5 DHBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000595288714 1040100629 /nfs/dbraw/zinc/10/06/29/1040100629.db2.gz KSLUOBNTUXYRHH-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000595288714 1040100635 /nfs/dbraw/zinc/10/06/35/1040100635.db2.gz KSLUOBNTUXYRHH-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2onc(C)c2[N+](=O)[O-])o1 ZINC000595327081 1040100646 /nfs/dbraw/zinc/10/06/46/1040100646.db2.gz CKAHHHJTJIAJBS-CYBMUJFWSA-N 1 1 319.361 3.910 20 5 DHBDMO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2onc(C)c2[N+](=O)[O-])o1 ZINC000595327081 1040100649 /nfs/dbraw/zinc/10/06/49/1040100649.db2.gz CKAHHHJTJIAJBS-CYBMUJFWSA-N 1 1 319.361 3.910 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000595340866 1040102366 /nfs/dbraw/zinc/10/23/66/1040102366.db2.gz YGXZVPBYUGZFMZ-UKRRQHHQSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000595340866 1040102370 /nfs/dbraw/zinc/10/23/70/1040102370.db2.gz YGXZVPBYUGZFMZ-UKRRQHHQSA-N 1 1 310.394 3.594 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595338376 1040103310 /nfs/dbraw/zinc/10/33/10/1040103310.db2.gz RRLPMIJEUNIDOA-BMIGLBTASA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595338376 1040103318 /nfs/dbraw/zinc/10/33/18/1040103318.db2.gz RRLPMIJEUNIDOA-BMIGLBTASA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[NH2+][C@H](c2ccccc2C)C(C)C)c1[N+](=O)[O-] ZINC000595413970 1040131035 /nfs/dbraw/zinc/13/10/35/1040131035.db2.gz DRHDDUTTYYRVGV-HNNXBMFYSA-N 1 1 303.362 3.687 20 5 DHBDMO Nc1cccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000595525191 1040159538 /nfs/dbraw/zinc/15/95/38/1040159538.db2.gz PMHKNDUFSKQQFF-MRXNPFEDSA-N 1 1 311.385 3.557 20 5 DHBDMO Cc1ccccc1C1([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595561986 1040173311 /nfs/dbraw/zinc/17/33/11/1040173311.db2.gz HJAJTSHXWOFOLV-UHFFFAOYSA-N 1 1 300.333 3.821 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000595786420 1040257181 /nfs/dbraw/zinc/25/71/81/1040257181.db2.gz ABWJJNLNMRRKSG-IIDMSEBBSA-N 1 1 318.417 3.937 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC2CC1(c1ccccc1)C2 ZINC000595907905 1040274015 /nfs/dbraw/zinc/27/40/15/1040274015.db2.gz KUZKZRBDCYHFAN-UHFFFAOYSA-N 1 1 312.344 3.855 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC2CC1(c1ccccc1)C2 ZINC000595907905 1040274025 /nfs/dbraw/zinc/27/40/25/1040274025.db2.gz KUZKZRBDCYHFAN-UHFFFAOYSA-N 1 1 312.344 3.855 20 5 DHBDMO C[C@H]1C[C@@H](Nc2ccc(C(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000596154969 1040330148 /nfs/dbraw/zinc/33/01/48/1040330148.db2.gz GLJORNOEWNIEHU-GXSJLCMTSA-N 1 1 311.332 3.570 20 5 DHBDMO Cc1cc(NC[C@H]2CC[N@H+](C(C)(C)C)C2)c(F)cc1[N+](=O)[O-] ZINC000596307320 1040374824 /nfs/dbraw/zinc/37/48/24/1040374824.db2.gz KNSXBSBEZGCVSA-GFCCVEGCSA-N 1 1 309.385 3.575 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000173841345 1040438406 /nfs/dbraw/zinc/43/84/06/1040438406.db2.gz XCDIZHAATWPWHX-INIZCTEOSA-N 1 1 322.380 3.658 20 5 DHBDMO C[C@H](C[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000608976697 1040656083 /nfs/dbraw/zinc/65/60/83/1040656083.db2.gz IMBFYNLBKCNPOQ-OAHLLOKOSA-N 1 1 314.385 3.709 20 5 DHBDMO C[C@H](C1CC1)[N@@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602444230 1041035989 /nfs/dbraw/zinc/03/59/89/1041035989.db2.gz ZLXZGMBCRKKJJQ-SSDOTTSWSA-N 1 1 319.224 3.649 20 5 DHBDMO Cc1ncc([C@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000602957840 1041325274 /nfs/dbraw/zinc/32/52/74/1041325274.db2.gz UUZHJYSPFVUOFP-QMMMGPOBSA-N 1 1 311.794 3.864 20 5 DHBDMO CCCC[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104661403 194022418 /nfs/dbraw/zinc/02/24/18/194022418.db2.gz QXXWTZPKIDLCCU-UHFFFAOYSA-N 1 1 303.362 3.524 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3c2cccc3O)c(Cl)c1 ZINC000273147684 130092845 /nfs/dbraw/zinc/09/28/45/130092845.db2.gz WXQKWSZJDCHCEG-OAHLLOKOSA-N 1 1 318.760 3.731 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(C(C)(C)C)o1 ZINC000285281722 131154844 /nfs/dbraw/zinc/15/48/44/131154844.db2.gz JNAIPFOYXHQFOE-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(C(C)(C)C)o1 ZINC000285281722 131154846 /nfs/dbraw/zinc/15/48/46/131154846.db2.gz JNAIPFOYXHQFOE-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC=C(c2ccncc2)C1 ZINC000289532379 131393418 /nfs/dbraw/zinc/39/34/18/131393418.db2.gz HSRGHJJCGPEUTJ-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO Cc1ccc(C[NH2+][C@H]2c3ccc(F)cc3O[C@@H]2C)cc1[N+](=O)[O-] ZINC000570546983 332771133 /nfs/dbraw/zinc/77/11/33/332771133.db2.gz SJGSTOAVFMBQAB-PIGZYNQJSA-N 1 1 316.332 3.654 20 5 DHBDMO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000179924930 333026879 /nfs/dbraw/zinc/02/68/79/333026879.db2.gz JCGMSSZLTQUFFQ-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO CC(C)[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000535556157 335125315 /nfs/dbraw/zinc/12/53/15/335125315.db2.gz MXMCQHSEPFETEE-AWEZNQCLSA-N 1 1 315.373 3.728 20 5 DHBDMO CCC[C@@H](NCC[N@@H+](C)[C@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000318973222 333236002 /nfs/dbraw/zinc/23/60/02/333236002.db2.gz HPVAHOMGTDKASN-RHSMWYFYSA-N 1 1 307.438 3.756 20 5 DHBDMO CCC[C@@H]([NH2+]CCN(C)[C@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000318973222 333236003 /nfs/dbraw/zinc/23/60/03/333236003.db2.gz HPVAHOMGTDKASN-RHSMWYFYSA-N 1 1 307.438 3.756 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCc3ccccc3C2)c(F)c1 ZINC000319384909 333292078 /nfs/dbraw/zinc/29/20/78/333292078.db2.gz XGUVERSYPQYDHU-UHFFFAOYSA-N 1 1 300.333 3.682 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCc3ccccc3C2)c(F)c1 ZINC000319384909 333292080 /nfs/dbraw/zinc/29/20/80/333292080.db2.gz XGUVERSYPQYDHU-UHFFFAOYSA-N 1 1 300.333 3.682 20 5 DHBDMO CCC[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000185860715 335154604 /nfs/dbraw/zinc/15/46/04/335154604.db2.gz KGOPDGHBFJNBFO-HNNXBMFYSA-N 1 1 320.389 3.616 20 5 DHBDMO CCc1nc(C)c(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000291876738 333805939 /nfs/dbraw/zinc/80/59/39/333805939.db2.gz JBJFGWHNFWYNRX-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccnn1-c1ccccc1 ZINC000343462931 335166645 /nfs/dbraw/zinc/16/66/45/335166645.db2.gz BLVGJJAAFKTNKT-AWEZNQCLSA-N 1 1 322.368 3.631 20 5 DHBDMO CC[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCC1 ZINC000340837701 334389078 /nfs/dbraw/zinc/38/90/78/334389078.db2.gz HMZMDABHHGRFDO-UHFFFAOYSA-N 1 1 301.346 3.624 20 5 DHBDMO Cc1csc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000417332845 334709415 /nfs/dbraw/zinc/70/94/15/334709415.db2.gz YAEAOIAGBXENKC-HNNXBMFYSA-N 1 1 317.414 3.917 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(c2ccncc2)CC1 ZINC000191675186 335826158 /nfs/dbraw/zinc/82/61/58/335826158.db2.gz OPOBHQQIEQVCEA-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)(C)C1 ZINC000332107747 336159174 /nfs/dbraw/zinc/15/91/74/336159174.db2.gz FOVDPPXKGKMWES-LBPRGKRZSA-N 1 1 315.373 3.870 20 5 DHBDMO COCC[C@H]1CCCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000332341295 336169208 /nfs/dbraw/zinc/16/92/08/336169208.db2.gz QWOFVUCYDRVDDJ-LSDHHAIUSA-N 1 1 306.406 3.794 20 5 DHBDMO COCC[C@@H]1CCCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000332338739 336169254 /nfs/dbraw/zinc/16/92/54/336169254.db2.gz QMVVWIOVHSQNFN-GJZGRUSLSA-N 1 1 306.406 3.794 20 5 DHBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000351933486 336180758 /nfs/dbraw/zinc/18/07/58/336180758.db2.gz CVGBSBDLTSFFCK-LBPRGKRZSA-N 1 1 310.369 3.513 20 5 DHBDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)on1 ZINC000352088177 336194064 /nfs/dbraw/zinc/19/40/64/336194064.db2.gz WJWGHWMZOGYWMR-CQSZACIVSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)on1 ZINC000352088177 336194065 /nfs/dbraw/zinc/19/40/65/336194065.db2.gz WJWGHWMZOGYWMR-CQSZACIVSA-N 1 1 301.346 3.537 20 5 DHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C12CCC2 ZINC000352609045 336226630 /nfs/dbraw/zinc/22/66/30/336226630.db2.gz QNDMCYUZANMGQY-HZPDHXFCSA-N 1 1 322.380 3.513 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@H](C)C3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000352767981 336233964 /nfs/dbraw/zinc/23/39/64/336233964.db2.gz FHKXVPYXTBQXHE-ZDUSSCGKSA-N 1 1 304.390 3.616 20 5 DHBDMO COc1cc(C[N@H+]([C@H](C)c2ccco2)C2CC2)ccc1[N+](=O)[O-] ZINC000352780277 336236009 /nfs/dbraw/zinc/23/60/09/336236009.db2.gz SRYYVIYVJWKGDC-GFCCVEGCSA-N 1 1 316.357 3.922 20 5 DHBDMO COc1cc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)ccc1[N+](=O)[O-] ZINC000352780277 336236010 /nfs/dbraw/zinc/23/60/10/336236010.db2.gz SRYYVIYVJWKGDC-GFCCVEGCSA-N 1 1 316.357 3.922 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000301879368 336335857 /nfs/dbraw/zinc/33/58/57/336335857.db2.gz ZIQZGYVUKFOQPI-DOTOQJQBSA-N 1 1 315.348 3.591 20 5 DHBDMO Cc1cc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301970288 336340490 /nfs/dbraw/zinc/34/04/90/336340490.db2.gz DHPNWWIUAIUYNL-SJLPKXTDSA-N 1 1 311.385 3.761 20 5 DHBDMO C[C@H](CNc1sccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000301984230 336341381 /nfs/dbraw/zinc/34/13/81/336341381.db2.gz CBYLXDIDPVCQIK-GFCCVEGCSA-N 1 1 305.403 3.589 20 5 DHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2sccc2[N+](=O)[O-])C1 ZINC000302020520 336343517 /nfs/dbraw/zinc/34/35/17/336343517.db2.gz NQGUAAWUNZOUFO-KBPBESRZSA-N 1 1 323.462 3.747 20 5 DHBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302067078 336346645 /nfs/dbraw/zinc/34/66/45/336346645.db2.gz WNAAUNNKWOBGDD-QWHCGFSZSA-N 1 1 321.396 3.799 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cncc(F)c1 ZINC000361130290 336740023 /nfs/dbraw/zinc/74/00/23/336740023.db2.gz GGEDDPQLJALCDA-VIFPVBQESA-N 1 1 309.728 3.633 20 5 DHBDMO CCC[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000361971895 336780510 /nfs/dbraw/zinc/78/05/10/336780510.db2.gz NWTDHFHPPIUYJL-RYRKJORJSA-N 1 1 319.449 3.898 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000375238527 337006426 /nfs/dbraw/zinc/00/64/26/337006426.db2.gz RIKMZOBGOGPGAT-HUUCEWRRSA-N 1 1 318.417 3.855 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1NCc1c[nH+]c2n1CCCC2 ZINC000376489135 337034756 /nfs/dbraw/zinc/03/47/56/337034756.db2.gz UGRICAYWCYYNQW-UHFFFAOYSA-N 1 1 320.780 3.702 20 5 DHBDMO CCSCC[C@@H](C)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000174034594 337138790 /nfs/dbraw/zinc/13/87/90/337138790.db2.gz QSNHMYYCTHBQKT-LLVKDONJSA-N 1 1 300.399 3.697 20 5 DHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000174034594 337138791 /nfs/dbraw/zinc/13/87/91/337138791.db2.gz QSNHMYYCTHBQKT-LLVKDONJSA-N 1 1 300.399 3.697 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC000514669660 337151496 /nfs/dbraw/zinc/15/14/96/337151496.db2.gz BAACLPXHTLUFST-KSSFIOAISA-N 1 1 312.369 3.809 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000183312792 337192942 /nfs/dbraw/zinc/19/29/42/337192942.db2.gz OZSBHXBXRUKKBF-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO Cc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc(C)c1O ZINC000572320180 337607005 /nfs/dbraw/zinc/60/70/05/337607005.db2.gz UKASTIGHBRRQQQ-UHFFFAOYSA-N 1 1 320.776 3.860 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1ccc2c(c1)[nH+]cn2C ZINC000537538073 337941557 /nfs/dbraw/zinc/94/15/57/337941557.db2.gz XGGQPFIVONYHTM-GFCCVEGCSA-N 1 1 310.357 3.963 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCCc1ccccc1 ZINC000430192899 338100549 /nfs/dbraw/zinc/10/05/49/338100549.db2.gz DRFOCZYXVQPGOU-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO CC[N@H+](Cc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430213747 338101777 /nfs/dbraw/zinc/10/17/77/338101777.db2.gz VMCZOZVTVCWBFV-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CC[N@@H+](Cc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430213747 338101778 /nfs/dbraw/zinc/10/17/78/338101778.db2.gz VMCZOZVTVCWBFV-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CC(C)c1ncc(C[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000440475879 338388020 /nfs/dbraw/zinc/38/80/20/338388020.db2.gz FJEVIVYRZVVXRJ-ZDUSSCGKSA-N 1 1 314.389 3.701 20 5 DHBDMO CC(C)c1ncc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000440475879 338388021 /nfs/dbraw/zinc/38/80/21/338388021.db2.gz FJEVIVYRZVVXRJ-ZDUSSCGKSA-N 1 1 314.389 3.701 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459786114 339048471 /nfs/dbraw/zinc/04/84/71/339048471.db2.gz BBSVJXBEKNQNPX-QWHCGFSZSA-N 1 1 322.405 3.565 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)CCCOC(C)C ZINC000470174586 339312804 /nfs/dbraw/zinc/31/28/04/339312804.db2.gz UFDXGQOONVMOJU-RVDMUPIBSA-N 1 1 306.406 3.745 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)CCCOC(C)C ZINC000470174585 339312933 /nfs/dbraw/zinc/31/29/33/339312933.db2.gz UFDXGQOONVMOJU-PTNGSMBKSA-N 1 1 306.406 3.745 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCC(F)(F)F ZINC000470178883 339312980 /nfs/dbraw/zinc/31/29/80/339312980.db2.gz PHHVWECEYLQBAA-FLIBITNWSA-N 1 1 302.296 3.882 20 5 DHBDMO CSC[C@H]1CCC[N@H+]1C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470179515 339313207 /nfs/dbraw/zinc/31/32/07/339313207.db2.gz YFZCAROPLDTYHX-LRFDDAOPSA-N 1 1 306.431 3.826 20 5 DHBDMO CC[C@@H]1C[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CCS1 ZINC000470183900 339313325 /nfs/dbraw/zinc/31/33/25/339313325.db2.gz SVOCJPFCNZDDLI-LRFDDAOPSA-N 1 1 306.431 3.826 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCc1ccccn1 ZINC000470202922 339314196 /nfs/dbraw/zinc/31/41/96/339314196.db2.gz NFLSQUPQGNRTCU-QINSGFPZSA-N 1 1 311.385 3.568 20 5 DHBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000470931335 339331424 /nfs/dbraw/zinc/33/14/24/339331424.db2.gz NJLYBHNUIPOGAL-GZMMTYOYSA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000470931335 339331425 /nfs/dbraw/zinc/33/14/25/339331425.db2.gz NJLYBHNUIPOGAL-GZMMTYOYSA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000470931336 339331520 /nfs/dbraw/zinc/33/15/20/339331520.db2.gz NJLYBHNUIPOGAL-KCJUWKMLSA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000470931336 339331521 /nfs/dbraw/zinc/33/15/21/339331521.db2.gz NJLYBHNUIPOGAL-KCJUWKMLSA-N 1 1 306.259 3.507 20 5 DHBDMO Cc1cc(F)cc2c1C[N@H+](Cc1cccc([N+](=O)[O-])c1)CC2 ZINC000502888293 340115694 /nfs/dbraw/zinc/11/56/94/340115694.db2.gz QQAGXLWFVJYXHZ-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cc(F)cc2c1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)CC2 ZINC000502888293 340115695 /nfs/dbraw/zinc/11/56/95/340115695.db2.gz QQAGXLWFVJYXHZ-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC000506476666 340195358 /nfs/dbraw/zinc/19/53/58/340195358.db2.gz HNXONNUZKYLUSE-QGZVFWFLSA-N 1 1 314.410 3.885 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC000506476666 340195359 /nfs/dbraw/zinc/19/53/59/340195359.db2.gz HNXONNUZKYLUSE-QGZVFWFLSA-N 1 1 314.410 3.885 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)cc1 ZINC000506476756 340195516 /nfs/dbraw/zinc/19/55/16/340195516.db2.gz JHJKKYKORKJPJW-QGZVFWFLSA-N 1 1 314.410 3.885 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)cc1 ZINC000506476756 340195517 /nfs/dbraw/zinc/19/55/17/340195517.db2.gz JHJKKYKORKJPJW-QGZVFWFLSA-N 1 1 314.410 3.885 20 5 DHBDMO CCC[N@@H+](C)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000506499697 340195705 /nfs/dbraw/zinc/19/57/05/340195705.db2.gz NIOYHQFAFPVULR-UHFFFAOYSA-N 1 1 304.346 3.705 20 5 DHBDMO CCC[N@@H+](CCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000506751285 340200920 /nfs/dbraw/zinc/20/09/20/340200920.db2.gz JEYXLTOODFXSLC-UHFFFAOYSA-N 1 1 320.414 3.528 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[NH2+]C2(C(F)F)CCCCC2)c1 ZINC000510072327 340287308 /nfs/dbraw/zinc/28/73/08/340287308.db2.gz LJLGGUIXDIHTRK-UHFFFAOYSA-N 1 1 314.332 3.531 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)s1 ZINC000511075226 340320166 /nfs/dbraw/zinc/32/01/66/340320166.db2.gz RBYXGYIHEOPKQZ-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO C[N@@H+](CCSc1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511093915 340320553 /nfs/dbraw/zinc/32/05/53/340320553.db2.gz FMBOWGCSTNLZRU-UHFFFAOYSA-N 1 1 316.426 3.861 20 5 DHBDMO CSc1ccccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511122127 340321543 /nfs/dbraw/zinc/32/15/43/340321543.db2.gz HPUJSXSUTLAYPE-UHFFFAOYSA-N 1 1 316.426 3.991 20 5 DHBDMO Cc1c(C[N@H+](C)[C@@H]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000512325629 340357167 /nfs/dbraw/zinc/35/71/67/340357167.db2.gz WGYYPQWNXSMNIS-GOSISDBHSA-N 1 1 310.397 3.893 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](COC(F)F)C1 ZINC000512844224 340380579 /nfs/dbraw/zinc/38/05/79/340380579.db2.gz MCBXRHZWJBREKE-NWDGAFQWSA-N 1 1 314.332 3.525 20 5 DHBDMO C[N@H+](CCc1ccccc1O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542317222 341004496 /nfs/dbraw/zinc/00/44/96/341004496.db2.gz SKDUAKQGPWATKH-UHFFFAOYSA-N 1 1 320.776 3.628 20 5 DHBDMO C[N@@H+](CCc1ccccc1O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542317222 341004497 /nfs/dbraw/zinc/00/44/97/341004497.db2.gz SKDUAKQGPWATKH-UHFFFAOYSA-N 1 1 320.776 3.628 20 5 DHBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000542320737 341004755 /nfs/dbraw/zinc/00/47/55/341004755.db2.gz UIWAFTMNRDYUET-NSHDSACASA-N 1 1 303.362 3.604 20 5 DHBDMO CCC[C@@H](NC[C@H](C)[N@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000130989740 341055871 /nfs/dbraw/zinc/05/58/71/341055871.db2.gz FQQSYOPEULHBMI-SUMWQHHRSA-N 1 1 305.422 3.508 20 5 DHBDMO CCC[C@@H](NC[C@H](C)[N@@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000130989740 341055872 /nfs/dbraw/zinc/05/58/72/341055872.db2.gz FQQSYOPEULHBMI-SUMWQHHRSA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000544611513 341088977 /nfs/dbraw/zinc/08/89/77/341088977.db2.gz FUYPFYBOVJYNKS-HOTGVXAUSA-N 1 1 306.431 3.763 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(F)cc(F)c1 ZINC000548935415 341281493 /nfs/dbraw/zinc/28/14/93/341281493.db2.gz KTMBPUNRLZHXMR-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO CC1(C)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549464376 341295204 /nfs/dbraw/zinc/29/52/04/341295204.db2.gz XUKIPOIJLREYKU-UHFFFAOYSA-N 1 1 302.296 3.846 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549464376 341295205 /nfs/dbraw/zinc/29/52/05/341295205.db2.gz XUKIPOIJLREYKU-UHFFFAOYSA-N 1 1 302.296 3.846 20 5 DHBDMO CC(C)c1[nH+]ccn1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159437359 519880318 /nfs/dbraw/zinc/88/03/18/519880318.db2.gz INBOEHIVDIMGGK-UHFFFAOYSA-N 1 1 324.178 3.726 20 5 DHBDMO CCCO[C@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000266721539 520287235 /nfs/dbraw/zinc/28/72/35/520287235.db2.gz HOPOAESAKZLUNN-CABCVRRESA-N 1 1 306.406 3.937 20 5 DHBDMO Cc1ncc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000182662641 527251515 /nfs/dbraw/zinc/25/15/15/527251515.db2.gz BLYASDJPFJNTIX-LLVKDONJSA-N 1 1 305.403 3.861 20 5 DHBDMO Cc1ncc(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000182662641 527251520 /nfs/dbraw/zinc/25/15/20/527251520.db2.gz BLYASDJPFJNTIX-LLVKDONJSA-N 1 1 305.403 3.861 20 5 DHBDMO CC[C@@H]([NH2+][C@H](C)c1nccn1CC)c1cccc([N+](=O)[O-])c1 ZINC000297689085 535808907 /nfs/dbraw/zinc/80/89/07/535808907.db2.gz LUNWNXFKCRIWAX-IUODEOHRSA-N 1 1 302.378 3.613 20 5 DHBDMO COCCc1cc[nH+]c(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000287747950 536832059 /nfs/dbraw/zinc/83/20/59/536832059.db2.gz ZBSJMOUPXDKRCX-CYBMUJFWSA-N 1 1 315.373 3.660 20 5 DHBDMO C[C@H]1CCC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000725263950 563570294 /nfs/dbraw/zinc/57/02/94/563570294.db2.gz WVUJFLWYTFOYAJ-JTQLQIEISA-N 1 1 313.195 3.589 20 5 DHBDMO C[C@H]1CCC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000725263950 563570295 /nfs/dbraw/zinc/57/02/95/563570295.db2.gz WVUJFLWYTFOYAJ-JTQLQIEISA-N 1 1 313.195 3.589 20 5 DHBDMO C[N@@H+]1CCC12CN(C(=O)c1c3ccccc3cc3ccccc31)C2 ZINC001270376818 1013113695 /nfs/dbraw/zinc/11/36/95/1013113695.db2.gz KJNSOWBPRNOBLN-UHFFFAOYSA-N 1 1 316.404 3.523 20 5 DHBDMO C[N@H+]1CCC12CN(C(=O)c1c3ccccc3cc3ccccc31)C2 ZINC001270376818 1013113698 /nfs/dbraw/zinc/11/36/98/1013113698.db2.gz KJNSOWBPRNOBLN-UHFFFAOYSA-N 1 1 316.404 3.523 20 5 DHBDMO CCC(CC)N(CC)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001167111419 1013157868 /nfs/dbraw/zinc/15/78/68/1013157868.db2.gz LYSYERRQBQHRML-MDZDMXLPSA-N 1 1 306.410 3.537 20 5 DHBDMO O=[N+]([O-])c1cccnc1Nc1ccc2c(c1)[nH+]c1n2CCCCC1 ZINC000007139592 1013410640 /nfs/dbraw/zinc/41/06/40/1013410640.db2.gz CQEAKYGDHQKVNE-UHFFFAOYSA-N 1 1 323.356 3.810 20 5 DHBDMO C[N@@H+](CCCNc1cccc(F)c1[N+](=O)[O-])Cc1ccccc1 ZINC000302872340 1013560993 /nfs/dbraw/zinc/56/09/93/1013560993.db2.gz OKJZGLRMAQWTLO-UHFFFAOYSA-N 1 1 317.364 3.668 20 5 DHBDMO COc1ncc(Nc2cc[nH+]c(-c3ccccc3)c2)cc1[N+](=O)[O-] ZINC001210137483 1013574864 /nfs/dbraw/zinc/57/48/64/1013574864.db2.gz YGZZSROXOOKFPE-UHFFFAOYSA-N 1 1 322.324 3.804 20 5 DHBDMO Cc1c(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)cccc1[N+](=O)[O-] ZINC000441434350 1013834309 /nfs/dbraw/zinc/83/43/09/1013834309.db2.gz JJFWNTXNORIKMJ-QGZVFWFLSA-N 1 1 318.417 3.827 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000441460676 1013908569 /nfs/dbraw/zinc/90/85/69/1013908569.db2.gz DRGBQTWIJKALKZ-KEYYUXOJSA-N 1 1 304.390 3.627 20 5 DHBDMO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)cn2C)cc1[N+](=O)[O-] ZINC000091930738 1014095192 /nfs/dbraw/zinc/09/51/92/1014095192.db2.gz WORPODAVGIUYTO-UHFFFAOYSA-N 1 1 307.781 3.527 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2cc(Cl)cn2C)cc1[N+](=O)[O-] ZINC000091930738 1014095194 /nfs/dbraw/zinc/09/51/94/1014095194.db2.gz WORPODAVGIUYTO-UHFFFAOYSA-N 1 1 307.781 3.527 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1C[C@H]1c1ccccc1 ZINC000580602331 1014246909 /nfs/dbraw/zinc/24/69/09/1014246909.db2.gz FZBXVNDDHYIXQW-MSOLQXFVSA-N 1 1 310.397 3.873 20 5 DHBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000093337786 1014342258 /nfs/dbraw/zinc/34/22/58/1014342258.db2.gz QLZDNTGQFXZPSQ-OAHLLOKOSA-N 1 1 306.406 3.577 20 5 DHBDMO CC[C@@H](C)C[N@@H+](CC)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000177846134 1014414441 /nfs/dbraw/zinc/41/44/41/1014414441.db2.gz CPDQITPGKUSDPX-GFCCVEGCSA-N 1 1 318.377 3.513 20 5 DHBDMO C[C@H](O)[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000581135391 1014585208 /nfs/dbraw/zinc/58/52/08/1014585208.db2.gz GPPQHIRADVOBMJ-PRXAMGSTSA-N 1 1 318.348 3.507 20 5 DHBDMO CCCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](C)c1ccc(C)o1 ZINC000610485007 1014604567 /nfs/dbraw/zinc/60/45/67/1014604567.db2.gz KDYIHXARQYYYKC-CQSZACIVSA-N 1 1 320.393 3.556 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000276216388 1014866713 /nfs/dbraw/zinc/86/67/13/1014866713.db2.gz IKTLZKRRYAQUNW-SECBINFHSA-N 1 1 308.325 3.819 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000276216388 1014866729 /nfs/dbraw/zinc/86/67/29/1014866729.db2.gz IKTLZKRRYAQUNW-SECBINFHSA-N 1 1 308.325 3.819 20 5 DHBDMO C[C@H]([NH2+][C@@H](CO)c1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-] ZINC000089210779 1015021538 /nfs/dbraw/zinc/02/15/38/1015021538.db2.gz YZLNJOYRIQWZMA-NHYWBVRUSA-N 1 1 320.776 3.632 20 5 DHBDMO CC[C@@H]([NH2+]Cc1nn(C)c2ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000610517418 1015079995 /nfs/dbraw/zinc/07/99/95/1015079995.db2.gz DXDWNUAEQAELGD-MRXNPFEDSA-N 1 1 324.384 3.722 20 5 DHBDMO C[N@H+](C/C=C/c1ccc(F)cc1)CCc1cccc([N+](=O)[O-])c1 ZINC000581837553 1015367312 /nfs/dbraw/zinc/36/73/12/1015367312.db2.gz YHKFFZJTSCUDMM-HWKANZROSA-N 1 1 314.360 3.922 20 5 DHBDMO C[C@@H](c1cccs1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581163 1015628803 /nfs/dbraw/zinc/62/88/03/1015628803.db2.gz HMIIJSBZFGNOLT-JTQLQIEISA-N 1 1 317.370 3.991 20 5 DHBDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581163 1015628806 /nfs/dbraw/zinc/62/88/06/1015628806.db2.gz HMIIJSBZFGNOLT-JTQLQIEISA-N 1 1 317.370 3.991 20 5 DHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1cccs1 ZINC000065208930 1015971920 /nfs/dbraw/zinc/97/19/20/1015971920.db2.gz HQXBPFKLKZISGC-UHFFFAOYSA-N 1 1 306.387 3.557 20 5 DHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccc(Cl)nc1 ZINC000255437043 1016060935 /nfs/dbraw/zinc/06/09/35/1016060935.db2.gz LNDXSKIUWWCVKI-XQRVVYSFSA-N 1 1 317.776 3.788 20 5 DHBDMO CC(C)[C@H]1CC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538303408 1016094562 /nfs/dbraw/zinc/09/45/62/1016094562.db2.gz JSRJPPVNTDVYGN-OAHLLOKOSA-N 1 1 317.414 3.949 20 5 DHBDMO CC(C)[C@H]1CC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538303408 1016094573 /nfs/dbraw/zinc/09/45/73/1016094573.db2.gz JSRJPPVNTDVYGN-OAHLLOKOSA-N 1 1 317.414 3.949 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1cccs1)C1CC1 ZINC000051421400 1016342361 /nfs/dbraw/zinc/34/23/61/1016342361.db2.gz BVDWGUQKCSPDMA-UHFFFAOYSA-N 1 1 318.398 3.700 20 5 DHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CC[C@@H](C)C1 ZINC000362160759 1032255032 /nfs/dbraw/zinc/25/50/32/1032255032.db2.gz YMLDXURRYRPCIQ-CZUORRHYSA-N 1 1 306.406 3.540 20 5 DHBDMO CC(C)[N@@H+](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000320195619 1012075655 /nfs/dbraw/zinc/07/56/55/1012075655.db2.gz QFSHKMBGLHXUIK-SNVBAGLBSA-N 1 1 319.327 3.754 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC2(C1)CCCCC2 ZINC000610216165 1012432458 /nfs/dbraw/zinc/43/24/58/1012432458.db2.gz SWXDJUSTEQOPHE-UHFFFAOYSA-N 1 1 304.390 3.630 20 5 DHBDMO Cc1cccc(OCC[N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])c1 ZINC001167071257 1012456088 /nfs/dbraw/zinc/45/60/88/1012456088.db2.gz KNNUORASAVIURP-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO Cc1cccc(OCC[N@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])c1 ZINC001167071257 1012456095 /nfs/dbraw/zinc/45/60/95/1012456095.db2.gz KNNUORASAVIURP-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO CCCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H]1CCC[C@H](C)C1 ZINC000339646870 1012721542 /nfs/dbraw/zinc/72/15/42/1012721542.db2.gz LCOIFOWSGSQSEA-UONOGXRCSA-N 1 1 308.426 3.509 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)cc1 ZINC000516998807 1012886950 /nfs/dbraw/zinc/88/69/50/1012886950.db2.gz BWMWRJGDSSZVDW-IBGZPJMESA-N 1 1 324.380 3.565 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CCOCC3)C2)cc1Cl ZINC000783575280 1017195727 /nfs/dbraw/zinc/19/57/27/1017195727.db2.gz WZGAQDYRMIQLBQ-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO CCc1ccc([C@H]([NH2+]CCSC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612405069 1017763031 /nfs/dbraw/zinc/76/30/31/1017763031.db2.gz YRYLGOKHFDCLPV-MRXNPFEDSA-N 1 1 320.414 3.792 20 5 DHBDMO C[C@H](c1ccc(F)cc1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445260458 1017809861 /nfs/dbraw/zinc/80/98/61/1017809861.db2.gz QOYCUQBQWDFTAT-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H](c1ccc(F)cc1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445260458 1017809884 /nfs/dbraw/zinc/80/98/84/1017809884.db2.gz QOYCUQBQWDFTAT-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC000525636756 1018342452 /nfs/dbraw/zinc/34/24/52/1018342452.db2.gz KOFLTBJKNKTZKS-GOSISDBHSA-N 1 1 310.397 3.702 20 5 DHBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H](C)C(C)C ZINC000065298521 1019322593 /nfs/dbraw/zinc/32/25/93/1019322593.db2.gz AUBWCLWOEXTDSF-GFCCVEGCSA-N 1 1 318.377 3.511 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000611350312 1019451522 /nfs/dbraw/zinc/45/15/22/1019451522.db2.gz ICCQPDDBOPEGOT-CVEARBPZSA-N 1 1 318.417 3.542 20 5 DHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc([N+](=O)[O-])s2)C1 ZINC000611509696 1019507132 /nfs/dbraw/zinc/50/71/32/1019507132.db2.gz FOHRZCDVJDHIDK-UONOGXRCSA-N 1 1 323.462 3.747 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCOc2ccccc2C1 ZINC000611515324 1019507418 /nfs/dbraw/zinc/50/74/18/1019507418.db2.gz IUXTZWRTMOOQRA-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCOc2ccccc2C1 ZINC000611515324 1019507433 /nfs/dbraw/zinc/50/74/33/1019507433.db2.gz IUXTZWRTMOOQRA-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1c([C@H](C)[NH2+]C[C@@H](C(C)C)N2CCCC2)cccc1[N+](=O)[O-] ZINC000480552816 1019749471 /nfs/dbraw/zinc/74/94/71/1019749471.db2.gz KLYOJVRHFOVQPI-YJBOKZPZSA-N 1 1 319.449 3.674 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000316898509 1019945645 /nfs/dbraw/zinc/94/56/45/1019945645.db2.gz ZBNBRYCPECSUDZ-LXZKKBNFSA-N 1 1 305.422 3.508 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000316898509 1019945652 /nfs/dbraw/zinc/94/56/52/1019945652.db2.gz ZBNBRYCPECSUDZ-LXZKKBNFSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@@H](NCC(C)(C)[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000154974325 1020173730 /nfs/dbraw/zinc/17/37/30/1020173730.db2.gz RLTTZGPSNGDIME-CQSZACIVSA-N 1 1 305.422 3.510 20 5 DHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000155219512 1020200294 /nfs/dbraw/zinc/20/02/94/1020200294.db2.gz DKSOLMSEWJAGAH-MRXNPFEDSA-N 1 1 312.369 3.593 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c[nH]nc2c1 ZINC000179320219 1020251818 /nfs/dbraw/zinc/25/18/18/1020251818.db2.gz FUWUCAFYNPWTKV-UHFFFAOYSA-N 1 1 324.384 3.882 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c1 ZINC000281038460 1020323031 /nfs/dbraw/zinc/32/30/31/1020323031.db2.gz PWEAWKPTHJLBPH-RCCFBDPRSA-N 1 1 318.417 3.500 20 5 DHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000738052953 1020860184 /nfs/dbraw/zinc/86/01/84/1020860184.db2.gz FZALQAWPUPFYBG-CJNGLKHVSA-N 1 1 316.405 3.803 20 5 DHBDMO CCC[C@H]([NH2+]Cc1ccc2cncn2c1)c1cccc([N+](=O)[O-])c1 ZINC000414193720 1020981179 /nfs/dbraw/zinc/98/11/79/1020981179.db2.gz UPPBKJDSWDWPFT-SFHVURJKSA-N 1 1 324.384 3.874 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000741790585 1021054257 /nfs/dbraw/zinc/05/42/57/1021054257.db2.gz HTZDGKDWEQBBRR-OAHLLOKOSA-N 1 1 314.360 3.799 20 5 DHBDMO CN(CC[C@@H]1CCCC[N@H+]1C)c1ccc([N+](=O)[O-])cc1Cl ZINC000742418217 1021118151 /nfs/dbraw/zinc/11/81/51/1021118151.db2.gz ABAPPEXZCZCEOR-LBPRGKRZSA-N 1 1 311.813 3.559 20 5 DHBDMO CCOc1cccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000180708213 1021149714 /nfs/dbraw/zinc/14/97/14/1021149714.db2.gz LCFZUILVFROFLD-LBPRGKRZSA-N 1 1 318.348 3.983 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](CC2CCCCC2)C2CC2)cc1 ZINC000776277390 1021209428 /nfs/dbraw/zinc/20/94/28/1021209428.db2.gz OENRMYMTZIQWRX-GOSISDBHSA-N 1 1 318.417 3.673 20 5 DHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@H]3C3CCCC3)c2c1 ZINC000917619741 1021325185 /nfs/dbraw/zinc/32/51/85/1021325185.db2.gz MRGIEIVMPOYMTG-INIZCTEOSA-N 1 1 314.389 3.557 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2C[C@H](O)c3ccccc32)c(Cl)c1 ZINC000850371958 1021495461 /nfs/dbraw/zinc/49/54/61/1021495461.db2.gz NRAUXWOTCKTMNV-HOTGVXAUSA-N 1 1 318.760 3.516 20 5 DHBDMO CSC[C@@H]1CCC[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154728790 1021522260 /nfs/dbraw/zinc/52/22/60/1021522260.db2.gz AVSCHGWBJOARES-NSHDSACASA-N 1 1 300.811 3.576 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCC(C)(C)C1 ZINC000619515272 1021780854 /nfs/dbraw/zinc/78/08/54/1021780854.db2.gz GHPYOSCPBXKPRJ-LBPRGKRZSA-N 1 1 303.362 3.747 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+]C1(c2ccccc2)CCC1 ZINC000170907785 1021918334 /nfs/dbraw/zinc/91/83/34/1021918334.db2.gz HFOVOFCPCAJLIM-UHFFFAOYSA-N 1 1 300.333 3.903 20 5 DHBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000290421417 1021993836 /nfs/dbraw/zinc/99/38/36/1021993836.db2.gz KRPGBEQJNXKRHL-MRXNPFEDSA-N 1 1 314.389 3.580 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](C)c2csc3ccccc23)c1[N+](=O)[O-] ZINC000851930920 1022042730 /nfs/dbraw/zinc/04/27/30/1022042730.db2.gz HAHJBASWATYNNF-VIFPVBQESA-N 1 1 317.370 3.957 20 5 DHBDMO CCCCC[C@@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587921 1022102653 /nfs/dbraw/zinc/10/26/53/1022102653.db2.gz ZMYPCGMBHYZMJH-NVXWUHKLSA-N 1 1 306.406 3.673 20 5 DHBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2C)n1 ZINC000183350502 1022112821 /nfs/dbraw/zinc/11/28/21/1022112821.db2.gz SWCYZBLUQWQQIA-GOSISDBHSA-N 1 1 311.385 3.944 20 5 DHBDMO CCC(CC)[N@@H+](CC(C)C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588730 1022115301 /nfs/dbraw/zinc/11/53/01/1022115301.db2.gz BJCMOVJJRHLWSM-KRWDZBQOSA-N 1 1 308.422 3.775 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169005946 1022212132 /nfs/dbraw/zinc/21/21/32/1022212132.db2.gz DKNYITMXFMWXRM-ZWNOBZJWSA-N 1 1 317.216 3.871 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)C1 ZINC001169038489 1022221143 /nfs/dbraw/zinc/22/11/43/1022221143.db2.gz ZDQDLMOLRKYMBW-PVXIVEMSSA-N 1 1 310.344 3.547 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCC[C@@H](Cc3ccc(F)cc3)C2)C1 ZINC001169039255 1022222284 /nfs/dbraw/zinc/22/22/84/1022222284.db2.gz OPOQLNQEQRNXCK-XYJFISCASA-N 1 1 320.408 3.526 20 5 DHBDMO CC(C)NC(=O)C[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000768204001 1022916708 /nfs/dbraw/zinc/91/67/08/1022916708.db2.gz MKGJJSXZCKKRGB-UHFFFAOYSA-N 1 1 320.436 3.949 20 5 DHBDMO COCCCC[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000418136293 1022968758 /nfs/dbraw/zinc/96/87/58/1022968758.db2.gz QFNKIWIDPRFIOX-UHFFFAOYSA-N 1 1 318.373 3.713 20 5 DHBDMO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCc1ccccn1 ZINC000769034450 1023073571 /nfs/dbraw/zinc/07/35/71/1023073571.db2.gz QEEBJMRXELRZEL-CLFYSBASSA-N 1 1 311.385 3.568 20 5 DHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCC2(C1)OCCO2 ZINC000769311419 1023119556 /nfs/dbraw/zinc/11/95/56/1023119556.db2.gz PWQDGMXHKZCDDD-UHFFFAOYSA-N 1 1 319.404 3.942 20 5 DHBDMO CNC(=O)[C@@H](C)C[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000769569800 1023182472 /nfs/dbraw/zinc/18/24/72/1023182472.db2.gz VYJMIIAJEDCPQC-HNNXBMFYSA-N 1 1 320.436 3.807 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000047611439 1023359201 /nfs/dbraw/zinc/35/92/01/1023359201.db2.gz XDKIOGIGFWUHMT-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO Cc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000108098198 1023524683 /nfs/dbraw/zinc/52/46/83/1023524683.db2.gz FCNZSKYUEHMEHF-KRWDZBQOSA-N 1 1 311.385 3.590 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)S1 ZINC000746673194 1023783908 /nfs/dbraw/zinc/78/39/08/1023783908.db2.gz KFVDGGCLTZGFKD-AOOOYVTPSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)S1 ZINC000746673194 1023783913 /nfs/dbraw/zinc/78/39/13/1023783913.db2.gz KFVDGGCLTZGFKD-AOOOYVTPSA-N 1 1 300.811 3.574 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@H](C)[C@@H]1C ZINC000112644972 1023816780 /nfs/dbraw/zinc/81/67/80/1023816780.db2.gz ZVHXSIIOIMZUHE-QWHCGFSZSA-N 1 1 324.446 3.708 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@H](C)[C@@H]1C ZINC000112644972 1023816782 /nfs/dbraw/zinc/81/67/82/1023816782.db2.gz ZVHXSIIOIMZUHE-QWHCGFSZSA-N 1 1 324.446 3.708 20 5 DHBDMO Cc1ccccc1OCC[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788469898 1023889994 /nfs/dbraw/zinc/88/99/94/1023889994.db2.gz JJECIJFWFHGCPI-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788481847 1023892169 /nfs/dbraw/zinc/89/21/69/1023892169.db2.gz JNMRUESFQDZGHO-QWHCGFSZSA-N 1 1 312.410 3.840 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000270129361 1024355883 /nfs/dbraw/zinc/35/58/83/1024355883.db2.gz BBBAOWUHYYRMCO-SNVBAGLBSA-N 1 1 300.280 3.850 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000270129361 1024355897 /nfs/dbraw/zinc/35/58/97/1024355897.db2.gz BBBAOWUHYYRMCO-SNVBAGLBSA-N 1 1 300.280 3.850 20 5 DHBDMO Cc1c(C[NH2+][C@@H]2COc3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000790695427 1024358183 /nfs/dbraw/zinc/35/81/83/1024358183.db2.gz OKNKDQLSLREGQJ-CQSZACIVSA-N 1 1 318.760 3.780 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+][C@H]2c3ccccc3CC[C@@H]2F)c1 ZINC000883384038 1024417860 /nfs/dbraw/zinc/41/78/60/1024417860.db2.gz KOTRLPWNSLZHHS-IRXDYDNUSA-N 1 1 300.333 3.710 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)c1 ZINC000883384036 1024418424 /nfs/dbraw/zinc/41/84/24/1024418424.db2.gz KOTRLPWNSLZHHS-DLBZAZTESA-N 1 1 300.333 3.710 20 5 DHBDMO COc1cc(C[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])ccc1O ZINC000270704661 1024420884 /nfs/dbraw/zinc/42/08/84/1024420884.db2.gz GKOGTWGAJXLKFI-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])ccc1O ZINC000270704661 1024420888 /nfs/dbraw/zinc/42/08/88/1024420888.db2.gz GKOGTWGAJXLKFI-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000883463694 1024440341 /nfs/dbraw/zinc/44/03/41/1024440341.db2.gz WDPFVJATGJDVSE-MRXNPFEDSA-N 1 1 315.348 3.769 20 5 DHBDMO CCCc1ncc(C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)o1 ZINC000453367116 1024491413 /nfs/dbraw/zinc/49/14/13/1024491413.db2.gz HBSGGMCXZOBBLH-OAHLLOKOSA-N 1 1 303.362 3.776 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1cnc(CC)o1)c1cccc([N+](=O)[O-])c1 ZINC000453376162 1024494644 /nfs/dbraw/zinc/49/46/44/1024494644.db2.gz PNKFLUCRUOVKJM-OAHLLOKOSA-N 1 1 303.362 3.776 20 5 DHBDMO CCC[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cccc([N+](=O)[O-])c1 ZINC000271495791 1024523046 /nfs/dbraw/zinc/52/30/46/1024523046.db2.gz LGHFNZRYCOMOBU-HZPDHXFCSA-N 1 1 314.389 3.826 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1scnc1C1CC1 ZINC000348670800 1024602777 /nfs/dbraw/zinc/60/27/77/1024602777.db2.gz KENKRLKPMSLSRN-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000106877051 1024606146 /nfs/dbraw/zinc/60/61/46/1024606146.db2.gz JKJIBTJQNVXPKG-NSHDSACASA-N 1 1 305.403 3.861 20 5 DHBDMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000106877051 1024606148 /nfs/dbraw/zinc/60/61/48/1024606148.db2.gz JKJIBTJQNVXPKG-NSHDSACASA-N 1 1 305.403 3.861 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000348946443 1024653766 /nfs/dbraw/zinc/65/37/66/1024653766.db2.gz GJIDZDUPCIRGQC-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170353474 1024748856 /nfs/dbraw/zinc/74/88/56/1024748856.db2.gz YNWHJFQQXZIRPI-MJBXVCDLSA-N 1 1 306.406 3.512 20 5 DHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878046 1024820954 /nfs/dbraw/zinc/82/09/54/1024820954.db2.gz RPQHLSMDEBIXSY-CYBMUJFWSA-N 1 1 307.350 3.658 20 5 DHBDMO CSC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000306007359 1024844266 /nfs/dbraw/zinc/84/42/66/1024844266.db2.gz QRKFNWFFQBMMMO-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(CC(F)(F)F)CC2)cc1F ZINC000792934421 1024847149 /nfs/dbraw/zinc/84/71/49/1024847149.db2.gz VCMVMBFTBWDDPA-UHFFFAOYSA-N 1 1 320.286 3.898 20 5 DHBDMO CC(C)C[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CC1 ZINC000728898872 1024870102 /nfs/dbraw/zinc/87/01/02/1024870102.db2.gz ZVKXAGVXIMEZLA-UHFFFAOYSA-N 1 1 314.389 3.536 20 5 DHBDMO Cc1c([C@H](C)[NH2+]Cc2ccc(Cl)cn2)cccc1[N+](=O)[O-] ZINC000182121171 1024922557 /nfs/dbraw/zinc/92/25/57/1024922557.db2.gz KFAHGSCAACTSGR-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000793370790 1025010903 /nfs/dbraw/zinc/01/09/03/1025010903.db2.gz RPAZRGOPNWQBIF-ZDUSSCGKSA-N 1 1 321.377 3.761 20 5 DHBDMO CCC[N@@H+]1CCC[C@H]1CN[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353971638 1025306458 /nfs/dbraw/zinc/30/64/58/1025306458.db2.gz LIBJNCNQYJXRPT-DLBZAZTESA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[N@H+]1CCC[C@H]1CN[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353971638 1025306467 /nfs/dbraw/zinc/30/64/67/1025306467.db2.gz LIBJNCNQYJXRPT-DLBZAZTESA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@H]1CCC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000354109248 1025355312 /nfs/dbraw/zinc/35/53/12/1025355312.db2.gz JNLIZMZOPZYIOG-ZDUSSCGKSA-N 1 1 322.405 3.624 20 5 DHBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000804576725 1025373612 /nfs/dbraw/zinc/37/36/12/1025373612.db2.gz CFGGDCKEXLCDCX-OAHLLOKOSA-N 1 1 317.776 3.847 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000885958838 1025420061 /nfs/dbraw/zinc/42/00/61/1025420061.db2.gz MPOGYRFVKBPICY-QGZVFWFLSA-N 1 1 311.385 3.587 20 5 DHBDMO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])c1 ZINC000886107045 1025509329 /nfs/dbraw/zinc/50/93/29/1025509329.db2.gz JIJCKCZKONDSAA-CYBMUJFWSA-N 1 1 315.373 3.628 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000886120799 1025516446 /nfs/dbraw/zinc/51/64/46/1025516446.db2.gz NXVZWORDIFWZLQ-SXSDINLZSA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000886120799 1025516468 /nfs/dbraw/zinc/51/64/68/1025516468.db2.gz NXVZWORDIFWZLQ-SXSDINLZSA-N 1 1 309.369 3.668 20 5 DHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCC[C@H]1c1ccccc1 ZINC000886242931 1025570982 /nfs/dbraw/zinc/57/09/82/1025570982.db2.gz JFHBCQPONVHVNI-IRXDYDNUSA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000355785046 1025838995 /nfs/dbraw/zinc/83/89/95/1025838995.db2.gz PBUMXAZBQRHNES-YOEHRIQHSA-N 1 1 304.390 3.548 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000355788058 1025840893 /nfs/dbraw/zinc/84/08/93/1025840893.db2.gz UIWBPCWOYSPRKM-MRXNPFEDSA-N 1 1 324.808 3.641 20 5 DHBDMO CSC1(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000356065637 1025936255 /nfs/dbraw/zinc/93/62/55/1025936255.db2.gz OOPKFYTUSWOINP-UHFFFAOYSA-N 1 1 306.431 3.845 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1O ZINC000080962446 1025972731 /nfs/dbraw/zinc/97/27/31/1025972731.db2.gz CKTFOAVKMYKEET-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000089512019 1026050874 /nfs/dbraw/zinc/05/08/74/1026050874.db2.gz UEFQWNHVHIJCHK-GFCCVEGCSA-N 1 1 315.329 3.662 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2C)on1 ZINC000052010708 1026150584 /nfs/dbraw/zinc/15/05/84/1026150584.db2.gz YLIODZYNFWXZGL-HNNXBMFYSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)on1 ZINC000052010708 1026150592 /nfs/dbraw/zinc/15/05/92/1026150592.db2.gz YLIODZYNFWXZGL-HNNXBMFYSA-N 1 1 301.346 3.537 20 5 DHBDMO CCCC[N@H+](C)CC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000052209347 1026259968 /nfs/dbraw/zinc/25/99/68/1026259968.db2.gz GJRPHAUSZSMTCA-UHFFFAOYSA-N 1 1 319.449 3.539 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000052209347 1026259995 /nfs/dbraw/zinc/25/99/95/1026259995.db2.gz GJRPHAUSZSMTCA-UHFFFAOYSA-N 1 1 319.449 3.539 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000576399656 1026280577 /nfs/dbraw/zinc/28/05/77/1026280577.db2.gz YGCUWEUHRYQGPP-SPQRHKFCSA-N 1 1 323.396 3.883 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000025448382 1026296923 /nfs/dbraw/zinc/29/69/23/1026296923.db2.gz YJOIARNXHGUKIL-LBPRGKRZSA-N 1 1 314.341 3.517 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000182328896 1026323962 /nfs/dbraw/zinc/32/39/62/1026323962.db2.gz RCUUOVHCAFMOMM-GFCCVEGCSA-N 1 1 311.341 3.895 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000182328914 1026325462 /nfs/dbraw/zinc/32/54/62/1026325462.db2.gz RCUUOVHCAFMOMM-LBPRGKRZSA-N 1 1 311.341 3.895 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000362384838 1027175183 /nfs/dbraw/zinc/17/51/83/1027175183.db2.gz MLUJRNNCQLBQDM-KBPBESRZSA-N 1 1 324.446 3.580 20 5 DHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000362455721 1027216730 /nfs/dbraw/zinc/21/67/30/1027216730.db2.gz SXVOZPBAVWJNQI-LBPRGKRZSA-N 1 1 312.435 3.567 20 5 DHBDMO CC(C)[N@@H+](CCc1cscn1)Cc1ccc([N+](=O)[O-])cc1 ZINC000295569919 1027340741 /nfs/dbraw/zinc/34/07/41/1027340741.db2.gz RBYKPKYKCUXWDC-UHFFFAOYSA-N 1 1 305.403 3.504 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](Cc3nccs3)C2)cc1 ZINC000932197072 1027410413 /nfs/dbraw/zinc/41/04/13/1027410413.db2.gz CLEPZLVZCAKYQM-CQSZACIVSA-N 1 1 317.414 3.506 20 5 DHBDMO CO[C@@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1(C)C ZINC000295976630 1027508408 /nfs/dbraw/zinc/50/84/08/1027508408.db2.gz KTZUACCISLNTRM-XJKSGUPXSA-N 1 1 306.406 3.711 20 5 DHBDMO CCC[C@@H]([NH2+][C@@H](CN)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000423533886 1027576141 /nfs/dbraw/zinc/57/61/41/1027576141.db2.gz UNPSDNPEBIVCLN-SJORKVTESA-N 1 1 305.422 3.543 20 5 DHBDMO CC[N@@H+](CCc1ccccn1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000778948346 1027629075 /nfs/dbraw/zinc/62/90/75/1027629075.db2.gz ZKNPUAMWAIPSOW-HNNXBMFYSA-N 1 1 313.401 3.924 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C2CCOCC2)C1 ZINC000933079265 1027670181 /nfs/dbraw/zinc/67/01/81/1027670181.db2.gz KXFISTXLJRQKPZ-GOEBONIOSA-N 1 1 318.417 3.794 20 5 DHBDMO Cc1cc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cnc1Cl ZINC000813791611 1027713492 /nfs/dbraw/zinc/71/34/92/1027713492.db2.gz FNBJCUAJODJYRR-UHFFFAOYSA-N 1 1 319.792 3.977 20 5 DHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)CCO2 ZINC000933495329 1027746766 /nfs/dbraw/zinc/74/67/66/1027746766.db2.gz WJHZKAZCDTYBNZ-LLVKDONJSA-N 1 1 316.332 3.520 20 5 DHBDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000814179415 1027918290 /nfs/dbraw/zinc/91/82/90/1027918290.db2.gz SVDIMYULFRGSPS-GFCCVEGCSA-N 1 1 314.838 3.823 20 5 DHBDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)n1 ZINC000367293299 1028158212 /nfs/dbraw/zinc/15/82/12/1028158212.db2.gz YSURSJVJTDZGAJ-QGZVFWFLSA-N 1 1 315.348 3.774 20 5 DHBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)n1 ZINC000367293299 1028158219 /nfs/dbraw/zinc/15/82/19/1028158219.db2.gz YSURSJVJTDZGAJ-QGZVFWFLSA-N 1 1 315.348 3.774 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@@H](C)Cc3ccccc3[N+](=O)[O-])[nH]c2c1 ZINC000449168827 1028410845 /nfs/dbraw/zinc/41/08/45/1028410845.db2.gz BQDWLATWRRRUBQ-ZDUSSCGKSA-N 1 1 324.384 3.500 20 5 DHBDMO CC(C)[NH+](CCCN[C@H](C)Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000449190824 1028430797 /nfs/dbraw/zinc/43/07/97/1028430797.db2.gz WRMCBWHQPRUXPP-MRXNPFEDSA-N 1 1 321.465 3.624 20 5 DHBDMO COc1ccc(C[NH2+]Cc2ccc(C)cc2Cl)cc1[N+](=O)[O-] ZINC000564731569 1028496661 /nfs/dbraw/zinc/49/66/61/1028496661.db2.gz JEIALHSWHKXVHG-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000449462327 1028682179 /nfs/dbraw/zinc/68/21/79/1028682179.db2.gz SJRMCMZTDZXNSP-JQWIXIFHSA-N 1 1 302.296 3.758 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@@H](O)c2ccccc2C1 ZINC000371875850 1028769620 /nfs/dbraw/zinc/76/96/20/1028769620.db2.gz GWOMUVOQURKROV-MTCRFPMVSA-N 1 1 324.380 3.547 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000449681483 1028908407 /nfs/dbraw/zinc/90/84/07/1028908407.db2.gz LXXQWNBIWMHBAH-SPQRHKFCSA-N 1 1 316.401 3.501 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000449731147 1028940854 /nfs/dbraw/zinc/94/08/54/1028940854.db2.gz HKQMCAXDZWBTIT-ZVVFDCPKSA-N 1 1 318.442 3.827 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000568468267 1029075817 /nfs/dbraw/zinc/07/58/17/1029075817.db2.gz LTFLNZRXWAOHOW-GOEBONIOSA-N 1 1 311.385 3.849 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cc1F ZINC000817281433 1029112996 /nfs/dbraw/zinc/11/29/96/1029112996.db2.gz KYTYIFRJXBOMGC-LLVKDONJSA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cc1F ZINC000817281433 1029113004 /nfs/dbraw/zinc/11/30/04/1029113004.db2.gz KYTYIFRJXBOMGC-LLVKDONJSA-N 1 1 320.286 3.898 20 5 DHBDMO COC(C)(C)CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544891 1029907593 /nfs/dbraw/zinc/90/75/93/1029907593.db2.gz GCXVNERRYASTON-OAHLLOKOSA-N 1 1 306.406 3.589 20 5 DHBDMO CCC(=O)CCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550483 1029912189 /nfs/dbraw/zinc/91/21/89/1029912189.db2.gz RXOWRMXIERCNQW-HNNXBMFYSA-N 1 1 304.390 3.534 20 5 DHBDMO CC[C@H](NC[C@@H]1CCCC[N@@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000358357032 1030454074 /nfs/dbraw/zinc/45/40/74/1030454074.db2.gz VTTDJXRTQULAPT-ROUUACIJSA-N 1 1 319.449 3.898 20 5 DHBDMO CC[C@H](NC[C@@H]1CCCC[N@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000358357032 1030454079 /nfs/dbraw/zinc/45/40/79/1030454079.db2.gz VTTDJXRTQULAPT-ROUUACIJSA-N 1 1 319.449 3.898 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCc2c1nccc2Cl)c1ccc([N+](=O)[O-])cc1 ZINC000926492963 1030762873 /nfs/dbraw/zinc/76/28/73/1030762873.db2.gz JSXGONBTNDOOLI-ZUZCIYMTSA-N 1 1 317.776 3.981 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1cn2c(n1)CCCC2 ZINC000926894276 1030972775 /nfs/dbraw/zinc/97/27/75/1030972775.db2.gz XDBQNCAXPDEFJF-CHWSQXEVSA-N 1 1 314.389 3.539 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+]([C@H]1CCc3ccc(F)cc31)C2 ZINC000533801623 1031294768 /nfs/dbraw/zinc/29/47/68/1031294768.db2.gz IVLCYIKHLKYBEP-KRWDZBQOSA-N 1 1 312.344 3.780 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+]([C@H]1CCc3ccc(F)cc31)C2 ZINC000533801623 1031294790 /nfs/dbraw/zinc/29/47/90/1031294790.db2.gz IVLCYIKHLKYBEP-KRWDZBQOSA-N 1 1 312.344 3.780 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2C2CCOCC2)c(Cl)c1 ZINC000360209699 1031327825 /nfs/dbraw/zinc/32/78/25/1031327825.db2.gz RGVOYMQHAXWPOK-MRXNPFEDSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000536696470 1031401050 /nfs/dbraw/zinc/40/10/50/1031401050.db2.gz WZGXBKCQQYYHKI-SLLSNFPASA-N 1 1 318.442 3.968 20 5 DHBDMO COCc1ccccc1C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872019144 1031401191 /nfs/dbraw/zinc/40/11/91/1031401191.db2.gz TUDSPEKCDVFPAZ-GFCCVEGCSA-N 1 1 318.348 3.731 20 5 DHBDMO C[C@H](O)c1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872026317 1031410390 /nfs/dbraw/zinc/41/03/90/1031410390.db2.gz COCXFMIZLHTXOA-RYUDHWBXSA-N 1 1 318.348 3.638 20 5 DHBDMO COc1cc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])ccc1C ZINC000872026822 1031410524 /nfs/dbraw/zinc/41/05/24/1031410524.db2.gz GLLRDPFJBPKWLT-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(F)cn1 ZINC000872044358 1031430158 /nfs/dbraw/zinc/43/01/58/1031430158.db2.gz UGDLCQBXWMSXQD-SNVBAGLBSA-N 1 1 321.377 3.702 20 5 DHBDMO CCC[C@H]([NH2+][C@H](C)c1nccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000872132580 1031526027 /nfs/dbraw/zinc/52/60/27/1031526027.db2.gz GPXPPERJVKVOPD-CJNGLKHVSA-N 1 1 314.389 3.885 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872260060 1031565932 /nfs/dbraw/zinc/56/59/32/1031565932.db2.gz HKNOMJRGIBXRKB-INIZCTEOSA-N 1 1 304.390 3.518 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC3(F)F)CC2)cc1Cl ZINC000846054331 1031849678 /nfs/dbraw/zinc/84/96/78/1031849678.db2.gz LHIIDLGIXGSUCY-UHFFFAOYSA-N 1 1 316.735 3.869 20 5 DHBDMO COc1cc(C[N@H+](C)Cc2sccc2C)c([N+](=O)[O-])cc1F ZINC000361616747 1032016554 /nfs/dbraw/zinc/01/65/54/1032016554.db2.gz PEINOQFXCXJSOX-UHFFFAOYSA-N 1 1 324.377 3.744 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2sccc2C)c([N+](=O)[O-])cc1F ZINC000361616747 1032016569 /nfs/dbraw/zinc/01/65/69/1032016569.db2.gz PEINOQFXCXJSOX-UHFFFAOYSA-N 1 1 324.377 3.744 20 5 DHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H]1CC[C@H](C)C1 ZINC000361639562 1032026062 /nfs/dbraw/zinc/02/60/62/1032026062.db2.gz PIDQTGAZIPKYDX-BBRMVZONSA-N 1 1 306.406 3.540 20 5 DHBDMO CC(C)[C@H]1CCC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777954042 1032029241 /nfs/dbraw/zinc/02/92/41/1032029241.db2.gz PNKCJFXFDLDDMP-QGZVFWFLSA-N 1 1 314.389 3.536 20 5 DHBDMO CO[C@]1(C)CCC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000877491099 1033320681 /nfs/dbraw/zinc/32/06/81/1033320681.db2.gz DROPIRUJUPAJRI-QGZVFWFLSA-N 1 1 306.406 3.603 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000877502112 1033327027 /nfs/dbraw/zinc/32/70/27/1033327027.db2.gz YOSLHFHTDDYVKW-OAHLLOKOSA-N 1 1 311.385 3.596 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000877522518 1033332676 /nfs/dbraw/zinc/33/26/76/1033332676.db2.gz BHTHHBQWJJOELY-GOSISDBHSA-N 1 1 311.385 3.944 20 5 DHBDMO CCOC1CC2(C1)CC[N@@H+](Cc1c(C)ccc([N+](=O)[O-])c1C)C2 ZINC000877520291 1033334602 /nfs/dbraw/zinc/33/46/02/1033334602.db2.gz SAEJRZQMFPMQEW-UHFFFAOYSA-N 1 1 318.417 3.603 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000877615126 1033382521 /nfs/dbraw/zinc/38/25/21/1033382521.db2.gz QVEWFABLLYTMSO-HNNXBMFYSA-N 1 1 310.344 3.833 20 5 DHBDMO C[C@@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172903279 1033437556 /nfs/dbraw/zinc/43/75/56/1033437556.db2.gz GJXOYQUVZNYNLE-PBHICJAKSA-N 1 1 302.418 3.964 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1C[C@@H]3CCCC[C@@H]3C1)CC2 ZINC001172908739 1033440243 /nfs/dbraw/zinc/44/02/43/1033440243.db2.gz NDOBHGNAYSJWSW-KSZLIROESA-N 1 1 314.429 3.964 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172913928 1033462135 /nfs/dbraw/zinc/46/21/35/1033462135.db2.gz VVDRAJYCFSKNDQ-JKIFEVAISA-N 1 1 302.418 3.820 20 5 DHBDMO CCC[N@@H+](CC1CC1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173187335 1033583197 /nfs/dbraw/zinc/58/31/97/1033583197.db2.gz ZJTZZCSRNVZANB-GFCCVEGCSA-N 1 1 324.396 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCCC[C@H]2C)c1F ZINC001173190079 1033583278 /nfs/dbraw/zinc/58/32/78/1033583278.db2.gz QAZOKDWCAKDRLF-CHWSQXEVSA-N 1 1 324.396 3.938 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)C2CCCC2)c1F ZINC001173189834 1033583332 /nfs/dbraw/zinc/58/33/32/1033583332.db2.gz MNBPAZOYSGPTSE-NSHDSACASA-N 1 1 310.369 3.548 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2C[C@@H](C)CC23CC3)c1F ZINC001173191698 1033583706 /nfs/dbraw/zinc/58/37/06/1033583706.db2.gz GKMQIBXHCYOWRE-RYUDHWBXSA-N 1 1 322.380 3.548 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCCC[C@H]2C)c1F ZINC001173190080 1033584118 /nfs/dbraw/zinc/58/41/18/1033584118.db2.gz QAZOKDWCAKDRLF-OLZOCXBDSA-N 1 1 324.396 3.938 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCC[C@H](C)C2)c1F ZINC001173181797 1033584892 /nfs/dbraw/zinc/58/48/92/1033584892.db2.gz PVANRUZOZKPSFH-QWHCGFSZSA-N 1 1 324.396 3.796 20 5 DHBDMO CC[C@H]1CCC[N@H+]1[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173188180 1033585202 /nfs/dbraw/zinc/58/52/02/1033585202.db2.gz CZNZDQTZAPZBDP-RYUDHWBXSA-N 1 1 310.369 3.548 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1cccnc1 ZINC001173226625 1033605377 /nfs/dbraw/zinc/60/53/77/1033605377.db2.gz MWOPDRQJOKNQIQ-RDTXWAMCSA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC001173228380 1033605508 /nfs/dbraw/zinc/60/55/08/1033605508.db2.gz VTXOBXIQDUQEOQ-DGCLKSJQSA-N 1 1 316.323 3.800 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCc2ccccc2C1 ZINC001173226814 1033606153 /nfs/dbraw/zinc/60/61/53/1033606153.db2.gz LQWOXPBKSWVTPW-HNNXBMFYSA-N 1 1 310.397 3.974 20 5 DHBDMO Cc1ccc2c(c1)CC[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173237757 1033647831 /nfs/dbraw/zinc/64/78/31/1033647831.db2.gz MBYFPMLLAVOJKS-OAHLLOKOSA-N 1 1 310.397 3.893 20 5 DHBDMO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000879750548 1034113710 /nfs/dbraw/zinc/11/37/10/1034113710.db2.gz WWYPUXAWUIRRCL-INIZCTEOSA-N 1 1 315.348 3.774 20 5 DHBDMO Cc1cncc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000879750548 1034113714 /nfs/dbraw/zinc/11/37/14/1034113714.db2.gz WWYPUXAWUIRRCL-INIZCTEOSA-N 1 1 315.348 3.774 20 5 DHBDMO CCc1onc(C)c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000927137673 1034122796 /nfs/dbraw/zinc/12/27/96/1034122796.db2.gz AJEXYKSOSOEIHV-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000880004373 1034178380 /nfs/dbraw/zinc/17/83/80/1034178380.db2.gz UMERDBXDJGPICI-LBPRGKRZSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000880004373 1034178389 /nfs/dbraw/zinc/17/83/89/1034178389.db2.gz UMERDBXDJGPICI-LBPRGKRZSA-N 1 1 306.259 3.508 20 5 DHBDMO Cc1csc([C@H]2CC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000880008872 1034180677 /nfs/dbraw/zinc/18/06/77/1034180677.db2.gz FEUVCIYZTSUUGC-STQMWFEESA-N 1 1 317.414 3.910 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H](CC(C)C)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000480543825 1034309896 /nfs/dbraw/zinc/30/98/96/1034309896.db2.gz XQFRRUUAMXATSA-LSDHHAIUSA-N 1 1 307.438 3.530 20 5 DHBDMO C[C@H](C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000183256113 1034368790 /nfs/dbraw/zinc/36/87/90/1034368790.db2.gz CLGXYRZNAVMVEP-VUDGCMKMSA-N 1 1 317.414 3.800 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000480852617 1034474516 /nfs/dbraw/zinc/47/45/16/1034474516.db2.gz CQVLXMQNIUKRTF-INIZCTEOSA-N 1 1 308.447 3.745 20 5 DHBDMO COc1ccsc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000186152845 1034604681 /nfs/dbraw/zinc/60/46/81/1034604681.db2.gz ANWPBKQRDBLSRY-JTQLQIEISA-N 1 1 322.386 3.524 20 5 DHBDMO Cc1ccc([C@H](C)N[C@@H](C)C[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000481169732 1034625890 /nfs/dbraw/zinc/62/58/90/1034625890.db2.gz FKCLYFVFWIARNR-KBMXLJTQSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([C@H](C)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000481169732 1034625896 /nfs/dbraw/zinc/62/58/96/1034625896.db2.gz FKCLYFVFWIARNR-KBMXLJTQSA-N 1 1 319.449 3.674 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000600187937 1034789995 /nfs/dbraw/zinc/78/99/95/1034789995.db2.gz BAXQMQLYGJSAHO-BGXJKKHCSA-N 1 1 318.442 3.968 20 5 DHBDMO C[C@@H](N[C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000481578603 1034890916 /nfs/dbraw/zinc/89/09/16/1034890916.db2.gz UVMNCBODKINXCG-XUWVNRHRSA-N 1 1 319.449 3.612 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)CN1C[C@H](C)C[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000481578603 1034890927 /nfs/dbraw/zinc/89/09/27/1034890927.db2.gz UVMNCBODKINXCG-XUWVNRHRSA-N 1 1 319.449 3.612 20 5 DHBDMO CC[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC(C)C ZINC000159415809 1035048998 /nfs/dbraw/zinc/04/89/98/1035048998.db2.gz VOMNCAJMMQDDQP-UHFFFAOYSA-N 1 1 315.211 3.835 20 5 DHBDMO Cc1ccc([C@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000483186843 1035240106 /nfs/dbraw/zinc/24/01/06/1035240106.db2.gz SBWJANMXSQKIPP-YOEHRIQHSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000483186843 1035240109 /nfs/dbraw/zinc/24/01/09/1035240109.db2.gz SBWJANMXSQKIPP-YOEHRIQHSA-N 1 1 321.465 3.920 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C2CC2)C[C@H]1C1CC1 ZINC001176657918 1035315700 /nfs/dbraw/zinc/31/57/00/1035315700.db2.gz RERQRSTWAGVHPH-YOEHRIQHSA-N 1 1 316.401 3.614 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(F)(C3CC3)CC2)c1 ZINC001176753448 1035329302 /nfs/dbraw/zinc/32/93/02/1035329302.db2.gz KBFCKFBZSKBRAK-UHFFFAOYSA-N 1 1 312.772 3.962 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494688007 1035771076 /nfs/dbraw/zinc/77/10/76/1035771076.db2.gz GQOKTLIDHIAWHX-CYBMUJFWSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494688007 1035771093 /nfs/dbraw/zinc/77/10/93/1035771093.db2.gz GQOKTLIDHIAWHX-CYBMUJFWSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494705578 1035772730 /nfs/dbraw/zinc/77/27/30/1035772730.db2.gz XKWCTTWERMYXRU-GUYCJALGSA-N 1 1 304.390 3.547 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC4(CCC4)C3)co2)cc1 ZINC000089909531 1035794429 /nfs/dbraw/zinc/79/44/29/1035794429.db2.gz GUKPDOADFRZXHJ-UHFFFAOYSA-N 1 1 313.357 3.626 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCc2ccsc2C1 ZINC000539836506 1035896464 /nfs/dbraw/zinc/89/64/64/1035896464.db2.gz KDSAGPPIJYNMFT-HYXAFXHYSA-N 1 1 300.383 3.728 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCc2ccsc2C1 ZINC000539836506 1035896481 /nfs/dbraw/zinc/89/64/81/1035896481.db2.gz KDSAGPPIJYNMFT-HYXAFXHYSA-N 1 1 300.383 3.728 20 5 DHBDMO Cc1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000539849010 1035903166 /nfs/dbraw/zinc/90/31/66/1035903166.db2.gz HNQOABOSYNHDBL-GDBMZVCRSA-N 1 1 306.431 3.763 20 5 DHBDMO COC[C@H](C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C(C)C ZINC001194478417 1035942737 /nfs/dbraw/zinc/94/27/37/1035942737.db2.gz VEUNVNARSUSKII-SJORKVTESA-N 1 1 320.433 3.693 20 5 DHBDMO CCCc1csc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000494846511 1036085316 /nfs/dbraw/zinc/08/53/16/1036085316.db2.gz LRKIRTFSDTYWSV-UHFFFAOYSA-N 1 1 305.403 3.602 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C/C=C\c2ccncc2)C2CC2)c1 ZINC000495067469 1036213107 /nfs/dbraw/zinc/21/31/07/1036213107.db2.gz OESUPFANTKUNPG-RQOWECAXSA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C/C=C/c1ccncc1)C1CC1 ZINC000495066538 1036213431 /nfs/dbraw/zinc/21/34/31/1036213431.db2.gz LYPOCCPJGPEGEE-ONEGZZNKSA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C/C=C/c1ccncc1)C1CC1 ZINC000495066538 1036213451 /nfs/dbraw/zinc/21/34/51/1036213451.db2.gz LYPOCCPJGPEGEE-ONEGZZNKSA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C/C=C/c2ccncc2)C2CC2)cc1 ZINC000495062298 1036217893 /nfs/dbraw/zinc/21/78/93/1036217893.db2.gz FBNRNEUZFSJRIR-OWOJBTEDSA-N 1 1 309.369 3.668 20 5 DHBDMO COc1ccc2c(c1)CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C2 ZINC000609133953 1036397061 /nfs/dbraw/zinc/39/70/61/1036397061.db2.gz OQMWJJYYLBMJTC-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO COc1ccc(C[NH2+]Cc2sccc2Cl)cc1[N+](=O)[O-] ZINC000486964286 1036488855 /nfs/dbraw/zinc/48/88/55/1036488855.db2.gz IBKSPSBNMHIYAX-UHFFFAOYSA-N 1 1 312.778 3.608 20 5 DHBDMO C/C=C\C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001196606748 1036571840 /nfs/dbraw/zinc/57/18/40/1036571840.db2.gz WOEHUBWSFRODOM-VQTKUKTRSA-N 1 1 304.390 3.782 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1C[C@H]2[C@H]3C=C[C@H](C3)[C@@]2(C)C1 ZINC001184056361 1036736940 /nfs/dbraw/zinc/73/69/40/1036736940.db2.gz PIKXKHNYIIRJGR-JHDROBOHSA-N 1 1 312.413 3.856 20 5 DHBDMO CCOc1cc(C[N@@H+](C)[C@@H](CC)CSC)ccc1[N+](=O)[O-] ZINC000492723878 1036989940 /nfs/dbraw/zinc/98/99/40/1036989940.db2.gz RHZOAZPNGFITFD-ZDUSSCGKSA-N 1 1 312.435 3.567 20 5 DHBDMO Cc1cc(NCC[N@H+](C)Cc2ccccc2)c([N+](=O)[O-])s1 ZINC001185017358 1036992932 /nfs/dbraw/zinc/99/29/32/1036992932.db2.gz KLBPMFWNNVOOBN-UHFFFAOYSA-N 1 1 305.403 3.509 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000492829322 1037026256 /nfs/dbraw/zinc/02/62/56/1037026256.db2.gz KQNVNQMORGVHKH-XHSDSOJGSA-N 1 1 318.417 3.713 20 5 DHBDMO C[C@@H]1CSCCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001198517080 1037053432 /nfs/dbraw/zinc/05/34/32/1037053432.db2.gz JNASKYPKICTDKV-SNVBAGLBSA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@@H]1CSCCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001198517080 1037053463 /nfs/dbraw/zinc/05/34/63/1037053463.db2.gz JNASKYPKICTDKV-SNVBAGLBSA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@@H](CNc1c(Cl)c(Cl)ccc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC001185231485 1037075896 /nfs/dbraw/zinc/07/58/96/1037075896.db2.gz YZGGVILGLSVSBP-QMMMGPOBSA-N 1 1 318.204 3.796 20 5 DHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774884322 1037148197 /nfs/dbraw/zinc/14/81/97/1037148197.db2.gz KLSUSGGEECMCGM-HNNXBMFYSA-N 1 1 307.350 3.515 20 5 DHBDMO CC[C@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774884327 1037151447 /nfs/dbraw/zinc/15/14/47/1037151447.db2.gz KLSUSGGEECMCGM-OAHLLOKOSA-N 1 1 307.350 3.515 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(NCC[N@H+](C)Cc2ccc(F)cc2)c1 ZINC001185631219 1037200005 /nfs/dbraw/zinc/20/00/05/1037200005.db2.gz ZTVXBOUIXNBUEW-UHFFFAOYSA-N 1 1 317.364 3.586 20 5 DHBDMO CC(C)[C@H]1C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000493133436 1037203766 /nfs/dbraw/zinc/20/37/66/1037203766.db2.gz PLDBMZPOLLWTKO-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000493133436 1037203777 /nfs/dbraw/zinc/20/37/77/1037203777.db2.gz PLDBMZPOLLWTKO-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CC1(C)C ZINC000489476486 1037452116 /nfs/dbraw/zinc/45/21/16/1037452116.db2.gz IIQGZOWSISCTGY-HNNXBMFYSA-N 1 1 315.373 3.523 20 5 DHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)C1 ZINC000775052439 1037500908 /nfs/dbraw/zinc/50/09/08/1037500908.db2.gz DHJRFZABHSYDCG-BLLLJJGKSA-N 1 1 319.361 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCOc2ccccc2)C2CC2)cc1 ZINC000490830067 1037821537 /nfs/dbraw/zinc/82/15/37/1037821537.db2.gz WAGJFPZHIKYZKI-UHFFFAOYSA-N 1 1 312.369 3.638 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c(F)c1 ZINC000491114910 1037907988 /nfs/dbraw/zinc/90/79/88/1037907988.db2.gz QRLMHOBOZAPYNS-OAHLLOKOSA-N 1 1 314.360 3.799 20 5 DHBDMO COc1cccc([C@@H](C)[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153005099 1038037756 /nfs/dbraw/zinc/03/77/56/1038037756.db2.gz LFEFNGGAVYQFQU-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc([C@@H](C)[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153005099 1038037775 /nfs/dbraw/zinc/03/77/75/1038037775.db2.gz LFEFNGGAVYQFQU-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000917090465 1038187771 /nfs/dbraw/zinc/18/77/71/1038187771.db2.gz RFLQFWWIWCYZDK-UHFFFAOYSA-N 1 1 305.422 3.543 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1CCCC1(F)F)C1CC1 ZINC000588232715 1038277818 /nfs/dbraw/zinc/27/78/18/1038277818.db2.gz YHXWEAVFPMIZSC-ZFWWWQNUSA-N 1 1 310.344 3.693 20 5 DHBDMO CC(C)C[N@@H+](CCc1ccccc1)Cc1cccnc1[N+](=O)[O-] ZINC001190549588 1038341727 /nfs/dbraw/zinc/34/17/27/1038341727.db2.gz CJPFXCJACVKIRB-UHFFFAOYSA-N 1 1 313.401 3.691 20 5 DHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000589111281 1038434071 /nfs/dbraw/zinc/43/40/71/1038434071.db2.gz URUVXYVNEYYZSM-NSHDSACASA-N 1 1 313.348 3.676 20 5 DHBDMO COc1cccc2c1C[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000590759933 1038699925 /nfs/dbraw/zinc/69/99/25/1038699925.db2.gz UYZZAWMHAJDCJH-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc2c1C[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000590759933 1038699928 /nfs/dbraw/zinc/69/99/28/1038699928.db2.gz UYZZAWMHAJDCJH-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO Cc1cnc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000591348059 1038836354 /nfs/dbraw/zinc/83/63/54/1038836354.db2.gz ZUCCHWGJQLSLGJ-OAHLLOKOSA-N 1 1 317.414 3.917 20 5 DHBDMO C[C@H](NC[C@@H]1CC[N@@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000599064139 1039018987 /nfs/dbraw/zinc/01/89/87/1039018987.db2.gz KHLGSEVHASXTMG-KSSFIOAISA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H](NC[C@@H]1CC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000599064139 1039019006 /nfs/dbraw/zinc/01/90/06/1039019006.db2.gz KHLGSEVHASXTMG-KSSFIOAISA-N 1 1 317.433 3.652 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593696018 1039084898 /nfs/dbraw/zinc/08/48/98/1039084898.db2.gz ATZGKNJDOWPEGX-WASHYIJTSA-N 1 1 308.328 3.729 20 5 DHBDMO CC(C)[N@@H+](CCC[C@@H]1CCOC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000592061252 1039105066 /nfs/dbraw/zinc/10/50/66/1039105066.db2.gz CFOOKLIJDAOIPQ-MRXNPFEDSA-N 1 1 306.406 3.622 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccc(F)cc2)C2CC2)cc1 ZINC000603852126 1039185753 /nfs/dbraw/zinc/18/57/53/1039185753.db2.gz MGCGHSFXAMSXIL-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC[C@H]1C ZINC000603854128 1039189337 /nfs/dbraw/zinc/18/93/37/1039189337.db2.gz QZMXGYFISWVGPW-VXGBXAGGSA-N 1 1 311.813 3.923 20 5 DHBDMO Cc1ccc(C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000603890543 1039215617 /nfs/dbraw/zinc/21/56/17/1039215617.db2.gz CEHKJYPFQDOKKZ-UHFFFAOYSA-N 1 1 300.358 3.703 20 5 DHBDMO C[C@@H]([NH2+][C@H](CCO)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000592402901 1039464487 /nfs/dbraw/zinc/46/44/87/1039464487.db2.gz LNCQNVKYFFKMGD-SJKOYZFVSA-N 1 1 318.348 3.508 20 5 DHBDMO O=[N+]([O-])c1sccc1NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000604433093 1039475098 /nfs/dbraw/zinc/47/50/98/1039475098.db2.gz MOPRYWGKENASMA-ZDUSSCGKSA-N 1 1 321.402 3.888 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1NCC[NH+]1Cc2ccccc2C1 ZINC000604482943 1039481157 /nfs/dbraw/zinc/48/11/57/1039481157.db2.gz VYIZKHONCKCOKK-UHFFFAOYSA-N 1 1 317.776 3.676 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594612902 1039874246 /nfs/dbraw/zinc/87/42/46/1039874246.db2.gz OUBJFSDCZQVKRV-PFWMLDTASA-N 1 1 316.401 3.642 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cccc(OC2CC2)c1F ZINC000594927206 1039928750 /nfs/dbraw/zinc/92/87/50/1039928750.db2.gz ZHCCHCAZQBMOBW-UHFFFAOYSA-N 1 1 316.332 3.565 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000574787830 1039937815 /nfs/dbraw/zinc/93/78/15/1039937815.db2.gz KZDDAAQNMDEDJH-ZDUSSCGKSA-N 1 1 309.410 3.526 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCCc2occc21 ZINC000595006827 1040016866 /nfs/dbraw/zinc/01/68/66/1040016866.db2.gz JSJLNWCKLQXPQQ-IAQYHMDHSA-N 1 1 316.357 3.925 20 5 DHBDMO Cc1noc(C[N@H+](Cc2ccccc2)C(C)(C)C)c1[N+](=O)[O-] ZINC000595348332 1040104828 /nfs/dbraw/zinc/10/48/28/1040104828.db2.gz RJPGWSMAJIRGRM-UHFFFAOYSA-N 1 1 303.362 3.692 20 5 DHBDMO Cc1noc(C[N@@H+](Cc2ccccc2)C(C)(C)C)c1[N+](=O)[O-] ZINC000595348332 1040104833 /nfs/dbraw/zinc/10/48/33/1040104833.db2.gz RJPGWSMAJIRGRM-UHFFFAOYSA-N 1 1 303.362 3.692 20 5 DHBDMO Cc1noc(C[N@@H+]2CCc3ccccc3[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC000595345056 1040105530 /nfs/dbraw/zinc/10/55/30/1040105530.db2.gz LGJZFYMEELMWJG-INIZCTEOSA-N 1 1 315.373 3.647 20 5 DHBDMO Cc1noc(C[N@H+]2CCc3ccccc3[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC000595345056 1040105538 /nfs/dbraw/zinc/10/55/38/1040105538.db2.gz LGJZFYMEELMWJG-INIZCTEOSA-N 1 1 315.373 3.647 20 5 DHBDMO Cc1noc(C[NH2+][C@H](c2ccccc2)C2CCC2)c1[N+](=O)[O-] ZINC000595370102 1040127766 /nfs/dbraw/zinc/12/77/66/1040127766.db2.gz USUCNBXEBRHFAV-OAHLLOKOSA-N 1 1 301.346 3.522 20 5 DHBDMO Cc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)c1[N+](=O)[O-] ZINC000595409456 1040131053 /nfs/dbraw/zinc/13/10/53/1040131053.db2.gz QGLDUMQOFREAHU-AWEZNQCLSA-N 1 1 321.764 3.786 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@@H](C)CC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595482099 1040141051 /nfs/dbraw/zinc/14/10/51/1040141051.db2.gz HMOBUXUOCJMIAR-SWLSCSKDSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1noc(C[N@H+]2C[C@@H](C)CC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595482099 1040141066 /nfs/dbraw/zinc/14/10/66/1040141066.db2.gz HMOBUXUOCJMIAR-SWLSCSKDSA-N 1 1 315.373 3.864 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000595467723 1040147390 /nfs/dbraw/zinc/14/73/90/1040147390.db2.gz VPXXIWUFGIQFPS-SECBINFHSA-N 1 1 306.259 3.508 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000595467723 1040147398 /nfs/dbraw/zinc/14/73/98/1040147398.db2.gz VPXXIWUFGIQFPS-SECBINFHSA-N 1 1 306.259 3.508 20 5 DHBDMO Cc1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)o1 ZINC000595522056 1040160390 /nfs/dbraw/zinc/16/03/90/1040160390.db2.gz IEMLGTMHVKNMDG-HNNXBMFYSA-N 1 1 315.373 3.579 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@@H]4CCCC[C@@H]43)co2)cc1 ZINC000595565886 1040163701 /nfs/dbraw/zinc/16/37/01/1040163701.db2.gz FEDFRZBKUQSHRU-BBRMVZONSA-N 1 1 313.357 3.624 20 5 DHBDMO Cc1noc(C[N@H+](C)[C@@H]2CCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595539401 1040168100 /nfs/dbraw/zinc/16/81/00/1040168100.db2.gz LZIPYNLLYARWIT-LSDHHAIUSA-N 1 1 315.373 3.659 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000595788269 1040253659 /nfs/dbraw/zinc/25/36/59/1040253659.db2.gz HXAVPYIEVWQWRP-QGPMSJSTSA-N 1 1 318.417 3.937 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)cccc1[N+](=O)[O-] ZINC000595790439 1040260282 /nfs/dbraw/zinc/26/02/82/1040260282.db2.gz QJAVGOUCLIMJCQ-SJLPKXTDSA-N 1 1 318.417 3.684 20 5 DHBDMO C[C@H]1C[C@H](Nc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000596144518 1040314585 /nfs/dbraw/zinc/31/45/85/1040314585.db2.gz GMIBBVQYXOIXSF-GXSJLCMTSA-N 1 1 317.311 3.508 20 5 DHBDMO CCCCC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C(C)C ZINC000063495629 1040328114 /nfs/dbraw/zinc/32/81/14/1040328114.db2.gz PVPVGJHANHNDQU-UHFFFAOYSA-N 1 1 321.421 3.742 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc3[nH]cnc3c2)C2CC2)cc1 ZINC000534336986 1040820322 /nfs/dbraw/zinc/82/03/22/1040820322.db2.gz RLSFXKBGSXFLAE-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc3nc[nH]c3c2)C2CC2)cc1 ZINC000534336986 1040820330 /nfs/dbraw/zinc/82/03/30/1040820330.db2.gz RLSFXKBGSXFLAE-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc3nc[nH]c3c2)C2CC2)cc1 ZINC000534336986 1040820340 /nfs/dbraw/zinc/82/03/40/1040820340.db2.gz RLSFXKBGSXFLAE-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc([N+](=O)[O-])cc1 ZINC000090460421 185297662 /nfs/dbraw/zinc/29/76/62/185297662.db2.gz LMOPXZHAKRWFTD-SNVBAGLBSA-N 1 1 303.387 3.780 20 5 DHBDMO Cc1cnc(C(C)(C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000080346488 192150553 /nfs/dbraw/zinc/15/05/53/192150553.db2.gz ZKDNSCVKXZXDDI-UHFFFAOYSA-N 1 1 305.403 3.693 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCc3c2cccc3O)c1 ZINC000105486820 194105931 /nfs/dbraw/zinc/10/59/31/194105931.db2.gz ANQWTNOCCBHSNM-OAHLLOKOSA-N 1 1 318.760 3.731 20 5 DHBDMO C[C@@]12CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]1C2(Cl)Cl ZINC000284384401 131076113 /nfs/dbraw/zinc/07/61/13/131076113.db2.gz FQTJJHBGUROFQH-QWHCGFSZSA-N 1 1 315.200 3.611 20 5 DHBDMO C[C@@]12CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]1C2(Cl)Cl ZINC000284384401 131076114 /nfs/dbraw/zinc/07/61/14/131076114.db2.gz FQTJJHBGUROFQH-QWHCGFSZSA-N 1 1 315.200 3.611 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000289484379 131389544 /nfs/dbraw/zinc/38/95/44/131389544.db2.gz IOROJLZPPYOOGI-KBRIMQKVSA-N 1 1 316.401 3.689 20 5 DHBDMO CC[C@H]([NH2+][C@@H](C)c1nccn1CC)c1cccc([N+](=O)[O-])c1 ZINC000297689106 132029169 /nfs/dbraw/zinc/02/91/69/132029169.db2.gz LUNWNXFKCRIWAX-WFASDCNBSA-N 1 1 302.378 3.613 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000298273710 132053900 /nfs/dbraw/zinc/05/39/00/132053900.db2.gz NYOKAOYRFMKSCU-GLQYFDAESA-N 1 1 310.344 3.941 20 5 DHBDMO Cc1csc(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3)CCC2)n1 ZINC000299548466 132110499 /nfs/dbraw/zinc/11/04/99/132110499.db2.gz BOFHPSGCDYSDFF-UHFFFAOYSA-N 1 1 303.387 3.529 20 5 DHBDMO C[C@@H](C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC000525875382 335089512 /nfs/dbraw/zinc/08/95/12/335089512.db2.gz SQFZUANEBWTQIU-ZDUSSCGKSA-N 1 1 314.360 3.896 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(OC(F)F)cc2)cs1 ZINC000037562627 331579722 /nfs/dbraw/zinc/57/97/22/331579722.db2.gz GXKTZOURBAAEHA-UHFFFAOYSA-N 1 1 314.313 3.548 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000408201458 332241187 /nfs/dbraw/zinc/24/11/87/332241187.db2.gz FMSRIMIXJGXCSK-ZIAGYGMSSA-N 1 1 304.390 3.547 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C[C@@H]3CCSC3)C2)cc1 ZINC000449495439 332308063 /nfs/dbraw/zinc/30/80/63/332308063.db2.gz DHVCOTQJOBMSBY-DZGCQCFKSA-N 1 1 306.431 3.527 20 5 DHBDMO CC[C@@H](NC[C@H](CC(C)C)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000314060732 333085011 /nfs/dbraw/zinc/08/50/11/333085011.db2.gz AIGKPSLLIJXROF-DLBZAZTESA-N 1 1 307.438 3.612 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccnc(Cl)c2)C2CC2)c1 ZINC000177999479 333134053 /nfs/dbraw/zinc/13/40/53/333134053.db2.gz UGWFURKVMJMADE-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccnc(Cl)c2)C2CC2)c1 ZINC000177999479 333134054 /nfs/dbraw/zinc/13/40/54/333134054.db2.gz UGWFURKVMJMADE-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)c(F)c1 ZINC000319273474 333279607 /nfs/dbraw/zinc/27/96/07/333279607.db2.gz DJFPXMNRKKGWGU-CQSZACIVSA-N 1 1 300.333 3.723 20 5 DHBDMO Cc1cc(NC[C@@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000390600011 333304778 /nfs/dbraw/zinc/30/47/78/333304778.db2.gz ZZJRQFUSKLULFI-OAHLLOKOSA-N 1 1 313.401 3.836 20 5 DHBDMO COc1ccc(C[NH2+]Cc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000021024382 333386776 /nfs/dbraw/zinc/38/67/76/333386776.db2.gz LLTCZYVXWOQYBM-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000185860692 335154562 /nfs/dbraw/zinc/15/45/62/335154562.db2.gz KGOPDGHBFJNBFO-OAHLLOKOSA-N 1 1 320.389 3.616 20 5 DHBDMO Cc1[nH+]ccn1CCCOc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000349842139 335705632 /nfs/dbraw/zinc/70/56/32/335705632.db2.gz ZKYUXROZJHLSEJ-UHFFFAOYSA-N 1 1 309.753 3.531 20 5 DHBDMO CS[C@H]1CCCC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000351753557 336064871 /nfs/dbraw/zinc/06/48/71/336064871.db2.gz WUOXSEZCELTKMJ-NSHDSACASA-N 1 1 316.373 3.591 20 5 DHBDMO CS[C@H]1CCCC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000351753557 336064873 /nfs/dbraw/zinc/06/48/73/336064873.db2.gz WUOXSEZCELTKMJ-NSHDSACASA-N 1 1 316.373 3.591 20 5 DHBDMO CC(C)CSCCC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000352621093 336227334 /nfs/dbraw/zinc/22/73/34/336227334.db2.gz LSGNMNLTZUYOJH-UHFFFAOYSA-N 1 1 324.446 3.569 20 5 DHBDMO CC(C)CSCCC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000352621093 336227335 /nfs/dbraw/zinc/22/73/35/336227335.db2.gz LSGNMNLTZUYOJH-UHFFFAOYSA-N 1 1 324.446 3.569 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1 ZINC000301820324 336332231 /nfs/dbraw/zinc/33/22/31/336332231.db2.gz AZOGLEDBFXYNEN-YJBOKZPZSA-N 1 1 311.385 3.761 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC000301842161 336333572 /nfs/dbraw/zinc/33/35/72/336333572.db2.gz QBKOTKDIDHLHIL-IRXDYDNUSA-N 1 1 315.348 3.591 20 5 DHBDMO C[N@H+]1CC[C@@H](Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000301879370 336335781 /nfs/dbraw/zinc/33/57/81/336335781.db2.gz ZIQZGYVUKFOQPI-NVXWUHKLSA-N 1 1 315.348 3.591 20 5 DHBDMO CCC[N@H+]1CC[C@@H](CNc2cc(C)c([N+](=O)[O-])cc2Cl)C1 ZINC000301973885 336340785 /nfs/dbraw/zinc/34/07/85/336340785.db2.gz BCGQZJLMCHTFOR-LBPRGKRZSA-N 1 1 311.813 3.700 20 5 DHBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302031749 336344276 /nfs/dbraw/zinc/34/42/76/336344276.db2.gz CHYFRVVLBXZGMS-ZIAGYGMSSA-N 1 1 303.406 3.660 20 5 DHBDMO C[C@H]([NH2+]C[C@@]1(N(C)C)CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000320902654 336384347 /nfs/dbraw/zinc/38/43/47/336384347.db2.gz ZWJUVKCGXBSNIP-RVKKMQEKSA-N 1 1 319.449 3.756 20 5 DHBDMO Cc1cc(C=C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)no1 ZINC000374577622 336992872 /nfs/dbraw/zinc/99/28/72/336992872.db2.gz SCFMDGVDIVEFEI-UHFFFAOYSA-N 1 1 313.357 3.571 20 5 DHBDMO Cc1c(C[N@@H+]2CC=C(c3cccnc3)CC2)cccc1[N+](=O)[O-] ZINC000375905417 337022825 /nfs/dbraw/zinc/02/28/25/337022825.db2.gz SLKBFVLCQCKTDL-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO COC[C@H]1CCCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000376389884 337032416 /nfs/dbraw/zinc/03/24/16/337032416.db2.gz YKZFMFOGKPUCRN-GJZGRUSLSA-N 1 1 306.406 3.713 20 5 DHBDMO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1nccn1-c1ccccc1 ZINC000376605458 337037852 /nfs/dbraw/zinc/03/78/52/337037852.db2.gz DUPGEETUQPPWEH-CQSZACIVSA-N 1 1 322.368 3.631 20 5 DHBDMO NC(=O)C[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000377847001 337062513 /nfs/dbraw/zinc/06/25/13/337062513.db2.gz IHEPTOIYJIPVJR-HNNXBMFYSA-N 1 1 318.420 3.690 20 5 DHBDMO Cc1[nH+]c(CNc2ccc(Cl)cc2[N+](=O)[O-])c2n1CCCC2 ZINC000378398762 337071711 /nfs/dbraw/zinc/07/17/11/337071711.db2.gz DOKAHQXWGFZRSX-UHFFFAOYSA-N 1 1 320.780 3.702 20 5 DHBDMO CCC[N@H+](CCCN(C)C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000583032642 337231547 /nfs/dbraw/zinc/23/15/47/337231547.db2.gz ZJBJRJGZUULBPM-SSZFMOIBSA-N 1 1 319.449 3.662 20 5 DHBDMO CCC[N@@H+](CCCN(C)C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000583032642 337231548 /nfs/dbraw/zinc/23/15/48/337231548.db2.gz ZJBJRJGZUULBPM-SSZFMOIBSA-N 1 1 319.449 3.662 20 5 DHBDMO CCCN(CCC[NH+](C)C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000583032642 337231549 /nfs/dbraw/zinc/23/15/49/337231549.db2.gz ZJBJRJGZUULBPM-SSZFMOIBSA-N 1 1 319.449 3.662 20 5 DHBDMO CCc1nocc1C[N@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000516324625 338010767 /nfs/dbraw/zinc/01/07/67/338010767.db2.gz WEQYLFONXSFZQZ-JYRVWZFOSA-N 1 1 315.373 3.681 20 5 DHBDMO CCc1nocc1C[N@@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000516324625 338010768 /nfs/dbraw/zinc/01/07/68/338010768.db2.gz WEQYLFONXSFZQZ-JYRVWZFOSA-N 1 1 315.373 3.681 20 5 DHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC1(O)CCCCCC1 ZINC000428454004 338052571 /nfs/dbraw/zinc/05/25/71/338052571.db2.gz QONWOZQQJYNCBQ-NTMALXAHSA-N 1 1 318.417 3.625 20 5 DHBDMO CCCc1nc(C)c(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000428937830 338065608 /nfs/dbraw/zinc/06/56/08/338065608.db2.gz HCAJHBPZFZJOMX-UHFFFAOYSA-N 1 1 317.389 3.518 20 5 DHBDMO C[C@@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000432145350 338147158 /nfs/dbraw/zinc/14/71/58/338147158.db2.gz RNUBLVVWVNRIAQ-LBPRGKRZSA-N 1 1 323.824 3.559 20 5 DHBDMO C[C@H]1CC[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000433046841 338178327 /nfs/dbraw/zinc/17/83/27/338178327.db2.gz QPHPXSHNTALTBI-CMPLNLGQSA-N 1 1 314.332 3.817 20 5 DHBDMO C[C@@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000437581736 338314501 /nfs/dbraw/zinc/31/45/01/338314501.db2.gz WZKZFASREAMHKO-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO C[C@H](c1ccco1)[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000440906395 338399660 /nfs/dbraw/zinc/39/96/60/338399660.db2.gz HFLGDDBKICAUPJ-CYBMUJFWSA-N 1 1 316.357 3.792 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2cc(C3CC3)ccc2F)c1 ZINC000449372028 338618689 /nfs/dbraw/zinc/61/86/89/338618689.db2.gz BKIKNPDKDGLJPE-UHFFFAOYSA-N 1 1 300.333 3.901 20 5 DHBDMO CCC[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000453361331 338831441 /nfs/dbraw/zinc/83/14/41/338831441.db2.gz QWJOWNWPZODOHQ-VBNZEHGJSA-N 1 1 314.389 3.928 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCC2 ZINC000459638221 339039786 /nfs/dbraw/zinc/03/97/86/339039786.db2.gz TUNOVXUCXFUWHW-GHMZBOCLSA-N 1 1 317.414 3.952 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1nc2c(s1)CCC2 ZINC000459651591 339040473 /nfs/dbraw/zinc/04/04/73/339040473.db2.gz PIZSUFYKISAEQL-NSHDSACASA-N 1 1 317.414 3.699 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459788606 339048626 /nfs/dbraw/zinc/04/86/26/339048626.db2.gz FHURLSRUXUUYEL-JEBQAFNWSA-N 1 1 318.417 3.529 20 5 DHBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H](C)OC ZINC000462828717 339092825 /nfs/dbraw/zinc/09/28/25/339092825.db2.gz ZHAAEJRHQPRHIV-CYBMUJFWSA-N 1 1 318.373 3.712 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2cccs2)CC1 ZINC000466497683 339207521 /nfs/dbraw/zinc/20/75/21/339207521.db2.gz UBCACAMAZAKDJL-CYBMUJFWSA-N 1 1 317.414 3.540 20 5 DHBDMO C[C@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000466995862 339223981 /nfs/dbraw/zinc/22/39/81/339223981.db2.gz GAGOIJXTOGDLQH-ZUZCIYMTSA-N 1 1 302.305 3.518 20 5 DHBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467834821 339247241 /nfs/dbraw/zinc/24/72/41/339247241.db2.gz MSHSWVVQQGYMDC-QXSJWSMHSA-N 1 1 319.449 3.612 20 5 DHBDMO C[C@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467834821 339247242 /nfs/dbraw/zinc/24/72/42/339247242.db2.gz MSHSWVVQQGYMDC-QXSJWSMHSA-N 1 1 319.449 3.612 20 5 DHBDMO CC(C)C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000468948046 339275574 /nfs/dbraw/zinc/27/55/74/339275574.db2.gz LHOBGNLBOOJTKH-CYBMUJFWSA-N 1 1 317.389 3.994 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000469467988 339290662 /nfs/dbraw/zinc/29/06/62/339290662.db2.gz DGRUDQHGXKLOMR-CYBMUJFWSA-N 1 1 318.323 3.863 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000469988410 339306973 /nfs/dbraw/zinc/30/69/73/339306973.db2.gz ARVVJHXAXYJGJU-ZDUSSCGKSA-N 1 1 316.323 3.800 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000469988417 339307009 /nfs/dbraw/zinc/30/70/09/339307009.db2.gz AUZODTZRJVASFN-LBPRGKRZSA-N 1 1 302.296 3.758 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](OCC(C)C)C1 ZINC000470184663 339313396 /nfs/dbraw/zinc/31/33/96/339313396.db2.gz SUFOFGUUVUGPAH-IDGGIGOKSA-N 1 1 318.417 3.745 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000470954777 339332623 /nfs/dbraw/zinc/33/26/23/339332623.db2.gz CCAYTKHMDBMQTM-JFGNBEQYSA-N 1 1 302.296 3.929 20 5 DHBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000471522761 339346709 /nfs/dbraw/zinc/34/67/09/339346709.db2.gz PAEIEVOLAHAAFT-DGCLKSJQSA-N 1 1 311.813 3.557 20 5 DHBDMO CC[N@H+]1CC[C@H](N(C)c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000471522760 339346750 /nfs/dbraw/zinc/34/67/50/339346750.db2.gz PAEIEVOLAHAAFT-AAEUAGOBSA-N 1 1 311.813 3.557 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2scnc2C2CC2)c(Cl)c1 ZINC000487568577 339757782 /nfs/dbraw/zinc/75/77/82/339757782.db2.gz ZDLVKHKZBNSZNU-UHFFFAOYSA-N 1 1 323.805 3.872 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCc2cc(F)ccc2C1 ZINC000500783487 340067240 /nfs/dbraw/zinc/06/72/40/340067240.db2.gz KEWPTQMKXIZHGP-HYXAFXHYSA-N 1 1 312.344 3.805 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCc2cc(F)ccc2C1 ZINC000500783487 340067241 /nfs/dbraw/zinc/06/72/41/340067241.db2.gz KEWPTQMKXIZHGP-HYXAFXHYSA-N 1 1 312.344 3.805 20 5 DHBDMO C[N@H+](CCSc1ccccc1F)Cc1ccccc1[N+](=O)[O-] ZINC000501758914 340088084 /nfs/dbraw/zinc/08/80/84/340088084.db2.gz WEMGGIBLTVSIBX-UHFFFAOYSA-N 1 1 320.389 3.958 20 5 DHBDMO C[N@@H+](CCSc1ccccc1F)Cc1ccccc1[N+](=O)[O-] ZINC000501758914 340088085 /nfs/dbraw/zinc/08/80/85/340088085.db2.gz WEMGGIBLTVSIBX-UHFFFAOYSA-N 1 1 320.389 3.958 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nc2c(s1)CCC2 ZINC000502058093 340094322 /nfs/dbraw/zinc/09/43/22/340094322.db2.gz YLLLGBLZATVZLG-QWRGUYRKSA-N 1 1 317.414 3.952 20 5 DHBDMO COCC[N@@H+](Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505565669 340171137 /nfs/dbraw/zinc/17/11/37/340171137.db2.gz WNUYYHXCICLNPZ-UHFFFAOYSA-N 1 1 314.385 3.552 20 5 DHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1F ZINC000505605346 340172655 /nfs/dbraw/zinc/17/26/55/340172655.db2.gz GGNRVSJJWBFVCC-RMKNXTFCSA-N 1 1 300.333 3.879 20 5 DHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1F ZINC000505605346 340172656 /nfs/dbraw/zinc/17/26/56/340172656.db2.gz GGNRVSJJWBFVCC-RMKNXTFCSA-N 1 1 300.333 3.879 20 5 DHBDMO CC[N@@H+](CCOC)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000506460979 340194915 /nfs/dbraw/zinc/19/49/15/340194915.db2.gz SAOLHYVSJUASIM-UHFFFAOYSA-N 1 1 320.414 3.792 20 5 DHBDMO CC[C@H]1C[C@@H](C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCO1 ZINC000507791525 340231617 /nfs/dbraw/zinc/23/16/17/340231617.db2.gz CQCORGJYFZINBD-YJBOKZPZSA-N 1 1 318.417 3.764 20 5 DHBDMO C[C@@H](c1ccccc1F)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511059422 340319803 /nfs/dbraw/zinc/31/98/03/340319803.db2.gz LQLPGXYVRVOTNX-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO Cc1ccc2c(c1)C[N@@H+](Cc1cccc([N+](=O)[O-])c1C)CCO2 ZINC000512245944 340353856 /nfs/dbraw/zinc/35/38/56/340353856.db2.gz UCRGSPWMIGUIJN-UHFFFAOYSA-N 1 1 312.369 3.606 20 5 DHBDMO Cc1ccc2c(c1)C[N@H+](Cc1cccc([N+](=O)[O-])c1C)CCO2 ZINC000512245944 340353857 /nfs/dbraw/zinc/35/38/57/340353857.db2.gz UCRGSPWMIGUIJN-UHFFFAOYSA-N 1 1 312.369 3.606 20 5 DHBDMO COc1ccc(Cl)cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000037995983 340788994 /nfs/dbraw/zinc/78/89/94/340788994.db2.gz KTKGJTCZQTUTCS-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)CO2 ZINC000539058199 340868834 /nfs/dbraw/zinc/86/88/34/340868834.db2.gz HUJRHISOGLLIDT-DYVFJYSZSA-N 1 1 312.369 3.996 20 5 DHBDMO C[C@H]1C[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)S1 ZINC000541998435 340992785 /nfs/dbraw/zinc/99/27/85/340992785.db2.gz QPCCJDCJPLBJOG-UWVGGRQHSA-N 1 1 300.811 3.574 20 5 DHBDMO CCc1cnc(C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)s1 ZINC000130582661 341029298 /nfs/dbraw/zinc/02/92/98/341029298.db2.gz UQMWIUXCGHDERI-AWEZNQCLSA-N 1 1 305.403 3.855 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000544440535 341082295 /nfs/dbraw/zinc/08/22/95/341082295.db2.gz SNSRTRIXSNYNIN-IAOVAPTHSA-N 1 1 320.433 3.693 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000544608138 341088666 /nfs/dbraw/zinc/08/86/66/341088666.db2.gz LAAMMXFHYDXIBO-BLLLJJGKSA-N 1 1 300.358 3.909 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000545235661 341116301 /nfs/dbraw/zinc/11/63/01/341116301.db2.gz JPLRANUORHFKBN-MEBBXXQBSA-N 1 1 302.305 3.518 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1sccc1Cl ZINC000549467375 341295455 /nfs/dbraw/zinc/29/54/55/341295455.db2.gz CGBLMZBMWCAECF-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO COc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)ccc1C ZINC000549806609 341303498 /nfs/dbraw/zinc/30/34/98/341303498.db2.gz VPXXIDSKRPXAHE-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO Cc1ccc([C@@H]2CC[N@@H+](Cc3cc([O-])ccc3[N+](=O)[O-])C2)cc1 ZINC000549932459 341307225 /nfs/dbraw/zinc/30/72/25/341307225.db2.gz SJYYBCZVKIGBJL-OAHLLOKOSA-N 1 1 312.369 3.598 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000550063118 341309231 /nfs/dbraw/zinc/30/92/31/341309231.db2.gz GGPUTEGRWGOJLK-CRAIPNDOSA-N 1 1 320.433 3.695 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](c3ccccc3F)C2)cc1 ZINC000550211419 341312537 /nfs/dbraw/zinc/31/25/37/341312537.db2.gz INCOZMQOVLVTEG-OAHLLOKOSA-N 1 1 314.360 3.766 20 5 DHBDMO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000366002074 524946060 /nfs/dbraw/zinc/94/60/60/524946060.db2.gz UJOYAVZFCFDDPN-YVEFUNNKSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000366002074 524946069 /nfs/dbraw/zinc/94/60/69/524946069.db2.gz UJOYAVZFCFDDPN-YVEFUNNKSA-N 1 1 315.348 3.712 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(Cl)n2)cc1[N+](=O)[O-] ZINC000181819266 525735014 /nfs/dbraw/zinc/73/50/14/525735014.db2.gz IBGABGIEHMULIV-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO CSCc1cccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)c1 ZINC000189481041 525740296 /nfs/dbraw/zinc/74/02/96/525740296.db2.gz JBQXAZCLYABVKK-UHFFFAOYSA-N 1 1 308.428 3.809 20 5 DHBDMO Cc1c([C@H](C)[NH2+][C@@H](C)c2ccncc2F)cccc1[N+](=O)[O-] ZINC000338006523 525922890 /nfs/dbraw/zinc/92/28/90/525922890.db2.gz DIGQHMDOZLPGCH-RYUDHWBXSA-N 1 1 303.337 3.849 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccncc2F)cc1[N+](=O)[O-] ZINC000338007980 525934823 /nfs/dbraw/zinc/93/48/23/525934823.db2.gz LDCWYGUUHWSZMP-RYUDHWBXSA-N 1 1 303.337 3.849 20 5 DHBDMO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000129455604 526111440 /nfs/dbraw/zinc/11/14/40/526111440.db2.gz LDDWXIYMRMSBAH-NSHDSACASA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000129455604 526111452 /nfs/dbraw/zinc/11/14/52/526111452.db2.gz LDDWXIYMRMSBAH-NSHDSACASA-N 1 1 305.765 3.836 20 5 DHBDMO Cc1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000130562982 527254357 /nfs/dbraw/zinc/25/43/57/527254357.db2.gz CVBRFGFSRJVYAA-UHFFFAOYSA-N 1 1 303.387 3.524 20 5 DHBDMO Cc1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000130562982 527254363 /nfs/dbraw/zinc/25/43/63/527254363.db2.gz CVBRFGFSRJVYAA-UHFFFAOYSA-N 1 1 303.387 3.524 20 5 DHBDMO Cc1ncsc1C[N@@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182772786 527499810 /nfs/dbraw/zinc/49/98/10/527499810.db2.gz RKHRIDAOWHYDKR-LBPRGKRZSA-N 1 1 305.403 3.861 20 5 DHBDMO Cc1ncsc1C[N@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182772786 527499813 /nfs/dbraw/zinc/49/98/13/527499813.db2.gz RKHRIDAOWHYDKR-LBPRGKRZSA-N 1 1 305.403 3.861 20 5 DHBDMO CC[C@](C)([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1nccs1 ZINC000152633083 1033535639 /nfs/dbraw/zinc/53/56/39/1033535639.db2.gz FKJJLJIKMBNONE-HNNXBMFYSA-N 1 1 305.403 3.775 20 5 DHBDMO F[C@H]1CNCC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC001210611225 1013973957 /nfs/dbraw/zinc/97/39/57/1013973957.db2.gz QMMOUUOGCQILFU-KRWDZBQOSA-N 1 1 308.400 3.736 20 5 DHBDMO F[C@H]1C[NH2+]CCN(Cc2c3ccccc3cc3ccccc32)C1 ZINC001210611225 1013973960 /nfs/dbraw/zinc/97/39/60/1013973960.db2.gz QMMOUUOGCQILFU-KRWDZBQOSA-N 1 1 308.400 3.736 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000580121419 1014037514 /nfs/dbraw/zinc/03/75/14/1014037514.db2.gz PEWMJFIKTBMAHR-LSDHHAIUSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000580121419 1014037517 /nfs/dbraw/zinc/03/75/17/1014037517.db2.gz PEWMJFIKTBMAHR-LSDHHAIUSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000580121418 1014037763 /nfs/dbraw/zinc/03/77/63/1014037763.db2.gz PEWMJFIKTBMAHR-GJZGRUSLSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000580121418 1014037767 /nfs/dbraw/zinc/03/77/67/1014037767.db2.gz PEWMJFIKTBMAHR-GJZGRUSLSA-N 1 1 307.438 3.674 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(F)c(F)c1 ZINC000579497982 1014069009 /nfs/dbraw/zinc/06/90/09/1014069009.db2.gz MSPMRMNIKMGHDA-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[C@H]([NH2+]Cc1cccc(O)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000328482947 1014182747 /nfs/dbraw/zinc/18/27/47/1014182747.db2.gz QFOUJMPTWVWWPT-JTQLQIEISA-N 1 1 306.749 3.805 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@]1(C)CCCO ZINC000579764990 1014270704 /nfs/dbraw/zinc/27/07/04/1014270704.db2.gz QWXJGHAWAIUZNI-NZHZHZHDSA-N 1 1 318.417 3.625 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cs1 ZINC000537624087 1014314522 /nfs/dbraw/zinc/31/45/22/1014314522.db2.gz SXXMZCGAXDEHKN-CYBMUJFWSA-N 1 1 320.389 3.860 20 5 DHBDMO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000580740462 1014325469 /nfs/dbraw/zinc/32/54/69/1014325469.db2.gz PJKPUUWVJXUHDI-XJKSGUPXSA-N 1 1 314.385 3.986 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000320030441 1014373155 /nfs/dbraw/zinc/37/31/55/1014373155.db2.gz JNRYDSWFPIODPT-KSZLIROESA-N 1 1 317.433 3.652 20 5 DHBDMO CCC[C@H]([NH2+][C@@H]1CCN2CCCC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000320030441 1014373168 /nfs/dbraw/zinc/37/31/68/1014373168.db2.gz JNRYDSWFPIODPT-KSZLIROESA-N 1 1 317.433 3.652 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000580964722 1014491351 /nfs/dbraw/zinc/49/13/51/1014491351.db2.gz MSGOQMNIUJJYSF-KRWDZBQOSA-N 1 1 300.333 3.666 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000580964722 1014491355 /nfs/dbraw/zinc/49/13/55/1014491355.db2.gz MSGOQMNIUJJYSF-KRWDZBQOSA-N 1 1 300.333 3.666 20 5 DHBDMO CCC[C@H]([NH2+]Cc1ncccc1F)c1cccc([N+](=O)[O-])c1 ZINC000090720006 1014617899 /nfs/dbraw/zinc/61/78/99/1014617899.db2.gz WWSSHQIKXAHYJK-HNNXBMFYSA-N 1 1 303.337 3.760 20 5 DHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCc1cccs1 ZINC000521191803 1014660803 /nfs/dbraw/zinc/66/08/03/1014660803.db2.gz CCYMEFHCNKBCRA-UHFFFAOYSA-N 1 1 320.414 3.600 20 5 DHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000443069029 1014800045 /nfs/dbraw/zinc/80/00/45/1014800045.db2.gz ODUUIMRBRLJJDU-UKRRQHHQSA-N 1 1 306.406 3.718 20 5 DHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000443069027 1014801338 /nfs/dbraw/zinc/80/13/38/1014801338.db2.gz ODUUIMRBRLJJDU-DZGCQCFKSA-N 1 1 306.406 3.718 20 5 DHBDMO Cc1[nH+]c(NCc2cccc([N+](=O)[O-])c2)ccc1-c1ccccc1 ZINC000581435578 1014853573 /nfs/dbraw/zinc/85/35/73/1014853573.db2.gz ZRELPKMXLRNCMP-UHFFFAOYSA-N 1 1 319.364 4.577 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000610518233 1015091140 /nfs/dbraw/zinc/09/11/40/1015091140.db2.gz WBXSGCZBJFPGBD-ZDUSSCGKSA-N 1 1 324.384 3.641 20 5 DHBDMO Cc1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cnc1F ZINC000891622272 1015460667 /nfs/dbraw/zinc/46/06/67/1015460667.db2.gz FQSIORHGUFJCRL-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cnc1F ZINC000891622272 1015460671 /nfs/dbraw/zinc/46/06/71/1015460671.db2.gz FQSIORHGUFJCRL-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO CCOc1cc(C[N@H+](C)[C@@H](C)c2ccccn2)ccc1[N+](=O)[O-] ZINC000276979564 1015790500 /nfs/dbraw/zinc/79/05/00/1015790500.db2.gz YEDJAUIRDCEXAG-ZDUSSCGKSA-N 1 1 315.373 3.582 20 5 DHBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)c2ccccn2)ccc1[N+](=O)[O-] ZINC000276979564 1015790502 /nfs/dbraw/zinc/79/05/02/1015790502.db2.gz YEDJAUIRDCEXAG-ZDUSSCGKSA-N 1 1 315.373 3.582 20 5 DHBDMO C[C@H](c1cccs1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000065534928 1016202533 /nfs/dbraw/zinc/20/25/33/1016202533.db2.gz YISZBGWNSOYSDH-GFCCVEGCSA-N 1 1 306.387 3.728 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000846905883 1032144090 /nfs/dbraw/zinc/14/40/90/1032144090.db2.gz MODXMRXQKLOVRC-CYBMUJFWSA-N 1 1 317.776 3.633 20 5 DHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCC[C@H](C)C1 ZINC000071954212 1016278881 /nfs/dbraw/zinc/27/88/81/1016278881.db2.gz WASVFEWCECDWBE-RYUDHWBXSA-N 1 1 311.813 3.781 20 5 DHBDMO C[C@@H](c1cccs1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000051502046 1016485960 /nfs/dbraw/zinc/48/59/60/1016485960.db2.gz WGYAKAIIZSPTNT-LBPRGKRZSA-N 1 1 306.387 3.728 20 5 DHBDMO CC(C)c1ncc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)s1 ZINC000338957799 1016777745 /nfs/dbraw/zinc/77/77/45/1016777745.db2.gz LOIYKHYCOHLJAQ-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cncc(F)c1 ZINC000773034654 1032534573 /nfs/dbraw/zinc/53/45/73/1032534573.db2.gz HVWVGLSRUQDGRH-VIFPVBQESA-N 1 1 309.728 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)[C@H](CO)C(C)(C)C)cc1[N+](=O)[O-] ZINC000537659815 1032620184 /nfs/dbraw/zinc/62/01/84/1032620184.db2.gz NGIOIRYPDBIVDG-MRXNPFEDSA-N 1 1 308.422 3.557 20 5 DHBDMO CC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1CCC1 ZINC000425401238 1012573812 /nfs/dbraw/zinc/57/38/12/1012573812.db2.gz GSBOTKKBHJHQSO-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000515549304 1012659738 /nfs/dbraw/zinc/65/97/38/1012659738.db2.gz IZMFCQPQBVSKRJ-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO Cc1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)cc1[N+](=O)[O-] ZINC000475287030 1017117645 /nfs/dbraw/zinc/11/76/45/1017117645.db2.gz MMVJRIWNPFXZTI-PWSUYJOCSA-N 1 1 302.296 3.676 20 5 DHBDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000444609445 1017589297 /nfs/dbraw/zinc/58/92/97/1017589297.db2.gz NCQPGHHXESBWSV-RYUDHWBXSA-N 1 1 316.405 3.870 20 5 DHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCCC[C@H]1C ZINC000444673658 1017624532 /nfs/dbraw/zinc/62/45/32/1017624532.db2.gz IITMKKQMGSHJPO-MLGOLLRUSA-N 1 1 316.405 3.872 20 5 DHBDMO Cc1ccc(C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C2CC2)o1 ZINC000051968104 1017789024 /nfs/dbraw/zinc/78/90/24/1017789024.db2.gz NXEAKEZLQGJYSR-UHFFFAOYSA-N 1 1 316.357 3.540 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCC2(CCCC2)O1 ZINC000558720546 1018076304 /nfs/dbraw/zinc/07/63/04/1018076304.db2.gz WFTVKDJDQFLEKQ-HNNXBMFYSA-N 1 1 304.390 3.518 20 5 DHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCC2(CCCC2)O1 ZINC000558720546 1018076318 /nfs/dbraw/zinc/07/63/18/1018076318.db2.gz WFTVKDJDQFLEKQ-HNNXBMFYSA-N 1 1 304.390 3.518 20 5 DHBDMO Cc1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc(C)c1O ZINC000263683446 1032754167 /nfs/dbraw/zinc/75/41/67/1032754167.db2.gz NEPPXWWWAOLFNK-UHFFFAOYSA-N 1 1 320.776 3.860 20 5 DHBDMO CCC(CC)[N@@H+](Cn1nc(C)c2cc([N+](=O)[O-])ccc21)C1CC1 ZINC000764898278 1018421394 /nfs/dbraw/zinc/42/13/94/1018421394.db2.gz BUFMPMAQYQIHFE-UHFFFAOYSA-N 1 1 316.405 3.863 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000447827488 1018484937 /nfs/dbraw/zinc/48/49/37/1018484937.db2.gz BOVRKQZFSFMUJK-BBRMVZONSA-N 1 1 306.406 3.711 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000447827488 1018484945 /nfs/dbraw/zinc/48/49/45/1018484945.db2.gz BOVRKQZFSFMUJK-BBRMVZONSA-N 1 1 306.406 3.711 20 5 DHBDMO CCc1ccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000052689982 1018762014 /nfs/dbraw/zinc/76/20/14/1018762014.db2.gz SXHAQIGJQXZDOO-UHFFFAOYSA-N 1 1 324.384 3.666 20 5 DHBDMO CCc1ccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000052689982 1018762027 /nfs/dbraw/zinc/76/20/27/1018762027.db2.gz SXHAQIGJQXZDOO-UHFFFAOYSA-N 1 1 324.384 3.666 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@H]2CCCC[C@@H]12 ZINC000611802416 1018893956 /nfs/dbraw/zinc/89/39/56/1018893956.db2.gz NUHXKDYYIGJCKE-ZLDLUXBVSA-N 1 1 315.373 3.747 20 5 DHBDMO CCc1[nH]nc(Cl)c1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000921817116 1018897490 /nfs/dbraw/zinc/89/74/90/1018897490.db2.gz ILNCDOQPHJNANF-JTQLQIEISA-N 1 1 322.796 3.693 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278613676 1018926901 /nfs/dbraw/zinc/92/69/01/1018926901.db2.gz FQAZXPQOBRJMFV-MNOVXSKESA-N 1 1 302.296 3.930 20 5 DHBDMO CC[C@H](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2 ZINC001168695086 1019097600 /nfs/dbraw/zinc/09/76/00/1019097600.db2.gz SSSQQGQWBSWMEX-QWHCGFSZSA-N 1 1 305.422 3.819 20 5 DHBDMO CC[C@H](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2 ZINC001168695086 1019097611 /nfs/dbraw/zinc/09/76/11/1019097611.db2.gz SSSQQGQWBSWMEX-QWHCGFSZSA-N 1 1 305.422 3.819 20 5 DHBDMO CCCC[N@@H+](C)CCNCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000489056249 1019288957 /nfs/dbraw/zinc/28/89/57/1019288957.db2.gz VWYSBDWRCUYQAS-UHFFFAOYSA-N 1 1 307.438 3.540 20 5 DHBDMO CCCCN(C)CC[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000489056249 1019288972 /nfs/dbraw/zinc/28/89/72/1019288972.db2.gz VWYSBDWRCUYQAS-UHFFFAOYSA-N 1 1 307.438 3.540 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccccn3)CC2)c(F)c1 ZINC000611090629 1019398016 /nfs/dbraw/zinc/39/80/16/1019398016.db2.gz ZSSGZWZSMWQRDA-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO Cc1ccc(C[N@@H+]2CCOc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000611262725 1019424462 /nfs/dbraw/zinc/42/44/62/1019424462.db2.gz HMZCHMLKUWSXJZ-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1ccc(C[N@H+]2CCOc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000611262725 1019424472 /nfs/dbraw/zinc/42/44/72/1019424472.db2.gz HMZCHMLKUWSXJZ-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO COc1cccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000611377513 1019466661 /nfs/dbraw/zinc/46/66/61/1019466661.db2.gz HDUCIENNKWGTJD-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C ZINC000316791935 1019938221 /nfs/dbraw/zinc/93/82/21/1019938221.db2.gz NWIVUCTWTJBQJP-MWLCHTKSSA-N 1 1 317.311 3.508 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000611983894 1020032796 /nfs/dbraw/zinc/03/27/96/1020032796.db2.gz UJDNRNUTTQJMRC-IVZVJUQRSA-N 1 1 323.396 3.568 20 5 DHBDMO CCOC[C@@H]1CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000093419235 1020152055 /nfs/dbraw/zinc/15/20/55/1020152055.db2.gz DIVWEFWPDRSIDR-MRXNPFEDSA-N 1 1 320.433 3.967 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)cs1 ZINC000154947882 1020169055 /nfs/dbraw/zinc/16/90/55/1020169055.db2.gz VJWRXDCLANUJHW-HNNXBMFYSA-N 1 1 317.414 3.733 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)cs1 ZINC000154947882 1020169065 /nfs/dbraw/zinc/16/90/65/1020169065.db2.gz VJWRXDCLANUJHW-HNNXBMFYSA-N 1 1 317.414 3.733 20 5 DHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000155214464 1020200127 /nfs/dbraw/zinc/20/01/27/1020200127.db2.gz KDOVMHKWTCLOQE-INIZCTEOSA-N 1 1 312.369 3.593 20 5 DHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)C12CCC2 ZINC000355156785 1020264180 /nfs/dbraw/zinc/26/41/80/1020264180.db2.gz DPLFDNMEIDNVHM-DLBZAZTESA-N 1 1 318.417 3.683 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c1 ZINC000281038456 1020323517 /nfs/dbraw/zinc/32/35/17/1020323517.db2.gz PWEAWKPTHJLBPH-KURKYZTESA-N 1 1 318.417 3.500 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCCC3(CC3)C2)c1 ZINC000186605548 1020338487 /nfs/dbraw/zinc/33/84/87/1020338487.db2.gz WSLAKFONJMIQQD-UHFFFAOYSA-N 1 1 312.316 3.572 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000186605548 1020338496 /nfs/dbraw/zinc/33/84/96/1020338496.db2.gz WSLAKFONJMIQQD-UHFFFAOYSA-N 1 1 312.316 3.572 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2cc(C)c(C)o2)cc1[N+](=O)[O-] ZINC000282280908 1020397694 /nfs/dbraw/zinc/39/76/94/1020397694.db2.gz RRSPMSIUJUMTBM-NSHDSACASA-N 1 1 304.346 3.664 20 5 DHBDMO Cn1cccc1[C@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000179704941 1020433912 /nfs/dbraw/zinc/43/39/12/1020433912.db2.gz NVVMAWOJTJQMLM-SBLNNXNXSA-N 1 1 311.385 3.784 20 5 DHBDMO C[N@@H+](CCCCC(F)(F)F)CCc1cccc([N+](=O)[O-])c1 ZINC000282566062 1020459645 /nfs/dbraw/zinc/45/96/45/1020459645.db2.gz ZAGDUXBMLCGXLC-UHFFFAOYSA-N 1 1 304.312 3.802 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@H]2CCCC[N@H+]2C(C)C)cc1[N+](=O)[O-] ZINC000556124191 1020480377 /nfs/dbraw/zinc/48/03/77/1020480377.db2.gz YKEQQYMVVFWZIQ-NVXWUHKLSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@H]2CCCC[N@@H+]2C(C)C)cc1[N+](=O)[O-] ZINC000556124191 1020480378 /nfs/dbraw/zinc/48/03/78/1020480378.db2.gz YKEQQYMVVFWZIQ-NVXWUHKLSA-N 1 1 319.449 3.817 20 5 DHBDMO CC(C)[N@@H+](CCc1cncs1)Cc1ccc([N+](=O)[O-])cc1 ZINC000411185246 1020508086 /nfs/dbraw/zinc/50/80/86/1020508086.db2.gz HPVKLARYKVFEJH-UHFFFAOYSA-N 1 1 305.403 3.504 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC000172579342 1020546463 /nfs/dbraw/zinc/54/64/63/1020546463.db2.gz KAVDYORGCJGYDT-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000162910409 1020560199 /nfs/dbraw/zinc/56/01/99/1020560199.db2.gz LXJHLRQBKGHXPJ-VHSXEESVSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000162910409 1020560202 /nfs/dbraw/zinc/56/02/02/1020560202.db2.gz LXJHLRQBKGHXPJ-VHSXEESVSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000766212605 1020688555 /nfs/dbraw/zinc/68/85/55/1020688555.db2.gz RZWRRIVXDVREQP-LBPRGKRZSA-N 1 1 318.348 3.503 20 5 DHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cccc(F)c1 ZINC000579983377 1020793459 /nfs/dbraw/zinc/79/34/59/1020793459.db2.gz REHJNKMMUUWRNY-UHFFFAOYSA-N 1 1 302.349 3.799 20 5 DHBDMO CCc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000581039145 1020865456 /nfs/dbraw/zinc/86/54/56/1020865456.db2.gz ODRMCWBKQHGQNM-UHFFFAOYSA-N 1 1 304.415 3.893 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000580964723 1020868186 /nfs/dbraw/zinc/86/81/86/1020868186.db2.gz MSGOQMNIUJJYSF-QGZVFWFLSA-N 1 1 300.333 3.666 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000580964723 1020868190 /nfs/dbraw/zinc/86/81/90/1020868190.db2.gz MSGOQMNIUJJYSF-QGZVFWFLSA-N 1 1 300.333 3.666 20 5 DHBDMO CCC[C@H](NCC[N@@H+]1CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000766271989 1021003102 /nfs/dbraw/zinc/00/31/02/1021003102.db2.gz WVAJPJKTTNAMCH-YOEHRIQHSA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@H](NCC[N@H+]1CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000766271989 1021003109 /nfs/dbraw/zinc/00/31/09/1021003109.db2.gz WVAJPJKTTNAMCH-YOEHRIQHSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1nn(C[NH+]2CCC(C3CCCCC3)CC2)c(C)c1[N+](=O)[O-] ZINC000917468833 1021276531 /nfs/dbraw/zinc/27/65/31/1021276531.db2.gz ZEUBCTNSJKTXLI-UHFFFAOYSA-N 1 1 320.437 3.658 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)cccc1[N+](=O)[O-] ZINC000182121149 1021488622 /nfs/dbraw/zinc/48/86/22/1021488622.db2.gz KFAHGSCAACTSGR-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCc3ccc(O)cc32)c1 ZINC000850386641 1021502707 /nfs/dbraw/zinc/50/27/07/1021502707.db2.gz KPFAJKJQYWURMC-MRXNPFEDSA-N 1 1 318.760 3.731 20 5 DHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000744440704 1021546057 /nfs/dbraw/zinc/54/60/57/1021546057.db2.gz GTMRCDPALZELNZ-XJKSGUPXSA-N 1 1 314.389 3.536 20 5 DHBDMO COc1ccc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000541117832 1021663050 /nfs/dbraw/zinc/66/30/50/1021663050.db2.gz KGCYKZYAHSVMFI-CFVMTHIKSA-N 1 1 304.390 3.614 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCC(C)(C)C1 ZINC000619515269 1021782131 /nfs/dbraw/zinc/78/21/31/1021782131.db2.gz GHPYOSCPBXKPRJ-GFCCVEGCSA-N 1 1 303.362 3.747 20 5 DHBDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037562819 1021839014 /nfs/dbraw/zinc/83/90/14/1021839014.db2.gz OCZCSQVZWUTYGZ-NSHDSACASA-N 1 1 306.387 3.824 20 5 DHBDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000122659814 1021898507 /nfs/dbraw/zinc/89/85/07/1021898507.db2.gz VAXNKWRVTREMCD-SFHVURJKSA-N 1 1 324.380 3.832 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C)c(C)c2)cc1[N+](=O)[O-] ZINC000556858970 1021906083 /nfs/dbraw/zinc/90/60/83/1021906083.db2.gz QBBWCSFVUDIZSI-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO COc1ccccc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000183230048 1022040493 /nfs/dbraw/zinc/04/04/93/1022040493.db2.gz MNUKLDGTKSRAPF-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1ccccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000183230048 1022040517 /nfs/dbraw/zinc/04/05/17/1022040517.db2.gz MNUKLDGTKSRAPF-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO CC(C)C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC(C)(C)C ZINC000776585836 1022105326 /nfs/dbraw/zinc/10/53/26/1022105326.db2.gz AJHPAZTYHVNLRW-MRXNPFEDSA-N 1 1 308.422 3.632 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)cc1F ZINC000852594143 1022145032 /nfs/dbraw/zinc/14/50/32/1022145032.db2.gz AASVSGBRFSWOGE-WMLDXEAASA-N 1 1 322.380 3.515 20 5 DHBDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169036174 1022222055 /nfs/dbraw/zinc/22/20/55/1022222055.db2.gz FPELEXPEHUVXPF-TZMCWYRMSA-N 1 1 316.323 3.583 20 5 DHBDMO CC[N@@H+](Cc1c(F)cccc1Cl)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169041639 1022224226 /nfs/dbraw/zinc/22/42/26/1022224226.db2.gz BTTZIWQKHYEUGD-NEPJUHHUSA-N 1 1 314.788 3.746 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C1 ZINC001169057503 1022232536 /nfs/dbraw/zinc/23/25/36/1022232536.db2.gz WDDAPLUWUDDOQH-XFBWCDHKSA-N 1 1 310.344 3.547 20 5 DHBDMO Cc1cccc(NCCNc2ccc(C(F)F)cc2[N+](=O)[O-])[nH+]1 ZINC000853328641 1022256918 /nfs/dbraw/zinc/25/69/18/1022256918.db2.gz UQKSMNQELYWVTI-UHFFFAOYSA-N 1 1 322.315 3.760 20 5 DHBDMO CCCCCC[N@@H+](C)CC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000854509844 1022485050 /nfs/dbraw/zinc/48/50/50/1022485050.db2.gz BLJFTETWBUAQIH-UHFFFAOYSA-N 1 1 321.421 3.662 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H]2CCc3ccc(Cl)nc32)cc1[N+](=O)[O-] ZINC000876500346 1033080663 /nfs/dbraw/zinc/08/06/63/1033080663.db2.gz QVJHWPYQWMTDAP-CYBMUJFWSA-N 1 1 317.776 3.729 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@H]2CC2(Cl)Cl)C2CC2)c1 ZINC000768544973 1022993569 /nfs/dbraw/zinc/99/35/69/1022993569.db2.gz WQGUXRXWNSRLKG-LLVKDONJSA-N 1 1 315.200 3.753 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H]2CC2(Cl)Cl)C2CC2)c1 ZINC000768544973 1022993582 /nfs/dbraw/zinc/99/35/82/1022993582.db2.gz WQGUXRXWNSRLKG-LLVKDONJSA-N 1 1 315.200 3.753 20 5 DHBDMO CCOc1cc([N+](=O)[O-])ccc1NCCC[N@H+]1CCCC[C@H]1C ZINC001167752046 1023030313 /nfs/dbraw/zinc/03/03/13/1023030313.db2.gz CAPZYCXKSCKDSR-CQSZACIVSA-N 1 1 321.421 3.670 20 5 DHBDMO CC1(C)CC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769400007 1023139264 /nfs/dbraw/zinc/13/92/64/1023139264.db2.gz ZRCUACAVNPANDQ-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769400007 1023139268 /nfs/dbraw/zinc/13/92/68/1023139268.db2.gz ZRCUACAVNPANDQ-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO CSC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000312743959 1023144026 /nfs/dbraw/zinc/14/40/26/1023144026.db2.gz VWURQOKBCYGFFX-LLVKDONJSA-N 1 1 314.838 3.823 20 5 DHBDMO COC1CCC([N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000876738253 1033130708 /nfs/dbraw/zinc/13/07/08/1033130708.db2.gz ZFWQBBXSMYUSAF-UHFFFAOYSA-N 1 1 306.406 3.601 20 5 DHBDMO CCCCCC[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000771224744 1023414150 /nfs/dbraw/zinc/41/41/50/1023414150.db2.gz PSXKJIANCBZGIY-UHFFFAOYSA-N 1 1 324.406 3.718 20 5 DHBDMO COc1ccc(CO[NH+]=C(N)C2CCCCCC2)cc1[N+](=O)[O-] ZINC000746557221 1023612321 /nfs/dbraw/zinc/61/23/21/1023612321.db2.gz VNHXJWXIIXPCJH-UHFFFAOYSA-N 1 1 321.377 3.572 20 5 DHBDMO Cc1nc(F)ccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000787088885 1023756458 /nfs/dbraw/zinc/75/64/58/1023756458.db2.gz VYIPRMPBPRMKMB-UHFFFAOYSA-N 1 1 317.364 3.848 20 5 DHBDMO COCC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCCC1 ZINC000746654463 1023766810 /nfs/dbraw/zinc/76/68/10/1023766810.db2.gz INQCVHPMZIPHAH-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCc2ccccc21 ZINC000788010952 1023836985 /nfs/dbraw/zinc/83/69/85/1023836985.db2.gz UQQCFUYZOQFSAJ-INIZCTEOSA-N 1 1 300.333 3.853 20 5 DHBDMO CC[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000181828990 1023869369 /nfs/dbraw/zinc/86/93/69/1023869369.db2.gz QSCIUGCOWDDZOU-MRXNPFEDSA-N 1 1 318.348 3.983 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)C[N@@H+]1CCC[C@@H](C)C1 ZINC000531697433 1024272561 /nfs/dbraw/zinc/27/25/61/1024272561.db2.gz RALLRBHMZQZYLA-BMFZPTHFSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC000531697433 1024272573 /nfs/dbraw/zinc/27/25/73/1024272573.db2.gz RALLRBHMZQZYLA-BMFZPTHFSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(Cl)n1 ZINC000883294398 1024354766 /nfs/dbraw/zinc/35/47/66/1024354766.db2.gz XYEVVHOJUPNPLS-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000270343443 1024377256 /nfs/dbraw/zinc/37/72/56/1024377256.db2.gz UZVJZNRVOQGEMO-SNVBAGLBSA-N 1 1 300.280 3.850 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000270343443 1024377269 /nfs/dbraw/zinc/37/72/69/1024377269.db2.gz UZVJZNRVOQGEMO-SNVBAGLBSA-N 1 1 300.280 3.850 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000105503841 1024396583 /nfs/dbraw/zinc/39/65/83/1024396583.db2.gz YBYXZDFOIAICIL-CYBMUJFWSA-N 1 1 305.403 3.909 20 5 DHBDMO Cc1c([C@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)cccc1[N+](=O)[O-] ZINC000585765571 1024602025 /nfs/dbraw/zinc/60/20/25/1024602025.db2.gz SVMDXIIWAOFWJL-ZDUSSCGKSA-N 1 1 324.384 3.673 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000585767911 1024604662 /nfs/dbraw/zinc/60/46/62/1024604662.db2.gz FCFGQEXIBVHJRI-SPQRHKFCSA-N 1 1 316.401 3.501 20 5 DHBDMO COc1ccc(C[N@@H+](C)C(C)(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000585754736 1024626201 /nfs/dbraw/zinc/62/62/01/1024626201.db2.gz YPKYKNAUMMYVDR-UHFFFAOYSA-N 1 1 314.385 3.971 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3nccs3)CCCC2)cc1F ZINC000283321353 1024634314 /nfs/dbraw/zinc/63/43/14/1024634314.db2.gz ZPQZEIKGCHFBHT-UHFFFAOYSA-N 1 1 321.377 3.750 20 5 DHBDMO CCCO[C@@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000108395592 1024639777 /nfs/dbraw/zinc/63/97/77/1024639777.db2.gz KIWBZVKDVHLPJV-WMLDXEAASA-N 1 1 306.406 3.937 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](Cc1ccccn1)C1CC1 ZINC000349237591 1024691973 /nfs/dbraw/zinc/69/19/73/1024691973.db2.gz FVOCEVGBYRSCEJ-ALCCZGGFSA-N 1 1 309.369 3.668 20 5 DHBDMO CC[C@@H]1CC[C@H](C)[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001170280673 1024733617 /nfs/dbraw/zinc/73/36/17/1024733617.db2.gz NNCFUVSOQYRLMH-LSDHHAIUSA-N 1 1 306.406 3.874 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC23CCCC3)c([N+](=O)[O-])c1 ZINC001170335661 1024746712 /nfs/dbraw/zinc/74/67/12/1024746712.db2.gz QAEBBMQLNIATKF-CYBMUJFWSA-N 1 1 304.390 3.553 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001170328998 1024747278 /nfs/dbraw/zinc/74/72/78/1024747278.db2.gz MVSZZFNQBVBXFZ-AWEZNQCLSA-N 1 1 314.385 3.666 20 5 DHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)C12CCC2 ZINC000349959761 1024772258 /nfs/dbraw/zinc/77/22/58/1024772258.db2.gz DMTSALHYHWJQHS-SJORKVTESA-N 1 1 318.417 3.683 20 5 DHBDMO C[C@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728901072 1024932523 /nfs/dbraw/zinc/93/25/23/1024932523.db2.gz WJMXATHFQDPVNE-AWEZNQCLSA-N 1 1 314.389 3.538 20 5 DHBDMO Cc1csc(C(C)(C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000118849244 1024933293 /nfs/dbraw/zinc/93/32/93/1024933293.db2.gz GCZUCXLJTSJPCB-UHFFFAOYSA-N 1 1 305.403 3.693 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCCCO2)C1 ZINC000365705303 1025070308 /nfs/dbraw/zinc/07/03/08/1025070308.db2.gz PMIGIWMMBSICOL-PBHICJAKSA-N 1 1 304.390 3.691 20 5 DHBDMO CCC1(CC)CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000353607770 1025149383 /nfs/dbraw/zinc/14/93/83/1025149383.db2.gz AZAGDEVSPBFSJQ-UHFFFAOYSA-N 1 1 322.405 3.624 20 5 DHBDMO COc1cc(C[N@H+]2CCCC(C)(C)CC2)c([N+](=O)[O-])cc1OC ZINC000353663586 1025188975 /nfs/dbraw/zinc/18/89/75/1025188975.db2.gz DCBUQCYRBUDRSF-UHFFFAOYSA-N 1 1 322.405 3.624 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)cs1 ZINC000859929513 1033270859 /nfs/dbraw/zinc/27/08/59/1033270859.db2.gz ACAIBUDIZKTGAA-HRCADAONSA-N 1 1 314.410 3.892 20 5 DHBDMO COc1cc(C[N@H+]2C[C@@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000353884234 1025279616 /nfs/dbraw/zinc/27/96/16/1025279616.db2.gz WIBUCUFZIHWPIH-QWHCGFSZSA-N 1 1 322.405 3.623 20 5 DHBDMO C[C@@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1cccnc1[N+](=O)[O-] ZINC000885956734 1025419612 /nfs/dbraw/zinc/41/96/12/1025419612.db2.gz XOBIJKAODFDINE-AWEZNQCLSA-N 1 1 311.385 3.791 20 5 DHBDMO CCC[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000886112149 1025511755 /nfs/dbraw/zinc/51/17/55/1025511755.db2.gz QOGHFEUWYRJFTQ-HNNXBMFYSA-N 1 1 321.327 3.899 20 5 DHBDMO C[C@H]([N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1(C)CC1 ZINC000355086913 1025600387 /nfs/dbraw/zinc/60/03/87/1025600387.db2.gz LYHLSFSZPMDZLS-JTQLQIEISA-N 1 1 314.332 3.817 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H](SC)C1 ZINC000355220482 1025647365 /nfs/dbraw/zinc/64/73/65/1025647365.db2.gz LHXDBQWUMRKBST-HNNXBMFYSA-N 1 1 324.446 3.711 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000886609126 1025735110 /nfs/dbraw/zinc/73/51/10/1025735110.db2.gz MPGCMCPZPWOFJE-JSGCOSHPSA-N 1 1 314.307 3.759 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCOCC2(CCCC2)C1 ZINC000614222694 1025955129 /nfs/dbraw/zinc/95/51/29/1025955129.db2.gz ZQACSUXEEIIVGY-CQSZACIVSA-N 1 1 304.390 3.548 20 5 DHBDMO Cc1nn(C[NH+]2CCC(C)(CC(C)C)CC2)c(C)c1[N+](=O)[O-] ZINC000808232214 1026238052 /nfs/dbraw/zinc/23/80/52/1026238052.db2.gz VVYNERHFLFIPPE-UHFFFAOYSA-N 1 1 308.426 3.514 20 5 DHBDMO COc1ccc(C[N@H+]2CC[C@H](C)C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000357043727 1026290587 /nfs/dbraw/zinc/29/05/87/1026290587.db2.gz RHYWLWBPUDSXNU-ZDUSSCGKSA-N 1 1 304.390 3.616 20 5 DHBDMO Cn1cnnc1C[N@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000809777376 1026608991 /nfs/dbraw/zinc/60/89/91/1026608991.db2.gz NHYKPXXDRPACRX-UHFFFAOYSA-N 1 1 316.408 3.754 20 5 DHBDMO Cn1cnnc1C[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000809777376 1026608996 /nfs/dbraw/zinc/60/89/96/1026608996.db2.gz NHYKPXXDRPACRX-UHFFFAOYSA-N 1 1 316.408 3.754 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420956471 1026893451 /nfs/dbraw/zinc/89/34/51/1026893451.db2.gz YJVLTCPPOPOOMK-LLVKDONJSA-N 1 1 302.296 3.759 20 5 DHBDMO CCC(C)(C)[C@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000156700862 1027146303 /nfs/dbraw/zinc/14/63/03/1027146303.db2.gz KQZKZDSBBYXDBP-JKSUJKDBSA-N 1 1 306.406 3.529 20 5 DHBDMO CCC[C@@H](NC[C@H]([NH3+])c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423238824 1027459832 /nfs/dbraw/zinc/45/98/32/1027459832.db2.gz JOORDCJSNBRLOM-ZWKOTPCHSA-N 1 1 313.401 3.726 20 5 DHBDMO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)Cc2ccccc21 ZINC000747841064 1027560981 /nfs/dbraw/zinc/56/09/81/1027560981.db2.gz NLEKUROOEOLXFP-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)Cc2ccccc21 ZINC000747841064 1027560991 /nfs/dbraw/zinc/56/09/91/1027560991.db2.gz NLEKUROOEOLXFP-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+](C2CCC2)C1 ZINC000813630198 1027679203 /nfs/dbraw/zinc/67/92/03/1027679203.db2.gz JDGSDYRJDXVYAN-GFCCVEGCSA-N 1 1 323.824 3.559 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cncs1 ZINC000934197246 1027926242 /nfs/dbraw/zinc/92/62/42/1027926242.db2.gz BMBFMDCEAMOOBH-LLVKDONJSA-N 1 1 321.402 3.689 20 5 DHBDMO C[N@@H+](CCc1cccc(F)c1F)Cc1ccccc1[N+](=O)[O-] ZINC000563648604 1028147685 /nfs/dbraw/zinc/14/76/85/1028147685.db2.gz FQOIBGNTQZRSBE-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccnc2ccccc12 ZINC000578470179 1028159602 /nfs/dbraw/zinc/15/96/02/1028159602.db2.gz SFFXZSMBHXMPAZ-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cc3cccnc3o2)C2CC2)cc1 ZINC000449009104 1028255273 /nfs/dbraw/zinc/25/52/73/1028255273.db2.gz GVTLAUFTFCJEPZ-UHFFFAOYSA-N 1 1 323.352 3.901 20 5 DHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC1CC1 ZINC000564742975 1028495560 /nfs/dbraw/zinc/49/55/60/1028495560.db2.gz ZCROVMACPXGXOR-UHFFFAOYSA-N 1 1 302.296 3.846 20 5 DHBDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000009902480 1028527805 /nfs/dbraw/zinc/52/78/05/1028527805.db2.gz YEZXUCPFOIDZIB-KRWDZBQOSA-N 1 1 312.369 3.941 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCSC[C@H]2C2CC2)c(Cl)c1 ZINC000449526711 1028756512 /nfs/dbraw/zinc/75/65/12/1028756512.db2.gz FEIMUJZPDKRNET-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC[C@H]2C2CC2)c(Cl)c1 ZINC000449526711 1028756518 /nfs/dbraw/zinc/75/65/18/1028756518.db2.gz FEIMUJZPDKRNET-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO COC[C@@H]1CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000449774921 1028987491 /nfs/dbraw/zinc/98/74/91/1028987491.db2.gz LMQAVODKMAROPG-UVQBRAAOSA-N 1 1 318.417 3.747 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CC(OC(C)(C)C)C1 ZINC000817287141 1029113654 /nfs/dbraw/zinc/11/36/54/1029113654.db2.gz KRWHALIBWBKRIT-UHFFFAOYSA-N 1 1 310.369 3.512 20 5 DHBDMO C[NH+](C)CC[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(C)C ZINC000569941399 1029288509 /nfs/dbraw/zinc/28/85/09/1029288509.db2.gz OLYOXWWGQTXGPW-NVXWUHKLSA-N 1 1 319.449 3.538 20 5 DHBDMO CN(C)CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(C)C ZINC000569941399 1029288517 /nfs/dbraw/zinc/28/85/17/1029288517.db2.gz OLYOXWWGQTXGPW-NVXWUHKLSA-N 1 1 319.449 3.538 20 5 DHBDMO CC(=O)c1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000450503272 1029518477 /nfs/dbraw/zinc/51/84/77/1029518477.db2.gz UTNXHHYQCKGWEI-UHFFFAOYSA-N 1 1 324.380 3.962 20 5 DHBDMO CC(=O)c1cccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000450503272 1029518487 /nfs/dbraw/zinc/51/84/87/1029518487.db2.gz UTNXHHYQCKGWEI-UHFFFAOYSA-N 1 1 324.380 3.962 20 5 DHBDMO CCC[N@H+]1CC[C@@H](CNc2cc(Cl)c(F)cc2[N+](=O)[O-])C1 ZINC000820633204 1029749733 /nfs/dbraw/zinc/74/97/33/1029749733.db2.gz ABJRXGVBARNZGC-JTQLQIEISA-N 1 1 315.776 3.531 20 5 DHBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000290421414 1030044845 /nfs/dbraw/zinc/04/48/45/1030044845.db2.gz KRPGBEQJNXKRHL-INIZCTEOSA-N 1 1 314.389 3.580 20 5 DHBDMO CCO[C@H]1C[C@@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C12CCC2 ZINC000357792860 1030192592 /nfs/dbraw/zinc/19/25/92/1030192592.db2.gz OJPYPDQCIMLTTA-CVEARBPZSA-N 1 1 322.380 3.513 20 5 DHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C12CCC2 ZINC000357792860 1030192598 /nfs/dbraw/zinc/19/25/98/1030192598.db2.gz OJPYPDQCIMLTTA-CVEARBPZSA-N 1 1 322.380 3.513 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCCc2c(Cl)ccnc21 ZINC000925311238 1030341381 /nfs/dbraw/zinc/34/13/81/1030341381.db2.gz RKISOMINBPQLLK-CQSZACIVSA-N 1 1 317.776 3.810 20 5 DHBDMO Cc1ccc(C[NH2+][C@H]2CCCc3scnc32)cc1[N+](=O)[O-] ZINC000866540211 1030359155 /nfs/dbraw/zinc/35/91/55/1030359155.db2.gz LAYCMSKFZVAXNM-LBPRGKRZSA-N 1 1 303.387 3.527 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000866581958 1030386753 /nfs/dbraw/zinc/38/67/53/1030386753.db2.gz FSVRMSWERXEPSO-BFHYXJOUSA-N 1 1 306.431 3.649 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccnn1C1CCC1 ZINC000925692536 1030455449 /nfs/dbraw/zinc/45/54/49/1030455449.db2.gz MGHITRXAPBIGHB-QWHCGFSZSA-N 1 1 314.389 3.928 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccnn1C1CCC1 ZINC000925692534 1030455877 /nfs/dbraw/zinc/45/58/77/1030455877.db2.gz MGHITRXAPBIGHB-CHWSQXEVSA-N 1 1 314.389 3.928 20 5 DHBDMO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1CCOC(C)(C)C1 ZINC000291575529 1030555849 /nfs/dbraw/zinc/55/58/49/1030555849.db2.gz OGLMWLZOPCUETN-OAHLLOKOSA-N 1 1 306.406 3.683 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000558509500 1030612595 /nfs/dbraw/zinc/61/25/95/1030612595.db2.gz VFCMWWZSFHJWGS-GJZGRUSLSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000558509500 1030612597 /nfs/dbraw/zinc/61/25/97/1030612597.db2.gz VFCMWWZSFHJWGS-GJZGRUSLSA-N 1 1 307.438 3.674 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(C2CC2)cc1F ZINC000291778472 1030639453 /nfs/dbraw/zinc/63/94/53/1030639453.db2.gz UOMLMMUGNQQPAB-UHFFFAOYSA-N 1 1 300.333 3.901 20 5 DHBDMO Cc1cc(C)c([N+](=O)[O-])c(NCCCC[N@@H+]2CCCC[C@H]2C)n1 ZINC000359085734 1030770234 /nfs/dbraw/zinc/77/02/34/1030770234.db2.gz UBJSXXJLPOPMDE-OAHLLOKOSA-N 1 1 320.437 3.673 20 5 DHBDMO COc1ccc(C[N@H+]2CC[C@]3(CC[C@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000359292243 1030892198 /nfs/dbraw/zinc/89/21/98/1030892198.db2.gz DPBFHBJDNSHZFQ-GUYCJALGSA-N 1 1 304.390 3.616 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000844406885 1031123766 /nfs/dbraw/zinc/12/37/66/1031123766.db2.gz DLBLXOZTSWAKNL-UHFFFAOYSA-N 1 1 316.735 3.869 20 5 DHBDMO CC[C@@H](NCC[N@@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000359927192 1031199648 /nfs/dbraw/zinc/19/96/48/1031199648.db2.gz UPWRNUVFJUFGDL-WMLDXEAASA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@@H](NCC[N@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000359927192 1031199658 /nfs/dbraw/zinc/19/96/58/1031199658.db2.gz UPWRNUVFJUFGDL-WMLDXEAASA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@H](NC[C@@H](CC)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000360054399 1031259209 /nfs/dbraw/zinc/25/92/09/1031259209.db2.gz MRUBUMADUMXVDI-AEFFLSMTSA-N 1 1 319.449 3.900 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc(O)c1F)c1cccc([N+](=O)[O-])c1 ZINC000872026394 1031410809 /nfs/dbraw/zinc/41/08/09/1031410809.db2.gz AFBIEDWZXJOGIM-MNOVXSKESA-N 1 1 304.321 3.851 20 5 DHBDMO C[C@@H]([NH2+]Cc1cccc(N(C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872031730 1031416836 /nfs/dbraw/zinc/41/68/36/1031416836.db2.gz LXWXZBCSTDSCIN-GFCCVEGCSA-N 1 1 317.364 3.651 20 5 DHBDMO CC[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccncc1 ZINC000872038551 1031421579 /nfs/dbraw/zinc/42/15/79/1031421579.db2.gz MLSUTOHBZBJBLH-SMDDNHRTSA-N 1 1 303.337 3.931 20 5 DHBDMO CC[NH+]1CCC(CCN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872039717 1031424150 /nfs/dbraw/zinc/42/41/50/1031424150.db2.gz UTFCDWWYDUVPNI-ZDUSSCGKSA-N 1 1 323.412 3.507 20 5 DHBDMO C[C@H]([NH2+][C@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872039563 1031424214 /nfs/dbraw/zinc/42/42/14/1031424214.db2.gz SYEPIEZXZHWAGX-SWLSCSKDSA-N 1 1 318.348 3.508 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCCc2ccncc2)C2CC2)c1 ZINC000360456290 1031436422 /nfs/dbraw/zinc/43/64/22/1031436422.db2.gz RCLRMEDXXXWPED-UHFFFAOYSA-N 1 1 311.385 3.587 20 5 DHBDMO COc1ccc([C@@H](C)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000537206324 1031530300 /nfs/dbraw/zinc/53/03/00/1031530300.db2.gz IHTRMIMXFFGXRD-AWEZNQCLSA-N 1 1 314.385 3.839 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000872260301 1031564205 /nfs/dbraw/zinc/56/42/05/1031564205.db2.gz UAFTXLXQVYBGPA-QGZVFWFLSA-N 1 1 318.417 3.827 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293837438 1031648509 /nfs/dbraw/zinc/64/85/09/1031648509.db2.gz SRMALUSVPCFEDP-NXEZZACHSA-N 1 1 321.327 3.867 20 5 DHBDMO CCc1cnc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)s1 ZINC000873063910 1031702225 /nfs/dbraw/zinc/70/22/25/1031702225.db2.gz IYPROJAHMUXOQU-UHFFFAOYSA-N 1 1 305.403 3.520 20 5 DHBDMO CC(C)c1ccc(C[N@H+](C(C)C)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000361080793 1031715610 /nfs/dbraw/zinc/71/56/10/1031715610.db2.gz MCJNBPSTCIVIFD-OAHLLOKOSA-N 1 1 306.406 3.718 20 5 DHBDMO C[C@@H]([N@@H+](C)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C(C)(C)C ZINC000777955821 1032043865 /nfs/dbraw/zinc/04/38/65/1032043865.db2.gz YSFHCUIWMZBSNW-CYBMUJFWSA-N 1 1 316.405 3.782 20 5 DHBDMO CC[C@]1(C)CC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963094 1032057408 /nfs/dbraw/zinc/05/74/08/1032057408.db2.gz GSAIIUGSVOIHLN-QGZVFWFLSA-N 1 1 314.389 3.538 20 5 DHBDMO COc1ccc(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC000539260290 1033312105 /nfs/dbraw/zinc/31/21/05/1033312105.db2.gz VLNFKFBDUZIYJK-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO C[C@@]1(CF)CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172906704 1033438314 /nfs/dbraw/zinc/43/83/14/1033438314.db2.gz YAYJPEFNKBWDMG-RDJZCZTQSA-N 1 1 306.381 3.524 20 5 DHBDMO C[C@@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H](C)C1 ZINC001172914830 1033464990 /nfs/dbraw/zinc/46/49/90/1033464990.db2.gz JOCQUUTUIOCQJG-KEYYUXOJSA-N 1 1 302.418 3.963 20 5 DHBDMO C[C@H]1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C2(CC2)C1 ZINC001172918754 1033466238 /nfs/dbraw/zinc/46/62/38/1033466238.db2.gz CGCMWBQZKUWBKF-CZUORRHYSA-N 1 1 300.402 3.717 20 5 DHBDMO CCCC[N@@H+](CC)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173186341 1033583591 /nfs/dbraw/zinc/58/35/91/1033583591.db2.gz REKJVGAIPGPVDC-LBPRGKRZSA-N 1 1 312.385 3.796 20 5 DHBDMO CC[C@H]1CCC[N@H+]1[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173188176 1033583809 /nfs/dbraw/zinc/58/38/09/1033583809.db2.gz CZNZDQTZAPZBDP-NEPJUHHUSA-N 1 1 310.369 3.548 20 5 DHBDMO CC[C@@H]1CCC[N@H+]1[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173188183 1033584597 /nfs/dbraw/zinc/58/45/97/1033584597.db2.gz CZNZDQTZAPZBDP-VXGBXAGGSA-N 1 1 310.369 3.548 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC[C@@H]2C)c1F ZINC001173187081 1033584725 /nfs/dbraw/zinc/58/47/25/1033584725.db2.gz WMFSSOCOHGGEHH-RYUDHWBXSA-N 1 1 310.369 3.548 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001173221293 1033600189 /nfs/dbraw/zinc/60/01/89/1033600189.db2.gz HPEOMKPKKLGRGG-BNOWGMLFSA-N 1 1 310.344 3.503 20 5 DHBDMO COc1cccc(C[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173226847 1033605902 /nfs/dbraw/zinc/60/59/02/1033605902.db2.gz LXGAWBVDJZBXAS-CQSZACIVSA-N 1 1 314.385 3.666 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccc(F)cc1 ZINC001173233719 1033608131 /nfs/dbraw/zinc/60/81/31/1033608131.db2.gz MNZVOQPHXHGOOE-AWEZNQCLSA-N 1 1 316.376 3.839 20 5 DHBDMO Cc1ccc2c(c1)CC[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173237756 1033648060 /nfs/dbraw/zinc/64/80/60/1033648060.db2.gz MBYFPMLLAVOJKS-HNNXBMFYSA-N 1 1 310.397 3.893 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H](c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000878614931 1033771110 /nfs/dbraw/zinc/77/11/10/1033771110.db2.gz SYWPMFJOLKMHMS-KRWDZBQOSA-N 1 1 311.385 3.678 20 5 DHBDMO CC[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000174499687 1033938078 /nfs/dbraw/zinc/93/80/78/1033938078.db2.gz OCARXUPSRNOHJP-OAHLLOKOSA-N 1 1 305.403 3.775 20 5 DHBDMO Cc1cncc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000879750549 1034114604 /nfs/dbraw/zinc/11/46/04/1034114604.db2.gz WWYPUXAWUIRRCL-MRXNPFEDSA-N 1 1 315.348 3.774 20 5 DHBDMO Cc1cncc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000879750549 1034114614 /nfs/dbraw/zinc/11/46/14/1034114614.db2.gz WWYPUXAWUIRRCL-MRXNPFEDSA-N 1 1 315.348 3.774 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc(F)cc(F)c1 ZINC000178729667 1034261904 /nfs/dbraw/zinc/26/19/04/1034261904.db2.gz WKXYPSUDBBWCLP-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@@H]2CCC(C)(C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000794683324 1034341563 /nfs/dbraw/zinc/34/15/63/1034341563.db2.gz DFXFKWCQWNXWHX-CQSZACIVSA-N 1 1 316.405 3.721 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H](C)[N@@H+]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000480622294 1034357123 /nfs/dbraw/zinc/35/71/23/1034357123.db2.gz GFSOJXMNKBBDFV-LZWOXQAQSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000480622294 1034357139 /nfs/dbraw/zinc/35/71/39/1034357139.db2.gz GFSOJXMNKBBDFV-LZWOXQAQSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000480658307 1034379898 /nfs/dbraw/zinc/37/98/98/1034379898.db2.gz AWQRZOPEQBDETG-HOTGVXAUSA-N 1 1 319.449 3.818 20 5 DHBDMO C[C@H]([NH2+]C[C@H](C1CCCCC1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000480693189 1034404257 /nfs/dbraw/zinc/40/42/57/1034404257.db2.gz JSSHHIMPOABZKA-KBXCAEBGSA-N 1 1 319.449 3.756 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1nc(C)cs1 ZINC000184390696 1034470285 /nfs/dbraw/zinc/47/02/85/1034470285.db2.gz QAWCVJUZCZFXMI-CYBMUJFWSA-N 1 1 305.403 3.909 20 5 DHBDMO CCc1ccc([C@H](COC)[NH2+]Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000184827413 1034503350 /nfs/dbraw/zinc/50/33/50/1034503350.db2.gz UIMZBCSMHQNZLX-HNNXBMFYSA-N 1 1 318.373 3.536 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCCC4(CC4)C3)co2)cc1 ZINC000186989903 1034677966 /nfs/dbraw/zinc/67/79/66/1034677966.db2.gz VTKNNKVVAYZSPU-UHFFFAOYSA-N 1 1 313.357 3.626 20 5 DHBDMO C[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000600182361 1034795203 /nfs/dbraw/zinc/79/52/03/1034795203.db2.gz AYHUZLRCEVORHQ-BXLSQVKPSA-N 1 1 310.344 3.831 20 5 DHBDMO CCc1cnc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000192910938 1034822340 /nfs/dbraw/zinc/82/23/40/1034822340.db2.gz JUUOHGLTJIXFJJ-HNNXBMFYSA-N 1 1 317.414 3.781 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c(F)c1 ZINC000555582987 1034825863 /nfs/dbraw/zinc/82/58/63/1034825863.db2.gz KIJYUUBLXYIBPA-LBPRGKRZSA-N 1 1 318.323 3.863 20 5 DHBDMO CC(C)CC[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159421116 1035051662 /nfs/dbraw/zinc/05/16/62/1035051662.db2.gz IFCOGJJLSBNEAW-UHFFFAOYSA-N 1 1 315.211 3.835 20 5 DHBDMO C[C@@]1(c2ccc(F)cc2)CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000482560057 1035135489 /nfs/dbraw/zinc/13/54/89/1035135489.db2.gz SVIQJHLVCRXFRE-MRXNPFEDSA-N 1 1 320.389 3.959 20 5 DHBDMO C[C@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)(C)C ZINC001175984642 1035173779 /nfs/dbraw/zinc/17/37/79/1035173779.db2.gz WTNJTRNCSBPBFW-LLVKDONJSA-N 1 1 309.366 3.617 20 5 DHBDMO CC[C@@H](C)C[N@@H+](CC)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000482893023 1035193400 /nfs/dbraw/zinc/19/34/00/1035193400.db2.gz RBZBHAAHWSTVIY-CYBMUJFWSA-N 1 1 321.421 3.600 20 5 DHBDMO CCC(CC)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])CC(C)C ZINC000482883033 1035194098 /nfs/dbraw/zinc/19/40/98/1035194098.db2.gz CDMXACXIWDQPNW-UHFFFAOYSA-N 1 1 321.421 3.680 20 5 DHBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@H]2CC(C)C)c1[N+](=O)[O-] ZINC001180091457 1035575590 /nfs/dbraw/zinc/57/55/90/1035575590.db2.gz BLWLTARTDVJSEJ-AWEZNQCLSA-N 1 1 322.405 3.710 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2nc(C)cs2)cc1[N+](=O)[O-] ZINC000152759544 1035684230 /nfs/dbraw/zinc/68/42/30/1035684230.db2.gz STWYBPOJJGNLRS-NSHDSACASA-N 1 1 321.402 3.609 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000535553041 1035688193 /nfs/dbraw/zinc/68/81/93/1035688193.db2.gz GIKNKLPDFYBBMY-AWEZNQCLSA-N 1 1 313.401 3.854 20 5 DHBDMO Cc1ccc(C(C)(C)[NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])cn1 ZINC000494644607 1035757124 /nfs/dbraw/zinc/75/71/24/1035757124.db2.gz CVEIYJBDUDIPMI-UHFFFAOYSA-N 1 1 319.792 3.977 20 5 DHBDMO CC(C)C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1 ZINC000089885642 1035757574 /nfs/dbraw/zinc/75/75/74/1035757574.db2.gz VQEZDUCGIYXHSC-UHFFFAOYSA-N 1 1 315.373 3.870 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089883470 1035764923 /nfs/dbraw/zinc/76/49/23/1035764923.db2.gz XFDCSVSPKCCGLV-BETUJISGSA-N 1 1 315.373 3.728 20 5 DHBDMO C[C@@H]1CSCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000539841153 1035896795 /nfs/dbraw/zinc/89/67/95/1035896795.db2.gz RHVHFHMJWCJAGU-GFCCVEGCSA-N 1 1 318.398 3.792 20 5 DHBDMO C[C@H]1CSCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000539840672 1035904379 /nfs/dbraw/zinc/90/43/79/1035904379.db2.gz JLKXAHKTFVWNMA-LBPRGKRZSA-N 1 1 318.398 3.792 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000485749620 1035937103 /nfs/dbraw/zinc/93/71/03/1035937103.db2.gz YXBGRVDETRPPSB-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO C[C@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC001195010970 1036106490 /nfs/dbraw/zinc/10/64/90/1036106490.db2.gz BJAAIMRSMWQSCU-GFCCVEGCSA-N 1 1 320.339 3.936 20 5 DHBDMO CSc1ccccc1C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000540966080 1036206823 /nfs/dbraw/zinc/20/68/23/1036206823.db2.gz TZJMRNQIZCHMQX-UHFFFAOYSA-N 1 1 314.410 3.875 20 5 DHBDMO CSc1ccccc1C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000540966080 1036206845 /nfs/dbraw/zinc/20/68/45/1036206845.db2.gz TZJMRNQIZCHMQX-UHFFFAOYSA-N 1 1 314.410 3.875 20 5 DHBDMO CC[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC000541073124 1036232086 /nfs/dbraw/zinc/23/20/86/1036232086.db2.gz NRWNAVDEYGHPHN-LBPRGKRZSA-N 1 1 300.811 3.576 20 5 DHBDMO CC[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC000541073124 1036232094 /nfs/dbraw/zinc/23/20/94/1036232094.db2.gz NRWNAVDEYGHPHN-LBPRGKRZSA-N 1 1 300.811 3.576 20 5 DHBDMO Cc1cc(N2CCC(C[N@H+](C)C(C)C)CC2)c([N+](=O)[O-])s1 ZINC000596086564 1036533521 /nfs/dbraw/zinc/53/35/21/1036533521.db2.gz RJGNTMNMDKXUBQ-UHFFFAOYSA-N 1 1 311.451 3.521 20 5 DHBDMO CC(C)[C@H]1CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636541 1036601263 /nfs/dbraw/zinc/60/12/63/1036601263.db2.gz VGWWANJSYGJETO-CQSZACIVSA-N 1 1 322.796 3.676 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000174998910 1036907673 /nfs/dbraw/zinc/90/76/73/1036907673.db2.gz TXFGFTHEJKJVSM-MRXNPFEDSA-N 1 1 316.332 3.520 20 5 DHBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1c(F)cccc1[N+](=O)[O-] ZINC001184999294 1036998863 /nfs/dbraw/zinc/99/88/63/1036998863.db2.gz VZXBXZWVUJCIAW-XQQFMLRXSA-N 1 1 309.385 3.512 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000775847276 1037014437 /nfs/dbraw/zinc/01/44/37/1037014437.db2.gz AKCZRKVXFJWOBD-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000775847276 1037014460 /nfs/dbraw/zinc/01/44/60/1037014460.db2.gz AKCZRKVXFJWOBD-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO CC(C)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCCC1 ZINC000774840353 1037065010 /nfs/dbraw/zinc/06/50/10/1037065010.db2.gz QGLCZYQMHRRHSW-UHFFFAOYSA-N 1 1 321.377 3.904 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@H](C(C)(C)C)CC1 ZINC001198800931 1037137635 /nfs/dbraw/zinc/13/76/35/1037137635.db2.gz NNWMITOICIVDKM-CJNGLKHVSA-N 1 1 306.406 3.793 20 5 DHBDMO Cc1cc(N(C)CCC[N@@H+](C)Cc2ccco2)c([N+](=O)[O-])s1 ZINC001186381952 1037397882 /nfs/dbraw/zinc/39/78/82/1037397882.db2.gz ZCZPGSUNTWSUJX-UHFFFAOYSA-N 1 1 323.418 3.516 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)cc1 ZINC000609234549 1037462087 /nfs/dbraw/zinc/46/20/87/1037462087.db2.gz URXXKOBTEJKUKB-GOSISDBHSA-N 1 1 312.369 3.558 20 5 DHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)C1 ZINC000775052446 1037500113 /nfs/dbraw/zinc/50/01/13/1037500113.db2.gz DHJRFZABHSYDCG-WBMJQRKESA-N 1 1 319.361 3.515 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCc2ccccc21 ZINC000029484802 1037756490 /nfs/dbraw/zinc/75/64/90/1037756490.db2.gz DCLLTOAOYSJMPY-KRWDZBQOSA-N 1 1 312.369 3.723 20 5 DHBDMO CCOc1ncccc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000151196103 1037767949 /nfs/dbraw/zinc/76/79/49/1037767949.db2.gz QJVSGFSFPYAFJW-ZDUSSCGKSA-N 1 1 315.373 3.548 20 5 DHBDMO C[C@@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000491181846 1037925050 /nfs/dbraw/zinc/92/50/50/1037925050.db2.gz GUBKOXJQZFMANP-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO CCC1(CC)[C@@H](OC)C[C@@H]1[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001191743972 1038541120 /nfs/dbraw/zinc/54/11/20/1038541120.db2.gz XSWAZFNWUIJSAQ-HOTGVXAUSA-N 1 1 306.406 3.620 20 5 DHBDMO CCC1(CC)[C@H](OC)C[C@H]1[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001191743973 1038541994 /nfs/dbraw/zinc/54/19/94/1038541994.db2.gz XSWAZFNWUIJSAQ-HZPDHXFCSA-N 1 1 306.406 3.620 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC(C)(C)[C@@H]2CCC[C@@H]21 ZINC000590203759 1038604245 /nfs/dbraw/zinc/60/42/45/1038604245.db2.gz ZCOTXRDAFDVAOK-CABCVRRESA-N 1 1 304.390 3.614 20 5 DHBDMO Cc1ccnc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000590757597 1038699494 /nfs/dbraw/zinc/69/94/94/1038699494.db2.gz BODZMGWSENSQID-MRXNPFEDSA-N 1 1 311.385 3.678 20 5 DHBDMO C[N@@H+](CCCNc1ccc(F)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000057877785 1038759949 /nfs/dbraw/zinc/75/99/49/1038759949.db2.gz CYQLKVPQFPWGFN-UHFFFAOYSA-N 1 1 317.364 3.668 20 5 DHBDMO C[C@@H](NCC[N@@H+](C)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000157451400 1038980548 /nfs/dbraw/zinc/98/05/48/1038980548.db2.gz YCEYDOFNNLHWJY-CQSZACIVSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@@H]([NH2+]CCN(C)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000157451400 1038980560 /nfs/dbraw/zinc/98/05/60/1038980560.db2.gz YCEYDOFNNLHWJY-CQSZACIVSA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@H](NC[C@@H]1CCCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068650 1039024466 /nfs/dbraw/zinc/02/44/66/1039024466.db2.gz BLMKLBMPQPQHJZ-YJBOKZPZSA-N 1 1 319.449 3.758 20 5 DHBDMO CCC[C@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068650 1039024487 /nfs/dbraw/zinc/02/44/87/1039024487.db2.gz BLMKLBMPQPQHJZ-YJBOKZPZSA-N 1 1 319.449 3.758 20 5 DHBDMO CCC[C@@H](NC[C@H]1CCCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068647 1039025599 /nfs/dbraw/zinc/02/55/99/1039025599.db2.gz BLMKLBMPQPQHJZ-CRAIPNDOSA-N 1 1 319.449 3.758 20 5 DHBDMO CCC[C@@H](NC[C@H]1CCCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068647 1039025615 /nfs/dbraw/zinc/02/56/15/1039025615.db2.gz BLMKLBMPQPQHJZ-CRAIPNDOSA-N 1 1 319.449 3.758 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H]2CC[N@@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000599074722 1039030795 /nfs/dbraw/zinc/03/07/95/1039030795.db2.gz VULMAWYWUKUFDO-HOCLYGCPSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H]2CC[N@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000599074722 1039030813 /nfs/dbraw/zinc/03/08/13/1039030813.db2.gz VULMAWYWUKUFDO-HOCLYGCPSA-N 1 1 317.433 3.571 20 5 DHBDMO C[C@@H](CCO)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000593693653 1039080362 /nfs/dbraw/zinc/08/03/62/1039080362.db2.gz AXUSTPRUVQBVRQ-LBPRGKRZSA-N 1 1 320.414 3.526 20 5 DHBDMO C[C@@H]1CC2(C[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-])CCOCC2 ZINC000592181475 1039162066 /nfs/dbraw/zinc/16/20/66/1039162066.db2.gz FBTDLLQEEODISR-GFCCVEGCSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@H]1CC2(C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl)CCOCC2 ZINC000592185089 1039172087 /nfs/dbraw/zinc/17/20/87/1039172087.db2.gz VICSQABDIPXDDF-LBPRGKRZSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCCC[C@@H]3C3CCC3)nc2c1 ZINC000592197411 1039182186 /nfs/dbraw/zinc/18/21/86/1039182186.db2.gz CBSNUROMCMRDDG-MRXNPFEDSA-N 1 1 314.389 3.626 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cc2n(n1)CCCC2 ZINC000592386863 1039184384 /nfs/dbraw/zinc/18/43/84/1039184384.db2.gz KXUAUQIEOHLSQT-STQMWFEESA-N 1 1 314.389 3.539 20 5 DHBDMO C[C@@H](c1ccccc1F)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603855083 1039189694 /nfs/dbraw/zinc/18/96/94/1039189694.db2.gz AYOSFFFIIFWSHB-ZDUSSCGKSA-N 1 1 318.348 3.806 20 5 DHBDMO O=[N+]([O-])c1ccccc1N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000603932246 1039227397 /nfs/dbraw/zinc/22/73/97/1039227397.db2.gz ZNVMXMQCUWXFSG-UHFFFAOYSA-N 1 1 317.433 3.687 20 5 DHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cccs1 ZINC000058563143 1039275323 /nfs/dbraw/zinc/27/53/23/1039275323.db2.gz CCQORTDZEOSGBQ-UHFFFAOYSA-N 1 1 306.387 3.557 20 5 DHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(Cl)cc1 ZINC000058575435 1039280771 /nfs/dbraw/zinc/28/07/71/1039280771.db2.gz DBPMXZPYDZZHNA-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCOc1ccccc1 ZINC000061759082 1039544594 /nfs/dbraw/zinc/54/45/94/1039544594.db2.gz VWVAVNJOIQXUKG-CQSZACIVSA-N 1 1 300.358 3.667 20 5 DHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000058932503 1039632472 /nfs/dbraw/zinc/63/24/72/1039632472.db2.gz SQCPZQAOGYXNPU-ZDUSSCGKSA-N 1 1 318.348 3.806 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594027743 1039955441 /nfs/dbraw/zinc/95/54/41/1039955441.db2.gz ZFXLKPYNJPRCOU-RHSMWYFYSA-N 1 1 318.417 3.998 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1cncc(F)c1 ZINC000595034631 1040042770 /nfs/dbraw/zinc/04/27/70/1040042770.db2.gz RDFBAKGVYKDJOZ-QWRGUYRKSA-N 1 1 319.336 3.549 20 5 DHBDMO C[C@@H](N[C@H]1CC[N@H+](C2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000595078771 1040073363 /nfs/dbraw/zinc/07/33/63/1040073363.db2.gz ATVWWVAOXSQJDT-ZBFHGGJFSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCN(C2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000595078771 1040073377 /nfs/dbraw/zinc/07/33/77/1040073377.db2.gz ATVWWVAOXSQJDT-ZBFHGGJFSA-N 1 1 317.433 3.652 20 5 DHBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000595288973 1040090182 /nfs/dbraw/zinc/09/01/82/1040090182.db2.gz CTTUMZNBQGIQSC-MRXNPFEDSA-N 1 1 300.333 3.853 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2CCC2CCCC2)c1[N+](=O)[O-] ZINC000595352813 1040124993 /nfs/dbraw/zinc/12/49/93/1040124993.db2.gz OLJDIXLKNRHEOB-AWEZNQCLSA-N 1 1 307.394 3.826 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](c2ccccc2)C2CCC2)c1[N+](=O)[O-] ZINC000595370101 1040128399 /nfs/dbraw/zinc/12/83/99/1040128399.db2.gz USUCNBXEBRHFAV-HNNXBMFYSA-N 1 1 301.346 3.522 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(c2ccccn2)CC1 ZINC000595387233 1040131646 /nfs/dbraw/zinc/13/16/46/1040131646.db2.gz CCABOHDRYUUJJC-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])cc2F)c1 ZINC000063247970 1040166634 /nfs/dbraw/zinc/16/66/34/1040166634.db2.gz CYKXYIKUZGIMSC-UHFFFAOYSA-N 1 1 317.364 3.798 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2ccco2)CC1 ZINC000595618992 1040191854 /nfs/dbraw/zinc/19/18/54/1040191854.db2.gz XUNBMDADIMLZGZ-UHFFFAOYSA-N 1 1 316.357 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H]3CCCCO3)CC2)c(F)c1 ZINC000595791153 1040258409 /nfs/dbraw/zinc/25/84/09/1040258409.db2.gz ZUIHFKLVNHEIEY-QGZVFWFLSA-N 1 1 322.380 3.515 20 5 DHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)C[C@H](O)c1ccc(C)cc1 ZINC000174282079 1040605838 /nfs/dbraw/zinc/60/58/38/1040605838.db2.gz ZLMLUGJDDWUHNB-HNNXBMFYSA-N 1 1 320.414 3.520 20 5 DHBDMO CC[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@H](O)c1ccc(C)cc1 ZINC000174282079 1040605846 /nfs/dbraw/zinc/60/58/46/1040605846.db2.gz ZLMLUGJDDWUHNB-HNNXBMFYSA-N 1 1 320.414 3.520 20 5 DHBDMO C[C@H](C[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000608976679 1040656098 /nfs/dbraw/zinc/65/60/98/1040656098.db2.gz GTCGJGGUXCGQFW-OAHLLOKOSA-N 1 1 314.385 3.709 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H]4C[C@H]4C3)cs2)c1 ZINC000597223593 1040703877 /nfs/dbraw/zinc/70/38/77/1040703877.db2.gz QOGXIMOKEQPCPS-AAEUAGOBSA-N 1 1 315.398 3.560 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(Cc3nccs3)CC2)cs1 ZINC000602735208 1041188050 /nfs/dbraw/zinc/18/80/50/1041188050.db2.gz SZHOHFWZQAZCKM-UHFFFAOYSA-N 1 1 323.443 3.568 20 5 DHBDMO CCC[C@@H]([NH2+][C@@H](C)Cc1cc(C)[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000090527796 185300571 /nfs/dbraw/zinc/30/05/71/185300571.db2.gz FMOIEZSJIFVZGK-YVEFUNNKSA-N 1 1 316.405 3.688 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000022745655 182332450 /nfs/dbraw/zinc/33/24/50/182332450.db2.gz QBOKKMOAFDYLBJ-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO COCC[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000272389136 130025990 /nfs/dbraw/zinc/02/59/90/130025990.db2.gz CMQBMQGRQHWJGJ-JSGCOSHPSA-N 1 1 304.346 3.616 20 5 DHBDMO COCC[C@@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccco1 ZINC000272592204 130045507 /nfs/dbraw/zinc/04/55/07/130045507.db2.gz RBNSKBRSCKNXCH-CYBMUJFWSA-N 1 1 324.764 3.709 20 5 DHBDMO C[C@H](C[N@@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000273109167 130090307 /nfs/dbraw/zinc/09/03/07/130090307.db2.gz XBXPNBSADARDOF-VXGBXAGGSA-N 1 1 305.403 3.848 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3c2cccc3O)c(Cl)c1 ZINC000273147682 130093594 /nfs/dbraw/zinc/09/35/94/130093594.db2.gz WXQKWSZJDCHCEG-HNNXBMFYSA-N 1 1 318.760 3.731 20 5 DHBDMO CC[C@H](Nc1cc(CCOC)cc[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000287340764 131275360 /nfs/dbraw/zinc/27/53/60/131275360.db2.gz GJHAQFSEBDBXKD-INIZCTEOSA-N 1 1 315.373 3.742 20 5 DHBDMO Cc1csc(C2([NH2+]Cc3cccc([N+](=O)[O-])c3)CCC2)n1 ZINC000299663856 132114932 /nfs/dbraw/zinc/11/49/32/132114932.db2.gz YFMUMQPNWQVWLA-UHFFFAOYSA-N 1 1 303.387 3.529 20 5 DHBDMO Cc1cn2cc(Nc3nc4ccccc4cc3[N+](=O)[O-])ccc2[nH+]1 ZINC000473518262 435142006 /nfs/dbraw/zinc/14/20/06/435142006.db2.gz DLGTYZJLPSFWLX-UHFFFAOYSA-N 1 1 319.324 3.843 20 5 DHBDMO Cc1ccc(C[N@H+]2CC[C@@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000092757837 332167711 /nfs/dbraw/zinc/16/77/11/332167711.db2.gz ISDVLPZKHWQXQE-QGZVFWFLSA-N 1 1 311.385 3.590 20 5 DHBDMO Cc1ccc(C[N@H+]2CC[C@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000092757835 332167922 /nfs/dbraw/zinc/16/79/22/332167922.db2.gz ISDVLPZKHWQXQE-KRWDZBQOSA-N 1 1 311.385 3.590 20 5 DHBDMO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000449463612 332237606 /nfs/dbraw/zinc/23/76/06/332237606.db2.gz WPTHBRPZDZPNJA-CMPLNLGQSA-N 1 1 302.296 3.758 20 5 DHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000179620684 333153332 /nfs/dbraw/zinc/15/33/32/333153332.db2.gz NHCMERRFYKODEW-GFCCVEGCSA-N 1 1 302.296 3.678 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000179620684 333153334 /nfs/dbraw/zinc/15/33/34/333153334.db2.gz NHCMERRFYKODEW-GFCCVEGCSA-N 1 1 302.296 3.678 20 5 DHBDMO Cc1cc(NC[C@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000390600010 333304847 /nfs/dbraw/zinc/30/48/47/333304847.db2.gz ZZJRQFUSKLULFI-HNNXBMFYSA-N 1 1 313.401 3.836 20 5 DHBDMO COc1ccc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000525787623 333313703 /nfs/dbraw/zinc/31/37/03/333313703.db2.gz FUWIRZNOSSYMKD-VHDGCEQUSA-N 1 1 304.390 3.756 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCSC2(CCCCC2)C1 ZINC000531191019 333329817 /nfs/dbraw/zinc/32/98/17/333329817.db2.gz HLNZCGBVCZKCTA-UHFFFAOYSA-N 1 1 306.431 3.847 20 5 DHBDMO COc1ccc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000531378412 333347442 /nfs/dbraw/zinc/34/74/42/333347442.db2.gz ITQGUHQGJULZMN-UGSOOPFHSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1ccc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000531378412 333347443 /nfs/dbraw/zinc/34/74/43/333347443.db2.gz ITQGUHQGJULZMN-UGSOOPFHSA-N 1 1 312.369 3.796 20 5 DHBDMO O=[N+]([O-])c1ccccc1CN(Cc1ccc2nc[nH]c2c1)C1CC1 ZINC000535072487 334364436 /nfs/dbraw/zinc/36/44/36/334364436.db2.gz OCFOTJJYEMDQGO-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc2[nH]cnc2c1)C1CC1 ZINC000535072487 334364438 /nfs/dbraw/zinc/36/44/38/334364438.db2.gz OCFOTJJYEMDQGO-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc2[nH]cnc2c1)C1CC1 ZINC000535072487 334364440 /nfs/dbraw/zinc/36/44/40/334364440.db2.gz OCFOTJJYEMDQGO-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc2nc[nH]c2c1)C1CC1 ZINC000535072487 334364441 /nfs/dbraw/zinc/36/44/41/334364441.db2.gz OCFOTJJYEMDQGO-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc2nc[nH]c2c1)C1CC1 ZINC000535072487 334364443 /nfs/dbraw/zinc/36/44/43/334364443.db2.gz OCFOTJJYEMDQGO-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO CCc1ncc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000341563098 334452714 /nfs/dbraw/zinc/45/27/14/334452714.db2.gz UHTASRCTFWLLFX-UHFFFAOYSA-N 1 1 311.794 3.557 20 5 DHBDMO COc1cccc(Cl)c1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000188282165 334670912 /nfs/dbraw/zinc/67/09/12/334670912.db2.gz LXYGUHKGPCFFAR-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H]3C3CC3)co2)cc1 ZINC000366893982 335314921 /nfs/dbraw/zinc/31/49/21/335314921.db2.gz DFHXPHMSGGIQBO-INIZCTEOSA-N 1 1 313.357 3.624 20 5 DHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1ccc([N+](=O)[O-])cc1 ZINC000350737999 335778567 /nfs/dbraw/zinc/77/85/67/335778567.db2.gz SMDJWXFSOPZSMW-UHFFFAOYSA-N 1 1 308.341 3.701 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cc(O)cc(F)c1 ZINC000352002314 336188034 /nfs/dbraw/zinc/18/80/34/336188034.db2.gz KQGUITWISUEYGR-UHFFFAOYSA-N 1 1 318.348 3.850 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)on1 ZINC000352088175 336194082 /nfs/dbraw/zinc/19/40/82/336194082.db2.gz WJWGHWMZOGYWMR-AWEZNQCLSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)on1 ZINC000352088175 336194083 /nfs/dbraw/zinc/19/40/83/336194083.db2.gz WJWGHWMZOGYWMR-AWEZNQCLSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1ccc(N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302035170 336344560 /nfs/dbraw/zinc/34/45/60/336344560.db2.gz FFXSQYVNENUEST-GJZGRUSLSA-N 1 1 317.433 3.968 20 5 DHBDMO C[C@@H](Nc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302049794 336345552 /nfs/dbraw/zinc/34/55/52/336345552.db2.gz NFFKEHMOOAXYHN-ZIAGYGMSSA-N 1 1 303.406 3.660 20 5 DHBDMO C[C@H]([NH2+][C@@H]1c2cccc(F)c2O[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000370573373 336887830 /nfs/dbraw/zinc/88/78/30/336887830.db2.gz DHBGNHOVFFVBQM-USBNGQNGSA-N 1 1 316.332 3.907 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000375238531 337006421 /nfs/dbraw/zinc/00/64/21/337006421.db2.gz RIKMZOBGOGPGAT-LSDHHAIUSA-N 1 1 318.417 3.855 20 5 DHBDMO Cc1c[nH+]cn1C1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000376472148 337034238 /nfs/dbraw/zinc/03/42/38/337034238.db2.gz GTUHKKSUABUBBT-UHFFFAOYSA-N 1 1 320.780 3.595 20 5 DHBDMO Cc1ccnc(SCC[N@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000193744433 337079318 /nfs/dbraw/zinc/07/93/18/337079318.db2.gz UYLRKEOBHCWCCE-UHFFFAOYSA-N 1 1 317.414 3.522 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000174349388 337140935 /nfs/dbraw/zinc/14/09/35/337140935.db2.gz JKLRWVBRFQKMLR-NWDGAFQWSA-N 1 1 300.449 3.762 20 5 DHBDMO CC[C@H](NC[C@H](C)C[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000321477763 337270539 /nfs/dbraw/zinc/27/05/39/337270539.db2.gz ATJWBJSDEHGCGR-YJBOKZPZSA-N 1 1 319.449 3.758 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(OC2CCC2)CC1 ZINC000419291796 337478325 /nfs/dbraw/zinc/47/83/25/337478325.db2.gz XLHPYKQTFBTQFE-UHFFFAOYSA-N 1 1 324.808 3.782 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)c1ccccc1F ZINC000429276786 338075777 /nfs/dbraw/zinc/07/57/77/338075777.db2.gz XGLXVBDMZXGJJL-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@H](CSC)C2)ccc1[N+](=O)[O-] ZINC000429290431 338076446 /nfs/dbraw/zinc/07/64/46/338076446.db2.gz GAHRSZYXGAJRFN-AWEZNQCLSA-N 1 1 324.446 3.569 20 5 DHBDMO C[C@H]1CC[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000429583810 338085333 /nfs/dbraw/zinc/08/53/33/338085333.db2.gz BWBKOAWUTVGRNN-LRDDRELGSA-N 1 1 315.373 3.870 20 5 DHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430194303 338100557 /nfs/dbraw/zinc/10/05/57/338100557.db2.gz JANFDLOJAOSNNS-LBPRGKRZSA-N 1 1 312.435 3.567 20 5 DHBDMO C[N@@H+](CCSCc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000430741155 338112979 /nfs/dbraw/zinc/11/29/79/338112979.db2.gz LQSHGHNEXAIAQC-UHFFFAOYSA-N 1 1 316.426 3.960 20 5 DHBDMO CC[C@H](C)[N@@H+](C)CCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433173671 338184122 /nfs/dbraw/zinc/18/41/22/338184122.db2.gz HHFGUQJOBHWFIP-GUYCJALGSA-N 1 1 319.449 3.637 20 5 DHBDMO CC[C@H](C)N(C)CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433173671 338184123 /nfs/dbraw/zinc/18/41/23/338184123.db2.gz HHFGUQJOBHWFIP-GUYCJALGSA-N 1 1 319.449 3.637 20 5 DHBDMO CCC(CC)C[N@@H+](CC)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000435067275 338231550 /nfs/dbraw/zinc/23/15/50/338231550.db2.gz XXQNJUHNRVSMRU-UHFFFAOYSA-N 1 1 305.378 3.994 20 5 DHBDMO CC(C)N(C)c1ccccc1C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000438335424 338340010 /nfs/dbraw/zinc/34/00/10/338340010.db2.gz PUMXQXOMUMNQQH-UHFFFAOYSA-N 1 1 319.430 3.791 20 5 DHBDMO Cc1ccc(C[NH+]2CC(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000462824511 339092448 /nfs/dbraw/zinc/09/24/48/339092448.db2.gz CKAIMFCRPADNIU-UHFFFAOYSA-N 1 1 300.333 3.642 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000462829075 339092883 /nfs/dbraw/zinc/09/28/83/339092883.db2.gz WNACAJVHWHTYSW-GFCCVEGCSA-N 1 1 309.797 3.677 20 5 DHBDMO COc1cc(C[N@H+](C)Cc2ccccc2C)c([N+](=O)[O-])cc1F ZINC000463472508 339118983 /nfs/dbraw/zinc/11/89/83/339118983.db2.gz CMZAGBQFGHZTSH-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2C)c([N+](=O)[O-])cc1F ZINC000463472508 339118984 /nfs/dbraw/zinc/11/89/84/339118984.db2.gz CMZAGBQFGHZTSH-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCC2(CCCCC2)O1 ZINC000467200639 339228041 /nfs/dbraw/zinc/22/80/41/339228041.db2.gz JCRBNZYGSWMQLF-INIZCTEOSA-N 1 1 318.417 3.909 20 5 DHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCC2(CCCCC2)O1 ZINC000467200639 339228042 /nfs/dbraw/zinc/22/80/42/339228042.db2.gz JCRBNZYGSWMQLF-INIZCTEOSA-N 1 1 318.417 3.909 20 5 DHBDMO CC[C@H]1C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CCCO1 ZINC000467562022 339242896 /nfs/dbraw/zinc/24/28/96/339242896.db2.gz IQUDMJOZCVJNQM-HNNXBMFYSA-N 1 1 306.406 3.719 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000470009406 339308336 /nfs/dbraw/zinc/30/83/36/339308336.db2.gz PETQKSPCIHTQLG-GFCCVEGCSA-N 1 1 302.296 3.758 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCc2ncsc2C1 ZINC000470220240 339314549 /nfs/dbraw/zinc/31/45/49/339314549.db2.gz XJDDUNXHFXCIBS-GHXNOFRVSA-N 1 1 315.398 3.513 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2ncsc2C1 ZINC000470220240 339314550 /nfs/dbraw/zinc/31/45/50/339314550.db2.gz XJDDUNXHFXCIBS-GHXNOFRVSA-N 1 1 315.398 3.513 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)cc1 ZINC000503582678 340131730 /nfs/dbraw/zinc/13/17/30/340131730.db2.gz FEYXDHZJPIRLQU-CQSZACIVSA-N 1 1 300.333 3.723 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000506960246 340204310 /nfs/dbraw/zinc/20/43/10/340204310.db2.gz AXTYBWNYULQLII-GUTXKFCHSA-N 1 1 321.396 3.576 20 5 DHBDMO CC[C@@H]1C[C@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000507793631 340231663 /nfs/dbraw/zinc/23/16/63/340231663.db2.gz HURPCPBVKZMFJD-RHSMWYFYSA-N 1 1 318.417 3.764 20 5 DHBDMO CC[C@H](C)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000509359856 340267260 /nfs/dbraw/zinc/26/72/60/340267260.db2.gz SZYOFLQNQIJWHS-JTQLQIEISA-N 1 1 302.321 3.674 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(F)ccc1F ZINC000511060711 340319763 /nfs/dbraw/zinc/31/97/63/340319763.db2.gz VDUJUVBBKSTKCL-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000511353431 340325649 /nfs/dbraw/zinc/32/56/49/340325649.db2.gz ZDNPYYIHJXWKBP-LSDHHAIUSA-N 1 1 317.433 3.968 20 5 DHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1Cc2ccccc2C1 ZINC000511646391 340333680 /nfs/dbraw/zinc/33/36/80/340333680.db2.gz GRIYSBZKWASEAV-POHAHGRESA-N 1 1 308.381 3.707 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000511667952 340334603 /nfs/dbraw/zinc/33/46/03/340334603.db2.gz QNQBZYWJZWLLOI-OAHLLOKOSA-N 1 1 306.406 3.719 20 5 DHBDMO C[C@@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173422452 340364584 /nfs/dbraw/zinc/36/45/84/340364584.db2.gz RAYAIEHHMFUCFC-CJNGLKHVSA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1ccccc1O ZINC000543251263 341038426 /nfs/dbraw/zinc/03/84/26/341038426.db2.gz YWZVWEWRJPBTDN-CYBMUJFWSA-N 1 1 300.358 3.536 20 5 DHBDMO C[C@H]1CCC[C@H](CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000543481238 341046725 /nfs/dbraw/zinc/04/67/25/341046725.db2.gz SHHUHDRNERMLNJ-UONOGXRCSA-N 1 1 303.406 3.564 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCOC1 ZINC000132042188 341115391 /nfs/dbraw/zinc/11/53/91/341115391.db2.gz HUSSTTLGHIQWPS-CQSZACIVSA-N 1 1 318.398 3.544 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H]3C3CCCC3)nc2c1 ZINC000548508988 341264986 /nfs/dbraw/zinc/26/49/86/341264986.db2.gz QGSYOCCHTBUTOB-INIZCTEOSA-N 1 1 314.389 3.626 20 5 DHBDMO CCc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)nc1 ZINC000549366549 341292564 /nfs/dbraw/zinc/29/25/64/341292564.db2.gz NRIZXUXZYDNBAS-UHFFFAOYSA-N 1 1 313.401 3.963 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC1=Cc2ccccc2OC1 ZINC000549808083 341303655 /nfs/dbraw/zinc/30/36/55/341303655.db2.gz JDJZBJKTCSYTTE-UHFFFAOYSA-N 1 1 324.380 3.545 20 5 DHBDMO CC(C)C[N@H+]1CCC[C@H](CN[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246358731 341344978 /nfs/dbraw/zinc/34/49/78/341344978.db2.gz IGDCFXTZXPQTQP-HZPDHXFCSA-N 1 1 319.449 3.613 20 5 DHBDMO C[C@H](O)[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000567358544 341598395 /nfs/dbraw/zinc/59/83/95/341598395.db2.gz VQXBNQYIIHZNEL-NVGCLXPQSA-N 1 1 318.348 3.507 20 5 DHBDMO CCCO[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000266721542 520273817 /nfs/dbraw/zinc/27/38/17/520273817.db2.gz HOPOAESAKZLUNN-HUUCEWRRSA-N 1 1 306.406 3.937 20 5 DHBDMO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000130956719 523023869 /nfs/dbraw/zinc/02/38/69/523023869.db2.gz MLQCWVSWUATZOG-MRXNPFEDSA-N 1 1 316.357 3.671 20 5 DHBDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000130956719 523023873 /nfs/dbraw/zinc/02/38/73/523023873.db2.gz MLQCWVSWUATZOG-MRXNPFEDSA-N 1 1 316.357 3.671 20 5 DHBDMO C[C@@H](C1CC1)[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000158023438 524320368 /nfs/dbraw/zinc/32/03/68/524320368.db2.gz CWGFRQJVROWAKN-NSHDSACASA-N 1 1 317.414 3.949 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccncc2F)cc1[N+](=O)[O-] ZINC000338007981 525747001 /nfs/dbraw/zinc/74/70/01/525747001.db2.gz LDCWYGUUHWSZMP-VXGBXAGGSA-N 1 1 303.337 3.849 20 5 DHBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000130614148 526514449 /nfs/dbraw/zinc/51/44/49/526514449.db2.gz DIEJASUTKFAMPC-INIZCTEOSA-N 1 1 314.389 3.580 20 5 DHBDMO C[C@@H]1CCCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000725263791 563570277 /nfs/dbraw/zinc/57/02/77/563570277.db2.gz IQQMASWPRWGUCG-SNVBAGLBSA-N 1 1 313.195 3.732 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000725263791 563570278 /nfs/dbraw/zinc/57/02/78/563570278.db2.gz IQQMASWPRWGUCG-SNVBAGLBSA-N 1 1 313.195 3.732 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2[C@H]2CCCOC2)c(Cl)c1 ZINC000517736054 1013053291 /nfs/dbraw/zinc/05/32/91/1013053291.db2.gz FPRJVBYVXZNZBD-BBRMVZONSA-N 1 1 324.808 3.639 20 5 DHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(F)c1 ZINC000176984110 1013693637 /nfs/dbraw/zinc/69/36/37/1013693637.db2.gz SXQHGVYDKNOFKF-UHFFFAOYSA-N 1 1 315.304 3.507 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(F)c1 ZINC000176984110 1013693640 /nfs/dbraw/zinc/69/36/40/1013693640.db2.gz SXQHGVYDKNOFKF-UHFFFAOYSA-N 1 1 315.304 3.507 20 5 DHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccc(F)cc21 ZINC000177684035 1013977315 /nfs/dbraw/zinc/97/73/15/1013977315.db2.gz NIGMKMADMISVOH-KRWDZBQOSA-N 1 1 300.333 3.853 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccc(F)cc21 ZINC000177684035 1013977318 /nfs/dbraw/zinc/97/73/18/1013977318.db2.gz NIGMKMADMISVOH-KRWDZBQOSA-N 1 1 300.333 3.853 20 5 DHBDMO CC[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000083198531 1013992876 /nfs/dbraw/zinc/99/28/76/1013992876.db2.gz CPHOHQJSXOUOGW-GFCCVEGCSA-N 1 1 303.362 3.748 20 5 DHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083211617 1014001814 /nfs/dbraw/zinc/00/18/14/1014001814.db2.gz DAQCJAZQPZROGH-NWDGAFQWSA-N 1 1 303.362 3.747 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](C[C@H]2CCCO2)C2CCCC2)cc1 ZINC000441490068 1014259749 /nfs/dbraw/zinc/25/97/49/1014259749.db2.gz VOVNKAVASXRXKV-GOSISDBHSA-N 1 1 318.417 3.561 20 5 DHBDMO CC(C)c1ncc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000348667448 1014885973 /nfs/dbraw/zinc/88/59/73/1014885973.db2.gz CUMYAKBVUCLROR-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO COc1c(C)cccc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000895209478 1014942999 /nfs/dbraw/zinc/94/29/99/1014942999.db2.gz WACRISFXMWYBGE-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001173221460 1033602367 /nfs/dbraw/zinc/60/23/67/1033602367.db2.gz IPYVWLRVNVHDRA-SMDDNHRTSA-N 1 1 316.323 3.595 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001173221460 1033602374 /nfs/dbraw/zinc/60/23/74/1033602374.db2.gz IPYVWLRVNVHDRA-SMDDNHRTSA-N 1 1 316.323 3.595 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1C[C@H](O)c2ccccc21 ZINC000895369988 1015105129 /nfs/dbraw/zinc/10/51/29/1015105129.db2.gz ZCTQNDVCQGNXCO-HOCLYGCPSA-N 1 1 318.760 3.516 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH+]1CCC(F)CC1 ZINC000895545562 1015198686 /nfs/dbraw/zinc/19/86/86/1015198686.db2.gz GQQMRRBUXRCMNZ-UHFFFAOYSA-N 1 1 306.259 3.548 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)CCC2CCOCC2)cc1[N+](=O)[O-] ZINC000129661561 1015252481 /nfs/dbraw/zinc/25/24/81/1015252481.db2.gz ZTSCYKNHEGEGPD-UHFFFAOYSA-N 1 1 320.433 3.967 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581721 1015633233 /nfs/dbraw/zinc/63/32/33/1015633233.db2.gz FRWHYOIVWHMZJY-TYNCELHUSA-N 1 1 315.373 3.889 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)C1CCCCC1)C1CC1 ZINC000474969258 1015734596 /nfs/dbraw/zinc/73/45/96/1015734596.db2.gz BKHWICXEQBRWEC-GOSISDBHSA-N 1 1 318.417 3.500 20 5 DHBDMO Cc1ccc([C@H](C)NCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000610799333 1015844655 /nfs/dbraw/zinc/84/46/55/1015844655.db2.gz SICKPKWTOCKBQG-LZWOXQAQSA-N 1 1 319.449 3.532 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]CCN2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000610799333 1015844658 /nfs/dbraw/zinc/84/46/58/1015844658.db2.gz SICKPKWTOCKBQG-LZWOXQAQSA-N 1 1 319.449 3.532 20 5 DHBDMO C[C@H](c1ccccc1F)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000065535208 1016214865 /nfs/dbraw/zinc/21/48/65/1016214865.db2.gz UGIXQMRNGHUCIE-CYBMUJFWSA-N 1 1 318.348 3.806 20 5 DHBDMO CC(C)([NH2+]Cc1ccncc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000611402654 1016517249 /nfs/dbraw/zinc/51/72/49/1016517249.db2.gz HNLTZGBFWFCOFD-UHFFFAOYSA-N 1 1 305.765 3.668 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H]1CC[C@@H](C2CC2)O1)C1CC1 ZINC001168317348 1032229764 /nfs/dbraw/zinc/22/97/64/1032229764.db2.gz MYQKTLKZCWNHFW-AEFFLSMTSA-N 1 1 316.401 3.517 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H]1CC[C@@H](C2CC2)O1)C1CC1 ZINC001168317348 1032229778 /nfs/dbraw/zinc/22/97/78/1032229778.db2.gz MYQKTLKZCWNHFW-AEFFLSMTSA-N 1 1 316.401 3.517 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@]3(CC[C@@H](C)C3)C2)c([N+](=O)[O-])cc1F ZINC000362190310 1032267699 /nfs/dbraw/zinc/26/76/99/1032267699.db2.gz LPHUUJBJZBXHEI-PXAZEXFGSA-N 1 1 322.380 3.755 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)[C@@H](CO)C(C)(C)C)cc1[N+](=O)[O-] ZINC000537659814 1032618733 /nfs/dbraw/zinc/61/87/33/1032618733.db2.gz NGIOIRYPDBIVDG-INIZCTEOSA-N 1 1 308.422 3.557 20 5 DHBDMO COc1ccc(C[N@H+]2CCC3(C2)CCCCC3)cc1[N+](=O)[O-] ZINC000610216174 1012429576 /nfs/dbraw/zinc/42/95/76/1012429576.db2.gz VZSHCWWRHCZHEB-UHFFFAOYSA-N 1 1 304.390 3.760 20 5 DHBDMO C[N@@H+](CCOc1ccccc1Cl)Cc1cccc([N+](=O)[O-])c1 ZINC000610226040 1012495182 /nfs/dbraw/zinc/49/51/82/1012495182.db2.gz PSKMVIYERDIQQE-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)NC/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000515096549 1012557603 /nfs/dbraw/zinc/55/76/03/1012557603.db2.gz NSCWIVYEDKMSFP-UVQBRAAOSA-N 1 1 319.449 3.708 20 5 DHBDMO CCCN(CC)C[C@@H](C)[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000515096549 1012557615 /nfs/dbraw/zinc/55/76/15/1012557615.db2.gz NSCWIVYEDKMSFP-UVQBRAAOSA-N 1 1 319.449 3.708 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000516919497 1012864297 /nfs/dbraw/zinc/86/42/97/1012864297.db2.gz KZDDAAQNMDEDJH-CYBMUJFWSA-N 1 1 309.410 3.526 20 5 DHBDMO CCC[C@@H](NCC[N@H+](CC)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000336862841 1013012445 /nfs/dbraw/zinc/01/24/45/1013012445.db2.gz LWEKHDOWEGVKQV-QGZVFWFLSA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@@H](NCC[N@@H+](CC)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000336862841 1013012466 /nfs/dbraw/zinc/01/24/66/1013012466.db2.gz LWEKHDOWEGVKQV-QGZVFWFLSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000475283515 1017114637 /nfs/dbraw/zinc/11/46/37/1017114637.db2.gz IMBLXHJDVCOFMQ-DMBZQDCGSA-N 1 1 314.307 3.881 20 5 DHBDMO CC(C)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCC1 ZINC000444592987 1017581482 /nfs/dbraw/zinc/58/14/82/1017581482.db2.gz FDZCNTDRYXZMIU-UHFFFAOYSA-N 1 1 316.405 3.872 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444697493 1017638766 /nfs/dbraw/zinc/63/87/66/1017638766.db2.gz KRDLEXTUEKNWCI-SECBINFHSA-N 1 1 306.259 3.508 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444697493 1017638772 /nfs/dbraw/zinc/63/87/72/1017638772.db2.gz KRDLEXTUEKNWCI-SECBINFHSA-N 1 1 306.259 3.508 20 5 DHBDMO Cc1cc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000444746811 1017659506 /nfs/dbraw/zinc/65/95/06/1017659506.db2.gz WJTZHXSOTQIUHB-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000523702277 1017766767 /nfs/dbraw/zinc/76/67/67/1017766767.db2.gz NJRITSIVFWCCBC-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cccc3cccnc31)CC2 ZINC000088605336 1017779807 /nfs/dbraw/zinc/77/98/07/1017779807.db2.gz AQFQMHFTOQVSPZ-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO C[N@@H+](CCc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000523839912 1017809586 /nfs/dbraw/zinc/80/95/86/1017809586.db2.gz DANROFBTFLZPOT-UHFFFAOYSA-N 1 1 304.777 3.923 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000245528568 1018209742 /nfs/dbraw/zinc/20/97/42/1018209742.db2.gz QSVNWUIPYKGSOI-ZIAGYGMSSA-N 1 1 314.389 3.567 20 5 DHBDMO Cc1nn(C[N@H+](CCC(C)C)C2CC2)c2ccc([N+](=O)[O-])cc12 ZINC000764880778 1018416353 /nfs/dbraw/zinc/41/63/53/1018416353.db2.gz YRSGOHOJXBOLBW-UHFFFAOYSA-N 1 1 316.405 3.721 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000526007965 1018429226 /nfs/dbraw/zinc/42/92/26/1018429226.db2.gz MYCOZEKCRKHVNC-HNNXBMFYSA-N 1 1 300.333 3.723 20 5 DHBDMO CS[C@@H]1CCCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000708322059 1018842672 /nfs/dbraw/zinc/84/26/72/1018842672.db2.gz XNHXNVGQITWYGY-GFCCVEGCSA-N 1 1 314.838 3.966 20 5 DHBDMO C[C@H](O)CC[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000093481439 1032791855 /nfs/dbraw/zinc/79/18/55/1032791855.db2.gz NBEQJGRYLIJHSY-LBPRGKRZSA-N 1 1 320.414 3.526 20 5 DHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCc1cccs1 ZINC000255154855 1019323281 /nfs/dbraw/zinc/32/32/81/1019323281.db2.gz WQMDCMKRAUYPFV-DAXSKMNVSA-N 1 1 302.399 3.844 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@H]2C2CC2)c1 ZINC000611268526 1019428734 /nfs/dbraw/zinc/42/87/34/1019428734.db2.gz CRUHQIBYAUXOPQ-ZDUSSCGKSA-N 1 1 312.316 3.571 20 5 DHBDMO COc1cc(C[N@@H+](C2CC2)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000611515372 1019507061 /nfs/dbraw/zinc/50/70/61/1019507061.db2.gz UWQBKLVOASOSAX-UHFFFAOYSA-N 1 1 304.390 3.901 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])s2)C1 ZINC000611509695 1019508032 /nfs/dbraw/zinc/50/80/32/1019508032.db2.gz FOHRZCDVJDHIDK-KGLIPLIRSA-N 1 1 323.462 3.747 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc([N+](=O)[O-])s2)C1 ZINC000611509697 1019509012 /nfs/dbraw/zinc/50/90/12/1019509012.db2.gz FOHRZCDVJDHIDK-ZIAGYGMSSA-N 1 1 323.462 3.747 20 5 DHBDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000611555203 1019517274 /nfs/dbraw/zinc/51/72/74/1019517274.db2.gz RHLRQKLAKOXVGL-CMPLNLGQSA-N 1 1 302.296 3.758 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000255831130 1019604876 /nfs/dbraw/zinc/60/48/76/1019604876.db2.gz NLWRKZBQAGOLPL-XOWYPZSQSA-N 1 1 323.396 3.794 20 5 DHBDMO C[C@@H](C[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000727436971 1019705485 /nfs/dbraw/zinc/70/54/85/1019705485.db2.gz ASEOBUIFMAKDCJ-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO CC[C@H](NCC1([NH+](C)C)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000317108138 1019957410 /nfs/dbraw/zinc/95/74/10/1019957410.db2.gz KTGLDUZSFJBIDW-INIZCTEOSA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCc2sccc2C1 ZINC000730432609 1019991348 /nfs/dbraw/zinc/99/13/48/1019991348.db2.gz MWHFGSIEIYPLHU-UHFFFAOYSA-N 1 1 306.362 3.744 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCc2sccc2C1 ZINC000730432609 1019991355 /nfs/dbraw/zinc/99/13/55/1019991355.db2.gz MWHFGSIEIYPLHU-UHFFFAOYSA-N 1 1 306.362 3.744 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000611983895 1020032152 /nfs/dbraw/zinc/03/21/52/1020032152.db2.gz UJDNRNUTTQJMRC-MAVJXHJTSA-N 1 1 323.396 3.568 20 5 DHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCc1cccs1 ZINC000093685360 1020167792 /nfs/dbraw/zinc/16/77/92/1020167792.db2.gz WQMDCMKRAUYPFV-QPJJXVBHSA-N 1 1 302.399 3.844 20 5 DHBDMO CCOc1cccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000179314805 1020252421 /nfs/dbraw/zinc/25/24/21/1020252421.db2.gz YLIUHTBXNBAPIE-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO CCOc1cccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000179314805 1020252428 /nfs/dbraw/zinc/25/24/28/1020252428.db2.gz YLIUHTBXNBAPIE-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO CNC(=O)CC[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000179410574 1020344172 /nfs/dbraw/zinc/34/41/72/1020344172.db2.gz PSVWVICDKCUCOP-UHFFFAOYSA-N 1 1 306.409 3.561 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H](C)[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000480618839 1020470956 /nfs/dbraw/zinc/47/09/56/1020470956.db2.gz WSTULPYHHKXJJA-PMPSAXMXSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000480618839 1020470963 /nfs/dbraw/zinc/47/09/63/1020470963.db2.gz WSTULPYHHKXJJA-PMPSAXMXSA-N 1 1 319.449 3.817 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000179863513 1020529626 /nfs/dbraw/zinc/52/96/26/1020529626.db2.gz RSJSXNXUBUHEDP-GFCCVEGCSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000179863513 1020529637 /nfs/dbraw/zinc/52/96/37/1020529637.db2.gz RSJSXNXUBUHEDP-GFCCVEGCSA-N 1 1 318.398 3.544 20 5 DHBDMO Cc1ccc([C@H](C)N[C@@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153722380 1020556668 /nfs/dbraw/zinc/55/66/68/1020556668.db2.gz RIKVHLGLHPLCEV-GOEBONIOSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153722380 1020556671 /nfs/dbraw/zinc/55/66/71/1020556671.db2.gz RIKVHLGLHPLCEV-GOEBONIOSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1COc2c1cccc2Cl ZINC000612580759 1020628619 /nfs/dbraw/zinc/62/86/19/1020628619.db2.gz MHJFLJJZPYRCPY-HNNXBMFYSA-N 1 1 318.760 3.780 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC(C(F)(F)F)CC1 ZINC000179963214 1020640028 /nfs/dbraw/zinc/64/00/28/1020640028.db2.gz LFSTVLSWAXASAF-HWKANZROSA-N 1 1 314.307 3.882 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1sccc1[N+](=O)[O-] ZINC000613184895 1020845043 /nfs/dbraw/zinc/84/50/43/1020845043.db2.gz SKIGMMJKWRUZNB-OCCSQVGLSA-N 1 1 317.414 3.589 20 5 DHBDMO CCc1nc(C)c(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000580928464 1020864019 /nfs/dbraw/zinc/86/40/19/1020864019.db2.gz QGUAJAADFRSWKQ-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO CCc1nc(C)c(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000580928463 1020864059 /nfs/dbraw/zinc/86/40/59/1020864059.db2.gz QGUAJAADFRSWKQ-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO Cc1nn(C[N@H+]2CCC[C@@H](C(C)(C)C)CC2)c(C)c1[N+](=O)[O-] ZINC000738237707 1020868319 /nfs/dbraw/zinc/86/83/19/1020868319.db2.gz BHJKLNWYGXAVHP-CQSZACIVSA-N 1 1 308.426 3.514 20 5 DHBDMO Cc1[nH+]c2cc(Nc3c(F)cccc3[N+](=O)[O-])ccc2n1C ZINC000581934919 1020921096 /nfs/dbraw/zinc/92/10/96/1020921096.db2.gz HNRVONYRRYETBH-UHFFFAOYSA-N 1 1 300.293 3.673 20 5 DHBDMO CCOc1cccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000180708193 1021149417 /nfs/dbraw/zinc/14/94/17/1021149417.db2.gz LCFZUILVFROFLD-GFCCVEGCSA-N 1 1 318.348 3.983 20 5 DHBDMO CCC(CC)C[N@@H+](CC)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917454584 1021268376 /nfs/dbraw/zinc/26/83/76/1021268376.db2.gz UHJFHOWCCLASSS-UHFFFAOYSA-N 1 1 304.394 3.660 20 5 DHBDMO CCC[C@]1(C)CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000743404197 1021282998 /nfs/dbraw/zinc/28/29/98/1021282998.db2.gz MLSNGQQZZCSZPM-QGZVFWFLSA-N 1 1 316.405 3.804 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)cc1[N+](=O)[O-] ZINC000069752533 1021347800 /nfs/dbraw/zinc/34/78/00/1021347800.db2.gz WDALJSFOSTYZCY-SWLSCSKDSA-N 1 1 300.358 3.909 20 5 DHBDMO COC1(CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)CCC1 ZINC000338924002 1021349975 /nfs/dbraw/zinc/34/99/75/1021349975.db2.gz FQSNHGNCLOUAIS-UHFFFAOYSA-N 1 1 306.406 3.764 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1C[C@@H](O)c2ccccc21 ZINC000850372247 1021494612 /nfs/dbraw/zinc/49/46/12/1021494612.db2.gz RUFHMZXANMFYBZ-GOEBONIOSA-N 1 1 318.760 3.516 20 5 DHBDMO Cc1nc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cs1 ZINC000618982791 1021605994 /nfs/dbraw/zinc/60/59/94/1021605994.db2.gz UXVGYNINDDTPFP-HNNXBMFYSA-N 1 1 317.414 3.872 20 5 DHBDMO CSCC[C@H](C)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000174868503 1021626028 /nfs/dbraw/zinc/62/60/28/1021626028.db2.gz LLBJAWHLRZSHEX-JTQLQIEISA-N 1 1 302.827 3.822 20 5 DHBDMO CC[N@H+](Cc1ccc(C)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746029416 1021830155 /nfs/dbraw/zinc/83/01/55/1021830155.db2.gz RQMHTDSAPKHQJI-UHFFFAOYSA-N 1 1 324.384 3.733 20 5 DHBDMO COc1cccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1F ZINC000619715443 1021846330 /nfs/dbraw/zinc/84/63/30/1021846330.db2.gz FOZKGTTXJVIQMK-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000290484686 1022052100 /nfs/dbraw/zinc/05/21/00/1022052100.db2.gz OFOQPIUZDNWMPM-OAHLLOKOSA-N 1 1 314.389 3.580 20 5 DHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586619 1022109270 /nfs/dbraw/zinc/10/92/70/1022109270.db2.gz OMHZFPPPJFRZLW-XKQJLSEDSA-N 1 1 306.406 3.529 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC([C@H]2CCCCO2)CC1 ZINC000852593599 1022144882 /nfs/dbraw/zinc/14/48/82/1022144882.db2.gz IKNNEGPXTQKKIE-QGZVFWFLSA-N 1 1 322.380 3.515 20 5 DHBDMO Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)c1 ZINC001169046718 1022229571 /nfs/dbraw/zinc/22/95/71/1022229571.db2.gz MGEKNWYCNNRAKY-SZMVWBNQSA-N 1 1 302.418 3.886 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000609705136 1022336086 /nfs/dbraw/zinc/33/60/86/1022336086.db2.gz SZUQTMUUNFZTJQ-GFCCVEGCSA-N 1 1 306.749 3.831 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278826263 1022387896 /nfs/dbraw/zinc/38/78/96/1022387896.db2.gz QBENAVOSWZJHQO-MNOVXSKESA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278826271 1022388983 /nfs/dbraw/zinc/38/89/83/1022388983.db2.gz QBENAVOSWZJHQO-WDEREUQCSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@H](CNc1ccc([N+](=O)[O-])s1)[N@@H+]1CCc2sccc2C1 ZINC000139415544 1022724308 /nfs/dbraw/zinc/72/43/08/1022724308.db2.gz NBOCOSHABANWAU-SNVBAGLBSA-N 1 1 323.443 3.577 20 5 DHBDMO C[C@H](CNc1ccc([N+](=O)[O-])s1)[N@H+]1CCc2sccc2C1 ZINC000139415544 1022724324 /nfs/dbraw/zinc/72/43/24/1022724324.db2.gz NBOCOSHABANWAU-SNVBAGLBSA-N 1 1 323.443 3.577 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000584836615 1022800498 /nfs/dbraw/zinc/80/04/98/1022800498.db2.gz MGTGPCHFRGWNDI-ZIAGYGMSSA-N 1 1 304.390 3.608 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000584836615 1022800511 /nfs/dbraw/zinc/80/05/11/1022800511.db2.gz MGTGPCHFRGWNDI-ZIAGYGMSSA-N 1 1 304.390 3.608 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc3c(c2)COC3)C2CC2)c1 ZINC000768333601 1022948102 /nfs/dbraw/zinc/94/81/02/1022948102.db2.gz GUHFZIMWLWZPTB-UHFFFAOYSA-N 1 1 324.380 3.790 20 5 DHBDMO COc1ccc([C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)c(OC)c1 ZINC000123468937 1023041805 /nfs/dbraw/zinc/04/18/05/1023041805.db2.gz SKPMDDYAAYXLRP-JTQLQIEISA-N 1 1 322.386 3.524 20 5 DHBDMO COc1cc(C)c([N+](=O)[O-])cc1NCCC[N@H+]1CCCC[C@H]1C ZINC001167753271 1023044196 /nfs/dbraw/zinc/04/41/96/1023044196.db2.gz NGOLJBOWUYQXFF-CQSZACIVSA-N 1 1 321.421 3.588 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(NCCC[N@@H+]2CCCC[C@H]2C)c1F ZINC001167753089 1023044938 /nfs/dbraw/zinc/04/49/38/1023044938.db2.gz CFLVRCXPROSSKP-CYBMUJFWSA-N 1 1 309.385 3.719 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cc(O)cc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000925690864 1023168852 /nfs/dbraw/zinc/16/88/52/1023168852.db2.gz HVNCAODMFXNGQD-WDEREUQCSA-N 1 1 304.321 3.851 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCc2c1nccc2Cl)c1ccccc1[N+](=O)[O-] ZINC000925693109 1023179258 /nfs/dbraw/zinc/17/92/58/1023179258.db2.gz OKAAZPKOVZKDDT-YGRLFVJLSA-N 1 1 317.776 3.981 20 5 DHBDMO C[C@H]1CC[C@H](C)[NH+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000770311425 1023295857 /nfs/dbraw/zinc/29/58/57/1023295857.db2.gz PCMWWKPTGAAWCL-UWVGGRQHSA-N 1 1 313.195 3.730 20 5 DHBDMO COc1cc(C)ccc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000124564164 1023345617 /nfs/dbraw/zinc/34/56/17/1023345617.db2.gz CFUMPABPPRNTHE-ZDUSSCGKSA-N 1 1 300.358 3.763 20 5 DHBDMO CSc1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)ccn1 ZINC000771881947 1023480658 /nfs/dbraw/zinc/48/06/58/1023480658.db2.gz ORTWHWAVNVFTNU-UHFFFAOYSA-N 1 1 323.805 3.655 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000538722834 1033145925 /nfs/dbraw/zinc/14/59/25/1033145925.db2.gz UBFFJJVNUYELNL-WGLAMXGCSA-N 1 1 308.381 3.925 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1ccc(F)cc1 ZINC000108816129 1023591376 /nfs/dbraw/zinc/59/13/76/1023591376.db2.gz WJKKIRNSXDCKMP-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO CC1(C)C[C@H]([NH2+]Cc2cccc(F)n2)c2cc([N+](=O)[O-])ccc21 ZINC000788594175 1023909880 /nfs/dbraw/zinc/90/98/80/1023909880.db2.gz ZXQZTAMJLREWBB-HNNXBMFYSA-N 1 1 315.348 3.641 20 5 DHBDMO COC[C@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000452110148 1023981256 /nfs/dbraw/zinc/98/12/56/1023981256.db2.gz YEJKFAHURGCQDG-GJZGRUSLSA-N 1 1 306.406 3.713 20 5 DHBDMO CCC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000296009738 1024106337 /nfs/dbraw/zinc/10/63/37/1024106337.db2.gz QZYGCPILCTXZBR-YCXXCVGLSA-N 1 1 317.433 3.651 20 5 DHBDMO CCC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000296009738 1024106346 /nfs/dbraw/zinc/10/63/46/1024106346.db2.gz QZYGCPILCTXZBR-YCXXCVGLSA-N 1 1 317.433 3.651 20 5 DHBDMO Cc1ccn2cc(C[NH2+][C@H](C)c3ccc(C)c([N+](=O)[O-])c3)nc2c1 ZINC000268836670 1024173718 /nfs/dbraw/zinc/17/37/18/1024173718.db2.gz DNSGMNBQVHMEGO-CQSZACIVSA-N 1 1 324.384 3.710 20 5 DHBDMO C[C@H]1C[C@H](C)[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000162910160 1024179689 /nfs/dbraw/zinc/17/96/89/1024179689.db2.gz LXJHLRQBKGHXPJ-UWVGGRQHSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@H]1C[C@H](C)[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000162910160 1024179685 /nfs/dbraw/zinc/17/96/85/1024179685.db2.gz LXJHLRQBKGHXPJ-UWVGGRQHSA-N 1 1 313.195 3.588 20 5 DHBDMO CC[C@H]([NH2+]C1CCN(C2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000268995748 1024214388 /nfs/dbraw/zinc/21/43/88/1024214388.db2.gz KMMLKWZGTBKBEY-SFHVURJKSA-N 1 1 317.433 3.652 20 5 DHBDMO Cc1c(C[NH2+][C@H](C)c2cccnc2Cl)cccc1[N+](=O)[O-] ZINC000790695298 1024356428 /nfs/dbraw/zinc/35/64/28/1024356428.db2.gz MTJVRZCKJAQQIQ-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO CCC[C@H](C)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000270651429 1024414876 /nfs/dbraw/zinc/41/48/76/1024414876.db2.gz UDKLJVIHNZMUQH-LBPRGKRZSA-N 1 1 303.362 3.870 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)cc1 ZINC000883384543 1024420833 /nfs/dbraw/zinc/42/08/33/1024420833.db2.gz UKPJQTDWMYHLBC-DLBZAZTESA-N 1 1 300.333 3.710 20 5 DHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000453363345 1024489781 /nfs/dbraw/zinc/48/97/81/1024489781.db2.gz RIIUKOXXNHEMIP-WBMJQRKESA-N 1 1 314.389 3.539 20 5 DHBDMO CCC[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cccc([N+](=O)[O-])c1 ZINC000271495781 1024522702 /nfs/dbraw/zinc/52/27/02/1024522702.db2.gz LGHFNZRYCOMOBU-CVEARBPZSA-N 1 1 314.389 3.826 20 5 DHBDMO CC[C@@H](C)C[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000111254974 1024750939 /nfs/dbraw/zinc/75/09/39/1024750939.db2.gz YBXINSOXICXVEG-CYBMUJFWSA-N 1 1 317.389 3.770 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]3CCC[C@@H]32)c([N+](=O)[O-])c1 ZINC001170348016 1024757690 /nfs/dbraw/zinc/75/76/90/1024757690.db2.gz URYCOZBPIMDGBO-VBQJREDUSA-N 1 1 318.417 3.799 20 5 DHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)C12CCC2 ZINC000349959745 1024772661 /nfs/dbraw/zinc/77/26/61/1024772661.db2.gz DMTSALHYHWJQHS-DLBZAZTESA-N 1 1 318.417 3.683 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CSc3ccccc32)c(F)c1 ZINC000350288028 1024799968 /nfs/dbraw/zinc/79/99/68/1024799968.db2.gz NVUSNWVDHUICSM-AWEZNQCLSA-N 1 1 304.346 3.671 20 5 DHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccn1 ZINC000350363218 1024810922 /nfs/dbraw/zinc/81/09/22/1024810922.db2.gz XJCLBXSQRGQYQS-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccn1 ZINC000350363218 1024810936 /nfs/dbraw/zinc/81/09/36/1024810936.db2.gz XJCLBXSQRGQYQS-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO CCC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878048 1024822010 /nfs/dbraw/zinc/82/20/10/1024822010.db2.gz RPQHLSMDEBIXSY-ZDUSSCGKSA-N 1 1 307.350 3.658 20 5 DHBDMO C[N@@H+](CC1CCCC1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899771 1024913006 /nfs/dbraw/zinc/91/30/06/1024913006.db2.gz PVWLVRKHDSDDKB-UHFFFAOYSA-N 1 1 314.389 3.538 20 5 DHBDMO CC[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)[C@H](C)C(C)C ZINC000728899889 1024916709 /nfs/dbraw/zinc/91/67/09/1024916709.db2.gz VCOVTWCXQJXQOE-CQSZACIVSA-N 1 1 316.405 3.782 20 5 DHBDMO C[C@@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728901073 1024930921 /nfs/dbraw/zinc/93/09/21/1024930921.db2.gz WJMXATHFQDPVNE-CQSZACIVSA-N 1 1 314.389 3.538 20 5 DHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000793370786 1025010365 /nfs/dbraw/zinc/01/03/65/1025010365.db2.gz RPAZRGOPNWQBIF-CYBMUJFWSA-N 1 1 321.377 3.761 20 5 DHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000134849662 1025136325 /nfs/dbraw/zinc/13/63/25/1025136325.db2.gz AHWWEDNKQFXVHC-SNVBAGLBSA-N 1 1 302.827 3.822 20 5 DHBDMO O=[N+]([O-])c1ccc([O-])cc1C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000353902020 1025286123 /nfs/dbraw/zinc/28/61/23/1025286123.db2.gz SXFDTQVLRJSYTM-KRWDZBQOSA-N 1 1 302.374 3.623 20 5 DHBDMO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000885938040 1025412778 /nfs/dbraw/zinc/41/27/78/1025412778.db2.gz QDIMUFHUZBCWMV-NSHDSACASA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000885938040 1025412786 /nfs/dbraw/zinc/41/27/86/1025412786.db2.gz QDIMUFHUZBCWMV-NSHDSACASA-N 1 1 305.765 3.836 20 5 DHBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886014091 1025438783 /nfs/dbraw/zinc/43/87/83/1025438783.db2.gz BWHGTUSGCIDNSU-GOEBONIOSA-N 1 1 311.385 3.676 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(c2ccccc2F)CC1 ZINC000886014944 1025441150 /nfs/dbraw/zinc/44/11/50/1025441150.db2.gz SMKOUCYQGYDMGY-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886107733 1025509194 /nfs/dbraw/zinc/50/91/94/1025509194.db2.gz YQHOQNQTETXANF-OAHLLOKOSA-N 1 1 315.373 3.629 20 5 DHBDMO CC[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000886112128 1025510218 /nfs/dbraw/zinc/51/02/18/1025510218.db2.gz QGWCFEVJEYTHLQ-AWEZNQCLSA-N 1 1 307.300 3.509 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000342819255 1025514410 /nfs/dbraw/zinc/51/44/10/1025514410.db2.gz AMMLVCYWIWLXGP-SJLPKXTDSA-N 1 1 318.417 3.862 20 5 DHBDMO Cc1ccc([C@@H]2CC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)c(C)c1 ZINC000886181723 1025552554 /nfs/dbraw/zinc/55/25/54/1025552554.db2.gz RYPGEPFXSCRLAU-OAHLLOKOSA-N 1 1 311.385 3.596 20 5 DHBDMO COc1cccc(NCCCC[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000355331461 1025682479 /nfs/dbraw/zinc/68/24/79/1025682479.db2.gz FSWLNKRDHOBXLQ-CQSZACIVSA-N 1 1 321.421 3.527 20 5 DHBDMO CCCC[N@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)c1ccccc1 ZINC000355343213 1025685773 /nfs/dbraw/zinc/68/57/73/1025685773.db2.gz ZKAMVALDGWFCKW-AWEZNQCLSA-N 1 1 316.405 3.692 20 5 DHBDMO CCCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)c1ccccc1 ZINC000355343213 1025685782 /nfs/dbraw/zinc/68/57/82/1025685782.db2.gz ZKAMVALDGWFCKW-AWEZNQCLSA-N 1 1 316.405 3.692 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000355785045 1025837867 /nfs/dbraw/zinc/83/78/67/1025837867.db2.gz PBUMXAZBQRHNES-WMLDXEAASA-N 1 1 304.390 3.548 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCOCC2(CCCC2)C1 ZINC000614222854 1025954384 /nfs/dbraw/zinc/95/43/84/1025954384.db2.gz KHIDMGCJGYIFTG-CQSZACIVSA-N 1 1 304.390 3.548 20 5 DHBDMO C[C@@H](c1ccccc1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000356813151 1026179439 /nfs/dbraw/zinc/17/94/39/1026179439.db2.gz KVWOMUOIBIYZTE-LBPRGKRZSA-N 1 1 310.357 3.664 20 5 DHBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000356813151 1026179444 /nfs/dbraw/zinc/17/94/44/1026179444.db2.gz KVWOMUOIBIYZTE-LBPRGKRZSA-N 1 1 310.357 3.664 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000513496985 1026523150 /nfs/dbraw/zinc/52/31/50/1026523150.db2.gz OPYNLEDBQQUEJV-CQSZACIVSA-N 1 1 300.333 3.723 20 5 DHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000513497557 1026523506 /nfs/dbraw/zinc/52/35/06/1026523506.db2.gz YNUYTRNKMVVISF-CQSZACIVSA-N 1 1 314.385 3.666 20 5 DHBDMO COc1ccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000513666273 1026555872 /nfs/dbraw/zinc/55/58/72/1026555872.db2.gz KNTZMOQUBXWSLF-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc(C[N@H+]2CCc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000513666273 1026555873 /nfs/dbraw/zinc/55/58/73/1026555873.db2.gz KNTZMOQUBXWSLF-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ccon2)s1 ZINC000747622687 1026830975 /nfs/dbraw/zinc/83/09/75/1026830975.db2.gz ULAZOPAHIFAZRI-UHFFFAOYSA-N 1 1 315.354 3.601 20 5 DHBDMO COCc1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000237175577 1026942516 /nfs/dbraw/zinc/94/25/16/1026942516.db2.gz DTKBKEKUNOKYRJ-UHFFFAOYSA-N 1 1 320.776 3.684 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1F ZINC000561967553 1027150584 /nfs/dbraw/zinc/15/05/84/1027150584.db2.gz GAYAKQGBBXYRLC-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO CCC[C@@H](N[C@@H]1CC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000157724074 1027358910 /nfs/dbraw/zinc/35/89/10/1027358910.db2.gz ZTMAEMCYXLUWRT-SJLPKXTDSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@@H](N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000157724074 1027358923 /nfs/dbraw/zinc/35/89/23/1027358923.db2.gz ZTMAEMCYXLUWRT-SJLPKXTDSA-N 1 1 317.433 3.510 20 5 DHBDMO CCCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H]1CCC[C@H](C)C1 ZINC001170684915 1027385569 /nfs/dbraw/zinc/38/55/69/1027385569.db2.gz YYZPPIPXWVWZRT-HOCLYGCPSA-N 1 1 322.453 3.781 20 5 DHBDMO CSC[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000362947643 1027458016 /nfs/dbraw/zinc/45/80/16/1027458016.db2.gz BQHCRGIFLASDKK-HNNXBMFYSA-N 1 1 324.446 3.709 20 5 DHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H]1CCC1CCCCC1 ZINC000362951512 1027461771 /nfs/dbraw/zinc/46/17/71/1027461771.db2.gz MUDVAZBFLGKZCB-OAHLLOKOSA-N 1 1 320.437 3.653 20 5 DHBDMO CCC[C@H]([NH2+][C@H](CN)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000423533883 1027578037 /nfs/dbraw/zinc/57/80/37/1027578037.db2.gz UNPSDNPEBIVCLN-DLBZAZTESA-N 1 1 305.422 3.543 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000778949884 1027635209 /nfs/dbraw/zinc/63/52/09/1027635209.db2.gz DFQFQJNWURGQOX-MNOVXSKESA-N 1 1 302.296 3.848 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934333889 1027967338 /nfs/dbraw/zinc/96/73/38/1027967338.db2.gz RIAQWTCLRDNOGV-QWHCGFSZSA-N 1 1 317.414 3.677 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc3c(n2)CCC3)C2CC2)cc1 ZINC000564540044 1028470211 /nfs/dbraw/zinc/47/02/11/1028470211.db2.gz LDRDHQSMQMBJBR-UHFFFAOYSA-N 1 1 323.396 3.643 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc3c(n2)CCC3)C2CC2)cc1 ZINC000564540044 1028470215 /nfs/dbraw/zinc/47/02/15/1028470215.db2.gz LDRDHQSMQMBJBR-UHFFFAOYSA-N 1 1 323.396 3.643 20 5 DHBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000449492139 1028688785 /nfs/dbraw/zinc/68/87/85/1028688785.db2.gz IOFVRKLUMTYNRU-KSSFIOAISA-N 1 1 320.433 3.965 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cccc(O)c3)C2)cc1 ZINC000449495427 1028705718 /nfs/dbraw/zinc/70/57/18/1028705718.db2.gz DEVIUDCGGVYREN-INIZCTEOSA-N 1 1 312.369 3.680 20 5 DHBDMO CCCC[C@@H](C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000568743055 1029120027 /nfs/dbraw/zinc/12/00/27/1029120027.db2.gz OVXOMGIENSGHMS-CQSZACIVSA-N 1 1 321.421 3.742 20 5 DHBDMO Cc1cncc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000451552673 1029910471 /nfs/dbraw/zinc/91/04/71/1029910471.db2.gz XAJMUPSMZCJBQD-QGZVFWFLSA-N 1 1 311.385 3.678 20 5 DHBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549104 1029911124 /nfs/dbraw/zinc/91/11/24/1029911124.db2.gz OXZAIMXXGIYAOE-GOEBONIOSA-N 1 1 311.385 3.930 20 5 DHBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549106 1029913793 /nfs/dbraw/zinc/91/37/93/1029913793.db2.gz OXZAIMXXGIYAOE-HOCLYGCPSA-N 1 1 311.385 3.930 20 5 DHBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2C(F)F)C[N@H+]1C1CC1 ZINC000865600423 1029932637 /nfs/dbraw/zinc/93/26/37/1029932637.db2.gz MSSCZHZOJOBLPH-VHSXEESVSA-N 1 1 311.332 3.570 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)cc1Cl ZINC000783678303 1030002391 /nfs/dbraw/zinc/00/23/91/1030002391.db2.gz ZBNBCHNFIBTRTJ-CQSZACIVSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)cc1Cl ZINC000783678303 1030002409 /nfs/dbraw/zinc/00/24/09/1030002409.db2.gz ZBNBCHNFIBTRTJ-CQSZACIVSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1 ZINC000451835692 1030025377 /nfs/dbraw/zinc/02/53/77/1030025377.db2.gz KGIWWXZBJPJSMJ-KRWDZBQOSA-N 1 1 312.369 3.958 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451966713 1030073456 /nfs/dbraw/zinc/07/34/56/1030073456.db2.gz POUKIVDFJDMIJO-BBRMVZONSA-N 1 1 306.431 3.875 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCc2c1nccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC000924797649 1030190621 /nfs/dbraw/zinc/19/06/21/1030190621.db2.gz HQQKDNZWPNEFRB-MEBBXXQBSA-N 1 1 317.776 3.981 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1Cc2ccccc2C[C@H]1C ZINC000357813221 1030204751 /nfs/dbraw/zinc/20/47/51/1030204751.db2.gz VWXMGIKLHKVMST-CYBMUJFWSA-N 1 1 312.369 3.550 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1Cc2ccccc2C[C@H]1C ZINC000357813221 1030204768 /nfs/dbraw/zinc/20/47/68/1030204768.db2.gz VWXMGIKLHKVMST-CYBMUJFWSA-N 1 1 312.369 3.550 20 5 DHBDMO CC(C)([NH2+]Cc1ccc(Cl)nc1)c1ccccc1[N+](=O)[O-] ZINC000291828494 1030660785 /nfs/dbraw/zinc/66/07/85/1030660785.db2.gz ZWUHULSEULUSOA-UHFFFAOYSA-N 1 1 305.765 3.668 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCSC[C@@H]2C2CC2)ccc1Cl ZINC000824913924 1030663750 /nfs/dbraw/zinc/66/37/50/1030663750.db2.gz JAYUEGKBIXRHDG-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCSC[C@@H]2C2CC2)ccc1Cl ZINC000824913924 1030663755 /nfs/dbraw/zinc/66/37/55/1030663755.db2.gz JAYUEGKBIXRHDG-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCc2c1nccc2Cl)c1ccc([N+](=O)[O-])cc1 ZINC000926492962 1030764367 /nfs/dbraw/zinc/76/43/67/1030764367.db2.gz JSXGONBTNDOOLI-BONVTDFDSA-N 1 1 317.776 3.981 20 5 DHBDMO CC(C)([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-] ZINC000292103448 1030809431 /nfs/dbraw/zinc/80/94/31/1030809431.db2.gz IESGEOBTZANGAJ-UHFFFAOYSA-N 1 1 315.329 3.528 20 5 DHBDMO CC[C@@H](NCC[N@@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000359927191 1031200480 /nfs/dbraw/zinc/20/04/80/1031200480.db2.gz UPWRNUVFJUFGDL-RHSMWYFYSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@@H](NCC[N@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000359927191 1031200499 /nfs/dbraw/zinc/20/04/99/1031200499.db2.gz UPWRNUVFJUFGDL-RHSMWYFYSA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000536696469 1031400938 /nfs/dbraw/zinc/40/09/38/1031400938.db2.gz WZGXBKCQQYYHKI-FWEDBPMCSA-N 1 1 318.442 3.968 20 5 DHBDMO COC1(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCC1 ZINC000361508387 1031961908 /nfs/dbraw/zinc/96/19/08/1031961908.db2.gz LLPQZUFUUWKSOY-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO COCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H]1CC[C@H](C)C1 ZINC000361641554 1032030493 /nfs/dbraw/zinc/03/04/93/1032030493.db2.gz CKEKVIRUEXFJLQ-BBRMVZONSA-N 1 1 306.406 3.540 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000877603633 1033376749 /nfs/dbraw/zinc/37/67/49/1033376749.db2.gz RKUKFBMKZGJUDQ-QAPCUYQASA-N 1 1 318.417 3.603 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccc(F)cc3)CC2)c(F)c1 ZINC000478253012 1033437410 /nfs/dbraw/zinc/43/74/10/1033437410.db2.gz IHYOEXWNQSYLJE-UHFFFAOYSA-N 1 1 304.296 3.652 20 5 DHBDMO C[C@H]1C[C@@H](CF)[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172906714 1033439952 /nfs/dbraw/zinc/43/99/52/1033439952.db2.gz YBJSSXWSTBNQOQ-NUTKFTJISA-N 1 1 306.381 3.522 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H]3CCC[C@H]3C1)CC2 ZINC001172906999 1033440285 /nfs/dbraw/zinc/44/02/85/1033440285.db2.gz ZLZCZNHTGWJVOB-FHLIZLRMSA-N 1 1 314.429 3.964 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCc3ccccc3C1)CC2 ZINC001172908752 1033440438 /nfs/dbraw/zinc/44/04/38/1033440438.db2.gz NPOPQVATORYWSA-IBGZPJMESA-N 1 1 322.408 3.901 20 5 DHBDMO C[C@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001172909721 1033482539 /nfs/dbraw/zinc/48/25/39/1033482539.db2.gz VFHYIQSCOHAMFA-SWLSCSKDSA-N 1 1 324.371 3.819 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC3(CCC3)C1)CC2 ZINC001172912667 1033486334 /nfs/dbraw/zinc/48/63/34/1033486334.db2.gz CDCRPUYGOQSSDT-INIZCTEOSA-N 1 1 300.402 3.718 20 5 DHBDMO CC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H](C)C(C)C ZINC000878000022 1033547236 /nfs/dbraw/zinc/54/72/36/1033547236.db2.gz BVXGCYNXTOYLKC-LBPRGKRZSA-N 1 1 318.377 3.511 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@H]2COc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000552926025 1033551326 /nfs/dbraw/zinc/55/13/26/1033551326.db2.gz SNXQHVBCYJZCJT-ABAIWWIYSA-N 1 1 316.332 3.827 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173191327 1033584522 /nfs/dbraw/zinc/58/45/22/1033584522.db2.gz CCZFYWMDPYDZFG-OLZOCXBDSA-N 1 1 324.396 3.938 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@H](C)[C@H]2C)c1F ZINC001173190930 1033584786 /nfs/dbraw/zinc/58/47/86/1033584786.db2.gz XRAHTWCNTUHFJO-FRRDWIJNSA-N 1 1 324.396 3.794 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@H](C)CC2)c1F ZINC001173182801 1033584836 /nfs/dbraw/zinc/58/48/36/1033584836.db2.gz UHSVQBQCRJNRLR-OLZOCXBDSA-N 1 1 324.396 3.796 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1Cc2ccc(F)cc2C1 ZINC001173224934 1033602817 /nfs/dbraw/zinc/60/28/17/1033602817.db2.gz AAANUOKKKPEEGD-LBPRGKRZSA-N 1 1 300.333 3.681 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1Cc2ccc(F)cc2C1 ZINC001173224934 1033602826 /nfs/dbraw/zinc/60/28/26/1033602826.db2.gz AAANUOKKKPEEGD-LBPRGKRZSA-N 1 1 300.333 3.681 20 5 DHBDMO COc1cccc(C[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173226845 1033606261 /nfs/dbraw/zinc/60/62/61/1033606261.db2.gz LXGAWBVDJZBXAS-AWEZNQCLSA-N 1 1 314.385 3.666 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2scnc2Cl)cc1[N+](=O)[O-] ZINC000878371477 1033679595 /nfs/dbraw/zinc/67/95/95/1033679595.db2.gz LXGJZKYPEXOCBX-VIFPVBQESA-N 1 1 311.794 3.864 20 5 DHBDMO CC[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000174499674 1033939386 /nfs/dbraw/zinc/93/93/86/1033939386.db2.gz OCARXUPSRNOHJP-HNNXBMFYSA-N 1 1 305.403 3.775 20 5 DHBDMO CCc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1 ZINC000339059034 1034133679 /nfs/dbraw/zinc/13/36/79/1034133679.db2.gz BUOHPISLQBJXDD-UHFFFAOYSA-N 1 1 311.385 3.717 20 5 DHBDMO CCc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1 ZINC000339059034 1034133689 /nfs/dbraw/zinc/13/36/89/1034133689.db2.gz BUOHPISLQBJXDD-UHFFFAOYSA-N 1 1 311.385 3.717 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC000879998807 1034173972 /nfs/dbraw/zinc/17/39/72/1034173972.db2.gz ASFFLFUNFADKJX-GWCFXTLKSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@]1(C(F)(F)F)CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000880001437 1034178055 /nfs/dbraw/zinc/17/80/55/1034178055.db2.gz UYWBTXNEGMRPNY-LBPRGKRZSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000880001437 1034178061 /nfs/dbraw/zinc/17/80/61/1034178061.db2.gz UYWBTXNEGMRPNY-LBPRGKRZSA-N 1 1 306.259 3.508 20 5 DHBDMO Cc1csc([C@H]2CC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000880008870 1034181070 /nfs/dbraw/zinc/18/10/70/1034181070.db2.gz FEUVCIYZTSUUGC-OLZOCXBDSA-N 1 1 317.414 3.910 20 5 DHBDMO Cc1nc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)sc1C ZINC000178182197 1034217000 /nfs/dbraw/zinc/21/70/00/1034217000.db2.gz QXXNMJQTFQBXEL-LLVKDONJSA-N 1 1 305.403 3.827 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCC(C)(C)O1 ZINC000480511126 1034276703 /nfs/dbraw/zinc/27/67/03/1034276703.db2.gz LBOKHEKHEHCOKT-MRXNPFEDSA-N 1 1 306.406 3.763 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880318465 1034294458 /nfs/dbraw/zinc/29/44/58/1034294458.db2.gz ZLAMFFQTHGRZOV-SNVBAGLBSA-N 1 1 323.805 3.694 20 5 DHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2C[C@@H]3CC[C@H]2c2ccccc23)c1 ZINC000880538484 1034354541 /nfs/dbraw/zinc/35/45/41/1034354541.db2.gz LLNHHYJEIZNYIR-ZOCIIQOWSA-N 1 1 324.380 3.563 20 5 DHBDMO Cc1c([C@H](C)NC[C@H](C)[N@@H+]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000480622296 1034358863 /nfs/dbraw/zinc/35/88/63/1034358863.db2.gz GFSOJXMNKBBDFV-YCPHGPKFSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1c([C@H](C)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000480622296 1034358871 /nfs/dbraw/zinc/35/88/71/1034358871.db2.gz GFSOJXMNKBBDFV-YCPHGPKFSA-N 1 1 319.449 3.817 20 5 DHBDMO C[C@@H](NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000481028076 1034559695 /nfs/dbraw/zinc/55/96/95/1034559695.db2.gz XRUSFRYQSBPRCU-HUUCEWRRSA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@@H]([NH2+]CC(C)(C)N1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000481028076 1034559703 /nfs/dbraw/zinc/55/97/03/1034559703.db2.gz XRUSFRYQSBPRCU-HUUCEWRRSA-N 1 1 319.449 3.756 20 5 DHBDMO Cc1csc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000192639967 1034814455 /nfs/dbraw/zinc/81/44/55/1034814455.db2.gz YDAFFAFSCMCHRP-AWEZNQCLSA-N 1 1 303.387 3.527 20 5 DHBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481578602 1034891219 /nfs/dbraw/zinc/89/12/19/1034891219.db2.gz UVMNCBODKINXCG-QXSJWSMHSA-N 1 1 319.449 3.612 20 5 DHBDMO C[C@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481578602 1034891226 /nfs/dbraw/zinc/89/12/26/1034891226.db2.gz UVMNCBODKINXCG-QXSJWSMHSA-N 1 1 319.449 3.612 20 5 DHBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000159853909 1035097149 /nfs/dbraw/zinc/09/71/49/1035097149.db2.gz OPYQIFAEESEBQP-SFHVURJKSA-N 1 1 311.385 3.944 20 5 DHBDMO Cc1ccc([C@H](C)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000482630806 1035149969 /nfs/dbraw/zinc/14/99/69/1035149969.db2.gz MVVDWHQVVZKENP-XHSDSOJGSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]CCN2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000482630806 1035149973 /nfs/dbraw/zinc/14/99/73/1035149973.db2.gz MVVDWHQVVZKENP-XHSDSOJGSA-N 1 1 319.449 3.817 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1CCN[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000482947471 1035204712 /nfs/dbraw/zinc/20/47/12/1035204712.db2.gz KGSNXVDEYXTLQE-DOTOQJQBSA-N 1 1 319.449 3.818 20 5 DHBDMO CC[C@@H]1CCCCN1CC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000482947471 1035204717 /nfs/dbraw/zinc/20/47/17/1035204717.db2.gz KGSNXVDEYXTLQE-DOTOQJQBSA-N 1 1 319.449 3.818 20 5 DHBDMO CCC(CC)[N@@H+](CCOC)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000042616370 1035228771 /nfs/dbraw/zinc/22/87/71/1035228771.db2.gz CVVJVKUVCYBDRU-UHFFFAOYSA-N 1 1 314.813 3.885 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)ccc1[N+](=O)[O-] ZINC000485470927 1035673225 /nfs/dbraw/zinc/67/32/25/1035673225.db2.gz AWEQJESSMCVJHS-GOSISDBHSA-N 1 1 316.401 3.926 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC[C@H]1CCCC1(F)F ZINC001193742446 1035712696 /nfs/dbraw/zinc/71/26/96/1035712696.db2.gz BTPJUMZERXVRRE-CQSZACIVSA-N 1 1 312.360 3.895 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCCC2(CCC2)O1 ZINC001194262533 1035894294 /nfs/dbraw/zinc/89/42/94/1035894294.db2.gz PAWKJGCUKHUBDC-INIZCTEOSA-N 1 1 318.417 3.561 20 5 DHBDMO CS[C@@H]1CCCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000539900452 1035925383 /nfs/dbraw/zinc/92/53/83/1035925383.db2.gz SUOTXMLDHFUHAT-DDJMYBDESA-N 1 1 306.431 3.826 20 5 DHBDMO C[C@@H](C1CCCCC1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000773974015 1036089611 /nfs/dbraw/zinc/08/96/11/1036089611.db2.gz CSRIPLOCVNWYJH-GUYCJALGSA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1c(C[N@H+]2C[C@H](C)OC3(CCCCC3)C2)cccc1[N+](=O)[O-] ZINC001195649995 1036309474 /nfs/dbraw/zinc/30/94/74/1036309474.db2.gz MFKAHLLSUOKZTA-AWEZNQCLSA-N 1 1 318.417 3.827 20 5 DHBDMO Cc1c(C[N@@H+]2C[C@H](C)OC3(CCCCC3)C2)cccc1[N+](=O)[O-] ZINC001195649995 1036309493 /nfs/dbraw/zinc/30/94/93/1036309493.db2.gz MFKAHLLSUOKZTA-AWEZNQCLSA-N 1 1 318.417 3.827 20 5 DHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000774618104 1036570026 /nfs/dbraw/zinc/57/00/26/1036570026.db2.gz JNGWLWZYKFPFMQ-CXAGYDPISA-N 1 1 314.389 3.536 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC001183371853 1036586408 /nfs/dbraw/zinc/58/64/08/1036586408.db2.gz UVFWYIRPVLUDSM-HUTFFOLGSA-N 1 1 318.442 3.683 20 5 DHBDMO CC[N@@H+](Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C1CCCC1 ZINC000774634406 1036595125 /nfs/dbraw/zinc/59/51/25/1036595125.db2.gz HLBBYRRIGWSERS-UHFFFAOYSA-N 1 1 322.796 3.820 20 5 DHBDMO CC[C@H](C)C[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774628352 1036595954 /nfs/dbraw/zinc/59/59/54/1036595954.db2.gz UIKWATOKDMYMNT-JTQLQIEISA-N 1 1 310.785 3.533 20 5 DHBDMO CC(C)[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774639747 1036605697 /nfs/dbraw/zinc/60/56/97/1036605697.db2.gz XYWXLUFFPIVTMP-NSHDSACASA-N 1 1 322.796 3.533 20 5 DHBDMO Cc1cccc(OCC[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000487681298 1036707938 /nfs/dbraw/zinc/70/79/38/1036707938.db2.gz YMGABLXDHFRZMZ-HNNXBMFYSA-N 1 1 314.385 3.975 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCc2ccsc2C1 ZINC001184135909 1036746681 /nfs/dbraw/zinc/74/66/81/1036746681.db2.gz XGKPWHKAMIPWKG-UHFFFAOYSA-N 1 1 302.399 3.831 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000492419455 1036863607 /nfs/dbraw/zinc/86/36/07/1036863607.db2.gz VNCRJFJAVSVCQN-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO Cc1cc(NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC001185159101 1037048098 /nfs/dbraw/zinc/04/80/98/1037048098.db2.gz SGUZSZFPDHDASF-LBPRGKRZSA-N 1 1 323.412 3.965 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCC(C)(C)CC1 ZINC000774905737 1037198686 /nfs/dbraw/zinc/19/86/86/1037198686.db2.gz RFZYCSWDFPZYCI-UHFFFAOYSA-N 1 1 321.377 3.904 20 5 DHBDMO CC1(C)C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000493361643 1037415515 /nfs/dbraw/zinc/41/55/15/1037415515.db2.gz KXEQUHCGGBRGPG-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO CC1(C)C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000493361643 1037415508 /nfs/dbraw/zinc/41/55/08/1037415508.db2.gz KXEQUHCGGBRGPG-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1sc(C)nc1C ZINC000194385488 1037474457 /nfs/dbraw/zinc/47/44/57/1037474457.db2.gz VRVOJJYLHPMUMI-SECBINFHSA-N 1 1 321.402 3.528 20 5 DHBDMO Cc1[nH+]ccn1-c1ccc(Nc2cc(O)cc([N+](=O)[O-])c2)cc1 ZINC001201221523 1037579507 /nfs/dbraw/zinc/57/95/07/1037579507.db2.gz CXWIPZQWRYUQBS-UHFFFAOYSA-N 1 1 310.313 3.538 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c(F)c1 ZINC000490406352 1037711190 /nfs/dbraw/zinc/71/11/90/1037711190.db2.gz YTGBQXDDRJSTJA-LSDHHAIUSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c(F)c1 ZINC000490406352 1037711206 /nfs/dbraw/zinc/71/12/06/1037711206.db2.gz YTGBQXDDRJSTJA-LSDHHAIUSA-N 1 1 310.394 3.594 20 5 DHBDMO Cc1cccc(OCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000491151843 1037929864 /nfs/dbraw/zinc/92/98/64/1037929864.db2.gz YECOGNVBUOLUMH-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO Cc1cccc(OCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000491151843 1037929878 /nfs/dbraw/zinc/92/98/78/1037929878.db2.gz YECOGNVBUOLUMH-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO C[C@H]1C[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])Cc2ccccc21 ZINC000917040916 1038123166 /nfs/dbraw/zinc/12/31/66/1038123166.db2.gz XTYBVIHDRWSTSD-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])Cc2ccccc21 ZINC000917040916 1038123172 /nfs/dbraw/zinc/12/31/72/1038123172.db2.gz XTYBVIHDRWSTSD-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1CCCC1(F)F)C1CC1 ZINC000588232712 1038277999 /nfs/dbraw/zinc/27/79/99/1038277999.db2.gz YHXWEAVFPMIZSC-DZGCQCFKSA-N 1 1 310.344 3.693 20 5 DHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1CC1CCCCC1 ZINC001190643072 1038361317 /nfs/dbraw/zinc/36/13/17/1038361317.db2.gz IOKNOCJTTGRDGG-MRXNPFEDSA-N 1 1 320.437 3.535 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC001190975696 1038412228 /nfs/dbraw/zinc/41/22/28/1038412228.db2.gz GPMSBKCOSDWAJX-SFHVURJKSA-N 1 1 316.401 3.926 20 5 DHBDMO Cc1[nH+]ccn1CCCNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000589113872 1038433730 /nfs/dbraw/zinc/43/37/30/1038433730.db2.gz RBURSDSVKADSLC-UHFFFAOYSA-N 1 1 310.304 3.540 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H]1C[C@@H]1c1ccccc1)CCO2 ZINC000589521537 1038500380 /nfs/dbraw/zinc/50/03/80/1038500380.db2.gz FKXZXJHDGVBWRJ-CRAIPNDOSA-N 1 1 324.380 3.593 20 5 DHBDMO Cn1nc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000589937961 1038553883 /nfs/dbraw/zinc/55/38/83/1038553883.db2.gz BHSKJSPJMLHGEV-UHFFFAOYSA-N 1 1 324.384 3.506 20 5 DHBDMO CO[C@H](CC(C)C)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001192080641 1038582153 /nfs/dbraw/zinc/58/21/53/1038582153.db2.gz MMIFGLCIHVBKLJ-CQSZACIVSA-N 1 1 314.813 3.741 20 5 DHBDMO CO[C@H](CC(C)C)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001192080641 1038582165 /nfs/dbraw/zinc/58/21/65/1038582165.db2.gz MMIFGLCIHVBKLJ-CQSZACIVSA-N 1 1 314.813 3.741 20 5 DHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001192173262 1038597998 /nfs/dbraw/zinc/59/79/98/1038597998.db2.gz HLALPGJZLCQODO-RHSMWYFYSA-N 1 1 306.406 3.874 20 5 DHBDMO CC(C)c1csc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000573576671 1038997959 /nfs/dbraw/zinc/99/79/59/1038997959.db2.gz MFQXTBGAAWLCDG-CYBMUJFWSA-N 1 1 317.414 3.952 20 5 DHBDMO Cc1c([C@@H](C)NC[C@H]2CC[N@@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000599074720 1039027564 /nfs/dbraw/zinc/02/75/64/1039027564.db2.gz VULMAWYWUKUFDO-GDBMZVCRSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c([C@@H](C)NC[C@H]2CC[N@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000599074720 1039027581 /nfs/dbraw/zinc/02/75/81/1039027581.db2.gz VULMAWYWUKUFDO-GDBMZVCRSA-N 1 1 317.433 3.571 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592181767 1039164026 /nfs/dbraw/zinc/16/40/26/1039164026.db2.gz HUXBUABTYYJEOY-KBPBESRZSA-N 1 1 304.390 3.547 20 5 DHBDMO C[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]12 ZINC000603847239 1039184658 /nfs/dbraw/zinc/18/46/58/1039184658.db2.gz KRFHLEZWGCYHIN-OWCLPIDISA-N 1 1 318.417 3.874 20 5 DHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC[C@H]1C ZINC000603854125 1039189827 /nfs/dbraw/zinc/18/98/27/1039189827.db2.gz QZMXGYFISWVGPW-NEPJUHHUSA-N 1 1 311.813 3.923 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@H]1C ZINC000573985076 1039193439 /nfs/dbraw/zinc/19/34/39/1039193439.db2.gz MPOFCJAKOXCHFV-ZJUUUORDSA-N 1 1 302.296 3.844 20 5 DHBDMO Cc1cc(NCCCC[N@@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000603860148 1039206609 /nfs/dbraw/zinc/20/66/09/1039206609.db2.gz SDHPUQYJRCEEII-CQSZACIVSA-N 1 1 305.422 3.827 20 5 DHBDMO C[C@@H](C1CC1)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000604012347 1039279107 /nfs/dbraw/zinc/27/91/07/1039279107.db2.gz YSACRBOKQFKNOT-ZDUSSCGKSA-N 1 1 304.390 3.627 20 5 DHBDMO Cc1ccc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cc1[N+](=O)[O-] ZINC000574143911 1039417814 /nfs/dbraw/zinc/41/78/14/1039417814.db2.gz DNGVZJDFHRTHGB-KRWDZBQOSA-N 1 1 318.417 3.827 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594612901 1039875632 /nfs/dbraw/zinc/87/56/32/1039875632.db2.gz OUBJFSDCZQVKRV-IMXKFXGHSA-N 1 1 316.401 3.642 20 5 DHBDMO CC1(C)CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000574885319 1040056916 /nfs/dbraw/zinc/05/69/16/1040056916.db2.gz ONUDNKZSOCGQEL-UHFFFAOYSA-N 1 1 302.296 3.988 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@@H]2c2ccccc2C)c1[N+](=O)[O-] ZINC000595293475 1040092321 /nfs/dbraw/zinc/09/23/21/1040092321.db2.gz ORFHCALZMVOCSD-CQSZACIVSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2c2ccccc2C)c1[N+](=O)[O-] ZINC000595293475 1040092331 /nfs/dbraw/zinc/09/23/31/1040092331.db2.gz ORFHCALZMVOCSD-CQSZACIVSA-N 1 1 301.346 3.537 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595329913 1040099922 /nfs/dbraw/zinc/09/99/22/1040099922.db2.gz DOVPNIQCTLYIRM-ZIAGYGMSSA-N 1 1 312.410 3.840 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000595338921 1040102167 /nfs/dbraw/zinc/10/21/67/1040102167.db2.gz LXWPMQDEUAOMHK-UHFFFAOYSA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000595338921 1040102169 /nfs/dbraw/zinc/10/21/69/1040102169.db2.gz LXWPMQDEUAOMHK-UHFFFAOYSA-N 1 1 320.286 3.898 20 5 DHBDMO Cc1noc(C[N@@H+](C)[C@H](C)Cc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000595320246 1040109528 /nfs/dbraw/zinc/10/95/28/1040109528.db2.gz GUEZOXWPAFABQG-SNVBAGLBSA-N 1 1 323.780 3.608 20 5 DHBDMO Cc1noc(C[N@H+](C)[C@H](C)Cc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000595320246 1040109537 /nfs/dbraw/zinc/10/95/37/1040109537.db2.gz GUEZOXWPAFABQG-SNVBAGLBSA-N 1 1 323.780 3.608 20 5 DHBDMO Cc1noc(C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)c1[N+](=O)[O-] ZINC000595367595 1040126482 /nfs/dbraw/zinc/12/64/82/1040126482.db2.gz FRZHABWLCOYAHU-HNNXBMFYSA-N 1 1 319.336 3.661 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)c1[N+](=O)[O-] ZINC000595367596 1040127415 /nfs/dbraw/zinc/12/74/15/1040127415.db2.gz FRZHABWLCOYAHU-OAHLLOKOSA-N 1 1 319.336 3.661 20 5 DHBDMO COc1ccccc1[C@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595407191 1040129507 /nfs/dbraw/zinc/12/95/07/1040129507.db2.gz COHNGGHGJYVDSI-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO CC(C)[N@@H+](CCc1nccs1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595390562 1040130906 /nfs/dbraw/zinc/13/09/06/1040130906.db2.gz YPTOMNUSQONXAT-UHFFFAOYSA-N 1 1 323.393 3.644 20 5 DHBDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595408212 1040131150 /nfs/dbraw/zinc/13/11/50/1040131150.db2.gz JTAGIEBFKLJHOE-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000595432199 1040138010 /nfs/dbraw/zinc/13/80/10/1040138010.db2.gz QYKNNAVWJWBAMT-CYBMUJFWSA-N 1 1 307.325 3.580 20 5 DHBDMO COc1ccc2c(c1)CC[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000595760192 1040232705 /nfs/dbraw/zinc/23/27/05/1040232705.db2.gz RQZFKEYLVATRMA-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc2c(c1)CC[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000595760192 1040232721 /nfs/dbraw/zinc/23/27/21/1040232721.db2.gz RQZFKEYLVATRMA-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000595785287 1040256100 /nfs/dbraw/zinc/25/61/00/1040256100.db2.gz DACGJCBYMJMLSA-PBHICJAKSA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC3CC2(c2ccccc2)C3)cc1 ZINC000595909679 1040273329 /nfs/dbraw/zinc/27/33/29/1040273329.db2.gz BMXJWPWROKHWEQ-UHFFFAOYSA-N 1 1 308.381 3.758 20 5 DHBDMO C[N@@H+](CCCCNc1ccc(C(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000596260852 1040362685 /nfs/dbraw/zinc/36/26/85/1040362685.db2.gz MBJYECKGTZELIO-UHFFFAOYSA-N 1 1 313.348 3.819 20 5 DHBDMO Cc1ncc(-c2cccc(C[N@@H+]3CCC[C@@H]3C)c2)cc1[N+](=O)[O-] ZINC000596630361 1040528701 /nfs/dbraw/zinc/52/87/01/1040528701.db2.gz PWYGDDZUNSYXKO-ZDUSSCGKSA-N 1 1 311.385 3.950 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000597224048 1040702065 /nfs/dbraw/zinc/70/20/65/1040702065.db2.gz CNHXEGLQNZRTQK-WMZOPIPTSA-N 1 1 318.417 3.684 20 5 DHBDMO CC[C@@H](C)[N@@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602438582 1041032939 /nfs/dbraw/zinc/03/29/39/1041032939.db2.gz FXAAJCJGGRIJPH-SSDOTTSWSA-N 1 1 307.213 3.649 20 5 DHBDMO CSC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000602724351 1041178195 /nfs/dbraw/zinc/17/81/95/1041178195.db2.gz FOXBQQDBFLDSBL-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO Cc1ncc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000602957839 1041324294 /nfs/dbraw/zinc/32/42/94/1041324294.db2.gz UUZHJYSPFVUOFP-MRVPVSSYSA-N 1 1 311.794 3.864 20 5 DHBDMO CCC[C@@H]([NH2+][C@H](C)Cc1cc(C)[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000090527810 185300711 /nfs/dbraw/zinc/30/07/11/185300711.db2.gz FMOIEZSJIFVZGK-SJKOYZFVSA-N 1 1 316.405 3.688 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCC2(CCOCC2)C1 ZINC000272293131 130017126 /nfs/dbraw/zinc/01/71/26/130017126.db2.gz HKBKCFOWEUPSNX-OAHLLOKOSA-N 1 1 318.417 3.857 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000275811546 130391253 /nfs/dbraw/zinc/39/12/53/130391253.db2.gz IFAOSXJXBAVRLY-INIZCTEOSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@H](c1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284015533 131041306 /nfs/dbraw/zinc/04/13/06/131041306.db2.gz HONQCCOKSJJXTL-GFCCVEGCSA-N 1 1 315.329 3.696 20 5 DHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284015533 131041307 /nfs/dbraw/zinc/04/13/07/131041307.db2.gz HONQCCOKSJJXTL-GFCCVEGCSA-N 1 1 315.329 3.696 20 5 DHBDMO C[C@H]([NH2+]Cc1cnc(C(C)(C)C)nc1)c1ccccc1[N+](=O)[O-] ZINC000284374385 131075416 /nfs/dbraw/zinc/07/54/16/131075416.db2.gz NWPMKAGXFKJXOS-LBPRGKRZSA-N 1 1 314.389 3.533 20 5 DHBDMO Cc1c(C[N@H+]2CCC=C(c3cccnc3)C2)cccc1[N+](=O)[O-] ZINC000289392000 131381525 /nfs/dbraw/zinc/38/15/25/131381525.db2.gz RBLXHRYBDFCFQK-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(F)cn1 ZINC000297353797 132011943 /nfs/dbraw/zinc/01/19/43/132011943.db2.gz PGQKWBPUKNCGEX-WDEREUQCSA-N 1 1 319.336 3.549 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000298273713 132053763 /nfs/dbraw/zinc/05/37/63/132053763.db2.gz NYOKAOYRFMKSCU-TUKIKUTGSA-N 1 1 310.344 3.941 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000119768494 132136773 /nfs/dbraw/zinc/13/67/73/132136773.db2.gz YTGSRMJIAWHQMP-HNNXBMFYSA-N 1 1 306.406 3.577 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccccn1 ZINC000179470386 331524734 /nfs/dbraw/zinc/52/47/34/331524734.db2.gz HJPSBAOQLGEGBQ-OAHLLOKOSA-N 1 1 315.373 3.629 20 5 DHBDMO C[C@@H](c1ccccc1F)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000520059596 332052918 /nfs/dbraw/zinc/05/29/18/332052918.db2.gz UGIXQMRNGHUCIE-ZDUSSCGKSA-N 1 1 318.348 3.806 20 5 DHBDMO CCc1noc(C)c1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000559882121 332287957 /nfs/dbraw/zinc/28/79/57/332287957.db2.gz IRHDZCDMLNQUPA-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CC(Cc2ccc(F)c(F)c2)C1 ZINC000559993370 332300215 /nfs/dbraw/zinc/30/02/15/332300215.db2.gz SYIYCHJZFWKMCK-UHFFFAOYSA-N 1 1 318.323 3.548 20 5 DHBDMO CC(C)OCCC[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000560554631 332359430 /nfs/dbraw/zinc/35/94/30/332359430.db2.gz CSJTUKVIGNIXNG-UHFFFAOYSA-N 1 1 308.422 3.965 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180429020 333028411 /nfs/dbraw/zinc/02/84/11/333028411.db2.gz LMOUAVOMCYQMGV-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1cccc(O)c1 ZINC000182432257 333040179 /nfs/dbraw/zinc/04/01/79/333040179.db2.gz CNWLFOVUCXXEHA-JTQLQIEISA-N 1 1 306.749 3.805 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)cn2c1 ZINC000178725939 333143074 /nfs/dbraw/zinc/14/30/74/333143074.db2.gz WTFICGHIZPKKCZ-AWEZNQCLSA-N 1 1 324.384 3.710 20 5 DHBDMO CCC[C@H](NC[C@@H](C)C[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000320696582 335125045 /nfs/dbraw/zinc/12/50/45/335125045.db2.gz HQEXLKSPZFEIJK-QAPCUYQASA-N 1 1 319.449 3.758 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2cccnc21 ZINC000365015578 333334476 /nfs/dbraw/zinc/33/44/76/333334476.db2.gz COBYBFWUWSFTJT-KRWDZBQOSA-N 1 1 311.385 3.542 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000463493454 333381175 /nfs/dbraw/zinc/38/11/75/333381175.db2.gz LJJWIVSKZOWCLO-YPMHNXCESA-N 1 1 310.369 3.753 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(C)s1 ZINC000430222804 334001235 /nfs/dbraw/zinc/00/12/35/334001235.db2.gz TVYOQOHFKWPWCV-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(C)s1 ZINC000430222804 334001236 /nfs/dbraw/zinc/00/12/36/334001236.db2.gz TVYOQOHFKWPWCV-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO CC(C)c1ccc([C@H](N)C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000414849512 334121855 /nfs/dbraw/zinc/12/18/55/334121855.db2.gz RKIPWUSFDQPNMZ-GOSISDBHSA-N 1 1 313.401 3.508 20 5 DHBDMO COc1ccc([C@H](C)[N@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000298754153 334251011 /nfs/dbraw/zinc/25/10/11/334251011.db2.gz NNOASWYVEPPHTJ-NSHDSACASA-N 1 1 306.387 3.858 20 5 DHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000298754153 334251013 /nfs/dbraw/zinc/25/10/13/334251013.db2.gz NNOASWYVEPPHTJ-NSHDSACASA-N 1 1 306.387 3.858 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(N(C)C)CCCCC1 ZINC000531947550 334305329 /nfs/dbraw/zinc/30/53/29/334305329.db2.gz COJOIOVPOQCQRI-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(N(C)C)CCCCC1 ZINC000531947549 334305403 /nfs/dbraw/zinc/30/54/03/334305403.db2.gz COJOIOVPOQCQRI-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO C[C@H](c1cccc(F)c1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000535245732 334381987 /nfs/dbraw/zinc/38/19/87/334381987.db2.gz DYBJWVASEQXLSD-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H](c1cccc(F)c1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000535245732 334381988 /nfs/dbraw/zinc/38/19/88/334381988.db2.gz DYBJWVASEQXLSD-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nccn2CC(C)C)cc1[N+](=O)[O-] ZINC000164792427 334667450 /nfs/dbraw/zinc/66/74/50/334667450.db2.gz WBYPKXJQEYGHNU-AWEZNQCLSA-N 1 1 316.405 3.607 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)N[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000344133039 335220474 /nfs/dbraw/zinc/22/04/74/335220474.db2.gz YADMWVFXOLYFSB-WMLDXEAASA-N 1 1 307.438 3.756 20 5 DHBDMO CCCCN(C)C[C@H](C)[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000344133039 335220475 /nfs/dbraw/zinc/22/04/75/335220475.db2.gz YADMWVFXOLYFSB-WMLDXEAASA-N 1 1 307.438 3.756 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@@H](CO)c2ccsc2)cc1[N+](=O)[O-] ZINC000349645192 335688024 /nfs/dbraw/zinc/68/80/24/335688024.db2.gz KELLUUKRGOTTSI-HNNXBMFYSA-N 1 1 320.414 3.603 20 5 DHBDMO CS[C@@H]1CCCC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000351753556 336064723 /nfs/dbraw/zinc/06/47/23/336064723.db2.gz WUOXSEZCELTKMJ-LLVKDONJSA-N 1 1 316.373 3.591 20 5 DHBDMO CS[C@@H]1CCCC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000351753556 336064725 /nfs/dbraw/zinc/06/47/25/336064725.db2.gz WUOXSEZCELTKMJ-LLVKDONJSA-N 1 1 316.373 3.591 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000332317062 336168076 /nfs/dbraw/zinc/16/80/76/336168076.db2.gz MWTWDSWNRDVVPW-STQMWFEESA-N 1 1 317.414 3.992 20 5 DHBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C2 ZINC000352422312 336217706 /nfs/dbraw/zinc/21/77/06/336217706.db2.gz IHLNEQFCAPXUHS-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C2 ZINC000352422312 336217707 /nfs/dbraw/zinc/21/77/07/336217707.db2.gz IHLNEQFCAPXUHS-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000352609238 336226640 /nfs/dbraw/zinc/22/66/40/336226640.db2.gz SALKKCBUKOQYLW-LLVKDONJSA-N 1 1 300.399 3.697 20 5 DHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C12CCC2 ZINC000352609044 336226672 /nfs/dbraw/zinc/22/66/72/336226672.db2.gz QNDMCYUZANMGQY-HOTGVXAUSA-N 1 1 322.380 3.513 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000532584485 336256447 /nfs/dbraw/zinc/25/64/47/336256447.db2.gz YNXGYVHIORBQMZ-HNNXBMFYSA-N 1 1 317.433 3.606 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000481756522 336279556 /nfs/dbraw/zinc/27/95/56/336279556.db2.gz NMVGVPINYXDSMP-ZWNOBZJWSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 ZINC000301272225 336298001 /nfs/dbraw/zinc/29/80/01/336298001.db2.gz JWVWAIZEXMFETB-HOTGVXAUSA-N 1 1 317.433 3.686 20 5 DHBDMO O=[N+]([O-])c1ccc(NCCNc2cc[nH+]c3ccsc32)cc1 ZINC000301376447 336303442 /nfs/dbraw/zinc/30/34/42/336303442.db2.gz WBEBSUKHAUVANC-UHFFFAOYSA-N 1 1 314.370 3.729 20 5 DHBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000301606750 336318022 /nfs/dbraw/zinc/31/80/22/336318022.db2.gz NGNJIPKFPRFBRK-GFCCVEGCSA-N 1 1 311.813 3.638 20 5 DHBDMO Cc1[nH+]ccn1CCCN(C)c1cc(C)c([N+](=O)[O-])cc1Cl ZINC000301810419 336331562 /nfs/dbraw/zinc/33/15/62/336331562.db2.gz ZRUVRGHISUSDHQ-UHFFFAOYSA-N 1 1 322.796 3.588 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CCN(c1cc[nH+]c3ccsc31)C2 ZINC000301842013 336333611 /nfs/dbraw/zinc/33/36/11/336333611.db2.gz ZKFOBRIQYRCWOG-UHFFFAOYSA-N 1 1 311.366 3.767 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC000301842159 336333669 /nfs/dbraw/zinc/33/36/69/336333669.db2.gz QBKOTKDIDHLHIL-DLBZAZTESA-N 1 1 315.348 3.591 20 5 DHBDMO O=[N+]([O-])c1ccsc1NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000301923567 336338305 /nfs/dbraw/zinc/33/83/05/336338305.db2.gz FXMYANRFHSPHTG-CYBMUJFWSA-N 1 1 321.402 3.888 20 5 DHBDMO Cc1[nH+]ccn1CCCN(C)c1c(C)cc([N+](=O)[O-])cc1Cl ZINC000302833622 336371402 /nfs/dbraw/zinc/37/14/02/336371402.db2.gz SNUCWKHAQQFGTQ-UHFFFAOYSA-N 1 1 322.796 3.588 20 5 DHBDMO O=[N+]([O-])c1ccccc1CN(c1cc[nH+]cc1Cl)C1CC1 ZINC000355090983 336494300 /nfs/dbraw/zinc/49/43/00/336494300.db2.gz LYWQVHOZZVBJPA-UHFFFAOYSA-N 1 1 303.749 3.812 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCCOCC2)s1 ZINC000376507048 337035279 /nfs/dbraw/zinc/03/52/79/337035279.db2.gz SXKNKKAHGAUTIS-UHFFFAOYSA-N 1 1 318.398 3.546 20 5 DHBDMO CC[N@@H+](CCc1nccs1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182931526 337190695 /nfs/dbraw/zinc/19/06/95/337190695.db2.gz NHDWDIRKVJTFCU-CYBMUJFWSA-N 1 1 319.430 3.985 20 5 DHBDMO Cc1c(CNc2cc[nH+]cc2Br)cccc1[N+](=O)[O-] ZINC000231869263 337278369 /nfs/dbraw/zinc/27/83/69/337278369.db2.gz CRTGRJKOBPTSGN-UHFFFAOYSA-N 1 1 322.162 3.673 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2cccc(C)c2C)ccc1[N+](=O)[O-] ZINC000428715279 338059214 /nfs/dbraw/zinc/05/92/14/338059214.db2.gz FQIZENIHWWVCNH-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO CSC[C@@H]1CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000429293572 338076690 /nfs/dbraw/zinc/07/66/90/338076690.db2.gz LVCWJCSWTFKJGY-LLVKDONJSA-N 1 1 314.838 3.823 20 5 DHBDMO CC[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430217123 338101743 /nfs/dbraw/zinc/10/17/43/338101743.db2.gz GWQSSGUSRIQLIC-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccco1)C(C)C ZINC000430229463 338102403 /nfs/dbraw/zinc/10/24/03/338102403.db2.gz VSEGZHPBDDCLKZ-UHFFFAOYSA-N 1 1 304.346 3.607 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccco1)C(C)C ZINC000430229463 338102404 /nfs/dbraw/zinc/10/24/04/338102404.db2.gz VSEGZHPBDDCLKZ-UHFFFAOYSA-N 1 1 304.346 3.607 20 5 DHBDMO CC1=C[C@@H](C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000430883234 338117914 /nfs/dbraw/zinc/11/79/14/338117914.db2.gz PKNGUWDXQRJSQG-SNVBAGLBSA-N 1 1 312.316 3.594 20 5 DHBDMO CC1=C[C@@H](C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000430883234 338117915 /nfs/dbraw/zinc/11/79/15/338117915.db2.gz PKNGUWDXQRJSQG-SNVBAGLBSA-N 1 1 312.316 3.594 20 5 DHBDMO CC(C)[N@@H+](C)CCCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433172020 338184048 /nfs/dbraw/zinc/18/40/48/338184048.db2.gz BTTMPAMYACJFKH-KRWDZBQOSA-N 1 1 319.449 3.637 20 5 DHBDMO COc1ccc(OCC[N@@H+](C(C)C)C2CCCC2)c([N+](=O)[O-])c1 ZINC000439967681 338382041 /nfs/dbraw/zinc/38/20/41/338382041.db2.gz XRQLRFKBLMNWFG-UHFFFAOYSA-N 1 1 322.405 3.635 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CC(C)(CC(F)(F)F)C1 ZINC000459637278 339039693 /nfs/dbraw/zinc/03/96/93/339039693.db2.gz LNISGPIZKMFUKZ-UHFFFAOYSA-N 1 1 302.296 3.678 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCC2 ZINC000459638226 339039703 /nfs/dbraw/zinc/03/97/03/339039703.db2.gz TUNOVXUCXFUWHW-WDEREUQCSA-N 1 1 317.414 3.952 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459788602 339048688 /nfs/dbraw/zinc/04/86/88/339048688.db2.gz FHURLSRUXUUYEL-DOPJRALCSA-N 1 1 318.417 3.529 20 5 DHBDMO Cc1cc(NC[C@@H]2CCC[N@H+](C(C)C)C2)c(F)cc1[N+](=O)[O-] ZINC000461787359 339067103 /nfs/dbraw/zinc/06/71/03/339067103.db2.gz UGTNRGVGIHQSLK-ZDUSSCGKSA-N 1 1 309.385 3.575 20 5 DHBDMO COCC[C@@H]1CCCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000468692169 339268684 /nfs/dbraw/zinc/26/86/84/339268684.db2.gz ZZEZSZSFDZWVFN-HWYHOQROSA-N 1 1 318.417 3.747 20 5 DHBDMO COC[C@@H]1CCCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000468693239 339268691 /nfs/dbraw/zinc/26/86/91/339268691.db2.gz IJQTULTVCIFYEI-MRXNPFEDSA-N 1 1 320.433 3.967 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000469988409 339307030 /nfs/dbraw/zinc/30/70/30/339307030.db2.gz ARVVJHXAXYJGJU-CYBMUJFWSA-N 1 1 316.323 3.800 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000469994355 339307392 /nfs/dbraw/zinc/30/73/92/339307392.db2.gz XCAZTFMHPWIXGD-GFCCVEGCSA-N 1 1 320.286 3.897 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000469994355 339307393 /nfs/dbraw/zinc/30/73/93/339307393.db2.gz XCAZTFMHPWIXGD-GFCCVEGCSA-N 1 1 320.286 3.897 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000470169028 339312497 /nfs/dbraw/zinc/31/24/97/339312497.db2.gz AQVIKXUCLOLXJH-SZGZABIGSA-N 1 1 311.385 3.876 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCn2cccc2[C@@H]1C ZINC000470169028 339312498 /nfs/dbraw/zinc/31/24/98/339312498.db2.gz AQVIKXUCLOLXJH-SZGZABIGSA-N 1 1 311.385 3.876 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000470169026 339312547 /nfs/dbraw/zinc/31/25/47/339312547.db2.gz AQVIKXUCLOLXJH-GOFCXVBSSA-N 1 1 311.385 3.876 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCn2cccc2[C@@H]1C ZINC000470169026 339312548 /nfs/dbraw/zinc/31/25/48/339312548.db2.gz AQVIKXUCLOLXJH-GOFCXVBSSA-N 1 1 311.385 3.876 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCC1CCOCC1 ZINC000470178619 339313037 /nfs/dbraw/zinc/31/30/37/339313037.db2.gz LLAVVDQHCBSKPA-QINSGFPZSA-N 1 1 318.417 3.747 20 5 DHBDMO CO[C@@H](C)C[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C(C)C ZINC000470179366 339313174 /nfs/dbraw/zinc/31/31/74/339313174.db2.gz WWGZSBIICQKIMR-MZLJFPOFSA-N 1 1 306.406 3.743 20 5 DHBDMO CCn1nc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000472055948 339361340 /nfs/dbraw/zinc/36/13/40/339361340.db2.gz RCXSKCIAOALSGQ-CYBMUJFWSA-N 1 1 324.384 3.815 20 5 DHBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](CC)c1ccccc1 ZINC000472455292 339372238 /nfs/dbraw/zinc/37/22/38/339372238.db2.gz SYVDBKBXRVWSNF-QGZVFWFLSA-N 1 1 316.405 3.655 20 5 DHBDMO Cc1c(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)cccc1[N+](=O)[O-] ZINC000478506804 339516808 /nfs/dbraw/zinc/51/68/08/339516808.db2.gz OFCWZYNZISIPTJ-OAHLLOKOSA-N 1 1 318.323 3.959 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000497112393 340020569 /nfs/dbraw/zinc/02/05/69/340020569.db2.gz DZUBLUOGVOSYEI-MAUKXSAKSA-N 1 1 320.433 3.701 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C1(C(F)F)CC1 ZINC000503928881 340137241 /nfs/dbraw/zinc/13/72/41/340137241.db2.gz UQMYDVBBJQZFOH-WCQYABFASA-N 1 1 310.344 3.693 20 5 DHBDMO COc1ccccc1C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000505598027 340172367 /nfs/dbraw/zinc/17/23/67/340172367.db2.gz UYGJOPCHLWFLHH-JXMROGBWSA-N 1 1 312.369 3.749 20 5 DHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000507162232 340210255 /nfs/dbraw/zinc/21/02/55/340210255.db2.gz CFEGWRZIVDFFIN-CQSZACIVSA-N 1 1 302.399 3.954 20 5 DHBDMO C[N@H+](C/C=C\c1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000507169289 340210731 /nfs/dbraw/zinc/21/07/31/340210731.db2.gz IFBPLHDWQBSKFA-PLNGDYQASA-N 1 1 300.333 3.879 20 5 DHBDMO C[N@@H+](C/C=C\c1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000507169289 340210732 /nfs/dbraw/zinc/21/07/32/340210732.db2.gz IFBPLHDWQBSKFA-PLNGDYQASA-N 1 1 300.333 3.879 20 5 DHBDMO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1c(F)cccc1F ZINC000507272058 340216483 /nfs/dbraw/zinc/21/64/83/340216483.db2.gz DPWOZACWZSRQMW-UHFFFAOYSA-N 1 1 320.339 3.938 20 5 DHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1c(F)cccc1F ZINC000507272058 340216484 /nfs/dbraw/zinc/21/64/84/340216484.db2.gz DPWOZACWZSRQMW-UHFFFAOYSA-N 1 1 320.339 3.938 20 5 DHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000508530248 340245859 /nfs/dbraw/zinc/24/58/59/340245859.db2.gz GOQHSVBUYXKIQY-HNNXBMFYSA-N 1 1 314.385 3.804 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(F)cc(F)c1 ZINC000511123980 340321476 /nfs/dbraw/zinc/32/14/76/340321476.db2.gz JVVUBDKSTMDHJE-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[C@@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173422478 340364678 /nfs/dbraw/zinc/36/46/78/340364678.db2.gz RAYAIEHHMFUCFC-CZUORRHYSA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@@H](N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173453394 340365453 /nfs/dbraw/zinc/36/54/53/340365453.db2.gz UIWWGICLQYDETC-PBHICJAKSA-N 1 1 317.433 3.510 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCN(CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173453394 340365454 /nfs/dbraw/zinc/36/54/54/340365454.db2.gz UIWWGICLQYDETC-PBHICJAKSA-N 1 1 317.433 3.510 20 5 DHBDMO Cc1c(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)cccc1[N+](=O)[O-] ZINC000237364039 340670367 /nfs/dbraw/zinc/67/03/67/340670367.db2.gz XVCCQGCXLAQSSC-ABAIWWIYSA-N 1 1 300.358 3.909 20 5 DHBDMO COC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000537984378 340795677 /nfs/dbraw/zinc/79/56/77/340795677.db2.gz SITNTKUSQKBYFY-YVEFUNNKSA-N 1 1 318.348 3.772 20 5 DHBDMO Cc1c(C[N@H+]2Cc3ccccc3OC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000543871107 341062139 /nfs/dbraw/zinc/06/21/39/341062139.db2.gz MVDCSHYIEFYSNP-ZDUSSCGKSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1c(C[N@@H+]2Cc3ccccc3OC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000543871107 341062140 /nfs/dbraw/zinc/06/21/40/341062140.db2.gz MVDCSHYIEFYSNP-ZDUSSCGKSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1ccc(C[N@H+]2Cc3ccccc3OC[C@H]2C)cc1[N+](=O)[O-] ZINC000544043592 341067819 /nfs/dbraw/zinc/06/78/19/341067819.db2.gz WWUSRRXNJGMBLF-CQSZACIVSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1ccc(C[N@@H+]2Cc3ccccc3OC[C@H]2C)cc1[N+](=O)[O-] ZINC000544043592 341067820 /nfs/dbraw/zinc/06/78/20/341067820.db2.gz WWUSRRXNJGMBLF-CQSZACIVSA-N 1 1 312.369 3.686 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)S1 ZINC000548296104 341254871 /nfs/dbraw/zinc/25/48/71/341254871.db2.gz VNZPPFYMKPJEOV-AOOOYVTPSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)S1 ZINC000548296104 341254872 /nfs/dbraw/zinc/25/48/72/341254872.db2.gz VNZPPFYMKPJEOV-AOOOYVTPSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H]1C ZINC000549859822 341305163 /nfs/dbraw/zinc/30/51/63/341305163.db2.gz BJKLYOQHAMQFQH-AOOOYVTPSA-N 1 1 302.296 3.701 20 5 DHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(F)F ZINC000556225500 341498121 /nfs/dbraw/zinc/49/81/21/341498121.db2.gz VNQMALKBADHEKN-JTQLQIEISA-N 1 1 304.362 3.710 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000577529311 341916014 /nfs/dbraw/zinc/91/60/14/341916014.db2.gz QIUZCAFHSFUUFC-OAHLLOKOSA-N 1 1 316.332 3.520 20 5 DHBDMO CCCC[N@@H+](CC)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000131855562 520482383 /nfs/dbraw/zinc/48/23/83/520482383.db2.gz VAEIUGYKBCSUEF-GFCCVEGCSA-N 1 1 318.377 3.828 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1CNc1cccc(C2CC2)[nH+]1 ZINC000339430330 521281081 /nfs/dbraw/zinc/28/10/81/521281081.db2.gz UPDNJLRWPWALCD-UHFFFAOYSA-N 1 1 313.357 3.878 20 5 DHBDMO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000265853744 521693217 /nfs/dbraw/zinc/69/32/17/521693217.db2.gz ITWIHJJQQVSGNB-NWANDNLSSA-N 1 1 324.446 3.682 20 5 DHBDMO COc1ccc(C[NH2+]C2(c3ccccc3F)CC2)cc1[N+](=O)[O-] ZINC000130543343 524068884 /nfs/dbraw/zinc/06/88/84/524068884.db2.gz CJDLKOHUMUNGQK-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000157962170 524813268 /nfs/dbraw/zinc/81/32/68/524813268.db2.gz VQMFHTOIVSNJAK-HNNXBMFYSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000359870828 1013058554 /nfs/dbraw/zinc/05/85/54/1013058554.db2.gz JNMKSNPFHSXJLV-KSSFIOAISA-N 1 1 311.385 3.615 20 5 DHBDMO CCOc1ncccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000151196313 1013066445 /nfs/dbraw/zinc/06/64/45/1013066445.db2.gz DMLQAUKCSOLASA-CYBMUJFWSA-N 1 1 315.373 3.548 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC000015301741 1013242173 /nfs/dbraw/zinc/24/21/73/1013242173.db2.gz DBWISGMOKMROLE-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000015301741 1013242181 /nfs/dbraw/zinc/24/21/81/1013242181.db2.gz DBWISGMOKMROLE-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccncc3)C2)c(Cl)c1 ZINC000519641813 1013586125 /nfs/dbraw/zinc/58/61/25/1013586125.db2.gz GSFIRTKHVPSDEN-ZDUSSCGKSA-N 1 1 317.776 3.633 20 5 DHBDMO Cn1cc[nH+]c1C[C@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000610282295 1013716792 /nfs/dbraw/zinc/71/67/92/1013716792.db2.gz GDBSKAPXFFKHOW-INIZCTEOSA-N 1 1 322.368 3.724 20 5 DHBDMO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000610003971 1013843121 /nfs/dbraw/zinc/84/31/21/1013843121.db2.gz UZCQUBGDQMGCAO-CYBMUJFWSA-N 1 1 314.360 3.896 20 5 DHBDMO C[C@H]1c2ccc(F)cc2CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610004028 1013844041 /nfs/dbraw/zinc/84/40/41/1013844041.db2.gz ZWDDQSNFWODBAE-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H]1c2ccc(F)cc2CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610004028 1013844043 /nfs/dbraw/zinc/84/40/43/1013844043.db2.gz ZWDDQSNFWODBAE-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000772953344 1032077266 /nfs/dbraw/zinc/07/72/66/1032077266.db2.gz UKZQXVVYJGJGBF-LBPRGKRZSA-N 1 1 315.329 3.662 20 5 DHBDMO F[C@@H]1CNCC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC001210611228 1013974222 /nfs/dbraw/zinc/97/42/22/1013974222.db2.gz QMMOUUOGCQILFU-QGZVFWFLSA-N 1 1 308.400 3.736 20 5 DHBDMO F[C@@H]1C[NH2+]CCN(Cc2c3ccccc3cc3ccccc32)C1 ZINC001210611228 1013974225 /nfs/dbraw/zinc/97/42/25/1013974225.db2.gz QMMOUUOGCQILFU-QGZVFWFLSA-N 1 1 308.400 3.736 20 5 DHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083211608 1014000931 /nfs/dbraw/zinc/00/09/31/1014000931.db2.gz DAQCJAZQPZROGH-VXGBXAGGSA-N 1 1 303.362 3.747 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(C(F)F)CC2)ccc1Cl ZINC000307886197 1014340974 /nfs/dbraw/zinc/34/09/74/1014340974.db2.gz VDFBRUCLNFLBEQ-UHFFFAOYSA-N 1 1 304.724 3.725 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccccc2C(F)(F)F)cs1 ZINC000060390884 1014462300 /nfs/dbraw/zinc/46/23/00/1014462300.db2.gz ASLXAWFVQHHASZ-UHFFFAOYSA-N 1 1 316.304 3.965 20 5 DHBDMO C[C@@H](c1ccccc1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000521479279 1014709077 /nfs/dbraw/zinc/70/90/77/1014709077.db2.gz MCIYCXLABPRVMC-AWEZNQCLSA-N 1 1 300.358 3.667 20 5 DHBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])s2)C[N@H+]1Cc1ccccc1 ZINC000610709511 1014898115 /nfs/dbraw/zinc/89/81/15/1014898115.db2.gz VDWRHFMMYWTTLC-JSGCOSHPSA-N 1 1 317.414 3.731 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1n[nH]c(C(C)C)n1 ZINC000537945286 1014937449 /nfs/dbraw/zinc/93/74/49/1014937449.db2.gz HQXHSFKDZGPTIE-NWDGAFQWSA-N 1 1 317.393 3.557 20 5 DHBDMO Cc1nc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)s1 ZINC000090888583 1015227871 /nfs/dbraw/zinc/22/78/71/1015227871.db2.gz HYXUWRVNRKTLGM-JTQLQIEISA-N 1 1 305.403 3.827 20 5 DHBDMO C[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000581774660 1015328488 /nfs/dbraw/zinc/32/84/88/1015328488.db2.gz CHHSUPZTFFGBEJ-SNVBAGLBSA-N 1 1 302.296 3.988 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000581774660 1015328496 /nfs/dbraw/zinc/32/84/96/1015328496.db2.gz CHHSUPZTFFGBEJ-SNVBAGLBSA-N 1 1 302.296 3.988 20 5 DHBDMO CCc1cccc(F)c1C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000474723829 1015564146 /nfs/dbraw/zinc/56/41/46/1015564146.db2.gz SVNWYKRSLYPXON-UHFFFAOYSA-N 1 1 318.348 3.595 20 5 DHBDMO CCC(CC)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000610581230 1015629469 /nfs/dbraw/zinc/62/94/69/1015629469.db2.gz NTTSSHGDRDYXRM-UHFFFAOYSA-N 1 1 303.362 3.889 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]4CCC[C@H]43)nc2c1 ZINC000610582575 1015632556 /nfs/dbraw/zinc/63/25/56/1015632556.db2.gz AQNUDDXRQQGNAJ-BXUZGUMPSA-N 1 1 301.346 3.501 20 5 DHBDMO CCOc1cc(C[N@H+](C)[C@@H](C)c2ccncc2)ccc1[N+](=O)[O-] ZINC000276866786 1015719797 /nfs/dbraw/zinc/71/97/97/1015719797.db2.gz HEBJTHUGHYPMOW-ZDUSSCGKSA-N 1 1 315.373 3.582 20 5 DHBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)c2ccncc2)ccc1[N+](=O)[O-] ZINC000276866786 1015719801 /nfs/dbraw/zinc/71/98/01/1015719801.db2.gz HEBJTHUGHYPMOW-ZDUSSCGKSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[C@H](C)C[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000247741761 1015964438 /nfs/dbraw/zinc/96/44/38/1015964438.db2.gz XCSHBYUYNSVHJO-NWDGAFQWSA-N 1 1 318.377 3.684 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000368218129 1032448228 /nfs/dbraw/zinc/44/82/28/1032448228.db2.gz DTCOTJDZMMIRGK-UONOGXRCSA-N 1 1 304.390 3.547 20 5 DHBDMO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000282716849 1032462125 /nfs/dbraw/zinc/46/21/25/1032462125.db2.gz LTUODGFSFNXNMA-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO CC[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1OC ZINC000037562877 1032638601 /nfs/dbraw/zinc/63/86/01/1032638601.db2.gz NTDJGHMVYJTEFH-CYBMUJFWSA-N 1 1 306.387 3.906 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)cc1 ZINC000515510516 1012648000 /nfs/dbraw/zinc/64/80/00/1012648000.db2.gz PCYXCGQWARAQAK-GOSISDBHSA-N 1 1 314.360 3.941 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)cc1 ZINC000515510517 1012649825 /nfs/dbraw/zinc/64/98/25/1012649825.db2.gz PCYXCGQWARAQAK-SFHVURJKSA-N 1 1 314.360 3.941 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)Cc1ccccc1C ZINC000515540857 1012662736 /nfs/dbraw/zinc/66/27/36/1012662736.db2.gz AQYZDFDRXYHRRJ-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO CC(C)[N@H+](C)C[C@@H](C)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000515559888 1012664855 /nfs/dbraw/zinc/66/48/55/1012664855.db2.gz PYIBYSOECFDUMD-CXAGYDPISA-N 1 1 319.449 3.636 20 5 DHBDMO CC(C)N(C)C[C@@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000515559888 1012664858 /nfs/dbraw/zinc/66/48/58/1012664858.db2.gz PYIBYSOECFDUMD-CXAGYDPISA-N 1 1 319.449 3.636 20 5 DHBDMO CCC[C@H]([NH2+][C@H](C)CN(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000336852403 1012943283 /nfs/dbraw/zinc/94/32/83/1012943283.db2.gz QCNPHZLUTVJKBN-PBHICJAKSA-N 1 1 307.438 3.756 20 5 DHBDMO CCC[C@H](NCC[N@H+](CC)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000336862840 1013017404 /nfs/dbraw/zinc/01/74/04/1013017404.db2.gz LWEKHDOWEGVKQV-KRWDZBQOSA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@H](NCC[N@@H+](CC)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000336862840 1013017418 /nfs/dbraw/zinc/01/74/18/1013017418.db2.gz LWEKHDOWEGVKQV-KRWDZBQOSA-N 1 1 305.422 3.510 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@]3(C2)CCCOC3)cc1[N+](=O)[O-] ZINC000342833979 1017534820 /nfs/dbraw/zinc/53/48/20/1017534820.db2.gz DKNLQVHWUFJVRE-SFHVURJKSA-N 1 1 318.417 3.721 20 5 DHBDMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444657204 1017610720 /nfs/dbraw/zinc/61/07/20/1017610720.db2.gz BOTHTCMKHXKLKU-OAHLLOKOSA-N 1 1 316.405 3.872 20 5 DHBDMO COc1cc(C[N@@H+](CC2CCC2)C(C)C)c([N+](=O)[O-])cc1F ZINC000444772563 1017671542 /nfs/dbraw/zinc/67/15/42/1017671542.db2.gz OCUDCNHCMPGEQF-UHFFFAOYSA-N 1 1 310.369 3.753 20 5 DHBDMO Cc1c([C@@H](C)N[C@H]2CC[N@H+](C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000153741843 1018003946 /nfs/dbraw/zinc/00/39/46/1018003946.db2.gz MVCPBLKVTCSHHM-CABCVRRESA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c([C@@H](C)[NH2+][C@H]2CCN(C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000153741843 1018003961 /nfs/dbraw/zinc/00/39/61/1018003961.db2.gz MVCPBLKVTCSHHM-CABCVRRESA-N 1 1 317.433 3.571 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](CCF)C2)c1 ZINC000701926038 1018122799 /nfs/dbraw/zinc/12/27/99/1018122799.db2.gz XUUUSXGFICOEKS-NSHDSACASA-N 1 1 300.761 3.820 20 5 DHBDMO Cc1c(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000525121245 1018175717 /nfs/dbraw/zinc/17/57/17/1018175717.db2.gz BWSVILHLAZGXNZ-KRWDZBQOSA-N 1 1 310.397 3.968 20 5 DHBDMO C[C@H]1CCCC[C@H]1OCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000446715941 1018221521 /nfs/dbraw/zinc/22/15/21/1018221521.db2.gz WGIPGHGXKRWVLF-KBXCAEBGSA-N 1 1 318.417 3.548 20 5 DHBDMO C[C@H]1CCCC[C@H]1OCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000446715941 1018221532 /nfs/dbraw/zinc/22/15/32/1018221532.db2.gz WGIPGHGXKRWVLF-KBXCAEBGSA-N 1 1 318.417 3.548 20 5 DHBDMO CS[C@@H]1CCCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000441121478 1018263079 /nfs/dbraw/zinc/26/30/79/1018263079.db2.gz YCRCPMHOQOUMJI-CYBMUJFWSA-N 1 1 314.838 3.966 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCC3CC3)CC2)c(Cl)c1 ZINC000611783470 1018637277 /nfs/dbraw/zinc/63/72/77/1018637277.db2.gz AHHMACGBIIZQEQ-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO CC1(C)CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000153854908 1018870955 /nfs/dbraw/zinc/87/09/55/1018870955.db2.gz YQZRFIJUZYIDRO-UHFFFAOYSA-N 1 1 315.373 3.872 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(c2ccccn2)CC1 ZINC000611090462 1019397984 /nfs/dbraw/zinc/39/79/84/1019397984.db2.gz XMQNLJSXEPQVFA-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC000611268137 1019428646 /nfs/dbraw/zinc/42/86/46/1019428646.db2.gz SGHREJOYQLMUGZ-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000611350528 1019451605 /nfs/dbraw/zinc/45/16/05/1019451605.db2.gz PUROKMXYMLLHJT-OWCLPIDISA-N 1 1 318.417 3.794 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000611377358 1019464770 /nfs/dbraw/zinc/46/47/70/1019464770.db2.gz QBZJTBVQQNXEND-LBPRGKRZSA-N 1 1 318.348 3.983 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(Cl)cn1 ZINC000611439035 1019485758 /nfs/dbraw/zinc/48/57/58/1019485758.db2.gz GLLHRYFAQNLHDT-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000611554550 1019521479 /nfs/dbraw/zinc/52/14/79/1019521479.db2.gz UWXURUAAAXVQAR-CMPLNLGQSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000611554550 1019521486 /nfs/dbraw/zinc/52/14/86/1019521486.db2.gz UWXURUAAAXVQAR-CMPLNLGQSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC[N@H+]1C ZINC000317376930 1019978485 /nfs/dbraw/zinc/97/84/85/1019978485.db2.gz HWZMPXVHGVFPLY-VHSXEESVSA-N 1 1 317.311 3.508 20 5 DHBDMO C[N@@H+](CC[N+](=O)[O-])[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC001168765356 1020068615 /nfs/dbraw/zinc/06/86/15/1020068615.db2.gz INLOPDDTBCQJNY-UONOGXRCSA-N 1 1 316.323 3.550 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)CCc2ccccc21 ZINC001171740770 1032878992 /nfs/dbraw/zinc/87/89/92/1032878992.db2.gz GXCJQCVCXWIRDU-GFCCVEGCSA-N 1 1 302.399 3.818 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)cc1 ZINC000154912602 1020163532 /nfs/dbraw/zinc/16/35/32/1020163532.db2.gz YPVZVBHOMSSJLO-KRWDZBQOSA-N 1 1 311.385 3.671 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)c1 ZINC000154917229 1020164743 /nfs/dbraw/zinc/16/47/43/1020164743.db2.gz BVTBHBOOQMCQMN-KRWDZBQOSA-N 1 1 311.385 3.671 20 5 DHBDMO CC(C)c1ccc(CN(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000093644436 1020165156 /nfs/dbraw/zinc/16/51/56/1020165156.db2.gz RCEWKEZYHNIZFD-GOEBONIOSA-N 1 1 319.449 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@H+](C)[C@@H]2CCN(C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000093644436 1020165163 /nfs/dbraw/zinc/16/51/63/1020165163.db2.gz RCEWKEZYHNIZFD-GOEBONIOSA-N 1 1 319.449 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)[C@@H]2CCN(C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000093644436 1020165172 /nfs/dbraw/zinc/16/51/72/1020165172.db2.gz RCEWKEZYHNIZFD-GOEBONIOSA-N 1 1 319.449 3.633 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)cs1 ZINC000154947773 1020169612 /nfs/dbraw/zinc/16/96/12/1020169612.db2.gz VJWRXDCLANUJHW-OAHLLOKOSA-N 1 1 317.414 3.733 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)cs1 ZINC000154947773 1020169615 /nfs/dbraw/zinc/16/96/15/1020169615.db2.gz VJWRXDCLANUJHW-OAHLLOKOSA-N 1 1 317.414 3.733 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000123099984 1020510248 /nfs/dbraw/zinc/51/02/48/1020510248.db2.gz PEJYWBCYMGZTIS-OLZOCXBDSA-N 1 1 315.373 3.728 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cccn2C2CC2)c1 ZINC001117743346 1020573150 /nfs/dbraw/zinc/57/31/50/1020573150.db2.gz CUKYTDFJCMBZGE-UHFFFAOYSA-N 1 1 305.765 3.674 20 5 DHBDMO CC[N@H+](CCc1ccccn1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000735491059 1020738957 /nfs/dbraw/zinc/73/89/57/1020738957.db2.gz BWTGLTVWPSKMCB-UHFFFAOYSA-N 1 1 319.792 3.708 20 5 DHBDMO CC[N@@H+](CCc1ccccn1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000735491059 1020738964 /nfs/dbraw/zinc/73/89/64/1020738964.db2.gz BWTGLTVWPSKMCB-UHFFFAOYSA-N 1 1 319.792 3.708 20 5 DHBDMO CCCCCC[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000735791903 1020768755 /nfs/dbraw/zinc/76/87/55/1020768755.db2.gz ZGFMQYWJQDORND-UHFFFAOYSA-N 1 1 318.377 3.657 20 5 DHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000738052046 1020859736 /nfs/dbraw/zinc/85/97/36/1020859736.db2.gz BWTUXHQVBYZTPL-CZUORRHYSA-N 1 1 316.405 3.803 20 5 DHBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@@H+]2Cn2nccc2[N+](=O)[O-])cc1 ZINC000738282637 1020868327 /nfs/dbraw/zinc/86/83/27/1020868327.db2.gz AJEMPBHEBAJMQT-PBHICJAKSA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2Cn2nccc2[N+](=O)[O-])cc1 ZINC000738282637 1020868329 /nfs/dbraw/zinc/86/83/29/1020868329.db2.gz AJEMPBHEBAJMQT-PBHICJAKSA-N 1 1 314.389 3.530 20 5 DHBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000740870915 1020957354 /nfs/dbraw/zinc/95/73/54/1020957354.db2.gz LZCFCLIEBVCPPB-VXGBXAGGSA-N 1 1 311.813 3.557 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000170688870 1021002137 /nfs/dbraw/zinc/00/21/37/1021002137.db2.gz RHNORRUFCPBXTA-PBHICJAKSA-N 1 1 311.385 3.842 20 5 DHBDMO CCC[C@@H](NCC[N@@H+]1CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000766271985 1021002590 /nfs/dbraw/zinc/00/25/90/1021002590.db2.gz WVAJPJKTTNAMCH-RHSMWYFYSA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@@H](NCC[N@H+]1CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000766271985 1021002597 /nfs/dbraw/zinc/00/25/97/1021002597.db2.gz WVAJPJKTTNAMCH-RHSMWYFYSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@H]1CCC[N@H+]1CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000742427866 1021120438 /nfs/dbraw/zinc/12/04/38/1021120438.db2.gz SDFSZNJAMDOUAR-JTQLQIEISA-N 1 1 317.311 3.510 20 5 DHBDMO CC(C)C[N@H+]1CCC[C@H](CN[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000090585613 1021233862 /nfs/dbraw/zinc/23/38/62/1021233862.db2.gz IGDCFXTZXPQTQP-JKSUJKDBSA-N 1 1 319.449 3.613 20 5 DHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154470727 1021335782 /nfs/dbraw/zinc/33/57/82/1021335782.db2.gz GKAIXOXYJXNFME-XKQJLSEDSA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1c([C@H](C)[NH2+][C@@H](C)CN2CCCCCC2)cccc1[N+](=O)[O-] ZINC000480700330 1021461115 /nfs/dbraw/zinc/46/11/15/1021461115.db2.gz QPTSYBMXRUUJET-HOCLYGCPSA-N 1 1 319.449 3.818 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCSc3ccccc32)cs1 ZINC000037563066 1021840341 /nfs/dbraw/zinc/84/03/41/1021840341.db2.gz VRZPPAZDMSRDLV-LBPRGKRZSA-N 1 1 306.412 3.983 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC1(Cl)Cl ZINC000920206115 1022077039 /nfs/dbraw/zinc/07/70/39/1022077039.db2.gz BTJVOSBQDKWHEJ-GFCCVEGCSA-N 1 1 317.216 3.999 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000183338264 1022103145 /nfs/dbraw/zinc/10/31/45/1022103145.db2.gz JNHBDGLUJFVMBX-CYBMUJFWSA-N 1 1 300.358 3.802 20 5 DHBDMO CCC[C@]1(C)CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776587439 1022105849 /nfs/dbraw/zinc/10/58/49/1022105849.db2.gz GNUAXSNRGSXLMB-IAGOWNOFSA-N 1 1 306.406 3.530 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCc2sccc2C1 ZINC000609323064 1022203424 /nfs/dbraw/zinc/20/34/24/1022203424.db2.gz RQNCIGKVUWMYFN-UHFFFAOYSA-N 1 1 318.398 3.613 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCc2sccc2C1 ZINC000609323064 1022203430 /nfs/dbraw/zinc/20/34/30/1022203430.db2.gz RQNCIGKVUWMYFN-UHFFFAOYSA-N 1 1 318.398 3.613 20 5 DHBDMO C[C@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CCc2ccc(Cl)cc21 ZINC001169038872 1022221268 /nfs/dbraw/zinc/22/12/68/1022221268.db2.gz LBVKWXQNSWXWCB-XEZPLFJOSA-N 1 1 322.836 3.747 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2F)C1 ZINC001169048430 1022228432 /nfs/dbraw/zinc/22/84/32/1022228432.db2.gz UZJIYWJFTTUSLJ-PVXIVEMSSA-N 1 1 310.344 3.547 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC001169025991 1022229136 /nfs/dbraw/zinc/22/91/36/1022229136.db2.gz KKOHYJVBJBOJDS-KCXAZCMYSA-N 1 1 308.809 3.922 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)C1 ZINC001169050178 1022231485 /nfs/dbraw/zinc/23/14/85/1022231485.db2.gz ZDQDLMOLRKYMBW-NORZTCDRSA-N 1 1 310.344 3.547 20 5 DHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C12CCC2 ZINC000763453598 1022290058 /nfs/dbraw/zinc/29/00/58/1022290058.db2.gz PMQAWMMXZNEKEC-HOTGVXAUSA-N 1 1 322.380 3.513 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CCc1c(F)cccc1F ZINC001169666357 1022493892 /nfs/dbraw/zinc/49/38/92/1022493892.db2.gz KXSNLFJZBOISFE-UHFFFAOYSA-N 1 1 320.339 3.590 20 5 DHBDMO CN(Cc1nnc[nH]1)Cc1c2ccccc2cc2ccccc21 ZINC000179794524 1022542065 /nfs/dbraw/zinc/54/20/65/1022542065.db2.gz QTBZSWCRNUYHOA-UHFFFAOYSA-N 1 1 302.381 3.743 20 5 DHBDMO O=C(CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000180152776 1022643082 /nfs/dbraw/zinc/64/30/82/1022643082.db2.gz JADJGBCRDVTGKO-UHFFFAOYSA-N 1 1 324.380 3.832 20 5 DHBDMO O=C(CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000180152776 1022643085 /nfs/dbraw/zinc/64/30/85/1022643085.db2.gz JADJGBCRDVTGKO-UHFFFAOYSA-N 1 1 324.380 3.832 20 5 DHBDMO CCn1ccc(C[N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)c1 ZINC000616737762 1022763353 /nfs/dbraw/zinc/76/33/53/1022763353.db2.gz SBNXPDRQUAPRIU-XNTDXEJSSA-N 1 1 313.401 3.952 20 5 DHBDMO CCOc1cc([N+](=O)[O-])ccc1NCCC[N@H+]1CCCC[C@@H]1C ZINC001167752045 1023029876 /nfs/dbraw/zinc/02/98/76/1023029876.db2.gz CAPZYCXKSCKDSR-AWEZNQCLSA-N 1 1 321.421 3.670 20 5 DHBDMO CC[C@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000150749209 1023151180 /nfs/dbraw/zinc/15/11/80/1023151180.db2.gz APYVACLCNFQHEG-HNNXBMFYSA-N 1 1 320.389 3.616 20 5 DHBDMO CCC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000106866083 1023386428 /nfs/dbraw/zinc/38/64/28/1023386428.db2.gz WPSLJZRNQVOWRI-CYBMUJFWSA-N 1 1 310.369 3.515 20 5 DHBDMO CCC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000106866083 1023386431 /nfs/dbraw/zinc/38/64/31/1023386431.db2.gz WPSLJZRNQVOWRI-CYBMUJFWSA-N 1 1 310.369 3.515 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000093503340 1023761587 /nfs/dbraw/zinc/76/15/87/1023761587.db2.gz BXYQVDCFUNIKSB-TXEJJXNPSA-N 1 1 317.414 3.806 20 5 DHBDMO C[N@H+](CCOc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746655028 1023766225 /nfs/dbraw/zinc/76/62/25/1023766225.db2.gz RQZMQSHMAYGXGZ-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746655028 1023766228 /nfs/dbraw/zinc/76/62/28/1023766228.db2.gz RQZMQSHMAYGXGZ-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)[C@@H](C)C(C)C ZINC000112658107 1023816428 /nfs/dbraw/zinc/81/64/28/1023816428.db2.gz QGNPTAGYSZOWLO-AWEZNQCLSA-N 1 1 321.421 3.598 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CCS1 ZINC000789763445 1024158111 /nfs/dbraw/zinc/15/81/11/1024158111.db2.gz KAGVZNAPTAVULB-UHFFFAOYSA-N 1 1 314.838 3.966 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)cn2c1 ZINC000268867096 1024181049 /nfs/dbraw/zinc/18/10/49/1024181049.db2.gz KTYDUPZJUPFHGO-AWEZNQCLSA-N 1 1 324.384 3.710 20 5 DHBDMO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000883462816 1024440197 /nfs/dbraw/zinc/44/01/97/1024440197.db2.gz APIFXQPKCDCANS-MRXNPFEDSA-N 1 1 315.348 3.769 20 5 DHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000532293404 1024594669 /nfs/dbraw/zinc/59/46/69/1024594669.db2.gz UJARBAZKABICRI-MRXNPFEDSA-N 1 1 302.399 3.820 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585765551 1024602797 /nfs/dbraw/zinc/60/27/97/1024602797.db2.gz PZTGVICTMWSJSA-CYBMUJFWSA-N 1 1 324.384 3.673 20 5 DHBDMO CC(C)CCOC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000283354948 1024642955 /nfs/dbraw/zinc/64/29/55/1024642955.db2.gz BKXPQYXRNBDZRH-UHFFFAOYSA-N 1 1 324.396 3.761 20 5 DHBDMO CCc1noc(CC)c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000166922959 1024659543 /nfs/dbraw/zinc/65/95/43/1024659543.db2.gz ZKTIZNYNGNFJBH-LLVKDONJSA-N 1 1 303.362 3.558 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC23CCCCC3)c([N+](=O)[O-])c1 ZINC000792874675 1024819588 /nfs/dbraw/zinc/81/95/88/1024819588.db2.gz WWZBBGWNZMILPP-UHFFFAOYSA-N 1 1 319.361 3.802 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC2CC2)CC2CCC2)c([N+](=O)[O-])c1 ZINC000792881644 1024819879 /nfs/dbraw/zinc/81/98/79/1024819879.db2.gz NBLMWWQAYRZFJD-UHFFFAOYSA-N 1 1 319.361 3.515 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CCCC[C@@H]1C ZINC000792880782 1024823304 /nfs/dbraw/zinc/82/33/04/1024823304.db2.gz VLYJHAJWVWROAW-WFASDCNBSA-N 1 1 321.377 3.904 20 5 DHBDMO CCC[N@@H+]1CCC[C@H]1CN[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353971640 1025308568 /nfs/dbraw/zinc/30/85/68/1025308568.db2.gz LIBJNCNQYJXRPT-IRXDYDNUSA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[N@H+]1CCC[C@H]1CN[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353971640 1025308581 /nfs/dbraw/zinc/30/85/81/1025308581.db2.gz LIBJNCNQYJXRPT-IRXDYDNUSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000584836613 1025408844 /nfs/dbraw/zinc/40/88/44/1025408844.db2.gz MGTGPCHFRGWNDI-KGLIPLIRSA-N 1 1 304.390 3.608 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000584836613 1025408850 /nfs/dbraw/zinc/40/88/50/1025408850.db2.gz MGTGPCHFRGWNDI-KGLIPLIRSA-N 1 1 304.390 3.608 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000886005729 1025434056 /nfs/dbraw/zinc/43/40/56/1025434056.db2.gz IUGVPBINLCGHCK-CYBMUJFWSA-N 1 1 317.776 3.633 20 5 DHBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886014613 1025438158 /nfs/dbraw/zinc/43/81/58/1025438158.db2.gz LPEMKDSBRRWEEY-DOMZBBRYSA-N 1 1 315.348 3.507 20 5 DHBDMO CSc1ccc([C@@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1 ZINC000886186236 1025552386 /nfs/dbraw/zinc/55/23/86/1025552386.db2.gz SZBDRJVVUZKQJV-LLVKDONJSA-N 1 1 303.387 3.563 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000886192045 1025553765 /nfs/dbraw/zinc/55/37/65/1025553765.db2.gz FBNYZWZFXSNFOK-BCDXTJNWSA-N 1 1 323.396 3.900 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc(Cl)nc1 ZINC000069219733 1025668559 /nfs/dbraw/zinc/66/85/59/1025668559.db2.gz BQWCEDFNPFTBGR-LLVKDONJSA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000069219733 1025668569 /nfs/dbraw/zinc/66/85/69/1025668569.db2.gz BQWCEDFNPFTBGR-LLVKDONJSA-N 1 1 305.765 3.836 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2Cc3cccc(Cl)c3C2)cc1 ZINC000805804974 1025684769 /nfs/dbraw/zinc/68/47/69/1025684769.db2.gz XALWZUWGTOTNOP-UHFFFAOYSA-N 1 1 302.761 3.807 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2Cc3cccc(Cl)c3C2)cc1 ZINC000805804974 1025684779 /nfs/dbraw/zinc/68/47/79/1025684779.db2.gz XALWZUWGTOTNOP-UHFFFAOYSA-N 1 1 302.761 3.807 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cc(C2CC2)no1 ZINC000886682349 1025782274 /nfs/dbraw/zinc/78/22/74/1025782274.db2.gz FWUOLWDYJXEHKY-LLVKDONJSA-N 1 1 301.346 3.619 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCOc3ccccc32)c(Cl)c1 ZINC000237813594 1025788875 /nfs/dbraw/zinc/78/88/75/1025788875.db2.gz SOBSOVWKCNPTGO-OAHLLOKOSA-N 1 1 318.760 3.862 20 5 DHBDMO C[N@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@@H]1CCCO1 ZINC000076299935 1025867385 /nfs/dbraw/zinc/86/73/85/1025867385.db2.gz LVIPSDOGJWDICK-INIZCTEOSA-N 1 1 323.392 3.557 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000047253511 1026065983 /nfs/dbraw/zinc/06/59/83/1026065983.db2.gz AXTYBWNYULQLII-VNHYZAJKSA-N 1 1 321.396 3.576 20 5 DHBDMO CCCC[C@H](C)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000289761062 1026161608 /nfs/dbraw/zinc/16/16/08/1026161608.db2.gz FYYFBFAXZHVOAI-LBPRGKRZSA-N 1 1 318.377 3.655 20 5 DHBDMO CCC[N@@H+](CCc1ccccn1)Cc1csc([N+](=O)[O-])c1 ZINC000289840507 1026194417 /nfs/dbraw/zinc/19/44/17/1026194417.db2.gz PHWLRPWWPPQJLQ-UHFFFAOYSA-N 1 1 305.403 3.506 20 5 DHBDMO CCOc1ccc2c(c1)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C2 ZINC000533079566 1026210463 /nfs/dbraw/zinc/21/04/63/1026210463.db2.gz MYXBBZCSUPKYMN-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCOc1ccc2c(c1)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C2 ZINC000533079566 1026210474 /nfs/dbraw/zinc/21/04/74/1026210474.db2.gz MYXBBZCSUPKYMN-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CC(C)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000178868642 1026431649 /nfs/dbraw/zinc/43/16/49/1026431649.db2.gz SIQILKYSVHXENX-QGZVFWFLSA-N 1 1 306.406 3.671 20 5 DHBDMO C[N@H+](Cc1ccc(O)cc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000809753259 1026616403 /nfs/dbraw/zinc/61/64/03/1026616403.db2.gz FXRJVEFCSZMPJY-UHFFFAOYSA-N 1 1 306.749 3.586 20 5 DHBDMO C[N@@H+](Cc1ccc(O)cc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000809753259 1026616407 /nfs/dbraw/zinc/61/64/07/1026616407.db2.gz FXRJVEFCSZMPJY-UHFFFAOYSA-N 1 1 306.749 3.586 20 5 DHBDMO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809787862 1026626309 /nfs/dbraw/zinc/62/63/09/1026626309.db2.gz LBQKSVXNAQXZMQ-QFYYESIMSA-N 1 1 318.760 3.860 20 5 DHBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000280423442 1026648244 /nfs/dbraw/zinc/64/82/44/1026648244.db2.gz ZHGJWGMBIMWOJV-OAHLLOKOSA-N 1 1 312.797 3.639 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1c[nH+]c2c1CCCC2 ZINC000295142447 1027115336 /nfs/dbraw/zinc/11/53/36/1027115336.db2.gz DGBQGDQURRAQRI-UHFFFAOYSA-N 1 1 315.373 3.506 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CC[N@@H+](C3CC3)C2)c(Cl)c1 ZINC000228844261 1027127337 /nfs/dbraw/zinc/12/73/37/1027127337.db2.gz JWVRAWGFQJAMMV-MRVPVSSYSA-N 1 1 316.188 3.550 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CC[N@H+](C3CC3)C2)c(Cl)c1 ZINC000228844261 1027127345 /nfs/dbraw/zinc/12/73/45/1027127345.db2.gz JWVRAWGFQJAMMV-MRVPVSSYSA-N 1 1 316.188 3.550 20 5 DHBDMO Cc1c(C[NH2+]Cc2cc(Cl)ccc2F)cccc1[N+](=O)[O-] ZINC000231884758 1027140765 /nfs/dbraw/zinc/14/07/65/1027140765.db2.gz BETOOWWKUKIANS-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO Cc1c(C[NH2+]Cc2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000231884774 1027140924 /nfs/dbraw/zinc/14/09/24/1027140924.db2.gz QZONDVWPMLPKDD-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@H]2[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000932274822 1027437651 /nfs/dbraw/zinc/43/76/51/1027437651.db2.gz KQUFMIWVWIPPCU-DOMZBBRYSA-N 1 1 315.373 3.659 20 5 DHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000812848635 1027445061 /nfs/dbraw/zinc/44/50/61/1027445061.db2.gz LKJXPVPUZPHMHW-KDOFPFPSSA-N 1 1 314.385 3.539 20 5 DHBDMO CC(C)C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)Cc1ccccn1 ZINC000932449877 1027500952 /nfs/dbraw/zinc/50/09/52/1027500952.db2.gz UVAFPWWEDLPTOL-UHFFFAOYSA-N 1 1 317.364 3.787 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cncs1 ZINC000934197247 1027926894 /nfs/dbraw/zinc/92/68/94/1027926894.db2.gz BMBFMDCEAMOOBH-NSHDSACASA-N 1 1 321.402 3.689 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc(C(F)F)nc1)c1ccccc1[N+](=O)[O-] ZINC000601113012 1027989054 /nfs/dbraw/zinc/98/90/54/1027989054.db2.gz JJIIEIADVKJBDN-SNVBAGLBSA-N 1 1 307.300 3.778 20 5 DHBDMO CC(C)O[C@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601184073 1028016108 /nfs/dbraw/zinc/01/61/08/1028016108.db2.gz GOSLDICPRKKKOH-AWEZNQCLSA-N 1 1 315.373 3.537 20 5 DHBDMO C[C@H]([NH2+][C@@H]1c2ccc(F)cc2O[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000368585158 1028382541 /nfs/dbraw/zinc/38/25/41/1028382541.db2.gz PMTHEHILDJTNRB-DINDLPBHSA-N 1 1 316.332 3.907 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(Cc3ccccn3)CC2)cs1 ZINC000369096160 1028445274 /nfs/dbraw/zinc/44/52/74/1028445274.db2.gz PDPCVQVKGBZNQM-UHFFFAOYSA-N 1 1 317.414 3.506 20 5 DHBDMO C[C@@H](Nc1cccc2cc[nH+]cc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815613770 1028569096 /nfs/dbraw/zinc/56/90/96/1028569096.db2.gz XDLKGNBQZXPJNK-LLVKDONJSA-N 1 1 308.341 3.898 20 5 DHBDMO CC[C@H](CO)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449375671 1028586147 /nfs/dbraw/zinc/58/61/47/1028586147.db2.gz IITYVVAKVVGMPS-GFCCVEGCSA-N 1 1 320.414 3.526 20 5 DHBDMO CC(C)C[C@H](CO)[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000566002543 1028665124 /nfs/dbraw/zinc/66/51/24/1028665124.db2.gz QNGHAHARPLBBHP-OAHLLOKOSA-N 1 1 308.422 3.557 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cncc(F)c3)C2)cc1 ZINC000449500878 1028717160 /nfs/dbraw/zinc/71/71/60/1028717160.db2.gz ONYDZMGHMCDIKY-OAHLLOKOSA-N 1 1 315.348 3.509 20 5 DHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000449507819 1028730505 /nfs/dbraw/zinc/73/05/05/1028730505.db2.gz UIEFCTHZTCGGST-CXAGYDPISA-N 1 1 306.406 3.575 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CC(c2cccc(Cl)c2)C1 ZINC000449557742 1028796968 /nfs/dbraw/zinc/79/69/68/1028796968.db2.gz SSXRJCRWZVILHJ-UHFFFAOYSA-N 1 1 302.761 3.848 20 5 DHBDMO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000449563057 1028806556 /nfs/dbraw/zinc/80/65/56/1028806556.db2.gz QSXHRZJRXLBQOB-CYBMUJFWSA-N 1 1 316.405 3.785 20 5 DHBDMO CCCc1ncc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)o1 ZINC000449615494 1028869704 /nfs/dbraw/zinc/86/97/04/1028869704.db2.gz ZBHLIWCUHLHIOM-UHFFFAOYSA-N 1 1 317.389 3.949 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]1C ZINC000816649564 1028978216 /nfs/dbraw/zinc/97/82/16/1028978216.db2.gz CPVDBFHDEJGXLT-GHMZBOCLSA-N 1 1 303.387 3.559 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]1C ZINC000816649564 1028978232 /nfs/dbraw/zinc/97/82/32/1028978232.db2.gz CPVDBFHDEJGXLT-GHMZBOCLSA-N 1 1 303.387 3.559 20 5 DHBDMO CC(C)[N@H+](C)C[C@H](C)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000568817462 1029130042 /nfs/dbraw/zinc/13/00/42/1029130042.db2.gz PYIBYSOECFDUMD-GUYCJALGSA-N 1 1 319.449 3.636 20 5 DHBDMO CC(C)N(C)C[C@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000568817462 1029130054 /nfs/dbraw/zinc/13/00/54/1029130054.db2.gz PYIBYSOECFDUMD-GUYCJALGSA-N 1 1 319.449 3.636 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000569238561 1029199731 /nfs/dbraw/zinc/19/97/31/1029199731.db2.gz NORALJIERPLJBB-CYBMUJFWSA-N 1 1 317.776 3.633 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCOCC3)s2)cc1 ZINC000374328524 1029293357 /nfs/dbraw/zinc/29/33/57/1029293357.db2.gz ZWKATXXOYZDDBF-UHFFFAOYSA-N 1 1 318.398 3.546 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3cccnc3)C2)c(Cl)c1 ZINC000570088380 1029311505 /nfs/dbraw/zinc/31/15/05/1029311505.db2.gz FLMLGWOGQQZFAQ-CYBMUJFWSA-N 1 1 317.776 3.633 20 5 DHBDMO CC[C@@H]([NH2+][C@H](C)c1cn(C(C)C)nn1)c1cccc([N+](=O)[O-])c1 ZINC000925227797 1029407302 /nfs/dbraw/zinc/40/73/02/1029407302.db2.gz BHSWYWIHOBTLLI-IUODEOHRSA-N 1 1 317.393 3.569 20 5 DHBDMO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000451412480 1029870129 /nfs/dbraw/zinc/87/01/29/1029870129.db2.gz WRDJUKOEVREVJV-WCQYABFASA-N 1 1 316.323 3.800 20 5 DHBDMO CC1(C)C[C@H]([NH2+]Cc2ncccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000530524147 1029877749 /nfs/dbraw/zinc/87/77/49/1029877749.db2.gz HZBWFTFEFHCROB-HNNXBMFYSA-N 1 1 315.348 3.641 20 5 DHBDMO CCO[C@@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C[C@@H]1C ZINC000451542041 1029909035 /nfs/dbraw/zinc/90/90/35/1029909035.db2.gz MRHMNXWELSJVMV-JJRVBVJISA-N 1 1 306.406 3.711 20 5 DHBDMO CCCC[N@@H+](CCOC)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470177004 1029990982 /nfs/dbraw/zinc/99/09/82/1029990982.db2.gz ZVBYJWQIQVSTAT-QINSGFPZSA-N 1 1 306.406 3.747 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@]3(CCSC3)C2)cccc1[N+](=O)[O-] ZINC000451965970 1030070845 /nfs/dbraw/zinc/07/08/45/1030070845.db2.gz NURPOLVXXQCXLV-INIZCTEOSA-N 1 1 306.431 3.622 20 5 DHBDMO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866539982 1030360929 /nfs/dbraw/zinc/36/09/29/1030360929.db2.gz IVAVHQGEHQLCMX-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO CC[C@H]([NH2+]Cc1nn(C)cc1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000866563967 1030374382 /nfs/dbraw/zinc/37/43/82/1030374382.db2.gz TZPIEJQFKMXVIP-ZDUSSCGKSA-N 1 1 324.331 3.507 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000558509501 1030611969 /nfs/dbraw/zinc/61/19/69/1030611969.db2.gz VFCMWWZSFHJWGS-LSDHHAIUSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000558509501 1030611976 /nfs/dbraw/zinc/61/19/76/1030611976.db2.gz VFCMWWZSFHJWGS-LSDHHAIUSA-N 1 1 307.438 3.674 20 5 DHBDMO CCC[C@H]([NH2+]C[C@@H](C)N(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000359021264 1030734676 /nfs/dbraw/zinc/73/46/76/1030734676.db2.gz UHGOFXXCZHIOIG-PBHICJAKSA-N 1 1 307.438 3.756 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cn2c(n1)CCCC2 ZINC000926493644 1030763379 /nfs/dbraw/zinc/76/33/79/1030763379.db2.gz XDBQNCAXPDEFJF-QWHCGFSZSA-N 1 1 314.389 3.539 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(F)ccc1F ZINC000558740735 1030763712 /nfs/dbraw/zinc/76/37/12/1030763712.db2.gz OBPASZAKGBLIKE-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO COc1ccc(C[N@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000359292236 1030889699 /nfs/dbraw/zinc/88/96/99/1030889699.db2.gz DPBFHBJDNSHZFQ-CXAGYDPISA-N 1 1 304.390 3.616 20 5 DHBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)C1 ZINC000359558460 1031027618 /nfs/dbraw/zinc/02/76/18/1031027618.db2.gz OJTVDFYGBXGOOS-SJCJKPOMSA-N 1 1 315.373 3.748 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@]3(CC[C@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000359559002 1031027742 /nfs/dbraw/zinc/02/77/42/1031027742.db2.gz OYNCHYPWQOEQOH-GUYCJALGSA-N 1 1 304.390 3.616 20 5 DHBDMO CC(C)O[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000844379298 1031108612 /nfs/dbraw/zinc/10/86/12/1031108612.db2.gz PJNFDBKSVACWJV-AWEZNQCLSA-N 1 1 312.797 3.638 20 5 DHBDMO CC(C)O[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000844379298 1031108626 /nfs/dbraw/zinc/10/86/26/1031108626.db2.gz PJNFDBKSVACWJV-AWEZNQCLSA-N 1 1 312.797 3.638 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)ccc1Cl ZINC000844439424 1031142323 /nfs/dbraw/zinc/14/23/23/1031142323.db2.gz WYMBBQWRSAABLX-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)ccc1Cl ZINC000844439424 1031142328 /nfs/dbraw/zinc/14/23/28/1031142328.db2.gz WYMBBQWRSAABLX-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872260061 1031564724 /nfs/dbraw/zinc/56/47/24/1031564724.db2.gz HKNOMJRGIBXRKB-MRXNPFEDSA-N 1 1 304.390 3.518 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H](OC3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000872260300 1031566364 /nfs/dbraw/zinc/56/63/64/1031566364.db2.gz UAFTXLXQVYBGPA-KRWDZBQOSA-N 1 1 318.417 3.827 20 5 DHBDMO CC[C@H](CSC)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000124329538 1031685312 /nfs/dbraw/zinc/68/53/12/1031685312.db2.gz PBUPSEWFJSMJNQ-LLVKDONJSA-N 1 1 302.827 3.822 20 5 DHBDMO C[C@H]1CCCCC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777956569 1032040579 /nfs/dbraw/zinc/04/05/79/1032040579.db2.gz JLGVBBDWHBLOPM-AWEZNQCLSA-N 1 1 314.389 3.680 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000877544422 1033347026 /nfs/dbraw/zinc/34/70/26/1033347026.db2.gz WWOHYJLEZJXGGX-LSDHHAIUSA-N 1 1 310.344 3.689 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H]3CCC[C@@H]3C1)CC2 ZINC001172906997 1033441234 /nfs/dbraw/zinc/44/12/34/1033441234.db2.gz ZLZCZNHTGWJVOB-BMGDILEWSA-N 1 1 314.429 3.964 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172913929 1033461053 /nfs/dbraw/zinc/46/10/53/1033461053.db2.gz VVDRAJYCFSKNDQ-VBQJREDUSA-N 1 1 302.418 3.820 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2[C@H](C)CCC[C@@H]2C)c1F ZINC001173181062 1033581783 /nfs/dbraw/zinc/58/17/83/1033581783.db2.gz BGMKATIQIJKQHN-FRRDWIJNSA-N 1 1 324.396 3.936 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC3(CCC3)C2)c1F ZINC001173195168 1033586671 /nfs/dbraw/zinc/58/66/71/1033586671.db2.gz CNVGUAIOLNCWTJ-LBPRGKRZSA-N 1 1 322.380 3.550 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCCC23CC3)c1F ZINC001173197318 1033589903 /nfs/dbraw/zinc/58/99/03/1033589903.db2.gz SPKFNGAYWWKZQA-LBPRGKRZSA-N 1 1 322.380 3.692 20 5 DHBDMO COc1ccc2c(c1)C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173225182 1033602707 /nfs/dbraw/zinc/60/27/07/1033602707.db2.gz BVPQHZBUWPQNQY-ZDUSSCGKSA-N 1 1 312.369 3.550 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1Cc2ccccc2C[C@@H]1C ZINC001173231212 1033605192 /nfs/dbraw/zinc/60/51/92/1033605192.db2.gz KKJZBFJGIGYWKL-CABCVRRESA-N 1 1 310.397 3.973 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1ccccn1 ZINC001173227574 1033605881 /nfs/dbraw/zinc/60/58/81/1033605881.db2.gz QXLYWFYMOKJRTA-KSSFIOAISA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1Cc2ccccc2C[C@H]1C ZINC001173231216 1033606024 /nfs/dbraw/zinc/60/60/24/1033606024.db2.gz KKJZBFJGIGYWKL-LSDHHAIUSA-N 1 1 310.397 3.973 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1ccccn1 ZINC001173227571 1033606242 /nfs/dbraw/zinc/60/62/42/1033606242.db2.gz QXLYWFYMOKJRTA-KBXCAEBGSA-N 1 1 311.385 3.758 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)nc1Cl ZINC000878355077 1033671011 /nfs/dbraw/zinc/67/10/11/1033671011.db2.gz CXXGVHAHVWLQIO-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO Cc1cc(F)c(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(F)c1 ZINC000927094386 1033671459 /nfs/dbraw/zinc/67/14/59/1033671459.db2.gz SZMFBZVZNWRMQO-SNVBAGLBSA-N 1 1 321.327 3.614 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC=C(c3ccccn3)C2)cc1[N+](=O)[O-] ZINC000878648165 1033782279 /nfs/dbraw/zinc/78/22/79/1033782279.db2.gz MGOWNLPGRWJUAQ-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO O=C1OC[C@@H]2C[N@@H+](Cc3c4ccccc4cc4ccccc43)C[C@H]12 ZINC000862545381 1033883001 /nfs/dbraw/zinc/88/30/01/1033883001.db2.gz RCYQMNGQELGCLJ-LPHOPBHVSA-N 1 1 317.388 3.598 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc(F)cc(F)c1 ZINC000178729678 1034260432 /nfs/dbraw/zinc/26/04/32/1034260432.db2.gz WKXYPSUDBBWCLP-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000480944109 1034517617 /nfs/dbraw/zinc/51/76/17/1034517617.db2.gz YKNWTCKWHBTKTM-AWEZNQCLSA-N 1 1 324.446 3.581 20 5 DHBDMO CCC[C@@H]([NH2+][C@H](CCO)c1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000186537982 1034642126 /nfs/dbraw/zinc/64/21/26/1034642126.db2.gz ZQJWUSSZBKQZPE-HZPDHXFCSA-N 1 1 318.373 3.742 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H]1CC1(C)C ZINC001174908272 1034674575 /nfs/dbraw/zinc/67/45/75/1034674575.db2.gz YAXMDFLYEVTMFH-AWEZNQCLSA-N 1 1 306.406 3.860 20 5 DHBDMO CCNC(=O)Nc1cc2[nH+]c3cc(N(C)C)ccc3cc2cc1C ZINC001202550216 1034736750 /nfs/dbraw/zinc/73/67/50/1034736750.db2.gz LNRKMESVTBEHPF-UHFFFAOYSA-N 1 1 322.412 3.904 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc3n[nH]cc32)C2CC2)cc1 ZINC000600111714 1034744403 /nfs/dbraw/zinc/74/44/03/1034744403.db2.gz LBPRADKBHLMSJV-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2Cc3ccccc3C3(CC3)C2)cc1 ZINC000481722137 1034950799 /nfs/dbraw/zinc/95/07/99/1034950799.db2.gz JMHUPQZWDUIZQX-UHFFFAOYSA-N 1 1 324.380 3.521 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2Cc3ccccc3C3(CC3)C2)cc1 ZINC000481730063 1034953120 /nfs/dbraw/zinc/95/31/20/1034953120.db2.gz SFJKAURAORSUIT-UHFFFAOYSA-N 1 1 308.381 3.685 20 5 DHBDMO C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC(C)(C)C ZINC000159425896 1035051810 /nfs/dbraw/zinc/05/18/10/1035051810.db2.gz JBOKKCSGYBBCDT-UHFFFAOYSA-N 1 1 315.211 3.835 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccccc1F ZINC000593061555 1035077233 /nfs/dbraw/zinc/07/72/33/1035077233.db2.gz SBCHEXPUUBPMKU-INIZCTEOSA-N 1 1 318.348 3.983 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]CCN2[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000482630804 1035148911 /nfs/dbraw/zinc/14/89/11/1035148911.db2.gz MVVDWHQVVZKENP-OAGGEKHMSA-N 1 1 319.449 3.817 20 5 DHBDMO COC1(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)CCCC1 ZINC000483174052 1035235562 /nfs/dbraw/zinc/23/55/62/1035235562.db2.gz ITYZVHHEMUYKBY-UHFFFAOYSA-N 1 1 306.406 3.764 20 5 DHBDMO CCOc1cc(C[N@@H+](CC2CC2)C2CCC2)ccc1[N+](=O)[O-] ZINC000483307669 1035256208 /nfs/dbraw/zinc/25/62/08/1035256208.db2.gz NNJSMOSFRHHJBZ-UHFFFAOYSA-N 1 1 304.390 3.758 20 5 DHBDMO COc1ccc(C[NH2+]Cc2cccc(Cl)c2F)cc1[N+](=O)[O-] ZINC001177732909 1035390241 /nfs/dbraw/zinc/39/02/41/1035390241.db2.gz DMDNKCSSULHZPM-UHFFFAOYSA-N 1 1 324.739 3.686 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cn2c(n1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000924798984 1035420305 /nfs/dbraw/zinc/42/03/05/1035420305.db2.gz QKTGQZNKVMXVGD-OLZOCXBDSA-N 1 1 314.389 3.539 20 5 DHBDMO COc1ccc(C[N@@H+]2CC=C(C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000535407081 1035612973 /nfs/dbraw/zinc/61/29/73/1035612973.db2.gz ZBWNKYBAXHUMML-UHFFFAOYSA-N 1 1 304.390 3.782 20 5 DHBDMO CC(C)CC[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089886341 1035766110 /nfs/dbraw/zinc/76/61/10/1035766110.db2.gz VFQXQXAMNZKQKM-UHFFFAOYSA-N 1 1 303.362 3.728 20 5 DHBDMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089907259 1035785456 /nfs/dbraw/zinc/78/54/56/1035785456.db2.gz WKVKEDDWHOLWGN-CHWSQXEVSA-N 1 1 315.373 3.870 20 5 DHBDMO COc1ccc(-c2ccc(C[N@@H+](C)C3CCC3)o2)c([N+](=O)[O-])c1 ZINC000539834732 1035891184 /nfs/dbraw/zinc/89/11/84/1035891184.db2.gz KWCCMWXZFMAFDK-UHFFFAOYSA-N 1 1 316.357 3.848 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000485766454 1035943284 /nfs/dbraw/zinc/94/32/84/1035943284.db2.gz OBOHHEIXCGFJRC-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]2C2CCCC2)ccc1[N+](=O)[O-] ZINC000485787495 1035968416 /nfs/dbraw/zinc/96/84/16/1035968416.db2.gz CZKYTYQCTJODDQ-OAHLLOKOSA-N 1 1 304.390 3.758 20 5 DHBDMO C[C@@H](C1CCCCC1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000773978555 1036101969 /nfs/dbraw/zinc/10/19/69/1036101969.db2.gz UPNRZZYBYFTAAU-SUMWQHHRSA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1c(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000540836882 1036168931 /nfs/dbraw/zinc/16/89/31/1036168931.db2.gz ITVCPORTRHJMCV-UHFFFAOYSA-N 1 1 324.302 3.953 20 5 DHBDMO Cc1c(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000540836882 1036168938 /nfs/dbraw/zinc/16/89/38/1036168938.db2.gz ITVCPORTRHJMCV-UHFFFAOYSA-N 1 1 324.302 3.953 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](OCCC(C)C)C1 ZINC000541772684 1036429107 /nfs/dbraw/zinc/42/91/07/1036429107.db2.gz HYSVMFGAKOQENN-QGZVFWFLSA-N 1 1 306.406 3.540 20 5 DHBDMO CC(C)CSCCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000443600043 1036432937 /nfs/dbraw/zinc/43/29/37/1036432937.db2.gz DOCMLHHNOUDSRF-UHFFFAOYSA-N 1 1 308.447 3.732 20 5 DHBDMO Cc1c(C[N@@H+]2CCOc3ccccc3[C@H]2C)cccc1[N+](=O)[O-] ZINC000609145593 1036505510 /nfs/dbraw/zinc/50/55/10/1036505510.db2.gz JJVXYTZVJJZLLA-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1c(C[N@H+]2CCOc3ccccc3[C@H]2C)cccc1[N+](=O)[O-] ZINC000609145593 1036505527 /nfs/dbraw/zinc/50/55/27/1036505527.db2.gz JJVXYTZVJJZLLA-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(CCF)CC1 ZINC001196758639 1036599601 /nfs/dbraw/zinc/59/96/01/1036599601.db2.gz HFTWZCOUECNVCJ-UHFFFAOYSA-N 1 1 300.761 3.820 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H](C3CCC3)CC2)cc1 ZINC001197202080 1036707250 /nfs/dbraw/zinc/70/72/50/1036707250.db2.gz LORFEQRAMPSWAC-MAUKXSAKSA-N 1 1 318.417 3.530 20 5 DHBDMO C[C@@H]([NH2+][C@@H](CO)c1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-] ZINC000089210782 1036930802 /nfs/dbraw/zinc/93/08/02/1036930802.db2.gz YZLNJOYRIQWZMA-ABAIWWIYSA-N 1 1 320.776 3.632 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000492626170 1036948421 /nfs/dbraw/zinc/94/84/21/1036948421.db2.gz ADUDZTSSWMVBJP-GJZGRUSLSA-N 1 1 304.390 3.758 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCSC[C@H]1C ZINC001198518329 1037057341 /nfs/dbraw/zinc/05/73/41/1037057341.db2.gz YFWVWUNNWIIZCN-CYBMUJFWSA-N 1 1 324.446 3.709 20 5 DHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774863491 1037129619 /nfs/dbraw/zinc/12/96/19/1037129619.db2.gz NRNKXDOOEUULSZ-AWEZNQCLSA-N 1 1 321.377 3.904 20 5 DHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774906715 1037198915 /nfs/dbraw/zinc/19/89/15/1037198915.db2.gz YEAXUJGGECHDKG-NWDGAFQWSA-N 1 1 307.350 3.514 20 5 DHBDMO Cc1ccccc1OCC[N@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000487675349 1037248773 /nfs/dbraw/zinc/24/87/73/1037248773.db2.gz QHESTRRTPACBPL-OAHLLOKOSA-N 1 1 314.385 3.975 20 5 DHBDMO COc1cc(C[N@@H+]2CCc3ccccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000489157379 1037289596 /nfs/dbraw/zinc/28/95/96/1037289596.db2.gz WETMEMJFTZHKAS-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cc(C[N@H+]2CCc3ccccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000489157379 1037289612 /nfs/dbraw/zinc/28/96/12/1037289612.db2.gz WETMEMJFTZHKAS-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO CCC(CC)[N@@H+](CCOC)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761505993 1037338452 /nfs/dbraw/zinc/33/84/52/1037338452.db2.gz KZIZZWRCZOQHDW-UHFFFAOYSA-N 1 1 314.813 3.885 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC12CCC2 ZINC000775054960 1037523469 /nfs/dbraw/zinc/52/34/69/1037523469.db2.gz DAQDDCLWOFZEKP-GFCCVEGCSA-N 1 1 319.361 3.515 20 5 DHBDMO Cc1cnc(NC[C@H]2CC[N@H+]2C2CCCCCC2)c([N+](=O)[O-])c1 ZINC001187361323 1037619417 /nfs/dbraw/zinc/61/94/17/1037619417.db2.gz JTGAJVKVFQQKGN-OAHLLOKOSA-N 1 1 318.421 3.507 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000609196491 1038073846 /nfs/dbraw/zinc/07/38/46/1038073846.db2.gz VYMLPBPLVUGIEW-CYBMUJFWSA-N 1 1 318.323 3.863 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1CCCC1(F)F)C1CC1 ZINC000588232714 1038279086 /nfs/dbraw/zinc/27/90/86/1038279086.db2.gz YHXWEAVFPMIZSC-UKRRQHHQSA-N 1 1 310.344 3.693 20 5 DHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1CC1CCCCC1 ZINC001190643070 1038361363 /nfs/dbraw/zinc/36/13/63/1038361363.db2.gz IOKNOCJTTGRDGG-INIZCTEOSA-N 1 1 320.437 3.535 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CCc1cccc(F)c1F ZINC000572738590 1038496542 /nfs/dbraw/zinc/49/65/42/1038496542.db2.gz LXDHPMRUZUJREM-UHFFFAOYSA-N 1 1 320.339 3.590 20 5 DHBDMO CC[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001191560029 1038521221 /nfs/dbraw/zinc/52/12/21/1038521221.db2.gz VIXJJSZSIVRTPS-JTQLQIEISA-N 1 1 313.195 3.589 20 5 DHBDMO COc1cccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1F ZINC000589938068 1038557236 /nfs/dbraw/zinc/55/72/36/1038557236.db2.gz XSFHZEVCUQYSIL-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)c1 ZINC000057621024 1038690843 /nfs/dbraw/zinc/69/08/43/1038690843.db2.gz BGIHTHHWQMUFQC-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C2CC2)cc1 ZINC001192927889 1038722122 /nfs/dbraw/zinc/72/21/22/1038722122.db2.gz CZNQAGMOGGTJFX-OWCLPIDISA-N 1 1 300.402 3.995 20 5 DHBDMO Cc1nc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000591347998 1038838499 /nfs/dbraw/zinc/83/84/99/1038838499.db2.gz QILLKWWFEVINAS-INIZCTEOSA-N 1 1 317.414 3.917 20 5 DHBDMO CCC[C@H](N[C@H]1CC[NH2+]C2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000591582330 1038939324 /nfs/dbraw/zinc/93/93/24/1038939324.db2.gz IMLRPSWNBHWWQC-RDJZCZTQSA-N 1 1 317.433 3.700 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H](c2ccccn2)C2CCC2)cs1 ZINC000598993784 1038986137 /nfs/dbraw/zinc/98/61/37/1038986137.db2.gz OQVUPRVSZFDTBB-OAHLLOKOSA-N 1 1 303.387 3.682 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCC[C@H]3CCOC3)C2)cc1 ZINC000592126847 1039122991 /nfs/dbraw/zinc/12/29/91/1039122991.db2.gz RIOCGXHEODBTLX-DOTOQJQBSA-N 1 1 318.417 3.591 20 5 DHBDMO CCC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000170958410 1039129762 /nfs/dbraw/zinc/12/97/62/1039129762.db2.gz XGEUFQNBLRRLPT-HNNXBMFYSA-N 1 1 310.369 3.515 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592181771 1039162270 /nfs/dbraw/zinc/16/22/70/1039162270.db2.gz HUXBUABTYYJEOY-KGLIPLIRSA-N 1 1 304.390 3.547 20 5 DHBDMO CCc1ccc(C[N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000603840012 1039193729 /nfs/dbraw/zinc/19/37/29/1039193729.db2.gz NPGKUYFFASTFMS-UHFFFAOYSA-N 1 1 314.385 3.798 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](OC(C)C)C1 ZINC000593053777 1039377770 /nfs/dbraw/zinc/37/77/70/1039377770.db2.gz MGVLPUWRFBJBQZ-HOCLYGCPSA-N 1 1 306.406 3.854 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cs1 ZINC000604484173 1039479615 /nfs/dbraw/zinc/47/96/15/1039479615.db2.gz APYUPESMYSQWBX-CQSZACIVSA-N 1 1 304.371 3.699 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cs1 ZINC000604484173 1039479624 /nfs/dbraw/zinc/47/96/24/1039479624.db2.gz APYUPESMYSQWBX-CQSZACIVSA-N 1 1 304.371 3.699 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1cncc(F)c1 ZINC000595034632 1040043239 /nfs/dbraw/zinc/04/32/39/1040043239.db2.gz RDFBAKGVYKDJOZ-WDEREUQCSA-N 1 1 319.336 3.549 20 5 DHBDMO C[C@H](N[C@H]1CC[N@H+](C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595079013 1040073108 /nfs/dbraw/zinc/07/31/08/1040073108.db2.gz BZDKFUMWJVUDIR-HOCLYGCPSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCN(C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595079013 1040073118 /nfs/dbraw/zinc/07/31/18/1040073118.db2.gz BZDKFUMWJVUDIR-HOCLYGCPSA-N 1 1 317.433 3.652 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2CC2CCCCC2)c1[N+](=O)[O-] ZINC000595297400 1040094549 /nfs/dbraw/zinc/09/45/49/1040094549.db2.gz SQLBUFZIDSSHLO-AWEZNQCLSA-N 1 1 307.394 3.826 20 5 DHBDMO Cc1noc(C[N@@H+](C(C)C)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000595500967 1040154555 /nfs/dbraw/zinc/15/45/55/1040154555.db2.gz VFAKPTKAIJUAIK-ZDUSSCGKSA-N 1 1 303.362 3.863 20 5 DHBDMO Cc1noc(C[N@H+](C(C)C)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000595500967 1040154564 /nfs/dbraw/zinc/15/45/64/1040154564.db2.gz VFAKPTKAIJUAIK-ZDUSSCGKSA-N 1 1 303.362 3.863 20 5 DHBDMO Cc1noc(C[N@@H+]2Cc3cc(C)ccc3CC2(C)C)c1[N+](=O)[O-] ZINC000595505435 1040155997 /nfs/dbraw/zinc/15/59/97/1040155997.db2.gz RNJRPOUXVDAQQT-UHFFFAOYSA-N 1 1 315.373 3.537 20 5 DHBDMO Cc1noc(C[N@H+]2Cc3cc(C)ccc3CC2(C)C)c1[N+](=O)[O-] ZINC000595505435 1040156004 /nfs/dbraw/zinc/15/60/04/1040156004.db2.gz RNJRPOUXVDAQQT-UHFFFAOYSA-N 1 1 315.373 3.537 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000595702204 1040222946 /nfs/dbraw/zinc/22/29/46/1040222946.db2.gz HKRHUJOPDVRWCU-HNNXBMFYSA-N 1 1 316.332 3.560 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000595702204 1040222956 /nfs/dbraw/zinc/22/29/56/1040222956.db2.gz HKRHUJOPDVRWCU-HNNXBMFYSA-N 1 1 316.332 3.560 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CCF)C1 ZINC000595755967 1040243684 /nfs/dbraw/zinc/24/36/84/1040243684.db2.gz RZCMHGLVTAPENO-ZDUSSCGKSA-N 1 1 310.369 3.565 20 5 DHBDMO C[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@H]1CC1(C)C ZINC000595908739 1040274661 /nfs/dbraw/zinc/27/46/61/1040274661.db2.gz KDSLTQOEYRPTIF-CYBMUJFWSA-N 1 1 315.373 3.728 20 5 DHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000595868644 1040275816 /nfs/dbraw/zinc/27/58/16/1040275816.db2.gz XITLWXGZZFUYKS-SWLSCSKDSA-N 1 1 320.389 3.614 20 5 DHBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000596308263 1040378190 /nfs/dbraw/zinc/37/81/90/1040378190.db2.gz JBNWIACRTBAJEF-LLVKDONJSA-N 1 1 313.348 3.817 20 5 DHBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccncc1 ZINC000596592982 1040506340 /nfs/dbraw/zinc/50/63/40/1040506340.db2.gz OFBIGJQOYMEHSX-QGZVFWFLSA-N 1 1 311.385 3.615 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC1=CCSC1 ZINC000597246516 1040709669 /nfs/dbraw/zinc/70/96/69/1040709669.db2.gz VSNMXUZLRFOVJL-JYRVWZFOSA-N 1 1 304.415 3.603 20 5 DHBDMO CC[C@]1(C)CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000534107172 1040719592 /nfs/dbraw/zinc/71/95/92/1040719592.db2.gz MIZHCNYHHYSUGH-QGZVFWFLSA-N 1 1 315.373 3.872 20 5 DHBDMO CC(C)[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccn1 ZINC000534347033 1040813731 /nfs/dbraw/zinc/81/37/31/1040813731.db2.gz XPKASFHYGNTCIQ-VQHVLOKHSA-N 1 1 311.385 3.914 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)cs1 ZINC000075831509 1040827109 /nfs/dbraw/zinc/82/71/09/1040827109.db2.gz RQIOJKPXYJMVFL-CQSZACIVSA-N 1 1 310.419 3.580 20 5 DHBDMO Cc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602533618 1041094247 /nfs/dbraw/zinc/09/42/47/1041094247.db2.gz JEHNDFPJEXKIHO-HNNXBMFYSA-N 1 1 323.352 3.822 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH+]1CC(CC(F)F)C1 ZINC000602692976 1041155030 /nfs/dbraw/zinc/15/50/30/1041155030.db2.gz PHFTUMIDJXIYNR-UHFFFAOYSA-N 1 1 324.249 3.701 20 5 DHBDMO CC1(F)CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000602993269 1041334530 /nfs/dbraw/zinc/33/45/30/1041334530.db2.gz WAMWOHUWDOAACF-UHFFFAOYSA-N 1 1 319.336 3.574 20 5 DHBDMO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000042977584 183325276 /nfs/dbraw/zinc/32/52/76/183325276.db2.gz YGIPMMTYEZUEFE-UHFFFAOYSA-N 1 1 322.311 3.828 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](COc3ccccc3)C2)cs1 ZINC000272603363 130045808 /nfs/dbraw/zinc/04/58/08/130045808.db2.gz RECACQCGCVODCY-CYBMUJFWSA-N 1 1 318.398 3.557 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](COc3ccccc3)C2)cs1 ZINC000272603363 130045809 /nfs/dbraw/zinc/04/58/09/130045809.db2.gz RECACQCGCVODCY-CYBMUJFWSA-N 1 1 318.398 3.557 20 5 DHBDMO COCC[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccco1 ZINC000273318791 130106305 /nfs/dbraw/zinc/10/63/05/130106305.db2.gz WBPRNJUIZJKOCE-CYBMUJFWSA-N 1 1 324.764 3.709 20 5 DHBDMO Cc1cncc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000274338661 130227435 /nfs/dbraw/zinc/22/74/35/130227435.db2.gz AIPAGXIGGLMAPL-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC=C(c3ccco3)C2)cc1F ZINC000285421776 131166340 /nfs/dbraw/zinc/16/63/40/131166340.db2.gz VSPFFVSKEKTLSX-UHFFFAOYSA-N 1 1 302.305 3.616 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC=C(c3ccco3)C2)cc1F ZINC000285421776 131166342 /nfs/dbraw/zinc/16/63/42/131166342.db2.gz VSPFFVSKEKTLSX-UHFFFAOYSA-N 1 1 302.305 3.616 20 5 DHBDMO COc1cc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(F)cn1 ZINC000287577988 131288646 /nfs/dbraw/zinc/28/86/46/131288646.db2.gz HESJJUSFHVWANI-MNOVXSKESA-N 1 1 319.336 3.549 20 5 DHBDMO COC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000288482388 131327258 /nfs/dbraw/zinc/32/72/58/131327258.db2.gz GPMKGTNJTXQVFL-MRXNPFEDSA-N 1 1 320.776 3.726 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)cnc2Cl)cc1[N+](=O)[O-] ZINC000297264113 132006128 /nfs/dbraw/zinc/00/61/28/132006128.db2.gz KHBOWDVPRUXMOK-SNVBAGLBSA-N 1 1 323.755 3.942 20 5 DHBDMO CCOC1(C)CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000298210369 132050839 /nfs/dbraw/zinc/05/08/39/132050839.db2.gz DKDVDAPFKRRSBQ-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO C[C@@]12CC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C[C@@H]1C2(F)F ZINC000298235694 132052382 /nfs/dbraw/zinc/05/23/82/132052382.db2.gz IFDANZALRUHXES-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@@]12CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C[C@@H]1C2(F)F ZINC000298235694 132052384 /nfs/dbraw/zinc/05/23/84/132052384.db2.gz IFDANZALRUHXES-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000298723248 132075289 /nfs/dbraw/zinc/07/52/89/132075289.db2.gz LVRJRXSRYMKTOD-GFCCVEGCSA-N 1 1 302.296 3.678 20 5 DHBDMO COc1ccc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)cc1[N+](=O)[O-] ZINC000299342616 132100024 /nfs/dbraw/zinc/10/00/24/132100024.db2.gz OVQGVJNCYYHQKU-SMDDNHRTSA-N 1 1 316.357 3.610 20 5 DHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000559431927 332258522 /nfs/dbraw/zinc/25/85/22/332258522.db2.gz MHKLYXURHBLFSG-KGLIPLIRSA-N 1 1 304.390 3.614 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC=C(c2ccccn2)C1 ZINC000555878325 332265929 /nfs/dbraw/zinc/26/59/29/332265929.db2.gz JBVCTGHHMZUYEC-AWEZNQCLSA-N 1 1 309.369 3.840 20 5 DHBDMO CCC[N@H+]1CCC[C@@H]1c1nc(-c2ccc([N+](=O)[O-])cc2C)no1 ZINC000564405345 332276264 /nfs/dbraw/zinc/27/62/64/332276264.db2.gz PTLSXYAFGJBWFX-CQSZACIVSA-N 1 1 316.361 3.500 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1cccc(O)c1 ZINC000182432279 333040269 /nfs/dbraw/zinc/04/02/69/333040269.db2.gz CNWLFOVUCXXEHA-SNVBAGLBSA-N 1 1 306.749 3.805 20 5 DHBDMO CCC(CC)[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000314114302 333087417 /nfs/dbraw/zinc/08/74/17/333087417.db2.gz NYOZKBZHQZXBNZ-SUMWQHHRSA-N 1 1 307.438 3.612 20 5 DHBDMO CCC(CC)[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000314114300 333087580 /nfs/dbraw/zinc/08/75/80/333087580.db2.gz NYOZKBZHQZXBNZ-GUYCJALGSA-N 1 1 307.438 3.612 20 5 DHBDMO CC[C@@H](C)[N@@H+](C)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000318885362 333220097 /nfs/dbraw/zinc/22/00/97/333220097.db2.gz NMDMEYQUSLKQMG-SNVBAGLBSA-N 1 1 319.327 3.756 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000319370839 333287649 /nfs/dbraw/zinc/28/76/49/333287649.db2.gz VEDVVOXHNQFYQK-LBPRGKRZSA-N 1 1 320.286 3.897 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000319370839 333287650 /nfs/dbraw/zinc/28/76/50/333287650.db2.gz VEDVVOXHNQFYQK-LBPRGKRZSA-N 1 1 320.286 3.897 20 5 DHBDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1(N)CCCCCC1 ZINC000414857412 334130333 /nfs/dbraw/zinc/13/03/33/334130333.db2.gz DDZDPVGMVAFWTJ-HNNXBMFYSA-N 1 1 319.449 3.557 20 5 DHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534841855 334339490 /nfs/dbraw/zinc/33/94/90/334339490.db2.gz GAINNTTUHMWVAK-WFASDCNBSA-N 1 1 315.373 3.870 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000526084970 335733207 /nfs/dbraw/zinc/73/32/07/335733207.db2.gz FJXRLKQLFCASQD-INIZCTEOSA-N 1 1 317.776 3.884 20 5 DHBDMO COCC[C@H]1CCCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000332233068 336164174 /nfs/dbraw/zinc/16/41/74/336164174.db2.gz FNTUOAGIQOZEJB-OAHLLOKOSA-N 1 1 306.406 3.542 20 5 DHBDMO COCC[C@@H]1CCCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000332240628 336164484 /nfs/dbraw/zinc/16/44/84/336164484.db2.gz AAZHNTKPERPDQL-HNNXBMFYSA-N 1 1 306.406 3.542 20 5 DHBDMO COCC[C@@H]1CCCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000332341291 336169259 /nfs/dbraw/zinc/16/92/59/336169259.db2.gz QWOFVUCYDRVDDJ-GJZGRUSLSA-N 1 1 306.406 3.794 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)cs1 ZINC000352332136 336212830 /nfs/dbraw/zinc/21/28/30/336212830.db2.gz SRAUMTZDZPCRHR-HNNXBMFYSA-N 1 1 318.398 3.700 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](Oc3ccccc3)C2)cs1 ZINC000352332136 336212831 /nfs/dbraw/zinc/21/28/31/336212831.db2.gz SRAUMTZDZPCRHR-HNNXBMFYSA-N 1 1 318.398 3.700 20 5 DHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C3CCCC3)C2)c(Cl)c1 ZINC000301183405 336293713 /nfs/dbraw/zinc/29/37/13/336293713.db2.gz IWMKDWVZVCPMOS-NSHDSACASA-N 1 1 309.797 3.677 20 5 DHBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302031748 336344348 /nfs/dbraw/zinc/34/43/48/336344348.db2.gz CHYFRVVLBXZGMS-UONOGXRCSA-N 1 1 303.406 3.660 20 5 DHBDMO CC[C@@H]([NH2+][C@H]1COc2cccc(F)c21)c1cccc([N+](=O)[O-])c1 ZINC000374679699 336994756 /nfs/dbraw/zinc/99/47/56/336994756.db2.gz NXNGXEWSKXCGFG-CABCVRRESA-N 1 1 316.332 3.908 20 5 DHBDMO CCC[N@H+](CCCN(C)C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000583032641 337231532 /nfs/dbraw/zinc/23/15/32/337231532.db2.gz ZJBJRJGZUULBPM-DTQAZKPQSA-N 1 1 319.449 3.662 20 5 DHBDMO CCC[N@@H+](CCCN(C)C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000583032641 337231533 /nfs/dbraw/zinc/23/15/33/337231533.db2.gz ZJBJRJGZUULBPM-DTQAZKPQSA-N 1 1 319.449 3.662 20 5 DHBDMO CCCN(CCC[NH+](C)C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000583032641 337231534 /nfs/dbraw/zinc/23/15/34/337231534.db2.gz ZJBJRJGZUULBPM-DTQAZKPQSA-N 1 1 319.449 3.662 20 5 DHBDMO CCC[C@H](NCC1([NH+](C)C)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000321703270 337284573 /nfs/dbraw/zinc/28/45/73/337284573.db2.gz NZHPHQAXLWOJQN-KRWDZBQOSA-N 1 1 319.449 3.900 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](CCC(F)(F)F)CC2CC2)cc1 ZINC000084138621 338000226 /nfs/dbraw/zinc/00/02/26/338000226.db2.gz ZXCXJWLMTIDSFD-UHFFFAOYSA-N 1 1 316.323 3.802 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H]4CCC[C@H]43)co2)cc1 ZINC000426473121 338033144 /nfs/dbraw/zinc/03/31/44/338033144.db2.gz QNAQDRQHPIIIJQ-BLLLJJGKSA-N 1 1 313.357 3.624 20 5 DHBDMO C[C@H]1CC[C@@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000429583807 338085239 /nfs/dbraw/zinc/08/52/39/338085239.db2.gz BWBKOAWUTVGRNN-BLLLJJGKSA-N 1 1 315.373 3.870 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000430093860 338096088 /nfs/dbraw/zinc/09/60/88/338096088.db2.gz HKXKUCQKYQXLEY-VGQMVEDTSA-N 1 1 322.355 3.975 20 5 DHBDMO CC[C@H]1CC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000430195444 338100724 /nfs/dbraw/zinc/10/07/24/338100724.db2.gz JJIUIPLTSJUDDH-ZDUSSCGKSA-N 1 1 303.387 3.703 20 5 DHBDMO CC[C@H]1CC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000430195444 338100725 /nfs/dbraw/zinc/10/07/25/338100725.db2.gz JJIUIPLTSJUDDH-ZDUSSCGKSA-N 1 1 303.387 3.703 20 5 DHBDMO CC[N@@H+](CCc1cccs1)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430224011 338102000 /nfs/dbraw/zinc/10/20/00/338102000.db2.gz XOJKVTHQZRXLEC-UHFFFAOYSA-N 1 1 320.414 3.730 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCN(C)c1ccccc1 ZINC000436394480 338270635 /nfs/dbraw/zinc/27/06/35/338270635.db2.gz WMLTUQJUCCCVJT-HNNXBMFYSA-N 1 1 313.401 3.724 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cc4ccccc4o3)nc2c1 ZINC000446857705 338538907 /nfs/dbraw/zinc/53/89/07/338538907.db2.gz WUADJVXGDWWHSZ-UHFFFAOYSA-N 1 1 322.324 3.507 20 5 DHBDMO CCC[C@H]([NH2+]Cc1cnc(CC)o1)c1cccc([N+](=O)[O-])c1 ZINC000453376158 338834260 /nfs/dbraw/zinc/83/42/60/338834260.db2.gz PNKFLUCRUOVKJM-HNNXBMFYSA-N 1 1 303.362 3.776 20 5 DHBDMO C[C@H](C[N@@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000459786110 339048450 /nfs/dbraw/zinc/04/84/50/339048450.db2.gz BBSVJXBEKNQNPX-CHWSQXEVSA-N 1 1 322.405 3.565 20 5 DHBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC(C)(C)C ZINC000463375656 339116131 /nfs/dbraw/zinc/11/61/31/339116131.db2.gz MPLVGVAUCDIBEG-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000463470906 339118925 /nfs/dbraw/zinc/11/89/25/339118925.db2.gz UEMSHJCDWYVCBR-DOMZBBRYSA-N 1 1 322.380 3.897 20 5 DHBDMO COc1cc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000464678516 339148433 /nfs/dbraw/zinc/14/84/33/339148433.db2.gz PMWBRAYMBBPFNP-XUJVJEKNSA-N 1 1 322.380 3.896 20 5 DHBDMO C[C@@H](NCC[N@@H+](C)C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000467837251 339247250 /nfs/dbraw/zinc/24/72/50/339247250.db2.gz ZFXJXZOSJJDWMT-CQSZACIVSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@@H]([NH2+]CCN(C)C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000467837251 339247251 /nfs/dbraw/zinc/24/72/51/339247251.db2.gz ZFXJXZOSJJDWMT-CQSZACIVSA-N 1 1 305.422 3.510 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@@H](CC(C)C)[NH+](C)C ZINC000468654867 339268131 /nfs/dbraw/zinc/26/81/31/339268131.db2.gz CTAVHUDVAAZDOV-SPQRHKFCSA-N 1 1 319.449 3.564 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)c1 ZINC000469450315 339289811 /nfs/dbraw/zinc/28/98/11/339289811.db2.gz NHMHWHNDGVQQOM-ZDUSSCGKSA-N 1 1 318.323 3.863 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000469994232 339307435 /nfs/dbraw/zinc/30/74/35/339307435.db2.gz YJPJFIPTOWPAIW-LBPRGKRZSA-N 1 1 302.296 3.758 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOC2(CCCC2)C1 ZINC000470178815 339312976 /nfs/dbraw/zinc/31/29/76/339312976.db2.gz OKBIKNHOGNSZCO-RVDMUPIBSA-N 1 1 316.401 3.643 20 5 DHBDMO Cc1c(C[NH2+][C@H]2CCc3c2c(F)ccc3F)cccc1[N+](=O)[O-] ZINC000478506803 339516832 /nfs/dbraw/zinc/51/68/32/339516832.db2.gz OFCWZYNZISIPTJ-HNNXBMFYSA-N 1 1 318.323 3.959 20 5 DHBDMO Cc1cc(F)cc2c1C[N@H+](Cc1ccccc1[N+](=O)[O-])CC2 ZINC000502930375 340116950 /nfs/dbraw/zinc/11/69/50/340116950.db2.gz JGZFBDKAXZPBGT-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cc(F)cc2c1C[N@@H+](Cc1ccccc1[N+](=O)[O-])CC2 ZINC000502930375 340116951 /nfs/dbraw/zinc/11/69/51/340116951.db2.gz JGZFBDKAXZPBGT-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000503594924 340131972 /nfs/dbraw/zinc/13/19/72/340131972.db2.gz TXFZMZPMRZFWMT-LBPRGKRZSA-N 1 1 318.323 3.863 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000503594924 340131973 /nfs/dbraw/zinc/13/19/73/340131973.db2.gz TXFZMZPMRZFWMT-LBPRGKRZSA-N 1 1 318.323 3.863 20 5 DHBDMO COc1ccccc1C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000505598028 340172480 /nfs/dbraw/zinc/17/24/80/340172480.db2.gz UYGJOPCHLWFLHH-YFHOEESVSA-N 1 1 312.369 3.749 20 5 DHBDMO CCC[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000507009662 340205325 /nfs/dbraw/zinc/20/53/25/340205325.db2.gz XPTZHHWPQQEMPY-JTQLQIEISA-N 1 1 302.321 3.817 20 5 DHBDMO CCC[C@@H](C)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000507022312 340205680 /nfs/dbraw/zinc/20/56/80/340205680.db2.gz NSIHWJGFYFJFFM-CYBMUJFWSA-N 1 1 316.405 3.616 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]2CC(C)C)c([N+](=O)[O-])cc1OC ZINC000507152318 340209711 /nfs/dbraw/zinc/20/97/11/340209711.db2.gz RPTIFYTYQZZDKQ-AWEZNQCLSA-N 1 1 322.405 3.623 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]2CC(C)C)c([N+](=O)[O-])cc1OC ZINC000507152319 340209777 /nfs/dbraw/zinc/20/97/77/340209777.db2.gz RPTIFYTYQZZDKQ-CQSZACIVSA-N 1 1 322.405 3.623 20 5 DHBDMO C[N@H+](C/C=C/c1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000507169290 340210713 /nfs/dbraw/zinc/21/07/13/340210713.db2.gz IFBPLHDWQBSKFA-SNAWJCMRSA-N 1 1 300.333 3.879 20 5 DHBDMO C[N@@H+](C/C=C/c1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000507169290 340210714 /nfs/dbraw/zinc/21/07/14/340210714.db2.gz IFBPLHDWQBSKFA-SNAWJCMRSA-N 1 1 300.333 3.879 20 5 DHBDMO CC[N@@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C1CC1 ZINC000507225621 340214398 /nfs/dbraw/zinc/21/43/98/340214398.db2.gz ALMKHWQQXWBSSB-UHFFFAOYSA-N 1 1 316.357 3.848 20 5 DHBDMO CC(C)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1CC1 ZINC000508037927 340237954 /nfs/dbraw/zinc/23/79/54/340237954.db2.gz BPYNWZHFZYGRHS-UHFFFAOYSA-N 1 1 314.332 3.817 20 5 DHBDMO CC[N@@H+](Cc1ccccc1C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000509050464 340259660 /nfs/dbraw/zinc/25/96/60/340259660.db2.gz DGKYKFCGWAMYLA-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000510454222 340299909 /nfs/dbraw/zinc/29/99/09/340299909.db2.gz HLJQUULVAHKCFA-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO COC[C@H](C)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000510467226 340300267 /nfs/dbraw/zinc/30/02/67/340300267.db2.gz IOEYVONNVWSSGF-LBPRGKRZSA-N 1 1 320.414 3.790 20 5 DHBDMO C[N@@H+](CCc1cccc(F)c1F)CCc1ccccc1[N+](=O)[O-] ZINC000511109050 340321201 /nfs/dbraw/zinc/32/12/01/340321201.db2.gz NYQOYTSTIPKNEN-UHFFFAOYSA-N 1 1 320.339 3.590 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1c(F)cccc1F ZINC000511111984 340321211 /nfs/dbraw/zinc/32/12/11/340321211.db2.gz XEIQLXJDXKHSKY-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c(F)cccc1F ZINC000511111984 340321212 /nfs/dbraw/zinc/32/12/12/340321212.db2.gz XEIQLXJDXKHSKY-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[N@@H+](CCCc1ccsc1)CCc1ccccc1[N+](=O)[O-] ZINC000511126868 340321661 /nfs/dbraw/zinc/32/16/61/340321661.db2.gz RXFVEIYSMSSUMD-UHFFFAOYSA-N 1 1 304.415 3.763 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000511353428 340325625 /nfs/dbraw/zinc/32/56/25/340325625.db2.gz ZDNPYYIHJXWKBP-CABCVRRESA-N 1 1 317.433 3.968 20 5 DHBDMO Cc1ccc2c(c1)C[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CCO2 ZINC000512251510 340354212 /nfs/dbraw/zinc/35/42/12/340354212.db2.gz HDJXDPALMDGMEP-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1ccc2c(c1)C[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CCO2 ZINC000512251510 340354213 /nfs/dbraw/zinc/35/42/13/340354213.db2.gz HDJXDPALMDGMEP-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1c(C[N@H+](C)[C@H]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000512325630 340357116 /nfs/dbraw/zinc/35/71/16/340357116.db2.gz WGYYPQWNXSMNIS-SFHVURJKSA-N 1 1 310.397 3.893 20 5 DHBDMO C[C@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173422437 340364658 /nfs/dbraw/zinc/36/46/58/340364658.db2.gz RAYAIEHHMFUCFC-BBRMVZONSA-N 1 1 307.438 3.612 20 5 DHBDMO C[N@@H+](CCc1ccc(Cl)cc1)Cc1csc([N+](=O)[O-])c1 ZINC000512701790 340373677 /nfs/dbraw/zinc/37/36/77/340373677.db2.gz VGVFELGBMSVSHH-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000237195537 340668832 /nfs/dbraw/zinc/66/88/32/340668832.db2.gz OKHFXCTUTLRBKL-UHFFFAOYSA-N 1 1 324.739 3.686 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCc1ccc(F)cc1 ZINC000542705330 341018334 /nfs/dbraw/zinc/01/83/34/341018334.db2.gz RWPFMFJVUJPODG-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC000543630951 341052125 /nfs/dbraw/zinc/05/21/25/341052125.db2.gz VXWMNPMIBPJYKG-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2ccc(F)cc2C1 ZINC000543630951 341052126 /nfs/dbraw/zinc/05/21/26/341052126.db2.gz VXWMNPMIBPJYKG-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO CSc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549169693 341287746 /nfs/dbraw/zinc/28/77/46/341287746.db2.gz AETDZLBXGIKUES-UHFFFAOYSA-N 1 1 316.426 3.991 20 5 DHBDMO CC[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549865827 341305529 /nfs/dbraw/zinc/30/55/29/341305529.db2.gz GWYAKZRVTKSOSB-SNVBAGLBSA-N 1 1 302.296 3.846 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cccnc1 ZINC000182889252 519782112 /nfs/dbraw/zinc/78/21/12/519782112.db2.gz RMRXITUJGFBPMH-CYBMUJFWSA-N 1 1 315.373 3.628 20 5 DHBDMO CC(C)c1[nH+]ccn1C[C@@H]1CCCN1c1ccccc1[N+](=O)[O-] ZINC000364828450 519879693 /nfs/dbraw/zinc/87/96/93/519879693.db2.gz DRMRDBJANRVVPB-AWEZNQCLSA-N 1 1 314.389 3.584 20 5 DHBDMO CCCOc1ncccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178650629 520503717 /nfs/dbraw/zinc/50/37/17/520503717.db2.gz GEVICGZPGSHNEY-ZDUSSCGKSA-N 1 1 315.373 3.629 20 5 DHBDMO CCCc1nc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cs1 ZINC000338355479 521502883 /nfs/dbraw/zinc/50/28/83/521502883.db2.gz XHHWKTGFGQIQKA-UHFFFAOYSA-N 1 1 319.430 3.678 20 5 DHBDMO CCCc1nc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cs1 ZINC000338355479 521502891 /nfs/dbraw/zinc/50/28/91/521502891.db2.gz XHHWKTGFGQIQKA-UHFFFAOYSA-N 1 1 319.430 3.678 20 5 DHBDMO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000265853740 521693257 /nfs/dbraw/zinc/69/32/57/521693257.db2.gz ITWIHJJQQVSGNB-BPLDGKMQSA-N 1 1 324.446 3.682 20 5 DHBDMO CC[C@@](C)([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1nccs1 ZINC000152633196 523657074 /nfs/dbraw/zinc/65/70/74/523657074.db2.gz FKJJLJIKMBNONE-OAHLLOKOSA-N 1 1 305.403 3.775 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000246463385 524299380 /nfs/dbraw/zinc/29/93/80/524299380.db2.gz OEWGCUUQDKKFJH-RYUDHWBXSA-N 1 1 317.414 3.949 20 5 DHBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000158004299 524813962 /nfs/dbraw/zinc/81/39/62/524813962.db2.gz LWIHAAGYLDLIEY-AWEZNQCLSA-N 1 1 312.369 3.593 20 5 DHBDMO CSCCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339155266 525444107 /nfs/dbraw/zinc/44/41/07/525444107.db2.gz CRMSRMBSTMAWMV-UHFFFAOYSA-N 1 1 322.352 3.799 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000249888196 526079627 /nfs/dbraw/zinc/07/96/27/526079627.db2.gz PVDFUCDBRLPHHT-GXTWGEPZSA-N 1 1 317.414 3.992 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1ccncc1F ZINC000338016708 526089574 /nfs/dbraw/zinc/08/95/74/526089574.db2.gz VFHKNDCWOSBNKO-RYUDHWBXSA-N 1 1 303.337 3.849 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2cccc(O)c2)CC2CC2)cs1 ZINC000112978240 527330111 /nfs/dbraw/zinc/33/01/11/527330111.db2.gz XIAZZXMBSSFVSV-UHFFFAOYSA-N 1 1 318.398 3.774 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)cs1 ZINC000112978240 527330115 /nfs/dbraw/zinc/33/01/15/527330115.db2.gz XIAZZXMBSSFVSV-UHFFFAOYSA-N 1 1 318.398 3.774 20 5 DHBDMO CC(C)([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000285935900 535250862 /nfs/dbraw/zinc/25/08/62/535250862.db2.gz JBQHDBMKEOZQPC-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO CCOC1CC2(C1)CC[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000285498415 535397624 /nfs/dbraw/zinc/39/76/24/535397624.db2.gz MYISKOXVHYBGLP-CBCUQQMYSA-N 1 1 304.390 3.547 20 5 DHBDMO CCCO[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000247107419 1013364384 /nfs/dbraw/zinc/36/43/84/1013364384.db2.gz KIWBZVKDVHLPJV-PBHICJAKSA-N 1 1 306.406 3.937 20 5 DHBDMO Cc1cccc(C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC(C)C)c1 ZINC001167199715 1013383057 /nfs/dbraw/zinc/38/30/57/1013383057.db2.gz SXGKZMSDLOEOGZ-UHFFFAOYSA-N 1 1 313.401 3.956 20 5 DHBDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000093839068 1013455939 /nfs/dbraw/zinc/45/59/39/1013455939.db2.gz XGDSGKWSIIHFHC-OAHLLOKOSA-N 1 1 306.406 3.577 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccccc1)C1CC1 ZINC000025124267 1013745896 /nfs/dbraw/zinc/74/58/96/1013745896.db2.gz VZHQUQJKAJAKAJ-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000025124267 1013745902 /nfs/dbraw/zinc/74/59/02/1013745902.db2.gz VZHQUQJKAJAKAJ-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO CC[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000091929207 1014092810 /nfs/dbraw/zinc/09/28/10/1014092810.db2.gz JSVBGDUGNBJZQN-LBPRGKRZSA-N 1 1 317.414 3.950 20 5 DHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000520592052 1014361670 /nfs/dbraw/zinc/36/16/70/1014361670.db2.gz QQVRYINRDAJNFL-ZIAGYGMSSA-N 1 1 306.406 3.873 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@H](C)c1nccs1 ZINC000248437209 1014442109 /nfs/dbraw/zinc/44/21/09/1014442109.db2.gz BDWOMHGPKLWEFU-NWDGAFQWSA-N 1 1 305.403 3.848 20 5 DHBDMO COc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])ccc1C ZINC000581456262 1014872096 /nfs/dbraw/zinc/87/20/96/1014872096.db2.gz YGOONDAOHKIIFS-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2cccs2)C2CC2)cc1 ZINC000522268813 1014992424 /nfs/dbraw/zinc/99/24/24/1014992424.db2.gz UKOBBBSSXBQZDB-UHFFFAOYSA-N 1 1 302.399 3.863 20 5 DHBDMO CC(C)C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582551 1015629791 /nfs/dbraw/zinc/62/97/91/1015629791.db2.gz XCYOPCOEMJNQPM-GFCCVEGCSA-N 1 1 303.362 3.604 20 5 DHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581136 1015630719 /nfs/dbraw/zinc/63/07/19/1015630719.db2.gz PVCCMVRWQAUVMG-RISCZKNCSA-N 1 1 303.362 3.747 20 5 DHBDMO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582705 1015635160 /nfs/dbraw/zinc/63/51/60/1015635160.db2.gz OMGVYBPJTZZBPH-LBPRGKRZSA-N 1 1 323.352 3.683 20 5 DHBDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582705 1015635165 /nfs/dbraw/zinc/63/51/65/1015635165.db2.gz OMGVYBPJTZZBPH-LBPRGKRZSA-N 1 1 323.352 3.683 20 5 DHBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])s2)C[N@H+]1Cc1ccccc1 ZINC000610709512 1015729399 /nfs/dbraw/zinc/72/93/99/1015729399.db2.gz VDWRHFMMYWTTLC-OCCSQVGLSA-N 1 1 317.414 3.731 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1Cc2ccccc2C1 ZINC000522536229 1015774510 /nfs/dbraw/zinc/77/45/10/1015774510.db2.gz BVAMNENSKDNUDR-UHFFFAOYSA-N 1 1 316.788 3.847 20 5 DHBDMO CCC[C@H]([NH2+]Cc1nc(C)cs1)c1cccc([N+](=O)[O-])c1 ZINC000038090886 1015960046 /nfs/dbraw/zinc/96/00/46/1015960046.db2.gz AFVKLPRIEHEPOG-AWEZNQCLSA-N 1 1 305.403 3.991 20 5 DHBDMO CC[C@H]1CCCCC[N@H+]1Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000538736458 1016164048 /nfs/dbraw/zinc/16/40/48/1016164048.db2.gz GFMXRYXUGSWJCJ-AWEZNQCLSA-N 1 1 322.405 3.767 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2C2CCCC2)cc1 ZINC000065535975 1016205415 /nfs/dbraw/zinc/20/54/15/1016205415.db2.gz WSYVNZCMJQSTLH-QGZVFWFLSA-N 1 1 304.390 3.628 20 5 DHBDMO CCCc1csc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000494312277 1016245113 /nfs/dbraw/zinc/24/51/13/1016245113.db2.gz NQUXXKSNVPKGIO-NSHDSACASA-N 1 1 305.403 3.855 20 5 DHBDMO O=[N+]([O-])c1ccccc1NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000380972304 1016258114 /nfs/dbraw/zinc/25/81/14/1016258114.db2.gz BBMNDNOVCRLDLV-MRXNPFEDSA-N 1 1 311.385 3.529 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccc2c1NCC2)C1CC1 ZINC000346819175 1016564609 /nfs/dbraw/zinc/56/46/09/1016564609.db2.gz HODAHOKQGOFEAI-UHFFFAOYSA-N 1 1 323.396 3.727 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc2c1NCC2)C1CC1 ZINC000346819175 1016564611 /nfs/dbraw/zinc/56/46/11/1016564611.db2.gz HODAHOKQGOFEAI-UHFFFAOYSA-N 1 1 323.396 3.727 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc(C)c(C)o1 ZINC000281984590 1016862514 /nfs/dbraw/zinc/86/25/14/1016862514.db2.gz CCRLFOPTVNVPNO-NSHDSACASA-N 1 1 304.346 3.664 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](OC3CCC3)C2)ccc1Cl ZINC000847037532 1032189747 /nfs/dbraw/zinc/18/97/47/1032189747.db2.gz OPERICXBRPUUGV-AWEZNQCLSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](OC3CCC3)C2)ccc1Cl ZINC000847037532 1032189780 /nfs/dbraw/zinc/18/97/80/1032189780.db2.gz OPERICXBRPUUGV-AWEZNQCLSA-N 1 1 324.808 3.782 20 5 DHBDMO CCC[C@H]([NH2+]CCC[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000336864119 1013019101 /nfs/dbraw/zinc/01/91/01/1013019101.db2.gz DXJKRIGQAGQWHI-SFHVURJKSA-N 1 1 319.449 3.902 20 5 DHBDMO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000165296425 1013039084 /nfs/dbraw/zinc/03/90/84/1013039084.db2.gz UFANZTXFAYBVDH-MLGOLLRUSA-N 1 1 318.373 3.789 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000475283513 1017115813 /nfs/dbraw/zinc/11/58/13/1017115813.db2.gz IMBLXHJDVCOFMQ-CBHWHFHUSA-N 1 1 314.307 3.881 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000475283519 1017115835 /nfs/dbraw/zinc/11/58/35/1017115835.db2.gz IMBLXHJDVCOFMQ-YJLKIPLNSA-N 1 1 314.307 3.881 20 5 DHBDMO Cc1c(C[N@@H+](C)CCc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000065596327 1017141033 /nfs/dbraw/zinc/14/10/33/1017141033.db2.gz NPKOITJDLXVBMM-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000128080321 1017155889 /nfs/dbraw/zinc/15/58/89/1017155889.db2.gz RUCNELTWKPZNFZ-KRWDZBQOSA-N 1 1 300.333 3.975 20 5 DHBDMO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444591281 1017579530 /nfs/dbraw/zinc/57/95/30/1017579530.db2.gz NEUYQPWDDDIOSK-CYBMUJFWSA-N 1 1 324.384 3.973 20 5 DHBDMO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444591281 1017579536 /nfs/dbraw/zinc/57/95/36/1017579536.db2.gz NEUYQPWDDDIOSK-CYBMUJFWSA-N 1 1 324.384 3.973 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H]4CCCC[C@@H]43)nc2c1 ZINC000083169972 1017604395 /nfs/dbraw/zinc/60/43/95/1017604395.db2.gz OJULCAHTOLCWBP-FZMZJTMJSA-N 1 1 301.346 3.501 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000444659755 1017610284 /nfs/dbraw/zinc/61/02/84/1017610284.db2.gz DZJNWBHZEZGSAZ-FZMZJTMJSA-N 1 1 310.369 3.753 20 5 DHBDMO CC(C)C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444643666 1017613785 /nfs/dbraw/zinc/61/37/85/1017613785.db2.gz TXXZWNIPKYWNDY-ZDUSSCGKSA-N 1 1 316.405 3.729 20 5 DHBDMO CC(C)C1(C)CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000444685828 1017615875 /nfs/dbraw/zinc/61/58/75/1017615875.db2.gz PYODPBRTNCLOED-UHFFFAOYSA-N 1 1 316.405 3.729 20 5 DHBDMO Cc1ccc(C)c(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444707549 1017641485 /nfs/dbraw/zinc/64/14/85/1017641485.db2.gz YIHKQCNAHROMKM-UHFFFAOYSA-N 1 1 324.384 3.720 20 5 DHBDMO Cc1ccc(C)c(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444707549 1017641490 /nfs/dbraw/zinc/64/14/90/1017641490.db2.gz YIHKQCNAHROMKM-UHFFFAOYSA-N 1 1 324.384 3.720 20 5 DHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000444771199 1017667955 /nfs/dbraw/zinc/66/79/55/1017667955.db2.gz INNJELWEZOJAID-GFCCVEGCSA-N 1 1 303.362 3.604 20 5 DHBDMO Cc1cc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000091479626 1017749207 /nfs/dbraw/zinc/74/92/07/1017749207.db2.gz HVIXKGJQXFBQRV-NSHDSACASA-N 1 1 320.780 3.664 20 5 DHBDMO COc1ccc(C[N@H+]2CCC[C@H](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000523707817 1017765083 /nfs/dbraw/zinc/76/50/83/1017765083.db2.gz VCXLUSUNAWDMDI-HNNXBMFYSA-N 1 1 306.406 3.862 20 5 DHBDMO Cc1c(C[N@@H+](C)Cc2cc(Cl)cn2C)cccc1[N+](=O)[O-] ZINC000120100358 1017903082 /nfs/dbraw/zinc/90/30/82/1017903082.db2.gz FZYOERGGQHIQMV-UHFFFAOYSA-N 1 1 307.781 3.527 20 5 DHBDMO Cc1c(C[N@H+](C)Cc2cc(Cl)cn2C)cccc1[N+](=O)[O-] ZINC000120100358 1017903098 /nfs/dbraw/zinc/90/30/98/1017903098.db2.gz FZYOERGGQHIQMV-UHFFFAOYSA-N 1 1 307.781 3.527 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3[nH]c4ccccc4c3C2)cc1 ZINC000171613875 1017965251 /nfs/dbraw/zinc/96/52/51/1017965251.db2.gz FNXDWFNDHHIYFI-UHFFFAOYSA-N 1 1 321.380 3.677 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000524356392 1017968898 /nfs/dbraw/zinc/96/88/98/1017968898.db2.gz AKIHRNQPRNSGEA-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000446724410 1018227061 /nfs/dbraw/zinc/22/70/61/1018227061.db2.gz ZYJOZWNTQXFJNV-GOSISDBHSA-N 1 1 314.360 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCC[C@H]3C3CC3)c2c1 ZINC000728563418 1018387566 /nfs/dbraw/zinc/38/75/66/1018387566.db2.gz UVYDAUUNSMHGCP-LBPRGKRZSA-N 1 1 319.386 3.704 20 5 DHBDMO CC[N@@H+](Cn1nc(C)c2cc([N+](=O)[O-])ccc21)[C@@H](C)C(C)C ZINC000764927081 1018428686 /nfs/dbraw/zinc/42/86/86/1018428686.db2.gz XAUVHWURUGDKJI-ZDUSSCGKSA-N 1 1 304.394 3.577 20 5 DHBDMO CC(C)[N@H+]1CC[C@H](Oc2cc(Cl)c([N+](=O)[O-])cc2Cl)C1 ZINC001228150881 1018454008 /nfs/dbraw/zinc/45/40/08/1018454008.db2.gz BYMLCDUXFUCJQN-VIFPVBQESA-N 1 1 319.188 3.763 20 5 DHBDMO Cc1ncsc1C[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255139989 1019304190 /nfs/dbraw/zinc/30/41/90/1019304190.db2.gz SXSCXLIKWRKWQZ-ALCCZGGFSA-N 1 1 303.387 3.505 20 5 DHBDMO Cc1ncsc1C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255139989 1019304207 /nfs/dbraw/zinc/30/42/07/1019304207.db2.gz SXSCXLIKWRKWQZ-ALCCZGGFSA-N 1 1 303.387 3.505 20 5 DHBDMO Cn1cccc1[C@@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255361573 1019408431 /nfs/dbraw/zinc/40/84/31/1019408431.db2.gz NVVMAWOJTJQMLM-MSEQUDFZSA-N 1 1 311.385 3.784 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(c2cccnc2)CC1 ZINC000611258857 1019424769 /nfs/dbraw/zinc/42/47/69/1019424769.db2.gz VEOLHMANXLDBJE-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000611350966 1019451672 /nfs/dbraw/zinc/45/16/72/1019451672.db2.gz VVZPWLPCPJVZGV-PMPSAXMXSA-N 1 1 318.417 3.794 20 5 DHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])s2)C1 ZINC000611370312 1019457679 /nfs/dbraw/zinc/45/76/79/1019457679.db2.gz XTNLSBYLSWTMIF-GXTWGEPZSA-N 1 1 317.414 3.904 20 5 DHBDMO COc1cccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000611377512 1019465607 /nfs/dbraw/zinc/46/56/07/1019465607.db2.gz HDUCIENNKWGTJD-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000611377357 1019466592 /nfs/dbraw/zinc/46/65/92/1019466592.db2.gz QBZJTBVQQNXEND-GFCCVEGCSA-N 1 1 318.348 3.983 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccsc2[N+](=O)[O-])C1 ZINC000611509748 1019505908 /nfs/dbraw/zinc/50/59/08/1019505908.db2.gz ZQWUEZZHERODBW-ZIAGYGMSSA-N 1 1 323.462 3.747 20 5 DHBDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000611555042 1019517360 /nfs/dbraw/zinc/51/73/60/1019517360.db2.gz KJEPFHNUOFOWTF-AAEUAGOBSA-N 1 1 316.323 3.800 20 5 DHBDMO C[C@@H](c1ccco1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000069065260 1019949726 /nfs/dbraw/zinc/94/97/26/1019949726.db2.gz JQLODCHDDGFDDC-ZDUSSCGKSA-N 1 1 304.346 3.650 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC(C)(C)O ZINC000093414436 1020151737 /nfs/dbraw/zinc/15/17/37/1020151737.db2.gz DJANBAQZHOZMRD-UHFFFAOYSA-N 1 1 320.414 3.526 20 5 DHBDMO CCC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350302 1020166873 /nfs/dbraw/zinc/16/68/73/1020166873.db2.gz WMSRRZBIPYVNSQ-KDOFPFPSSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350302 1020166880 /nfs/dbraw/zinc/16/68/80/1020166880.db2.gz WMSRRZBIPYVNSQ-KDOFPFPSSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350302 1020166889 /nfs/dbraw/zinc/16/68/89/1020166889.db2.gz WMSRRZBIPYVNSQ-KDOFPFPSSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350302 1020166895 /nfs/dbraw/zinc/16/68/95/1020166895.db2.gz WMSRRZBIPYVNSQ-KDOFPFPSSA-N 1 1 317.433 3.510 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000330711154 1020238917 /nfs/dbraw/zinc/23/89/17/1020238917.db2.gz PSEHKBWKZBGJJS-GOEBONIOSA-N 1 1 318.417 3.713 20 5 DHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cc(F)c(F)c(F)c1 ZINC000179314703 1020251920 /nfs/dbraw/zinc/25/19/20/1020251920.db2.gz WSOHARXRPAGSBQ-UHFFFAOYSA-N 1 1 310.275 3.644 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cc(F)c(F)c(F)c1 ZINC000179314703 1020251931 /nfs/dbraw/zinc/25/19/31/1020251931.db2.gz WSOHARXRPAGSBQ-UHFFFAOYSA-N 1 1 310.275 3.644 20 5 DHBDMO CC[N@@H+](CC1CC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000732663239 1020267325 /nfs/dbraw/zinc/26/73/25/1020267325.db2.gz LHGSAXZSRBRMAZ-UHFFFAOYSA-N 1 1 307.375 3.561 20 5 DHBDMO CCC[C@H]([NH2+]Cc1ncc(C)s1)c1cccc([N+](=O)[O-])c1 ZINC000122949618 1020326365 /nfs/dbraw/zinc/32/63/65/1020326365.db2.gz RKHVLSDPIHGZEM-AWEZNQCLSA-N 1 1 305.403 3.991 20 5 DHBDMO C[C@H](Cc1cccc(F)c1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000489832260 1020419704 /nfs/dbraw/zinc/41/97/04/1020419704.db2.gz NBQCLQUTPPVEBN-CYBMUJFWSA-N 1 1 302.349 3.797 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC000172579338 1020546870 /nfs/dbraw/zinc/54/68/70/1020546870.db2.gz KAVDYORGCJGYDT-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(Cl)cn2)C2CC2)cc1 ZINC000554495931 1020547688 /nfs/dbraw/zinc/54/76/88/1020547688.db2.gz MHPZAEWJRBJYKF-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(Cl)cn2)C2CC2)cc1 ZINC000554495931 1020547693 /nfs/dbraw/zinc/54/76/93/1020547693.db2.gz MHPZAEWJRBJYKF-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO Cc1ccc(NC[C@@H]2CC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000715647168 1020554408 /nfs/dbraw/zinc/55/44/08/1020554408.db2.gz VXOLIDGUNPPGEK-INIZCTEOSA-N 1 1 311.385 3.590 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@H]1C[C@H]1c1cccc(F)c1 ZINC000411689470 1020582011 /nfs/dbraw/zinc/58/20/11/1020582011.db2.gz FWEIDHAMKXOTDT-ROUUACIJSA-N 1 1 314.360 3.764 20 5 DHBDMO C[C@H](NC[C@H](C)[N@@H+]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000480642922 1020596791 /nfs/dbraw/zinc/59/67/91/1020596791.db2.gz NVZDPDMTENYCOE-KKUMJFAQSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](NC[C@H](C)[N@H+]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000480642922 1020596800 /nfs/dbraw/zinc/59/68/00/1020596800.db2.gz NVZDPDMTENYCOE-KKUMJFAQSA-N 1 1 305.422 3.508 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1C[C@@H]1c1ccccc1 ZINC000580602333 1020851016 /nfs/dbraw/zinc/85/10/16/1020851016.db2.gz FZBXVNDDHYIXQW-ZWKOTPCHSA-N 1 1 310.397 3.873 20 5 DHBDMO C[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)CC(C)(C)C ZINC000738098960 1020859673 /nfs/dbraw/zinc/85/96/73/1020859673.db2.gz MKDIOKFLNXIVKM-UHFFFAOYSA-N 1 1 309.391 3.807 20 5 DHBDMO CCCc1ncc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000581173709 1020873770 /nfs/dbraw/zinc/87/37/70/1020873770.db2.gz XQBIYWAYQPYHDP-GFCCVEGCSA-N 1 1 303.362 3.695 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000740860735 1020954168 /nfs/dbraw/zinc/95/41/68/1020954168.db2.gz RJSVNIHYZCMGAE-VHSXEESVSA-N 1 1 307.375 3.560 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000741790584 1021053677 /nfs/dbraw/zinc/05/36/77/1021053677.db2.gz HTZDGKDWEQBBRR-HNNXBMFYSA-N 1 1 314.360 3.799 20 5 DHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC3(C2)CCCCC3)c1 ZINC000742165285 1021059051 /nfs/dbraw/zinc/05/90/51/1021059051.db2.gz GFURHVXVZDYAKC-UHFFFAOYSA-N 1 1 314.389 3.558 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1c(C)cccc1F ZINC000742380711 1021108377 /nfs/dbraw/zinc/10/83/77/1021108377.db2.gz QYFAQOXNDFXZHM-UHFFFAOYSA-N 1 1 318.348 3.731 20 5 DHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(F)cc1 ZINC000176986571 1021191973 /nfs/dbraw/zinc/19/19/73/1021191973.db2.gz WWCMBNNZSRHYJH-UHFFFAOYSA-N 1 1 315.304 3.507 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(F)cc1 ZINC000176986571 1021191981 /nfs/dbraw/zinc/19/19/81/1021191981.db2.gz WWCMBNNZSRHYJH-UHFFFAOYSA-N 1 1 315.304 3.507 20 5 DHBDMO CC(C)C[C@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277258 1021209358 /nfs/dbraw/zinc/20/93/58/1021209358.db2.gz MDQKKMJOLPDLPC-IAGOWNOFSA-N 1 1 306.406 3.529 20 5 DHBDMO CCOc1ccccc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892662471 1021209765 /nfs/dbraw/zinc/20/97/65/1021209765.db2.gz IJBABGLAQQSCPT-UHFFFAOYSA-N 1 1 320.776 3.937 20 5 DHBDMO Cc1ccc([C@H](C)[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776274237 1021217245 /nfs/dbraw/zinc/21/72/45/1021217245.db2.gz CHQRWECPMMJREC-KSSFIOAISA-N 1 1 314.385 3.630 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2c2cccs2)cc1 ZINC000776276448 1021219467 /nfs/dbraw/zinc/21/94/67/1021219467.db2.gz NCFKWNPMPLKTBD-LSDHHAIUSA-N 1 1 318.398 3.527 20 5 DHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000743380244 1021286973 /nfs/dbraw/zinc/28/69/73/1021286973.db2.gz XLGOCNYUECXYQB-CZUORRHYSA-N 1 1 316.405 3.803 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccc(Cl)cc1F ZINC000189189944 1021343759 /nfs/dbraw/zinc/34/37/59/1021343759.db2.gz ARKDJKGJUMZKAU-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO CC(C)c1cc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)on1 ZINC000618568492 1021426330 /nfs/dbraw/zinc/42/63/30/1021426330.db2.gz XGGWUNJVJWKKLE-INIZCTEOSA-N 1 1 315.373 3.873 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2C[C@H](O)c3ccccc32)c1 ZINC000850369868 1021492087 /nfs/dbraw/zinc/49/20/87/1021492087.db2.gz CAJNNVARSUUBHD-CVEARBPZSA-N 1 1 318.760 3.516 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2C[C@H](O)c3ccccc32)c1 ZINC000850369869 1021493086 /nfs/dbraw/zinc/49/30/86/1021493086.db2.gz CAJNNVARSUUBHD-HOTGVXAUSA-N 1 1 318.760 3.516 20 5 DHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000092224062 1021565517 /nfs/dbraw/zinc/56/55/17/1021565517.db2.gz BHDMRXXVBJTLKA-OAHLLOKOSA-N 1 1 315.373 3.582 20 5 DHBDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000102534867 1021952135 /nfs/dbraw/zinc/95/21/35/1021952135.db2.gz VMJRUSBDUHYBGX-CYBMUJFWSA-N 1 1 300.358 3.763 20 5 DHBDMO CCC1CCC([N@@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000921047271 1022210482 /nfs/dbraw/zinc/21/04/82/1022210482.db2.gz XQSTXPMZUVUDRE-UHFFFAOYSA-N 1 1 316.405 3.803 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)C1 ZINC001169005674 1022213498 /nfs/dbraw/zinc/21/34/98/1022213498.db2.gz BYMNTSNFZQRQBX-DYVFJYSZSA-N 1 1 320.820 3.875 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H](c3ccccc3)CC2)C1 ZINC001169035496 1022221516 /nfs/dbraw/zinc/22/15/16/1022221516.db2.gz BNRAWXFRZCYBGO-KBAYOESNSA-N 1 1 302.418 3.702 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H](c3ccccc3)CC2)C1 ZINC001169035495 1022221925 /nfs/dbraw/zinc/22/19/25/1022221925.db2.gz BNRAWXFRZCYBGO-BPQIPLTHSA-N 1 1 302.418 3.702 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)C1 ZINC001169039717 1022221987 /nfs/dbraw/zinc/22/19/87/1022221987.db2.gz SPXIJRBSLXUUCP-INWMFGNUSA-N 1 1 308.809 3.575 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H](c3ccccc3)CC2)C1 ZINC001169035497 1022222521 /nfs/dbraw/zinc/22/25/21/1022222521.db2.gz BNRAWXFRZCYBGO-NJAFHUGGSA-N 1 1 302.418 3.702 20 5 DHBDMO C[Si](C)(C)C[N@@H+](Cc1ccccc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169036760 1022223057 /nfs/dbraw/zinc/22/30/57/1022223057.db2.gz PWTVAZATLCAKBH-DLBZAZTESA-N 1 1 320.509 3.811 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC001169025986 1022228321 /nfs/dbraw/zinc/22/83/21/1022228321.db2.gz KKOHYJVBJBOJDS-DAXOMENPSA-N 1 1 308.809 3.922 20 5 DHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@H+]2Cc2ccccc2)s1 ZINC000609631012 1022323678 /nfs/dbraw/zinc/32/36/78/1022323678.db2.gz TVAHPUHPAWXDBT-CQSZACIVSA-N 1 1 317.414 3.733 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)CCc2ccncc2)cc1[N+](=O)[O-] ZINC000183756548 1022350866 /nfs/dbraw/zinc/35/08/66/1022350866.db2.gz UWPVUUGVKOIKCE-UHFFFAOYSA-N 1 1 313.401 3.788 20 5 DHBDMO C[C@@H]1c2c(F)cccc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610004451 1022402609 /nfs/dbraw/zinc/40/26/09/1022402609.db2.gz KWGCHQNLBZSYPM-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H]1c2c(F)cccc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610004451 1022402611 /nfs/dbraw/zinc/40/26/11/1022402611.db2.gz KWGCHQNLBZSYPM-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO CC[C@@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000233852105 1022414164 /nfs/dbraw/zinc/41/41/64/1022414164.db2.gz XQOYNOSYKJILDD-SECBINFHSA-N 1 1 301.184 3.588 20 5 DHBDMO CC[C@@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000233852105 1022414175 /nfs/dbraw/zinc/41/41/75/1022414175.db2.gz XQOYNOSYKJILDD-SECBINFHSA-N 1 1 301.184 3.588 20 5 DHBDMO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001169714522 1022514377 /nfs/dbraw/zinc/51/43/77/1022514377.db2.gz BQMYHZAPZNYWQV-SFHVURJKSA-N 1 1 314.360 3.974 20 5 DHBDMO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001169714522 1022514389 /nfs/dbraw/zinc/51/43/89/1022514389.db2.gz BQMYHZAPZNYWQV-SFHVURJKSA-N 1 1 314.360 3.974 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1csc(C)n1 ZINC000615722634 1022547222 /nfs/dbraw/zinc/54/72/22/1022547222.db2.gz RFUVAAPKUYXDHL-IZZDOVSWSA-N 1 1 303.387 3.553 20 5 DHBDMO C[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CCCC1 ZINC000768215118 1022926813 /nfs/dbraw/zinc/92/68/13/1022926813.db2.gz ZZLRFDDDXCNJLY-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO C[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CCCC1 ZINC000768215118 1022926821 /nfs/dbraw/zinc/92/68/21/1022926821.db2.gz ZZLRFDDDXCNJLY-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO COCCCC[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000418131070 1022967634 /nfs/dbraw/zinc/96/76/34/1022967634.db2.gz HKWKWWHQDRKFJY-UHFFFAOYSA-N 1 1 318.373 3.713 20 5 DHBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[C@@H]1C ZINC000781925392 1023086952 /nfs/dbraw/zinc/08/69/52/1023086952.db2.gz TVQDUNDYOHOJED-XKQJLSEDSA-N 1 1 306.406 3.529 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1coc3ccccc13)C2 ZINC000769426773 1023146396 /nfs/dbraw/zinc/14/63/96/1023146396.db2.gz WRUZOGLRRGVGLJ-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1coc3ccccc13)C2 ZINC000769426773 1023146399 /nfs/dbraw/zinc/14/63/99/1023146399.db2.gz WRUZOGLRRGVGLJ-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@@H]1C ZINC000770281760 1023290133 /nfs/dbraw/zinc/29/01/33/1023290133.db2.gz ADCYFHGBLUXXPR-NXEZZACHSA-N 1 1 313.195 3.588 20 5 DHBDMO Cc1c([C@H](C)Nc2ccc3c(c2)[nH+]cn3C)cccc1[N+](=O)[O-] ZINC000538636553 1033121861 /nfs/dbraw/zinc/12/18/61/1033121861.db2.gz AMILEIQEFUETIT-LBPRGKRZSA-N 1 1 310.357 3.963 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCc1cccc(F)c1)C2 ZINC000538712809 1033141696 /nfs/dbraw/zinc/14/16/96/1033141696.db2.gz JZJXLLSIAQCQNF-UHFFFAOYSA-N 1 1 314.360 3.725 20 5 DHBDMO C[C@H]1C[C@H](C)[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000538717424 1033142173 /nfs/dbraw/zinc/14/21/73/1033142173.db2.gz ZZFRFIUYSDIFIR-RYUDHWBXSA-N 1 1 317.414 3.949 20 5 DHBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](C)C(C)C ZINC000112656957 1023815242 /nfs/dbraw/zinc/81/52/42/1023815242.db2.gz WMZPAVVMSGKQBY-LBPRGKRZSA-N 1 1 318.377 3.511 20 5 DHBDMO Cc1cccc(OCC[N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000788479616 1023891750 /nfs/dbraw/zinc/89/17/50/1023891750.db2.gz XIWMZNYSJAHYFB-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO CCCC[N@H+]1CCCC[C@@H]1CNCc1ccc(C)c([N+](=O)[O-])c1 ZINC000520214218 1024262241 /nfs/dbraw/zinc/26/22/41/1024262241.db2.gz JMAQVUVIVXIJHX-QGZVFWFLSA-N 1 1 319.449 3.647 20 5 DHBDMO CCCCN1CCCC[C@@H]1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000520214218 1024262249 /nfs/dbraw/zinc/26/22/49/1024262249.db2.gz JMAQVUVIVXIJHX-QGZVFWFLSA-N 1 1 319.449 3.647 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCOC3(C2)CCCCCC3)cc1 ZINC000531661518 1024262370 /nfs/dbraw/zinc/26/23/70/1024262370.db2.gz UPRJYJNEJDVNJQ-UHFFFAOYSA-N 1 1 304.390 3.520 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCOC3(C2)CCCCCC3)cc1 ZINC000531661518 1024262379 /nfs/dbraw/zinc/26/23/79/1024262379.db2.gz UPRJYJNEJDVNJQ-UHFFFAOYSA-N 1 1 304.390 3.520 20 5 DHBDMO C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000051650297 1024324122 /nfs/dbraw/zinc/32/41/22/1024324122.db2.gz LTQQAWXCEAFNNN-KRWDZBQOSA-N 1 1 300.333 3.853 20 5 DHBDMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000051650297 1024324137 /nfs/dbraw/zinc/32/41/37/1024324137.db2.gz LTQQAWXCEAFNNN-KRWDZBQOSA-N 1 1 300.333 3.853 20 5 DHBDMO CC(C)[N@@H+](C)C[C@@H](C)Nc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000314606415 1024334420 /nfs/dbraw/zinc/33/44/20/1024334420.db2.gz YMBYXWINCAJXIM-SNVBAGLBSA-N 1 1 301.337 3.673 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)cc1 ZINC000883384544 1024421079 /nfs/dbraw/zinc/42/10/79/1024421079.db2.gz UKPJQTDWMYHLBC-IAGOWNOFSA-N 1 1 300.333 3.710 20 5 DHBDMO CCC[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000453361329 1024487697 /nfs/dbraw/zinc/48/76/97/1024487697.db2.gz QWJOWNWPZODOHQ-UHOFOFEASA-N 1 1 314.389 3.928 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2cccnc2)C2CC2)ccc1Cl ZINC000271407298 1024500290 /nfs/dbraw/zinc/50/02/90/1024500290.db2.gz VJKYIWWCDFAFOX-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2cccnc2)C2CC2)ccc1Cl ZINC000271407298 1024500296 /nfs/dbraw/zinc/50/02/96/1024500296.db2.gz VJKYIWWCDFAFOX-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO CCC[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cccc([N+](=O)[O-])c1 ZINC000271495795 1024522905 /nfs/dbraw/zinc/52/29/05/1024522905.db2.gz LGHFNZRYCOMOBU-JKSUJKDBSA-N 1 1 314.389 3.826 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2ccccn2)C2CC2)ccc1Cl ZINC000271508925 1024526633 /nfs/dbraw/zinc/52/66/33/1024526633.db2.gz KAZFRBPKERWGBT-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccccn2)C2CC2)ccc1Cl ZINC000271508925 1024526642 /nfs/dbraw/zinc/52/66/42/1024526642.db2.gz KAZFRBPKERWGBT-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO CCC1C[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000453606722 1024551403 /nfs/dbraw/zinc/55/14/03/1024551403.db2.gz QUVOAZLOHNMRFC-UHFFFAOYSA-N 1 1 303.387 3.560 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-] ZINC000271649552 1024557187 /nfs/dbraw/zinc/55/71/87/1024557187.db2.gz URDZWYPBPBVLOK-RYUDHWBXSA-N 1 1 315.329 3.915 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC[N@@H+](C)C1CCCCC1 ZINC000532211990 1024577666 /nfs/dbraw/zinc/57/76/66/1024577666.db2.gz OCLABAYRDHJRKN-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCN(C)C1CCCCC1 ZINC000532211990 1024577674 /nfs/dbraw/zinc/57/76/74/1024577674.db2.gz OCLABAYRDHJRKN-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1[nH+]ccn1Cc1ccc(Nc2ccccc2[N+](=O)[O-])cc1 ZINC001206164674 1033222344 /nfs/dbraw/zinc/22/23/44/1033222344.db2.gz NFURHGGOSDAPIP-UHFFFAOYSA-N 1 1 308.341 3.892 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3cccc(F)c3)CC2)cc1F ZINC000283194781 1024609043 /nfs/dbraw/zinc/60/90/43/1024609043.db2.gz QYEXTUPFUHOJOJ-UHFFFAOYSA-N 1 1 304.296 3.652 20 5 DHBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCC1 ZINC000108364393 1024639963 /nfs/dbraw/zinc/63/99/63/1024639963.db2.gz YGOVKQMADCOJPR-UHFFFAOYSA-N 1 1 320.389 3.614 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000349707076 1024744100 /nfs/dbraw/zinc/74/41/00/1024744100.db2.gz MZEVJNLNXCGNIX-GXTWGEPZSA-N 1 1 322.405 3.623 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](C)CC2)c([N+](=O)[O-])c1 ZINC001170336391 1024746236 /nfs/dbraw/zinc/74/62/36/1024746236.db2.gz XKGRZGGRKRHIIS-KGLIPLIRSA-N 1 1 306.406 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H]3CCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001170334436 1024746259 /nfs/dbraw/zinc/74/62/59/1024746259.db2.gz DSLFKUGPLGOYSP-OFQRWUPVSA-N 1 1 318.417 3.656 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001170329756 1024746662 /nfs/dbraw/zinc/74/66/62/1024746662.db2.gz TWEPMFWFLWKKCW-BMFZPTHFSA-N 1 1 318.417 3.656 20 5 DHBDMO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000111312484 1024752927 /nfs/dbraw/zinc/75/29/27/1024752927.db2.gz VIYWPUDNLPXMBG-HNNXBMFYSA-N 1 1 317.414 3.869 20 5 DHBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000111312484 1024752942 /nfs/dbraw/zinc/75/29/42/1024752942.db2.gz VIYWPUDNLPXMBG-HNNXBMFYSA-N 1 1 317.414 3.869 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000170719148 1024866155 /nfs/dbraw/zinc/86/61/55/1024866155.db2.gz SGFUPQRHINDYCH-PWSUYJOCSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000170719148 1024866173 /nfs/dbraw/zinc/86/61/73/1024866173.db2.gz SGFUPQRHINDYCH-PWSUYJOCSA-N 1 1 302.296 3.930 20 5 DHBDMO CC[C@@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000135649605 1025252622 /nfs/dbraw/zinc/25/26/22/1025252622.db2.gz CBBUSDCTEFJEFA-SNVBAGLBSA-N 1 1 313.195 3.589 20 5 DHBDMO CC[C@@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000135649605 1025252632 /nfs/dbraw/zinc/25/26/32/1025252632.db2.gz CBBUSDCTEFJEFA-SNVBAGLBSA-N 1 1 313.195 3.589 20 5 DHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000353949230 1025302929 /nfs/dbraw/zinc/30/29/29/1025302929.db2.gz AOJNCABSLLYKTJ-LBPRGKRZSA-N 1 1 312.435 3.567 20 5 DHBDMO CCOc1ccc2c(c1)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C2 ZINC000354107870 1025351658 /nfs/dbraw/zinc/35/16/58/1025351658.db2.gz BINWGZKDWWSVJR-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCOc1ccc2c(c1)CC[N@H+](Cc1ccccc1[N+](=O)[O-])C2 ZINC000354107870 1025351668 /nfs/dbraw/zinc/35/16/68/1025351668.db2.gz BINWGZKDWWSVJR-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000136947911 1025494404 /nfs/dbraw/zinc/49/44/04/1025494404.db2.gz CPRGEVVWYJMLHZ-KDOFPFPSSA-N 1 1 314.385 3.630 20 5 DHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCC[C@H]1c1ccccc1 ZINC000886242929 1025570380 /nfs/dbraw/zinc/57/03/80/1025570380.db2.gz JFHBCQPONVHVNI-DLBZAZTESA-N 1 1 311.385 3.758 20 5 DHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000355211446 1025639767 /nfs/dbraw/zinc/63/97/67/1025639767.db2.gz BYPOBDGBZNZAQD-KRWDZBQOSA-N 1 1 306.406 3.719 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCOCC2(CCCC2)C1 ZINC000614222898 1025953541 /nfs/dbraw/zinc/95/35/41/1025953541.db2.gz OUJJNDWEJXDCKS-HNNXBMFYSA-N 1 1 318.417 3.857 20 5 DHBDMO CCC[C@@H](NC[C@H]1CC[N@H+](CCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000151119958 1026338293 /nfs/dbraw/zinc/33/82/93/1026338293.db2.gz LWNJFPACPKUDJC-CRAIPNDOSA-N 1 1 319.449 3.758 20 5 DHBDMO CCC[C@@H](NC[C@H]1CC[N@@H+](CCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000151119958 1026338300 /nfs/dbraw/zinc/33/83/00/1026338300.db2.gz LWNJFPACPKUDJC-CRAIPNDOSA-N 1 1 319.449 3.758 20 5 DHBDMO CCC[C@@H](NC[C@@H]1CC[N@H+](CCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000151119852 1026342249 /nfs/dbraw/zinc/34/22/49/1026342249.db2.gz LWNJFPACPKUDJC-MAUKXSAKSA-N 1 1 319.449 3.758 20 5 DHBDMO CCC[C@@H](NC[C@@H]1CC[N@@H+](CCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000151119852 1026342258 /nfs/dbraw/zinc/34/22/58/1026342258.db2.gz LWNJFPACPKUDJC-MAUKXSAKSA-N 1 1 319.449 3.758 20 5 DHBDMO Cc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc(Cl)n1 ZINC000809688560 1026593581 /nfs/dbraw/zinc/59/35/81/1026593581.db2.gz LZOZNBXFMSYBPL-UHFFFAOYSA-N 1 1 319.792 3.626 20 5 DHBDMO CCOC1CC2(C1)CC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C2 ZINC000809708137 1026599577 /nfs/dbraw/zinc/59/95/77/1026599577.db2.gz ZLFBGXBOKUWQEC-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO CC[C@H](CSC)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809767831 1026605871 /nfs/dbraw/zinc/60/58/71/1026605871.db2.gz VNHFCTFIJOQRPQ-LLVKDONJSA-N 1 1 302.827 3.822 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000809936297 1026643018 /nfs/dbraw/zinc/64/30/18/1026643018.db2.gz VBARGLDSMDXBDA-NSHDSACASA-N 1 1 319.188 3.512 20 5 DHBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000809936297 1026643019 /nfs/dbraw/zinc/64/30/19/1026643019.db2.gz VBARGLDSMDXBDA-NSHDSACASA-N 1 1 319.188 3.512 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420956473 1026892195 /nfs/dbraw/zinc/89/21/95/1026892195.db2.gz YJVLTCPPOPOOMK-NSHDSACASA-N 1 1 302.296 3.759 20 5 DHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000362455720 1027214915 /nfs/dbraw/zinc/21/49/15/1027214915.db2.gz SXVOZPBAVWJNQI-GFCCVEGCSA-N 1 1 312.435 3.567 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)Nc1ccc(C(=O)CC)cc1[N+](=O)[O-] ZINC000574372625 1027389514 /nfs/dbraw/zinc/38/95/14/1027389514.db2.gz FGTOGCGEOYSIGQ-CYBMUJFWSA-N 1 1 321.421 3.720 20 5 DHBDMO CCc1cc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)on1 ZINC000562415157 1027423732 /nfs/dbraw/zinc/42/37/32/1027423732.db2.gz WQBFHTVYWHULOU-MRXNPFEDSA-N 1 1 315.373 3.657 20 5 DHBDMO CC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H](C)OC ZINC000812807594 1027430475 /nfs/dbraw/zinc/43/04/75/1027430475.db2.gz RVWFJNJKOKJONP-VIFPVBQESA-N 1 1 321.204 3.758 20 5 DHBDMO CCc1ccccc1[C@H](N)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000423499263 1027563928 /nfs/dbraw/zinc/56/39/28/1027563928.db2.gz JGIZQHMPOFXOJZ-SCLBCKFNSA-N 1 1 313.401 3.508 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 ZINC000296787352 1027731799 /nfs/dbraw/zinc/73/17/99/1027731799.db2.gz SLYVOXAGFVDFOW-RYUDHWBXSA-N 1 1 315.329 3.915 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)ccc1Cl ZINC000778173302 1027740013 /nfs/dbraw/zinc/74/00/13/1027740013.db2.gz RVHCELZRBGKIAJ-CQSZACIVSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)ccc1Cl ZINC000778173302 1027740027 /nfs/dbraw/zinc/74/00/27/1027740027.db2.gz RVHCELZRBGKIAJ-CQSZACIVSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000369391828 1028484954 /nfs/dbraw/zinc/48/49/54/1028484954.db2.gz PNZRVPRIVNKPLR-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO CC(C)[N@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)C1CC1 ZINC000075666458 1028525659 /nfs/dbraw/zinc/52/56/59/1028525659.db2.gz AKTWQAPUWQARAE-UHFFFAOYSA-N 1 1 307.375 3.702 20 5 DHBDMO CC(C)[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)C1CC1 ZINC000075666458 1028525668 /nfs/dbraw/zinc/52/56/68/1028525668.db2.gz AKTWQAPUWQARAE-UHFFFAOYSA-N 1 1 307.375 3.702 20 5 DHBDMO Cc1csc([C@H](C)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000565213457 1028557046 /nfs/dbraw/zinc/55/70/46/1028557046.db2.gz AOYWSMJCQMDXLR-GXFFZTMASA-N 1 1 303.387 3.698 20 5 DHBDMO CS[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449447380 1028652470 /nfs/dbraw/zinc/65/24/70/1028652470.db2.gz YKIOHUKDPWXFPJ-HNNXBMFYSA-N 1 1 318.398 3.792 20 5 DHBDMO CO[C@@H]1CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1(C)C ZINC000449499310 1028713235 /nfs/dbraw/zinc/71/32/35/1028713235.db2.gz LSXYFOSUFVJAKU-IDKBZEPQSA-N 1 1 318.417 3.745 20 5 DHBDMO C[C@@H]1C[C@@H](C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449498905 1028715150 /nfs/dbraw/zinc/71/51/50/1028715150.db2.gz LKGWUYYGIUIHBI-VYDXJSESSA-N 1 1 318.417 3.589 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000371681876 1028743272 /nfs/dbraw/zinc/74/32/72/1028743272.db2.gz UJDNRNUTTQJMRC-RCFWFJCLSA-N 1 1 323.396 3.568 20 5 DHBDMO CC(C)[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CCS1 ZINC000687932822 1028754559 /nfs/dbraw/zinc/75/45/59/1028754559.db2.gz IUAPVMMRHHZSOK-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CCS1 ZINC000687932822 1028754580 /nfs/dbraw/zinc/75/45/80/1028754580.db2.gz IUAPVMMRHHZSOK-CQSZACIVSA-N 1 1 314.838 3.822 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCSC[C@@H]2C2CC2)c(Cl)c1 ZINC000449526712 1028755838 /nfs/dbraw/zinc/75/58/38/1028755838.db2.gz FEIMUJZPDKRNET-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC[C@@H]2C2CC2)c(Cl)c1 ZINC000449526712 1028755855 /nfs/dbraw/zinc/75/58/55/1028755855.db2.gz FEIMUJZPDKRNET-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000568468269 1029074445 /nfs/dbraw/zinc/07/44/45/1029074445.db2.gz LTFLNZRXWAOHOW-ZBFHGGJFSA-N 1 1 311.385 3.849 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](c3cccc(F)c3)C2)cc1 ZINC000568979688 1029155686 /nfs/dbraw/zinc/15/56/86/1029155686.db2.gz RLKJGUOSXJCHCR-INIZCTEOSA-N 1 1 314.360 3.766 20 5 DHBDMO C[C@@H](Cc1ccsc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000570551391 1029384273 /nfs/dbraw/zinc/38/42/73/1029384273.db2.gz AHNFAOYZCGNEKB-ZDUSSCGKSA-N 1 1 304.415 3.762 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CC[C@@H]3CCCCO3)C2)cc1 ZINC000451543121 1029908134 /nfs/dbraw/zinc/90/81/34/1029908134.db2.gz AWXCCVSRQMNJQW-WMZOPIPTSA-N 1 1 318.417 3.733 20 5 DHBDMO Cc1cncc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000451552672 1029913425 /nfs/dbraw/zinc/91/34/25/1029913425.db2.gz XAJMUPSMZCJBQD-KRWDZBQOSA-N 1 1 311.385 3.678 20 5 DHBDMO C[C@H]1c2ccccc2CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000530663118 1029952399 /nfs/dbraw/zinc/95/23/99/1029952399.db2.gz KGDWJUVSIHUDJO-AWEZNQCLSA-N 1 1 312.369 3.593 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](OCC3CC3)C2)cc1Cl ZINC000783678302 1030000134 /nfs/dbraw/zinc/00/01/34/1030000134.db2.gz ZBNBCHNFIBTRTJ-AWEZNQCLSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](OCC3CC3)C2)cc1Cl ZINC000783678302 1030000148 /nfs/dbraw/zinc/00/01/48/1030000148.db2.gz ZBNBCHNFIBTRTJ-AWEZNQCLSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805840048 1030400188 /nfs/dbraw/zinc/40/01/88/1030400188.db2.gz WIRFSFKJFBBARA-UKPHBRMFSA-N 1 1 320.433 3.775 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccnc(Cl)c2F)cc1[N+](=O)[O-] ZINC000823961092 1030435838 /nfs/dbraw/zinc/43/58/38/1030435838.db2.gz KWCBTMGWAHBZRB-JTQLQIEISA-N 1 1 323.755 3.942 20 5 DHBDMO CO[C@H](C)C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000558418735 1030568346 /nfs/dbraw/zinc/56/83/46/1030568346.db2.gz ZTZXUEMVKXHNFN-GFCCVEGCSA-N 1 1 320.414 3.790 20 5 DHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)C1 ZINC000359558458 1031027290 /nfs/dbraw/zinc/02/72/90/1031027290.db2.gz OJTVDFYGBXGOOS-PXAZEXFGSA-N 1 1 315.373 3.748 20 5 DHBDMO CC(C)[N@@H+](CCC1CCOCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000292777029 1031169856 /nfs/dbraw/zinc/16/98/56/1031169856.db2.gz YVLUDWJOPZKVKN-UHFFFAOYSA-N 1 1 306.406 3.622 20 5 DHBDMO COCc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872022233 1031405134 /nfs/dbraw/zinc/40/51/34/1031405134.db2.gz ICPBKNHAVFDEBP-LBPRGKRZSA-N 1 1 318.348 3.731 20 5 DHBDMO C[C@@H](O)c1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872026316 1031409726 /nfs/dbraw/zinc/40/97/26/1031409726.db2.gz COCXFMIZLHTXOA-NWDGAFQWSA-N 1 1 318.348 3.638 20 5 DHBDMO C[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052961 1031440474 /nfs/dbraw/zinc/44/04/74/1031440474.db2.gz UQBOBXREXPKPET-DIFFPNOSSA-N 1 1 315.348 3.931 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1C ZINC001171157671 1031445877 /nfs/dbraw/zinc/44/58/77/1031445877.db2.gz XMCXCIFIHQIUQA-UHFFFAOYSA-N 1 1 324.384 3.720 20 5 DHBDMO Cc1ccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1C ZINC001171157671 1031445882 /nfs/dbraw/zinc/44/58/82/1031445882.db2.gz XMCXCIFIHQIUQA-UHFFFAOYSA-N 1 1 324.384 3.720 20 5 DHBDMO Cc1c(C[NH2+][C@H](C)c2cc(O)ccc2F)cccc1[N+](=O)[O-] ZINC000872066428 1031460979 /nfs/dbraw/zinc/46/09/79/1031460979.db2.gz NCTAXLYRVGIOFU-LLVKDONJSA-N 1 1 304.321 3.599 20 5 DHBDMO C[C@H](O)[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872087469 1031484009 /nfs/dbraw/zinc/48/40/09/1031484009.db2.gz FFETUCRRNRBZRW-NVGCLXPQSA-N 1 1 318.348 3.507 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccnc(F)c1 ZINC000872093035 1031491047 /nfs/dbraw/zinc/49/10/47/1031491047.db2.gz SRDRPEFMAUOXBS-JTQLQIEISA-N 1 1 321.377 3.702 20 5 DHBDMO CC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccc(OC)cc1 ZINC000054176437 1031509168 /nfs/dbraw/zinc/50/91/68/1031509168.db2.gz FHOPSGMNSQLMTB-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccc(OC)cc1 ZINC000054176437 1031509196 /nfs/dbraw/zinc/50/91/96/1031509196.db2.gz FHOPSGMNSQLMTB-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO CCC[C@@H]([NH2+][C@H](C)c1nccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000872132581 1031524528 /nfs/dbraw/zinc/52/45/28/1031524528.db2.gz GPXPPERJVKVOPD-CZUORRHYSA-N 1 1 314.389 3.885 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(C(C)(C)C)n1 ZINC000930353107 1031790487 /nfs/dbraw/zinc/79/04/87/1031790487.db2.gz HOIHWGUWKAYWIZ-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(C(C)(C)C)n1 ZINC000930353107 1031790495 /nfs/dbraw/zinc/79/04/95/1031790495.db2.gz HOIHWGUWKAYWIZ-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO COc1cc(C[N@@H+](CC2CC2)C2CCC2)c([N+](=O)[O-])cc1F ZINC000361588964 1032001459 /nfs/dbraw/zinc/00/14/59/1032001459.db2.gz ZWVZOQZCAUELKZ-UHFFFAOYSA-N 1 1 308.353 3.507 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cccc(F)c1F ZINC001173230229 1033605668 /nfs/dbraw/zinc/60/56/68/1033605668.db2.gz CZYFXCGWEDAGKA-GFCCVEGCSA-N 1 1 320.339 3.936 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1ccccn1 ZINC001173227572 1033606354 /nfs/dbraw/zinc/60/63/54/1033606354.db2.gz QXLYWFYMOKJRTA-KDOFPFPSSA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C[C@H](C)C1(F)F ZINC000862444396 1033858676 /nfs/dbraw/zinc/85/86/76/1033858676.db2.gz WFPCCZGIUFIFEU-AOOOYVTPSA-N 1 1 318.751 3.971 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C[C@H](C)C1(F)F ZINC000862444396 1033858681 /nfs/dbraw/zinc/85/86/81/1033858681.db2.gz WFPCCZGIUFIFEU-AOOOYVTPSA-N 1 1 318.751 3.971 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@](C)(C(F)(F)F)C1 ZINC000879998809 1034172914 /nfs/dbraw/zinc/17/29/14/1034172914.db2.gz ASFFLFUNFADKJX-MFKMUULPSA-N 1 1 302.296 3.930 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@H](c3nccs3)C2)c1 ZINC000880317511 1034293359 /nfs/dbraw/zinc/29/33/59/1034293359.db2.gz OXRDTILVFRNLEC-JTQLQIEISA-N 1 1 323.805 3.694 20 5 DHBDMO Cc1c([C@@H](C)NC[C@@H](CC(C)C)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000480543824 1034309025 /nfs/dbraw/zinc/30/90/25/1034309025.db2.gz XQFRRUUAMXATSA-HUUCEWRRSA-N 1 1 307.438 3.530 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H](C)[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000480619839 1034354860 /nfs/dbraw/zinc/35/48/60/1034354860.db2.gz BHYAQNAHDNOUKT-IMJJTQAJSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000480619839 1034354877 /nfs/dbraw/zinc/35/48/77/1034354877.db2.gz BHYAQNAHDNOUKT-IMJJTQAJSA-N 1 1 319.449 3.674 20 5 DHBDMO C[N@@H+](CCCCC1CCOCC1)CCc1cccc([N+](=O)[O-])c1 ZINC000554846060 1034363728 /nfs/dbraw/zinc/36/37/28/1034363728.db2.gz JHKVGOKEILPHHZ-UHFFFAOYSA-N 1 1 320.433 3.666 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@H](C3CCOCC3)C2)cs1 ZINC000880575260 1034367063 /nfs/dbraw/zinc/36/70/63/1034367063.db2.gz WSPSSMINKSZTOI-HNNXBMFYSA-N 1 1 324.446 3.685 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2nccs2)CCCC1 ZINC000183478782 1034390317 /nfs/dbraw/zinc/39/03/17/1034390317.db2.gz UDDDMBNYQQBPSZ-UHFFFAOYSA-N 1 1 317.414 3.919 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000480852618 1034474923 /nfs/dbraw/zinc/47/49/23/1034474923.db2.gz CQVLXMQNIUKRTF-MRXNPFEDSA-N 1 1 308.447 3.745 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000480944110 1034517440 /nfs/dbraw/zinc/51/74/40/1034517440.db2.gz YKNWTCKWHBTKTM-CQSZACIVSA-N 1 1 324.446 3.581 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000481017635 1034553714 /nfs/dbraw/zinc/55/37/14/1034553714.db2.gz RGSCUWYZOKERGD-INIZCTEOSA-N 1 1 324.446 3.581 20 5 DHBDMO COc1ccsc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000186152859 1034604219 /nfs/dbraw/zinc/60/42/19/1034604219.db2.gz ANWPBKQRDBLSRY-SNVBAGLBSA-N 1 1 322.386 3.524 20 5 DHBDMO Cc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)ccc1F ZINC000555339757 1034630516 /nfs/dbraw/zinc/63/05/16/1034630516.db2.gz HSZDGPYYBHZNQV-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2c(O)cccc2C1 ZINC000600209165 1034816837 /nfs/dbraw/zinc/81/68/37/1034816837.db2.gz XVBKQCQJTLWANJ-GXDHUFHOSA-N 1 1 324.380 3.762 20 5 DHBDMO Cc1ccc(C[N@H+]2CC[C@@H](c3ccc(O)cc3)C2)cc1[N+](=O)[O-] ZINC000600214516 1034817514 /nfs/dbraw/zinc/81/75/14/1034817514.db2.gz RTKXEGGSPVFHKA-MRXNPFEDSA-N 1 1 312.369 3.598 20 5 DHBDMO CCCc1[nH+]ccn1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159443008 1035055120 /nfs/dbraw/zinc/05/51/20/1035055120.db2.gz FHNLUMJXHSDKAQ-UHFFFAOYSA-N 1 1 324.178 3.555 20 5 DHBDMO CC(C)[N@@H+](CCc1nccs1)CCc1ccc([N+](=O)[O-])cc1 ZINC000159744157 1035085173 /nfs/dbraw/zinc/08/51/73/1035085173.db2.gz BQLQRVVTIWAVSC-UHFFFAOYSA-N 1 1 319.430 3.547 20 5 DHBDMO C[C@@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)(C)C ZINC001175984643 1035174418 /nfs/dbraw/zinc/17/44/18/1035174418.db2.gz WTNJTRNCSBPBFW-NSHDSACASA-N 1 1 309.366 3.617 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1CCN[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000482941707 1035202479 /nfs/dbraw/zinc/20/24/79/1035202479.db2.gz AKGVETSGRMDNTD-HZPDHXFCSA-N 1 1 319.449 3.818 20 5 DHBDMO CC[C@@H]1CCCCN1CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000482941707 1035202483 /nfs/dbraw/zinc/20/24/83/1035202483.db2.gz AKGVETSGRMDNTD-HZPDHXFCSA-N 1 1 319.449 3.818 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000483115569 1035228683 /nfs/dbraw/zinc/22/86/83/1035228683.db2.gz YMMNMHAYUIIOIS-CYBMUJFWSA-N 1 1 318.323 3.863 20 5 DHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000483242731 1035243617 /nfs/dbraw/zinc/24/36/17/1035243617.db2.gz CFWRHEAMLCUVPJ-LBPRGKRZSA-N 1 1 316.405 3.729 20 5 DHBDMO COc1ccc(Nc2cccn3c(C)c(C)[nH+]c23)cc1[N+](=O)[O-] ZINC001176362870 1035257705 /nfs/dbraw/zinc/25/77/05/1035257705.db2.gz IEQCLKURPLDCJK-UHFFFAOYSA-N 1 1 312.329 3.612 20 5 DHBDMO CC(C)c1ccc(CNCCC[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC001177231210 1035358362 /nfs/dbraw/zinc/35/83/62/1035358362.db2.gz GDAFCMBQLGZGHU-UHFFFAOYSA-N 1 1 307.438 3.538 20 5 DHBDMO C[C@@H]([NH2+]Cc1cc2ccccc2[nH]c1=O)c1ccccc1[N+](=O)[O-] ZINC001179512006 1035482887 /nfs/dbraw/zinc/48/28/87/1035482887.db2.gz KJMYLTIKDVYBBK-GFCCVEGCSA-N 1 1 323.352 3.699 20 5 DHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@@H]1C ZINC001193413517 1035632102 /nfs/dbraw/zinc/63/21/02/1035632102.db2.gz OBXDTOQRCIHZPM-YOEHRIQHSA-N 1 1 306.406 3.874 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc2c(c1)CCC2 ZINC001193742390 1035714037 /nfs/dbraw/zinc/71/40/37/1035714037.db2.gz BKJXHDACSYUNFL-UHFFFAOYSA-N 1 1 310.397 3.758 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494704451 1035770282 /nfs/dbraw/zinc/77/02/82/1035770282.db2.gz SEGYXWUZEQTRMZ-WMLDXEAASA-N 1 1 318.417 3.855 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494705579 1035771263 /nfs/dbraw/zinc/77/12/63/1035771263.db2.gz XKWCTTWERMYXRU-SUMWQHHRSA-N 1 1 304.390 3.547 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cccs2)ccc1[N+](=O)[O-] ZINC000485741572 1035929568 /nfs/dbraw/zinc/92/95/68/1035929568.db2.gz CQNHWZRLTZZNGI-NSHDSACASA-N 1 1 306.387 3.858 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[N@@H+](C)C2(CCCCC2)C1 ZINC001194477545 1035943581 /nfs/dbraw/zinc/94/35/81/1035943581.db2.gz MDVZRVLGAHAWGA-HNNXBMFYSA-N 1 1 317.433 3.606 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(C)C2(CCCCC2)C1 ZINC001194477545 1035943591 /nfs/dbraw/zinc/94/35/91/1035943591.db2.gz MDVZRVLGAHAWGA-HNNXBMFYSA-N 1 1 317.433 3.606 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCN(C)C2(CCCCC2)C1 ZINC001194477545 1035943602 /nfs/dbraw/zinc/94/36/02/1035943602.db2.gz MDVZRVLGAHAWGA-HNNXBMFYSA-N 1 1 317.433 3.606 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCOCC3CCC3)C2)cc1 ZINC001194476961 1035944021 /nfs/dbraw/zinc/94/40/21/1035944021.db2.gz GNBRZCXBYVVVBB-KRWDZBQOSA-N 1 1 318.417 3.591 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccccc1O ZINC000541387333 1036318315 /nfs/dbraw/zinc/31/83/15/1036318315.db2.gz MBWYGERQTAMTPU-CYBMUJFWSA-N 1 1 300.358 3.536 20 5 DHBDMO COc1cccc(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000271734852 1036505821 /nfs/dbraw/zinc/50/58/21/1036505821.db2.gz UDXPFYPOUYUELX-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO C[C@H]1c2ccccc2OCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000609145422 1036508631 /nfs/dbraw/zinc/50/86/31/1036508631.db2.gz BRNZMCFMEQKGGS-AWEZNQCLSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000596144520 1036546780 /nfs/dbraw/zinc/54/67/80/1036546780.db2.gz GMIBBVQYXOIXSF-MWLCHTKSSA-N 1 1 317.311 3.508 20 5 DHBDMO C/C=C/C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001196606749 1036573220 /nfs/dbraw/zinc/57/32/20/1036573220.db2.gz WOEHUBWSFRODOM-XGACYXMMSA-N 1 1 304.390 3.782 20 5 DHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000774625067 1036586486 /nfs/dbraw/zinc/58/64/86/1036586486.db2.gz OIEITSTXHLNXRQ-GUYCJALGSA-N 1 1 314.389 3.536 20 5 DHBDMO CCOc1cc(C[N@H+](C)Cc2cccs2)ccc1[N+](=O)[O-] ZINC000492378737 1036847750 /nfs/dbraw/zinc/84/77/50/1036847750.db2.gz UHOVZIPDXDKQSY-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2cccs2)ccc1[N+](=O)[O-] ZINC000492378737 1036847766 /nfs/dbraw/zinc/84/77/66/1036847766.db2.gz UHOVZIPDXDKQSY-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCSC[C@@H]1C ZINC001198518330 1037057526 /nfs/dbraw/zinc/05/75/26/1037057526.db2.gz YFWVWUNNWIIZCN-ZDUSSCGKSA-N 1 1 324.446 3.709 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000493108260 1037180117 /nfs/dbraw/zinc/18/01/17/1037180117.db2.gz VDSKHGMNOSNCCT-INIZCTEOSA-N 1 1 324.808 3.641 20 5 DHBDMO CC[C@H](C)C[N@@H+](CC)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000489353373 1037368160 /nfs/dbraw/zinc/36/81/60/1037368160.db2.gz GXLFBDGEEKHZCT-GXTWGEPZSA-N 1 1 321.421 3.598 20 5 DHBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNc1ccc([N+](=O)[O-])cc1Cl ZINC001186367491 1037374733 /nfs/dbraw/zinc/37/47/33/1037374733.db2.gz CLWYZVHKLCFVCP-CQSZACIVSA-N 1 1 311.813 3.781 20 5 DHBDMO O=[N+]([O-])c1cnc(Nc2ccc3[nH+]ccn3c2)c2ccccc21 ZINC001187117121 1037566488 /nfs/dbraw/zinc/56/64/88/1037566488.db2.gz VTSVTBUGLRYWKX-UHFFFAOYSA-N 1 1 305.297 3.534 20 5 DHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](CC2CC2)C2CCCCC2)c1 ZINC000153944389 1037738786 /nfs/dbraw/zinc/73/87/86/1037738786.db2.gz MWQAAMHAENDWEP-SFHVURJKSA-N 1 1 318.417 3.673 20 5 DHBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491137041 1037914842 /nfs/dbraw/zinc/91/48/42/1037914842.db2.gz PJPLXERWAWZWSR-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491137041 1037914859 /nfs/dbraw/zinc/91/48/59/1037914859.db2.gz PJPLXERWAWZWSR-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO Cc1cccc(OCC[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000917021161 1038120358 /nfs/dbraw/zinc/12/03/58/1038120358.db2.gz QBZCAEQVIPMMRV-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO Cc1cccc(OCC[N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000917021161 1038120387 /nfs/dbraw/zinc/12/03/87/1038120387.db2.gz QBZCAEQVIPMMRV-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO Cc1ccnc([C@@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000572131884 1038339669 /nfs/dbraw/zinc/33/96/69/1038339669.db2.gz QYUAECRCHXIQQY-MRXNPFEDSA-N 1 1 311.385 3.596 20 5 DHBDMO CCCC[C@@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000589310113 1038462680 /nfs/dbraw/zinc/46/26/80/1038462680.db2.gz LJLPPATWGAPZDO-CYBMUJFWSA-N 1 1 321.421 3.742 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1CCCC13CCOCC3)C2 ZINC001191350304 1038488040 /nfs/dbraw/zinc/48/80/40/1038488040.db2.gz JKQOXWOOMQHUGH-INIZCTEOSA-N 1 1 316.401 3.507 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCOC3(C2)CCCCCC3)cc1 ZINC001191549599 1038520528 /nfs/dbraw/zinc/52/05/28/1038520528.db2.gz FGIYIEPVBCTKGE-UHFFFAOYSA-N 1 1 318.417 3.563 20 5 DHBDMO CC[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001191560030 1038521160 /nfs/dbraw/zinc/52/11/60/1038521160.db2.gz VIXJJSZSIVRTPS-SNVBAGLBSA-N 1 1 313.195 3.589 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC001192626850 1038687672 /nfs/dbraw/zinc/68/76/72/1038687672.db2.gz QQBANDDFJZILQK-CYBMUJFWSA-N 1 1 324.384 3.641 20 5 DHBDMO CCC[C@@H](NC[C@@H]1CCCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068648 1039026172 /nfs/dbraw/zinc/02/61/72/1039026172.db2.gz BLMKLBMPQPQHJZ-MAUKXSAKSA-N 1 1 319.449 3.758 20 5 DHBDMO CCC[C@@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068648 1039026187 /nfs/dbraw/zinc/02/61/87/1039026187.db2.gz BLMKLBMPQPQHJZ-MAUKXSAKSA-N 1 1 319.449 3.758 20 5 DHBDMO C[C@@H](c1ccccc1F)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000603894839 1039215295 /nfs/dbraw/zinc/21/52/95/1039215295.db2.gz ZBBLPTYLNVQKOQ-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000604013232 1039281952 /nfs/dbraw/zinc/28/19/52/1039281952.db2.gz URWZRMBDNFQVDE-MRXNPFEDSA-N 1 1 304.390 3.758 20 5 DHBDMO Cc1cccc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000604016361 1039285802 /nfs/dbraw/zinc/28/58/02/1039285802.db2.gz VNRUKPSAAPABKV-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO C[N@@H+](CCCNc1ccc(F)cc1[N+](=O)[O-])C1CCCCC1 ZINC000058666368 1039456983 /nfs/dbraw/zinc/45/69/83/1039456983.db2.gz PETJRHTWIYKBTJ-UHFFFAOYSA-N 1 1 309.385 3.800 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CC4(CC4(F)F)C3)o2)cc1 ZINC000594609019 1039867093 /nfs/dbraw/zinc/86/70/93/1039867093.db2.gz LTYLUCSHQGGIKL-UHFFFAOYSA-N 1 1 320.295 3.696 20 5 DHBDMO CC[C@H](N[C@@H]1CC[N@@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056864 1040023318 /nfs/dbraw/zinc/02/33/18/1040023318.db2.gz RWNJGGCBOYGVDZ-ZBFHGGJFSA-N 1 1 305.422 3.508 20 5 DHBDMO CC[C@H](N[C@@H]1CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056864 1040023334 /nfs/dbraw/zinc/02/33/34/1040023334.db2.gz RWNJGGCBOYGVDZ-ZBFHGGJFSA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2onc(C)c2[N+](=O)[O-])o1 ZINC000595327100 1040098700 /nfs/dbraw/zinc/09/87/00/1040098700.db2.gz CKAHHHJTJIAJBS-ZDUSSCGKSA-N 1 1 319.361 3.910 20 5 DHBDMO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2onc(C)c2[N+](=O)[O-])o1 ZINC000595327100 1040098717 /nfs/dbraw/zinc/09/87/17/1040098717.db2.gz CKAHHHJTJIAJBS-ZDUSSCGKSA-N 1 1 319.361 3.910 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595329910 1040100590 /nfs/dbraw/zinc/10/05/90/1040100590.db2.gz DOVPNIQCTLYIRM-KGLIPLIRSA-N 1 1 312.410 3.840 20 5 DHBDMO Cc1noc(C[NH2+][C@H](CC(C)C)c2ccccc2)c1[N+](=O)[O-] ZINC000595410773 1040129610 /nfs/dbraw/zinc/12/96/10/1040129610.db2.gz VIXUPXQKJJNVGK-CQSZACIVSA-N 1 1 303.362 3.768 20 5 DHBDMO Cc1noc(C[NH2+][C@H](CC(C)C)c2cccs2)c1[N+](=O)[O-] ZINC000595423050 1040133952 /nfs/dbraw/zinc/13/39/52/1040133952.db2.gz DLBBAXOMCOVHMC-LLVKDONJSA-N 1 1 309.391 3.830 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000595432200 1040138723 /nfs/dbraw/zinc/13/87/23/1040138723.db2.gz QYKNNAVWJWBAMT-ZDUSSCGKSA-N 1 1 307.325 3.580 20 5 DHBDMO Cc1noc(C[N@H+]2CCCC3(CCCCC3)CC2)c1[N+](=O)[O-] ZINC000595457728 1040145003 /nfs/dbraw/zinc/14/50/03/1040145003.db2.gz ZXPSTZFULRMOEV-UHFFFAOYSA-N 1 1 307.394 3.828 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595469125 1040146212 /nfs/dbraw/zinc/14/62/12/1040146212.db2.gz MUPZTFFMMGGRFX-KCJUWKMLSA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595469125 1040146217 /nfs/dbraw/zinc/14/62/17/1040146217.db2.gz MUPZTFFMMGGRFX-KCJUWKMLSA-N 1 1 306.259 3.507 20 5 DHBDMO CC[C@@H](CC(F)F)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000595478127 1040150818 /nfs/dbraw/zinc/15/08/18/1040150818.db2.gz XRURMONNYSQFNX-LBPRGKRZSA-N 1 1 300.349 3.751 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000595503143 1040155956 /nfs/dbraw/zinc/15/59/56/1040155956.db2.gz QRQYICPOQJHSQY-ZDUSSCGKSA-N 1 1 315.348 3.509 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000595787652 1040253299 /nfs/dbraw/zinc/25/32/99/1040253299.db2.gz FQSRPGYBVJXGIT-CXAGYDPISA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000595787655 1040253948 /nfs/dbraw/zinc/25/39/48/1040253948.db2.gz FQSRPGYBVJXGIT-SUMWQHHRSA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)c(F)c1 ZINC000595786550 1040257089 /nfs/dbraw/zinc/25/70/89/1040257089.db2.gz BHMJGLKLXITJGW-RHSMWYFYSA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H]3CCCCO3)CC2)c(F)c1 ZINC000595791151 1040259661 /nfs/dbraw/zinc/25/96/61/1040259661.db2.gz ZUIHFKLVNHEIEY-KRWDZBQOSA-N 1 1 322.380 3.515 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595904465 1040273686 /nfs/dbraw/zinc/27/36/86/1040273686.db2.gz DELKUNBGLAIJPE-JCGIZDLHSA-N 1 1 316.401 3.548 20 5 DHBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccnc1 ZINC000596593780 1040506397 /nfs/dbraw/zinc/50/63/97/1040506397.db2.gz RRPWFZPZHMUHRT-KRWDZBQOSA-N 1 1 311.385 3.615 20 5 DHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)C[C@@H](O)c1ccc(C)cc1 ZINC000174282091 1040604961 /nfs/dbraw/zinc/60/49/61/1040604961.db2.gz ZLMLUGJDDWUHNB-OAHLLOKOSA-N 1 1 320.414 3.520 20 5 DHBDMO CC[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@@H](O)c1ccc(C)cc1 ZINC000174282091 1040604963 /nfs/dbraw/zinc/60/49/63/1040604963.db2.gz ZLMLUGJDDWUHNB-OAHLLOKOSA-N 1 1 320.414 3.520 20 5 DHBDMO C[C@H](C[N@@H+](C)CCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000608976597 1040656521 /nfs/dbraw/zinc/65/65/21/1040656521.db2.gz BULFQECIDYXZJR-OAHLLOKOSA-N 1 1 314.385 3.709 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)cc1[N+](=O)[O-] ZINC000597224012 1040703741 /nfs/dbraw/zinc/70/37/41/1040703741.db2.gz ARRNSUAXFAXBFG-WMZOPIPTSA-N 1 1 318.417 3.684 20 5 DHBDMO Cc1occc1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602519340 1041065941 /nfs/dbraw/zinc/06/59/41/1041065941.db2.gz YKJQFSHRLMCNAB-UHFFFAOYSA-N 1 1 314.263 3.805 20 5 DHBDMO C[C@H](C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000273109156 130090420 /nfs/dbraw/zinc/09/04/20/130090420.db2.gz XBXPNBSADARDOF-NEPJUHHUSA-N 1 1 305.403 3.848 20 5 DHBDMO Cc1csc(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3C)CCC2)n1 ZINC000273387688 130115865 /nfs/dbraw/zinc/11/58/65/130115865.db2.gz IXOMXQOHXWIHQQ-UHFFFAOYSA-N 1 1 317.414 3.837 20 5 DHBDMO COc1ncc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1Cl ZINC000284420959 131078920 /nfs/dbraw/zinc/07/89/20/131078920.db2.gz QTOCDFFFBVNNMK-JTQLQIEISA-N 1 1 321.764 3.503 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1ncc[nH]1)C1CCCCC1 ZINC000285900213 131209279 /nfs/dbraw/zinc/20/92/79/131209279.db2.gz CRYBATLDRGWYHV-MRXNPFEDSA-N 1 1 314.389 3.729 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2ccncc2)C1 ZINC000289288961 131371235 /nfs/dbraw/zinc/37/12/35/131371235.db2.gz HABAVYMTCUJVFY-YOEHRIQHSA-N 1 1 311.385 3.930 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(C3CC3)cc2F)cs1 ZINC000291812162 131601317 /nfs/dbraw/zinc/60/13/17/131601317.db2.gz YHCBOGNSOKNGLQ-UHFFFAOYSA-N 1 1 306.362 3.963 20 5 DHBDMO C[C@@]12CC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@@H]1C2(F)F ZINC000298184404 132049340 /nfs/dbraw/zinc/04/93/40/132049340.db2.gz AJKIEISNDRCAHC-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@@]12CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@@H]1C2(F)F ZINC000298184404 132049341 /nfs/dbraw/zinc/04/93/41/132049341.db2.gz AJKIEISNDRCAHC-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO CCC[C@H](NCC[N@@H+](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000320520124 335070582 /nfs/dbraw/zinc/07/05/82/335070582.db2.gz GOAZFTHRIIVYAF-SFHVURJKSA-N 1 1 319.449 3.900 20 5 DHBDMO CCC[C@H]([NH2+]CCN(C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000320520124 335070583 /nfs/dbraw/zinc/07/05/83/335070583.db2.gz GOAZFTHRIIVYAF-SFHVURJKSA-N 1 1 319.449 3.900 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H]2c3ccc(F)cc3O[C@H]2C)cc1[N+](=O)[O-] ZINC000570546982 332771126 /nfs/dbraw/zinc/77/11/26/332771126.db2.gz SJGSTOAVFMBQAB-GTNSWQLSSA-N 1 1 316.332 3.654 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000092757724 332164841 /nfs/dbraw/zinc/16/48/41/332164841.db2.gz NLWRKZBQAGOLPL-JHTBKMLMSA-N 1 1 323.396 3.794 20 5 DHBDMO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000449458875 332217755 /nfs/dbraw/zinc/21/77/55/332217755.db2.gz JIRJHFSIADFWBU-ONGXEEELSA-N 1 1 320.286 3.897 20 5 DHBDMO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000449458875 332217757 /nfs/dbraw/zinc/21/77/57/332217757.db2.gz JIRJHFSIADFWBU-ONGXEEELSA-N 1 1 320.286 3.897 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C[C@H]3CCSC3)C2)cc1 ZINC000449495441 332308038 /nfs/dbraw/zinc/30/80/38/332308038.db2.gz DHVCOTQJOBMSBY-UKRRQHHQSA-N 1 1 306.431 3.527 20 5 DHBDMO CC[C@H](NC[C@@H](CC(C)C)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000314060735 333085020 /nfs/dbraw/zinc/08/50/20/333085020.db2.gz AIGKPSLLIJXROF-SJORKVTESA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@H]([NH2+]CC1(N(C)C)CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000314122306 333088369 /nfs/dbraw/zinc/08/83/69/333088369.db2.gz PMFVKAXTQJMFMV-AWEZNQCLSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cn2cc(C)ccc2n1)c1cccc([N+](=O)[O-])c1 ZINC000178726450 333143133 /nfs/dbraw/zinc/14/31/33/333143133.db2.gz IKBTWLFUKYPCHB-QGZVFWFLSA-N 1 1 324.384 3.792 20 5 DHBDMO Cc1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000179620672 333153454 /nfs/dbraw/zinc/15/34/54/333153454.db2.gz NHCMERRFYKODEW-LBPRGKRZSA-N 1 1 302.296 3.678 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000179620672 333153455 /nfs/dbraw/zinc/15/34/55/333153455.db2.gz NHCMERRFYKODEW-LBPRGKRZSA-N 1 1 302.296 3.678 20 5 DHBDMO O=[N+]([O-])c1ccccc1NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000390705827 333316371 /nfs/dbraw/zinc/31/63/71/333316371.db2.gz QBZDVPBCBACICG-INIZCTEOSA-N 1 1 311.385 3.671 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2cccnc21 ZINC000365003394 333334269 /nfs/dbraw/zinc/33/42/69/333334269.db2.gz WOJOZSPICIMQSZ-QGZVFWFLSA-N 1 1 311.385 3.889 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)CCSC ZINC000353832217 335155184 /nfs/dbraw/zinc/15/51/84/335155184.db2.gz XBAODHWOSMDTMX-LBPRGKRZSA-N 1 1 312.435 3.567 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)CC[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000343458262 335166157 /nfs/dbraw/zinc/16/61/57/335166157.db2.gz CAGFWZHMFKMUKF-OAHLLOKOSA-N 1 1 306.406 3.719 20 5 DHBDMO Cc1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000414521196 334006194 /nfs/dbraw/zinc/00/61/94/334006194.db2.gz DTIUGMWKZDYZDG-KRWDZBQOSA-N 1 1 318.417 3.540 20 5 DHBDMO C[N@@H+](CCCCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000276598820 334083301 /nfs/dbraw/zinc/08/33/01/334083301.db2.gz DZOPCPMPXRSWQB-UHFFFAOYSA-N 1 1 320.414 3.528 20 5 DHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000126510975 334379658 /nfs/dbraw/zinc/37/96/58/334379658.db2.gz MTEARURSQYNRER-SNVBAGLBSA-N 1 1 302.827 3.822 20 5 DHBDMO CC[C@@H]([NH2+][C@H]1COc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000344096541 335217828 /nfs/dbraw/zinc/21/78/28/335217828.db2.gz HGAJQAZQJMIKKM-CVEARBPZSA-N 1 1 316.332 3.908 20 5 DHBDMO COCC[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000347995359 335544598 /nfs/dbraw/zinc/54/45/98/335544598.db2.gz FSERCDJULVOIRB-ZDUSSCGKSA-N 1 1 324.764 3.709 20 5 DHBDMO COc1cc(C[N@H+](Cc2ccco2)C(C)C)ccc1[N+](=O)[O-] ZINC000352404724 336216553 /nfs/dbraw/zinc/21/65/53/336216553.db2.gz ITDYTVCJMVPOAD-UHFFFAOYSA-N 1 1 304.346 3.607 20 5 DHBDMO COc1cc(C[N@@H+](Cc2ccco2)C(C)C)ccc1[N+](=O)[O-] ZINC000352404724 336216554 /nfs/dbraw/zinc/21/65/54/336216554.db2.gz ITDYTVCJMVPOAD-UHFFFAOYSA-N 1 1 304.346 3.607 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352540039 336223340 /nfs/dbraw/zinc/22/33/40/336223340.db2.gz GMMBQHHVSVAOKB-KBPBESRZSA-N 1 1 324.446 3.709 20 5 DHBDMO COc1cc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)ccc1[N+](=O)[O-] ZINC000352780278 336236061 /nfs/dbraw/zinc/23/60/61/336236061.db2.gz SRYYVIYVJWKGDC-LBPRGKRZSA-N 1 1 316.357 3.922 20 5 DHBDMO COc1cc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)ccc1[N+](=O)[O-] ZINC000352780278 336236062 /nfs/dbraw/zinc/23/60/62/336236062.db2.gz SRYYVIYVJWKGDC-LBPRGKRZSA-N 1 1 316.357 3.922 20 5 DHBDMO C[C@@H]1C[C@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000532575214 336257052 /nfs/dbraw/zinc/25/70/52/336257052.db2.gz NGIFWAFTOYBCTD-OLZOCXBDSA-N 1 1 315.373 3.523 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nccs1 ZINC000192839841 336265453 /nfs/dbraw/zinc/26/54/53/336265453.db2.gz ZEJFJKRHCITEIE-HZMBPMFUSA-N 1 1 303.387 3.780 20 5 DHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 ZINC000301272227 336297990 /nfs/dbraw/zinc/29/79/90/336297990.db2.gz JWVWAIZEXMFETB-JKSUJKDBSA-N 1 1 317.433 3.686 20 5 DHBDMO NC(=O)C[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000377847002 337062543 /nfs/dbraw/zinc/06/25/43/337062543.db2.gz IHEPTOIYJIPVJR-OAHLLOKOSA-N 1 1 318.420 3.690 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000174349402 337140939 /nfs/dbraw/zinc/14/09/39/337140939.db2.gz JKLRWVBRFQKMLR-RYUDHWBXSA-N 1 1 300.449 3.762 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000321156384 337202707 /nfs/dbraw/zinc/20/27/07/337202707.db2.gz WBOQRQAQBRIVCA-GFCCVEGCSA-N 1 1 310.357 3.630 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CSC)C1 ZINC000429295689 337271877 /nfs/dbraw/zinc/27/18/77/337271877.db2.gz QQMPFVPPSCYJDD-CYBMUJFWSA-N 1 1 324.446 3.569 20 5 DHBDMO C[C@H]([N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000532928543 337393351 /nfs/dbraw/zinc/39/33/51/337393351.db2.gz NJPISLIOQGEAJW-NSHDSACASA-N 1 1 318.377 3.511 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCS[C@H](C)CC1 ZINC000426389398 338030091 /nfs/dbraw/zinc/03/00/91/338030091.db2.gz FDFXPWIBAVPHFZ-QLKUMGTLSA-N 1 1 306.431 3.826 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2nc3ccc(F)cc3s2)cc1 ZINC000428866610 338063227 /nfs/dbraw/zinc/06/32/27/338063227.db2.gz JUZLWNSNKAWZGE-UHFFFAOYSA-N 1 1 317.345 3.633 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC000430213980 338101793 /nfs/dbraw/zinc/10/17/93/338101793.db2.gz DHLNJTUDFZVWNM-QGZVFWFLSA-N 1 1 312.369 3.723 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430232219 338102395 /nfs/dbraw/zinc/10/23/95/338102395.db2.gz FWGQEWVMCGWENA-DZGCQCFKSA-N 1 1 324.446 3.709 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449092604 338592763 /nfs/dbraw/zinc/59/27/63/338592763.db2.gz UVHXKMPMRVEJJJ-GFCCVEGCSA-N 1 1 322.286 3.789 20 5 DHBDMO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H](C)OC ZINC000462828276 339092758 /nfs/dbraw/zinc/09/27/58/339092758.db2.gz VVHYIFJMHWTQJW-CYBMUJFWSA-N 1 1 318.373 3.712 20 5 DHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(C)(C)C ZINC000463357885 339115560 /nfs/dbraw/zinc/11/55/60/339115560.db2.gz KNYLLNKTJDRNOD-UHFFFAOYSA-N 1 1 321.421 3.600 20 5 DHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(C)(C)C ZINC000463368075 339116023 /nfs/dbraw/zinc/11/60/23/339116023.db2.gz MXYUROCMRNUQFD-UHFFFAOYSA-N 1 1 321.421 3.600 20 5 DHBDMO Cc1c([C@H](C)[NH2+][C@H]2COc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000468052175 339252938 /nfs/dbraw/zinc/25/29/38/339252938.db2.gz RIBVTIBMBNUUAX-NHYWBVRUSA-N 1 1 316.332 3.827 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCN(C(C)C)C(C)C ZINC000468646357 339267901 /nfs/dbraw/zinc/26/79/01/339267901.db2.gz CUSXQJJEYNHZNG-LFIBNONCSA-N 1 1 319.449 3.707 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCN(C(C)C)C(C)C ZINC000468646358 339267940 /nfs/dbraw/zinc/26/79/40/339267940.db2.gz CUSXQJJEYNHZNG-WJDWOHSUSA-N 1 1 319.449 3.707 20 5 DHBDMO CSC[C@@H]1CCC[N@H+]1C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470179518 339313146 /nfs/dbraw/zinc/31/31/46/339313146.db2.gz YFZCAROPLDTYHX-WQMJKPAKSA-N 1 1 306.431 3.826 20 5 DHBDMO C[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000471049524 339335871 /nfs/dbraw/zinc/33/58/71/339335871.db2.gz ZMAYKIHXMHJEGL-KBXCAEBGSA-N 1 1 312.369 3.667 20 5 DHBDMO CC[N@H+]1CC[C@H](N(C)c2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000471522763 339346735 /nfs/dbraw/zinc/34/67/35/339346735.db2.gz PAEIEVOLAHAAFT-YPMHNXCESA-N 1 1 311.813 3.557 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000497112395 340020606 /nfs/dbraw/zinc/02/06/06/340020606.db2.gz DZUBLUOGVOSYEI-YJBOKZPZSA-N 1 1 320.433 3.701 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nc2c(s1)CCC2 ZINC000502058094 340094352 /nfs/dbraw/zinc/09/43/52/340094352.db2.gz YLLLGBLZATVZLG-WDEREUQCSA-N 1 1 317.414 3.952 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccccc3F)C2)cc1 ZINC000503582677 340131717 /nfs/dbraw/zinc/13/17/17/340131717.db2.gz FEYXDHZJPIRLQU-AWEZNQCLSA-N 1 1 300.333 3.723 20 5 DHBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000505608362 340172820 /nfs/dbraw/zinc/17/28/20/340172820.db2.gz LAKQYZSDNGLSIT-RYUDHWBXSA-N 1 1 311.813 3.781 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCOc2ccccc2F)cc1[N+](=O)[O-] ZINC000506148367 340186842 /nfs/dbraw/zinc/18/68/42/340186842.db2.gz PUULUAVCTVUUDW-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc3c(c2)CCO3)C2CC2)c1 ZINC000507157272 340209928 /nfs/dbraw/zinc/20/99/28/340209928.db2.gz WKRIAUQZIOYKRJ-UHFFFAOYSA-N 1 1 324.380 3.694 20 5 DHBDMO C[N@@H+](CCSc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1 ZINC000509090031 340260961 /nfs/dbraw/zinc/26/09/61/340260961.db2.gz NWNHAZCHZLPRMW-UHFFFAOYSA-N 1 1 320.389 3.958 20 5 DHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)c(F)c1 ZINC000509327233 340266347 /nfs/dbraw/zinc/26/63/47/340266347.db2.gz KBWJNIRYJBSHDU-ZDUSSCGKSA-N 1 1 318.323 3.863 20 5 DHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CC[C@H](c3ccccc3)C2)c(F)c1 ZINC000509327233 340266348 /nfs/dbraw/zinc/26/63/48/340266348.db2.gz KBWJNIRYJBSHDU-ZDUSSCGKSA-N 1 1 318.323 3.863 20 5 DHBDMO C[N@H+](CCc1cccs1)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509666841 340276248 /nfs/dbraw/zinc/27/62/48/340276248.db2.gz PKRWVZPHSYNARH-UHFFFAOYSA-N 1 1 312.341 3.609 20 5 DHBDMO C[N@@H+](CCc1cccs1)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509666841 340276249 /nfs/dbraw/zinc/27/62/49/340276249.db2.gz PKRWVZPHSYNARH-UHFFFAOYSA-N 1 1 312.341 3.609 20 5 DHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCc1ccc(F)cc1 ZINC000510455593 340299947 /nfs/dbraw/zinc/29/99/47/340299947.db2.gz CFJCNVZSIHXCQE-XQRVVYSFSA-N 1 1 314.360 3.922 20 5 DHBDMO COc1ccc(C)cc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511071958 340319994 /nfs/dbraw/zinc/31/99/94/340319994.db2.gz BWRQQVMZPSXCHF-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO Cc1ccc2c(c1)C[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CCO2 ZINC000512238246 340353596 /nfs/dbraw/zinc/35/35/96/340353596.db2.gz ZHSQOXTVVZHSQU-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1ccc2c(c1)C[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CCO2 ZINC000512238246 340353597 /nfs/dbraw/zinc/35/35/97/340353597.db2.gz ZHSQOXTVVZHSQU-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1ccc([C@H](C)Nc2ccc3c(c2)[nH+]cn3C)cc1[N+](=O)[O-] ZINC000539741396 340898473 /nfs/dbraw/zinc/89/84/73/340898473.db2.gz QYJOITNMRHSSIN-LBPRGKRZSA-N 1 1 310.357 3.963 20 5 DHBDMO CCc1cnc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000130500053 341023930 /nfs/dbraw/zinc/02/39/30/341023930.db2.gz UEZYYBAZQOTBHZ-LLVKDONJSA-N 1 1 305.403 3.773 20 5 DHBDMO C[C@H](Cc1ccsc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000543096346 341031660 /nfs/dbraw/zinc/03/16/60/341031660.db2.gz XEZCWDYZGZNEKT-GFCCVEGCSA-N 1 1 302.399 3.646 20 5 DHBDMO Cc1ccc([C@@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)cc1 ZINC000543246193 341037877 /nfs/dbraw/zinc/03/78/77/341037877.db2.gz OKGWJKZIQCKPNA-OAHLLOKOSA-N 1 1 302.399 3.954 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCc1ccccc1O ZINC000543249358 341038282 /nfs/dbraw/zinc/03/82/82/341038282.db2.gz QQRZWKPHMKPXQB-CQSZACIVSA-N 1 1 314.385 3.844 20 5 DHBDMO CC1(C)Cc2cccc(C[NH2+]Cc3ccccc3[N+](=O)[O-])c2O1 ZINC000134269462 341211640 /nfs/dbraw/zinc/21/16/40/341211640.db2.gz PZHDARNDOVKVJI-UHFFFAOYSA-N 1 1 312.369 3.598 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccsc1Cl ZINC000549809247 341303649 /nfs/dbraw/zinc/30/36/49/341303649.db2.gz CWQVLKRWRPOIJD-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccsc1Cl ZINC000549809247 341303650 /nfs/dbraw/zinc/30/36/50/341303650.db2.gz CWQVLKRWRPOIJD-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)C1 ZINC000246918822 341358673 /nfs/dbraw/zinc/35/86/73/341358673.db2.gz YJRIKRLDZAWVPY-RYUDHWBXSA-N 1 1 303.362 3.604 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCc2ccc(F)cc2C1 ZINC000552242551 341380633 /nfs/dbraw/zinc/38/06/33/341380633.db2.gz VDQKCMJTUVGUML-HYXAFXHYSA-N 1 1 312.344 3.805 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCc2ccc(F)cc2C1 ZINC000552242551 341380634 /nfs/dbraw/zinc/38/06/34/341380634.db2.gz VDQKCMJTUVGUML-HYXAFXHYSA-N 1 1 312.344 3.805 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCCO[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000552442641 341394013 /nfs/dbraw/zinc/39/40/13/341394013.db2.gz HIVYPZQPYLWVFN-SFHVURJKSA-N 1 1 320.433 3.965 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCCO[C@@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000552442640 341394123 /nfs/dbraw/zinc/39/41/23/341394123.db2.gz HIVYPZQPYLWVFN-GOSISDBHSA-N 1 1 320.433 3.965 20 5 DHBDMO CCC[C@H]([NH2+][C@@H](C)c1ccn(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000414168290 517612448 /nfs/dbraw/zinc/61/24/48/517612448.db2.gz ABDBTURCCCRODU-LRDDRELGSA-N 1 1 302.378 3.520 20 5 DHBDMO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000265853747 521692742 /nfs/dbraw/zinc/69/27/42/521692742.db2.gz ITWIHJJQQVSGNB-YUELXQCFSA-N 1 1 324.446 3.682 20 5 DHBDMO CCc1cnc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000130530606 522042506 /nfs/dbraw/zinc/04/25/06/522042506.db2.gz ONHNQDCAGNJDRW-LLVKDONJSA-N 1 1 305.403 3.773 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181827282 524314985 /nfs/dbraw/zinc/31/49/85/524314985.db2.gz CBLAGSGBWHRCHD-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000182126392 525928888 /nfs/dbraw/zinc/92/88/88/525928888.db2.gz SQNKLFLLELGZDV-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nccn2C(C)C)cc1[N+](=O)[O-] ZINC000181823870 525929677 /nfs/dbraw/zinc/92/96/77/525929677.db2.gz PZCJMWJNHXEGME-ZDUSSCGKSA-N 1 1 302.378 3.531 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000368218130 526083866 /nfs/dbraw/zinc/08/38/66/526083866.db2.gz DTCOTJDZMMIRGK-ZIAGYGMSSA-N 1 1 304.390 3.547 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC([C@H]3CCCO3)CC2)c1 ZINC000189165822 527355035 /nfs/dbraw/zinc/35/50/35/527355035.db2.gz SKMUGYUJJUSAQC-MRXNPFEDSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000359870830 1013059563 /nfs/dbraw/zinc/05/95/63/1013059563.db2.gz JNMKSNPFHSXJLV-RDTXWAMCSA-N 1 1 311.385 3.615 20 5 DHBDMO Cc1ncsc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000154466274 1013101755 /nfs/dbraw/zinc/10/17/55/1013101755.db2.gz CMIVXIZLRAEGFE-UHFFFAOYSA-N 1 1 305.403 3.770 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000441462425 1013909857 /nfs/dbraw/zinc/90/98/57/1013909857.db2.gz IAWUHPUHBMWIPP-IOASZLSFSA-N 1 1 304.390 3.756 20 5 DHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21 ZINC000521480325 1014708201 /nfs/dbraw/zinc/70/82/01/1014708201.db2.gz XMPFSAJDCOJKQR-GOSISDBHSA-N 1 1 312.369 3.593 20 5 DHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001167457841 1014771264 /nfs/dbraw/zinc/77/12/64/1014771264.db2.gz LYIOMEUPFNRSAJ-RHSMWYFYSA-N 1 1 306.406 3.874 20 5 DHBDMO CC1(C)C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@H]2O1 ZINC000442967925 1014782005 /nfs/dbraw/zinc/78/20/05/1014782005.db2.gz VNNAWCCLNRUUFA-WPLBAPSMSA-N 1 1 316.401 3.640 20 5 DHBDMO CC1(C)C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@H]2O1 ZINC000442967925 1014782008 /nfs/dbraw/zinc/78/20/08/1014782008.db2.gz VNNAWCCLNRUUFA-WPLBAPSMSA-N 1 1 316.401 3.640 20 5 DHBDMO CC(C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000610581385 1014858909 /nfs/dbraw/zinc/85/89/09/1014858909.db2.gz NRWDHGGCZGSFBT-UHFFFAOYSA-N 1 1 311.341 3.761 20 5 DHBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])c1C ZINC001167465599 1014902566 /nfs/dbraw/zinc/90/25/66/1014902566.db2.gz YMLJZTMQYQTESV-KRWDZBQOSA-N 1 1 311.385 3.944 20 5 DHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000276291990 1014917546 /nfs/dbraw/zinc/91/75/46/1014917546.db2.gz HZPQSXDVKWOIJJ-HNNXBMFYSA-N 1 1 303.337 3.712 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000051129847 1015102339 /nfs/dbraw/zinc/10/23/39/1015102339.db2.gz CCYQQAIWQMXHGV-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO C[C@H](CNc1ccccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000025500381 1015442638 /nfs/dbraw/zinc/44/26/38/1015442638.db2.gz QNTYWUVCLVSLDW-GFCCVEGCSA-N 1 1 317.414 3.515 20 5 DHBDMO CC(C)([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000175989592 1015547949 /nfs/dbraw/zinc/54/79/49/1015547949.db2.gz QBFPWOWFDHPXGQ-UHFFFAOYSA-N 1 1 312.341 3.959 20 5 DHBDMO CC(C)(C)OCCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000610995240 1015574032 /nfs/dbraw/zinc/57/40/32/1015574032.db2.gz SYSOGHYAMRVPDZ-UHFFFAOYSA-N 1 1 306.406 3.764 20 5 DHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581137 1015631663 /nfs/dbraw/zinc/63/16/63/1015631663.db2.gz PVCCMVRWQAUVMG-SMDDNHRTSA-N 1 1 303.362 3.747 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000610707566 1015726920 /nfs/dbraw/zinc/72/69/20/1015726920.db2.gz BPIUBIORXAXHAG-CQSZACIVSA-N 1 1 318.760 3.780 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2cccs2)C2CC2)cc1 ZINC000065533480 1016201717 /nfs/dbraw/zinc/20/17/17/1016201717.db2.gz QTUJHYBGRVQCBM-UHFFFAOYSA-N 1 1 318.398 3.700 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3ccncc3)C2)ccc1Cl ZINC000846908855 1032145106 /nfs/dbraw/zinc/14/51/06/1032145106.db2.gz WTTCGMXLSWSTNJ-CQSZACIVSA-N 1 1 317.776 3.633 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC000071959567 1016284956 /nfs/dbraw/zinc/28/49/56/1016284956.db2.gz NADSPHGFCYKJJH-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000611377502 1016408002 /nfs/dbraw/zinc/40/80/02/1016408002.db2.gz NDYHBBNFVCVWMN-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000349707077 1016582723 /nfs/dbraw/zinc/58/27/23/1016582723.db2.gz MZEVJNLNXCGNIX-JSGCOSHPSA-N 1 1 322.405 3.623 20 5 DHBDMO Cc1cnc([C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C2CC2)s1 ZINC000185332496 1016859145 /nfs/dbraw/zinc/85/91/45/1016859145.db2.gz HBRJLXKXIMZTHE-OAHLLOKOSA-N 1 1 317.414 3.909 20 5 DHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000076458679 1016977789 /nfs/dbraw/zinc/97/77/89/1016977789.db2.gz LWDBMOONDQGPES-UHFFFAOYSA-N 1 1 306.387 3.557 20 5 DHBDMO C[C@@H]1CSCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000537636778 1032466547 /nfs/dbraw/zinc/46/65/47/1032466547.db2.gz VAUUSEBHGWGYDU-GFCCVEGCSA-N 1 1 318.398 3.792 20 5 DHBDMO C[C@@H]1C[C@H](Nc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000557589812 1011937529 /nfs/dbraw/zinc/93/75/29/1011937529.db2.gz ZHLJVTIAUDQWAM-PSASIEDQSA-N 1 1 318.204 3.796 20 5 DHBDMO CCc1cnc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000515127320 1012561863 /nfs/dbraw/zinc/56/18/63/1012561863.db2.gz JSKFKBVRJNYRJN-AWEZNQCLSA-N 1 1 315.373 3.525 20 5 DHBDMO CCc1cnc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000515127320 1012561875 /nfs/dbraw/zinc/56/18/75/1012561875.db2.gz JSKFKBVRJNYRJN-AWEZNQCLSA-N 1 1 315.373 3.525 20 5 DHBDMO CCCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H]1CCC[C@@H](C)C1 ZINC000339646871 1012720082 /nfs/dbraw/zinc/72/00/82/1012720082.db2.gz LCOIFOWSGSQSEA-ZIAGYGMSSA-N 1 1 308.426 3.509 20 5 DHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCCCC1 ZINC000083168328 1017597186 /nfs/dbraw/zinc/59/71/86/1017597186.db2.gz BZQCJZWKTMDZBU-UHFFFAOYSA-N 1 1 303.362 3.891 20 5 DHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444652755 1017606310 /nfs/dbraw/zinc/60/63/10/1017606310.db2.gz KCDVPQGGMZGSOM-LRDDRELGSA-N 1 1 316.405 3.872 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCC(C)(C)CC1 ZINC000444639644 1017613016 /nfs/dbraw/zinc/61/30/16/1017613016.db2.gz AVCIQCMJDVPMBK-UHFFFAOYSA-N 1 1 316.405 3.872 20 5 DHBDMO COc1cc(C[N@H+](C)Cc2cc(F)cc(F)c2)ccc1[N+](=O)[O-] ZINC000444718962 1017650382 /nfs/dbraw/zinc/65/03/82/1017650382.db2.gz XIJMODKYCFENFR-UHFFFAOYSA-N 1 1 322.311 3.514 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2cc(F)cc(F)c2)ccc1[N+](=O)[O-] ZINC000444718962 1017650391 /nfs/dbraw/zinc/65/03/91/1017650391.db2.gz XIJMODKYCFENFR-UHFFFAOYSA-N 1 1 322.311 3.514 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000444769775 1017667040 /nfs/dbraw/zinc/66/70/40/1017667040.db2.gz JNFGTNPWPCJELP-LBPRGKRZSA-N 1 1 310.369 3.611 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000444828578 1017689536 /nfs/dbraw/zinc/68/95/36/1017689536.db2.gz OGRFCVFNXCENNN-VXGBXAGGSA-N 1 1 309.797 3.595 20 5 DHBDMO C[C@H]1c2c(F)cccc2CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000523448666 1017702804 /nfs/dbraw/zinc/70/28/04/1017702804.db2.gz DOOJJYSLICMPGE-ZDUSSCGKSA-N 1 1 314.360 3.896 20 5 DHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000612539152 1017816823 /nfs/dbraw/zinc/81/68/23/1017816823.db2.gz VXNVXUQJPYWWLO-GFCCVEGCSA-N 1 1 303.362 3.891 20 5 DHBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2F)C1 ZINC000524266075 1017945019 /nfs/dbraw/zinc/94/50/19/1017945019.db2.gz RHQXTXAFLKLLRJ-LBPRGKRZSA-N 1 1 309.385 3.656 20 5 DHBDMO CC[C@H](NCC[N@@H+](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000171509889 1017950366 /nfs/dbraw/zinc/95/03/66/1017950366.db2.gz YQQLVLQEVMHRFS-KRWDZBQOSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@H]([NH2+]CCN(C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000171509889 1017950377 /nfs/dbraw/zinc/95/03/77/1017950377.db2.gz YQQLVLQEVMHRFS-KRWDZBQOSA-N 1 1 305.422 3.510 20 5 DHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000524895232 1018119047 /nfs/dbraw/zinc/11/90/47/1018119047.db2.gz PSVFTJUBXZOVNL-CVEARBPZSA-N 1 1 306.406 3.539 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000079723786 1018148446 /nfs/dbraw/zinc/14/84/46/1018148446.db2.gz LSGHVPUMHZAVME-NEPJUHHUSA-N 1 1 315.329 3.915 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278116446 1018155609 /nfs/dbraw/zinc/15/56/09/1018155609.db2.gz ANFQAIBVOWXCJX-OGOUPESXSA-N 1 1 314.307 3.882 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@H]3CCC[C@H]32)c1 ZINC000428452092 1018242849 /nfs/dbraw/zinc/24/28/49/1018242849.db2.gz JDEOBPAFFYHDKW-ZWNOBZJWSA-N 1 1 312.316 3.571 20 5 DHBDMO CS[C@@H]1CCCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000441136341 1018272320 /nfs/dbraw/zinc/27/23/20/1018272320.db2.gz VYYXHPOMIYMYRI-MRXNPFEDSA-N 1 1 324.446 3.581 20 5 DHBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000447057985 1018319891 /nfs/dbraw/zinc/31/98/91/1018319891.db2.gz FPQDFLRSMKVDDU-KRWDZBQOSA-N 1 1 306.406 3.684 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC3(C2)CCCCC3)cc1 ZINC000525637180 1018343637 /nfs/dbraw/zinc/34/36/37/1018343637.db2.gz AUWUZIHIZVMYGY-UHFFFAOYSA-N 1 1 304.390 3.630 20 5 DHBDMO Cc1cc(C)c(CSCc2cccnc2[N+](=O)[O-])c(C)[nH+]1 ZINC001350624133 1018404097 /nfs/dbraw/zinc/40/40/97/1018404097.db2.gz YLPMFLXEXLZWLN-UHFFFAOYSA-N 1 1 303.387 3.743 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(F)c(C)c2)cc1[N+](=O)[O-] ZINC000573153061 1019029404 /nfs/dbraw/zinc/02/94/04/1019029404.db2.gz QHXJWTOJILBZOQ-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ncccc2[N+](=O)[O-])cc1 ZINC000080914795 1019118312 /nfs/dbraw/zinc/11/83/12/1019118312.db2.gz WVVKGPFAWDJEKR-LBPRGKRZSA-N 1 1 323.356 3.657 20 5 DHBDMO CC(C)([NH2+]Cc1nc2c(s1)CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000611314514 1019447064 /nfs/dbraw/zinc/44/70/64/1019447064.db2.gz SMYDMOGPHHWVCU-UHFFFAOYSA-N 1 1 317.414 3.565 20 5 DHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])s2)C1 ZINC000611370314 1019456552 /nfs/dbraw/zinc/45/65/52/1019456552.db2.gz XTNLSBYLSWTMIF-OCCSQVGLSA-N 1 1 317.414 3.904 20 5 DHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])s2)C1 ZINC000611370315 1019457497 /nfs/dbraw/zinc/45/74/97/1019457497.db2.gz XTNLSBYLSWTMIF-TZMCWYRMSA-N 1 1 317.414 3.904 20 5 DHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000750053920 1019582839 /nfs/dbraw/zinc/58/28/39/1019582839.db2.gz AGVIORIPGPXWSI-JKSUJKDBSA-N 1 1 306.406 3.529 20 5 DHBDMO COc1cc(F)cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000093899600 1019593017 /nfs/dbraw/zinc/59/30/17/1019593017.db2.gz OWKWMEVANLBLBS-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]C[C@@H](C(C)C)N2CCCC2)cccc1[N+](=O)[O-] ZINC000480552813 1019747441 /nfs/dbraw/zinc/74/74/41/1019747441.db2.gz KLYOJVRHFOVQPI-QAPCUYQASA-N 1 1 319.449 3.674 20 5 DHBDMO CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000080933249 1019914179 /nfs/dbraw/zinc/91/41/79/1019914179.db2.gz KORBDTORZURDDX-CYBMUJFWSA-N 1 1 300.358 3.884 20 5 DHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000080933249 1019914189 /nfs/dbraw/zinc/91/41/89/1019914189.db2.gz KORBDTORZURDDX-CYBMUJFWSA-N 1 1 300.358 3.884 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc2c[nH]nc2c1)C1CC1 ZINC000154304368 1020093569 /nfs/dbraw/zinc/09/35/69/1020093569.db2.gz LGHXDADSCBUJHH-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc2c[nH]nc2c1)C1CC1 ZINC000154304368 1020093573 /nfs/dbraw/zinc/09/35/73/1020093573.db2.gz LGHXDADSCBUJHH-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO Cc1cnc(Cl)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000922542799 1020122783 /nfs/dbraw/zinc/12/27/83/1020122783.db2.gz YSNGCZBEGUFHAL-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO C[N@H+](CCc1ccccc1F)Cc1c(F)cccc1[N+](=O)[O-] ZINC000731669827 1020134299 /nfs/dbraw/zinc/13/42/99/1020134299.db2.gz OYKQCLNKMDGLCW-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[N@@H+](CCc1ccccc1F)Cc1c(F)cccc1[N+](=O)[O-] ZINC000731669827 1020134306 /nfs/dbraw/zinc/13/43/06/1020134306.db2.gz OYKQCLNKMDGLCW-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO CC[C@H](C)C[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000732183877 1020208859 /nfs/dbraw/zinc/20/88/59/1020208859.db2.gz ULQGZLZBJFLXHX-JTQLQIEISA-N 1 1 309.391 3.807 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000732571786 1020253525 /nfs/dbraw/zinc/25/35/25/1020253525.db2.gz YXAVZQPJXUSABR-AWEZNQCLSA-N 1 1 312.410 3.842 20 5 DHBDMO CC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1CC1 ZINC000125625370 1020334244 /nfs/dbraw/zinc/33/42/44/1020334244.db2.gz AQCZNPARVCELBV-UHFFFAOYSA-N 1 1 317.414 3.950 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000614222649 1020419207 /nfs/dbraw/zinc/41/92/07/1020419207.db2.gz SATWKSWECMAKGN-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000614222649 1020419213 /nfs/dbraw/zinc/41/92/13/1020419213.db2.gz SATWKSWECMAKGN-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H](C)[N@@H+]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000480622293 1020464725 /nfs/dbraw/zinc/46/47/25/1020464725.db2.gz GFSOJXMNKBBDFV-FMKPAKJESA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000480622293 1020464733 /nfs/dbraw/zinc/46/47/33/1020464733.db2.gz GFSOJXMNKBBDFV-FMKPAKJESA-N 1 1 319.449 3.817 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)cc1F ZINC000282578409 1020466290 /nfs/dbraw/zinc/46/62/90/1020466290.db2.gz VUCZTCRJNYZWNZ-SNVBAGLBSA-N 1 1 306.259 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cc1F ZINC000282578409 1020466295 /nfs/dbraw/zinc/46/62/95/1020466295.db2.gz VUCZTCRJNYZWNZ-SNVBAGLBSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC=C(c2cccnc2)CC1 ZINC000365388480 1020624216 /nfs/dbraw/zinc/62/42/16/1020624216.db2.gz HGIOWYLPXZZERG-CQSZACIVSA-N 1 1 309.369 3.840 20 5 DHBDMO CCCCC[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)C(C)C ZINC000734829746 1020666784 /nfs/dbraw/zinc/66/67/84/1020666784.db2.gz XNZVJHIIEKBDNZ-UHFFFAOYSA-N 1 1 304.394 3.803 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccncc1 ZINC000742371930 1021112760 /nfs/dbraw/zinc/11/27/60/1021112760.db2.gz CHNAZACMOHKZNU-OAHLLOKOSA-N 1 1 305.765 3.884 20 5 DHBDMO C[C@@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276269683 1021142791 /nfs/dbraw/zinc/14/27/91/1021142791.db2.gz ZJRVJEKPWRQYTL-TUAOUCFPSA-N 1 1 316.361 3.579 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000183229065 1022040925 /nfs/dbraw/zinc/04/09/25/1022040925.db2.gz DDWZMHDRADFLHZ-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000183245454 1022056240 /nfs/dbraw/zinc/05/62/40/1022056240.db2.gz XOLSADIXIMZYKF-UHFFFAOYSA-N 1 1 324.380 3.898 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000290546520 1022070482 /nfs/dbraw/zinc/07/04/82/1022070482.db2.gz CUQXKUDKXGLVQD-VXGBXAGGSA-N 1 1 316.357 3.721 20 5 DHBDMO CC(C)CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000776580749 1022100914 /nfs/dbraw/zinc/10/09/14/1022100914.db2.gz ZQMYDNOQHMATGO-SFHVURJKSA-N 1 1 320.433 3.919 20 5 DHBDMO Cc1cc2c(cc1[N+](=O)[O-])N(C[C@H]1CCCC[N@@H+]1C(C)C)CC2 ZINC001168784654 1022101508 /nfs/dbraw/zinc/10/15/08/1022101508.db2.gz FYNXTCVWJLQQEO-MRXNPFEDSA-N 1 1 317.433 3.529 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cc(Cl)cn1C ZINC000183392041 1022128766 /nfs/dbraw/zinc/12/87/66/1022128766.db2.gz JFGHHTWSEDPGCJ-UHFFFAOYSA-N 1 1 307.781 3.527 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cc(Cl)cn1C ZINC000183392041 1022128777 /nfs/dbraw/zinc/12/87/77/1022128777.db2.gz JFGHHTWSEDPGCJ-UHFFFAOYSA-N 1 1 307.781 3.527 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)cc1F ZINC000852594139 1022145014 /nfs/dbraw/zinc/14/50/14/1022145014.db2.gz AASVSGBRFSWOGE-PBHICJAKSA-N 1 1 322.380 3.515 20 5 DHBDMO CC[N@@H+](c1ccc(Nc2cc[nH]c(=O)c2[N+](=O)[O-])cc1)C(C)C ZINC000853085046 1022218460 /nfs/dbraw/zinc/21/84/60/1022218460.db2.gz DBINYMPHLLPVPF-UHFFFAOYSA-N 1 1 316.361 3.674 20 5 DHBDMO CC[N@H+](c1ccc(Nc2cc[nH]c(=O)c2[N+](=O)[O-])cc1)C(C)C ZINC000853085046 1022218473 /nfs/dbraw/zinc/21/84/73/1022218473.db2.gz DBINYMPHLLPVPF-UHFFFAOYSA-N 1 1 316.361 3.674 20 5 DHBDMO CCOc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169032928 1022219360 /nfs/dbraw/zinc/21/93/60/1022219360.db2.gz AAAJEVDIHUXJMO-LESCRADOSA-N 1 1 318.417 3.668 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2ccc(Cl)s2)C1 ZINC001169033308 1022220223 /nfs/dbraw/zinc/22/02/23/1022220223.db2.gz BUFNJMKWNTZNRP-GRYCIOLGSA-N 1 1 314.838 3.984 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H](c3ccccc3)CC2)C1 ZINC001169035498 1022221997 /nfs/dbraw/zinc/22/19/97/1022221997.db2.gz BNRAWXFRZCYBGO-NXHRZFHOSA-N 1 1 302.418 3.702 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2c(F)cccc2F)C1 ZINC001169046327 1022229187 /nfs/dbraw/zinc/22/91/87/1022229187.db2.gz KNNAMVYTQGFPSI-LALPHHSUSA-N 1 1 310.344 3.547 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cc(Cl)cn1C ZINC000120257082 1022394454 /nfs/dbraw/zinc/39/44/54/1022394454.db2.gz HHDNNMAMXVSDJP-LLVKDONJSA-N 1 1 307.781 3.780 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cc(Cl)cn1C ZINC000120257082 1022394461 /nfs/dbraw/zinc/39/44/61/1022394461.db2.gz HHDNNMAMXVSDJP-LLVKDONJSA-N 1 1 307.781 3.780 20 5 DHBDMO COC1CCC([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000341501960 1022875337 /nfs/dbraw/zinc/87/53/37/1022875337.db2.gz UNQRFYAZDMWRRK-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO CCOc1cc(C[N@H+](CC)CCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000617196034 1022887296 /nfs/dbraw/zinc/88/72/96/1022887296.db2.gz AXDQGHPVRQMPFB-UHFFFAOYSA-N 1 1 320.311 3.768 20 5 DHBDMO CCOc1cc(C[N@@H+](CC)CCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000617196034 1022887317 /nfs/dbraw/zinc/88/73/17/1022887317.db2.gz AXDQGHPVRQMPFB-UHFFFAOYSA-N 1 1 320.311 3.768 20 5 DHBDMO C[C@H]1CCCC[N@H+]1CCCNc1cc([N+](=O)[O-])ccc1Cl ZINC001167752580 1023034301 /nfs/dbraw/zinc/03/43/01/1023034301.db2.gz WKGZMTWPDFPBJS-LBPRGKRZSA-N 1 1 311.813 3.925 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1cc(O)cc(F)c1 ZINC000925690852 1023168750 /nfs/dbraw/zinc/16/87/50/1023168750.db2.gz HVNCAODMFXNGQD-GHMZBOCLSA-N 1 1 304.321 3.851 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCc2c1nccc2Cl)c1ccccc1[N+](=O)[O-] ZINC000925693107 1023178880 /nfs/dbraw/zinc/17/88/80/1023178880.db2.gz OKAAZPKOVZKDDT-QMTHXVAHSA-N 1 1 317.776 3.981 20 5 DHBDMO COc1cc(C)ccc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000124564367 1023345327 /nfs/dbraw/zinc/34/53/27/1023345327.db2.gz CFUMPABPPRNTHE-CYBMUJFWSA-N 1 1 300.358 3.763 20 5 DHBDMO CSc1cc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])ccn1 ZINC000771883669 1023480822 /nfs/dbraw/zinc/48/08/22/1023480822.db2.gz XROBTCBKPJACCU-UHFFFAOYSA-N 1 1 323.805 3.655 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000859412378 1033136341 /nfs/dbraw/zinc/13/63/41/1033136341.db2.gz TZXUMUQSZFRREP-AOOOYVTPSA-N 1 1 318.751 3.971 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000859412378 1033136345 /nfs/dbraw/zinc/13/63/45/1033136345.db2.gz TZXUMUQSZFRREP-AOOOYVTPSA-N 1 1 318.751 3.971 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1Cc2ccccc2C1 ZINC000746662540 1023774309 /nfs/dbraw/zinc/77/43/09/1023774309.db2.gz DCMCWUNQEBCBCO-UHFFFAOYSA-N 1 1 316.788 3.847 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccnc3ccccc13)C2 ZINC000538725523 1033160720 /nfs/dbraw/zinc/16/07/20/1033160720.db2.gz ASPQJUMQYXCMPG-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccnc3ccccc13)C2 ZINC000538725523 1033160727 /nfs/dbraw/zinc/16/07/27/1033160727.db2.gz ASPQJUMQYXCMPG-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO CCc1[nH+]ccn1[C@H]1CCCN(c2cc(C)ccc2[N+](=O)[O-])C1 ZINC000268053070 1024062288 /nfs/dbraw/zinc/06/22/88/1024062288.db2.gz UOWQQDFZNQDAGL-AWEZNQCLSA-N 1 1 314.389 3.504 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000538808953 1033195513 /nfs/dbraw/zinc/19/55/13/1033195513.db2.gz CESXQFGDFOHVQR-UHFFFAOYSA-N 1 1 314.385 3.552 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC000568979689 1024446054 /nfs/dbraw/zinc/44/60/54/1024446054.db2.gz RLKJGUOSXJCHCR-MRXNPFEDSA-N 1 1 314.360 3.766 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cnc(C3CC3)o1)CCC2 ZINC000453338906 1024469285 /nfs/dbraw/zinc/46/92/85/1024469285.db2.gz CSEBRWHFENASSQ-MRXNPFEDSA-N 1 1 313.357 3.627 20 5 DHBDMO CCCc1ncc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000453382267 1024483259 /nfs/dbraw/zinc/48/32/59/1024483259.db2.gz LZHRDYYNRKUSTA-LBPRGKRZSA-N 1 1 303.362 3.695 20 5 DHBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000791583167 1024519389 /nfs/dbraw/zinc/51/93/89/1024519389.db2.gz LZNAHFPURXKRCD-KWQFWETISA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000791583167 1024519394 /nfs/dbraw/zinc/51/93/94/1024519394.db2.gz LZNAHFPURXKRCD-KWQFWETISA-N 1 1 306.259 3.507 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C(C)C)N1CCCC1 ZINC000532202442 1024575295 /nfs/dbraw/zinc/57/52/95/1024575295.db2.gz CMSKSQKAPKTJAA-YJBOKZPZSA-N 1 1 319.449 3.674 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000585754270 1024594301 /nfs/dbraw/zinc/59/43/01/1024594301.db2.gz CRFJRBSKSQQQOA-UHFFFAOYSA-N 1 1 314.385 3.971 20 5 DHBDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000317742239 1024624489 /nfs/dbraw/zinc/62/44/89/1024624489.db2.gz QJKQYGKKVRMGNU-GHMZBOCLSA-N 1 1 303.362 3.920 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000348931364 1024651116 /nfs/dbraw/zinc/65/11/16/1024651116.db2.gz AWHSAAVBERRQFX-LYLYKKCESA-N 1 1 309.369 3.840 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000109781471 1024696088 /nfs/dbraw/zinc/69/60/88/1024696088.db2.gz KUTFWIIEQCIWTA-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000109781471 1024696095 /nfs/dbraw/zinc/69/60/95/1024696095.db2.gz KUTFWIIEQCIWTA-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO CO[C@@H]1C[C@@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C12CCC2 ZINC001170324904 1024743305 /nfs/dbraw/zinc/74/33/05/1024743305.db2.gz UTKKSOJIROFNEG-HUUCEWRRSA-N 1 1 324.808 3.638 20 5 DHBDMO CO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C12CCC2 ZINC001170324904 1024743315 /nfs/dbraw/zinc/74/33/15/1024743315.db2.gz UTKKSOJIROFNEG-HUUCEWRRSA-N 1 1 324.808 3.638 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001170328999 1024746346 /nfs/dbraw/zinc/74/63/46/1024746346.db2.gz MVSZZFNQBVBXFZ-CQSZACIVSA-N 1 1 314.385 3.666 20 5 DHBDMO CC[C@H]1CCC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170353608 1024748379 /nfs/dbraw/zinc/74/83/79/1024748379.db2.gz ZXYCLSMDARBLAJ-KGLIPLIRSA-N 1 1 306.406 3.656 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170352790 1024749239 /nfs/dbraw/zinc/74/92/39/1024749239.db2.gz QGXPRGNHOOCBNH-ZFWWWQNUSA-N 1 1 306.406 3.799 20 5 DHBDMO CCC[N@@H+](CC(C)C)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170355297 1024750231 /nfs/dbraw/zinc/75/02/31/1024750231.db2.gz ZFHFLQPJHDADMB-AWEZNQCLSA-N 1 1 308.422 3.902 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2ccsc2)c([N+](=O)[O-])c1 ZINC001170345210 1024757577 /nfs/dbraw/zinc/75/75/77/1024757577.db2.gz HYZUKHHTTRVDFH-LBPRGKRZSA-N 1 1 320.414 3.728 20 5 DHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879190 1024821426 /nfs/dbraw/zinc/82/14/26/1024821426.db2.gz FRBFCSVDLXBYHH-FZMZJTMJSA-N 1 1 307.350 3.514 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cccc3cc[nH]c31)CC2 ZINC000353591857 1025139709 /nfs/dbraw/zinc/13/97/09/1025139709.db2.gz YSZODTUVBREYPB-UHFFFAOYSA-N 1 1 307.353 3.634 20 5 DHBDMO COc1ccc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000353649302 1025174587 /nfs/dbraw/zinc/17/45/87/1025174587.db2.gz RWHYEXCOSKOVCN-ZDUSSCGKSA-N 1 1 312.369 3.550 20 5 DHBDMO COc1ccc(C[N@H+]2Cc3ccccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000353649302 1025174592 /nfs/dbraw/zinc/17/45/92/1025174592.db2.gz RWHYEXCOSKOVCN-ZDUSSCGKSA-N 1 1 312.369 3.550 20 5 DHBDMO COc1cc(C[N@H+]2C[C@@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000353884236 1025279457 /nfs/dbraw/zinc/27/94/57/1025279457.db2.gz WIBUCUFZIHWPIH-STQMWFEESA-N 1 1 322.405 3.623 20 5 DHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000015300584 1025373878 /nfs/dbraw/zinc/37/38/78/1025373878.db2.gz CLNLWJMNBAZNEX-QGZVFWFLSA-N 1 1 312.369 3.941 20 5 DHBDMO CC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000885964703 1025421670 /nfs/dbraw/zinc/42/16/70/1025421670.db2.gz DWVRVSGVEKRKAY-CYBMUJFWSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000885964703 1025421674 /nfs/dbraw/zinc/42/16/74/1025421674.db2.gz DWVRVSGVEKRKAY-CYBMUJFWSA-N 1 1 315.373 3.582 20 5 DHBDMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886014617 1025438635 /nfs/dbraw/zinc/43/86/35/1025438635.db2.gz LUOLCDDZUXDLHV-GFCCVEGCSA-N 1 1 319.792 3.706 20 5 DHBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886023499 1025443261 /nfs/dbraw/zinc/44/32/61/1025443261.db2.gz QLMUQDPOJAQZBP-LRDDRELGSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886023499 1025443269 /nfs/dbraw/zinc/44/32/69/1025443269.db2.gz QLMUQDPOJAQZBP-LRDDRELGSA-N 1 1 315.348 3.712 20 5 DHBDMO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cccnc2[N+](=O)[O-])o1 ZINC000886028859 1025446220 /nfs/dbraw/zinc/44/62/20/1025446220.db2.gz ZBTFCSCAYNWTNZ-SWLSCSKDSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2cccnc2[N+](=O)[O-])o1 ZINC000886028859 1025446224 /nfs/dbraw/zinc/44/62/24/1025446224.db2.gz ZBTFCSCAYNWTNZ-SWLSCSKDSA-N 1 1 315.373 3.864 20 5 DHBDMO CC(C)([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000886112484 1025511895 /nfs/dbraw/zinc/51/18/95/1025511895.db2.gz ZIDZSJVPRSECDY-UHFFFAOYSA-N 1 1 305.765 3.668 20 5 DHBDMO C[C@@H](CSc1ccccc1)[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886266956 1025573996 /nfs/dbraw/zinc/57/39/96/1025573996.db2.gz BZRRWJRZRYZOJE-ZDUSSCGKSA-N 1 1 317.414 3.602 20 5 DHBDMO C[C@@H](CSc1ccccc1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886266956 1025574003 /nfs/dbraw/zinc/57/40/03/1025574003.db2.gz BZRRWJRZRYZOJE-ZDUSSCGKSA-N 1 1 317.414 3.602 20 5 DHBDMO CC(C)[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1F ZINC000886279393 1025579297 /nfs/dbraw/zinc/57/92/97/1025579297.db2.gz XMHVUIHCICRNJW-OAHLLOKOSA-N 1 1 303.337 3.616 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3c2cccc3F)c(F)c1 ZINC000886361345 1025604115 /nfs/dbraw/zinc/60/41/15/1025604115.db2.gz CQWDAQZFYXNEKM-INIZCTEOSA-N 1 1 304.296 3.650 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cc(C2CC2)no1 ZINC000886682350 1025782178 /nfs/dbraw/zinc/78/21/78/1025782178.db2.gz FWUOLWDYJXEHKY-NSHDSACASA-N 1 1 301.346 3.619 20 5 DHBDMO C[N@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@H]1CCCO1 ZINC000076299938 1025867304 /nfs/dbraw/zinc/86/73/04/1025867304.db2.gz LVIPSDOGJWDICK-MRXNPFEDSA-N 1 1 323.392 3.557 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCOCC2(CCCC2)C1 ZINC000614222899 1025955773 /nfs/dbraw/zinc/95/57/73/1025955773.db2.gz OUJJNDWEJXDCKS-OAHLLOKOSA-N 1 1 318.417 3.857 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000576399646 1026280971 /nfs/dbraw/zinc/28/09/71/1026280971.db2.gz YGCUWEUHRYQGPP-BXBOZWQASA-N 1 1 323.396 3.883 20 5 DHBDMO COc1ccc(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000357043726 1026291351 /nfs/dbraw/zinc/29/13/51/1026291351.db2.gz RHYWLWBPUDSXNU-CYBMUJFWSA-N 1 1 304.390 3.616 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000513483094 1026518693 /nfs/dbraw/zinc/51/86/93/1026518693.db2.gz AVHOERNMVHULDB-OAHLLOKOSA-N 1 1 300.333 3.723 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc(O)c1Cl ZINC000513554740 1026540060 /nfs/dbraw/zinc/54/00/60/1026540060.db2.gz SAPNJWLOOIWAHH-UHFFFAOYSA-N 1 1 320.776 3.628 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc(O)c1Cl ZINC000513554740 1026540068 /nfs/dbraw/zinc/54/00/68/1026540068.db2.gz SAPNJWLOOIWAHH-UHFFFAOYSA-N 1 1 320.776 3.628 20 5 DHBDMO COc1ccc(C[N@@H+]2CCc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000513666272 1026554928 /nfs/dbraw/zinc/55/49/28/1026554928.db2.gz KNTZMOQUBXWSLF-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc(C[N@H+]2CCc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000513666272 1026554936 /nfs/dbraw/zinc/55/49/36/1026554936.db2.gz KNTZMOQUBXWSLF-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCSC1 ZINC000809965933 1026647625 /nfs/dbraw/zinc/64/76/25/1026647625.db2.gz QCHGDGRHVFUMMU-JTQLQIEISA-N 1 1 321.229 3.839 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812851052 1027448607 /nfs/dbraw/zinc/44/86/07/1027448607.db2.gz PSDQVJOMANTLGO-KSSFIOAISA-N 1 1 314.385 3.539 20 5 DHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812852391 1027449964 /nfs/dbraw/zinc/44/99/64/1027449964.db2.gz FKFVOROCVMYRJH-WBMJQRKESA-N 1 1 320.414 3.600 20 5 DHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812852388 1027450019 /nfs/dbraw/zinc/45/00/19/1027450019.db2.gz FKFVOROCVMYRJH-BLLLJJGKSA-N 1 1 320.414 3.600 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000932377587 1027470907 /nfs/dbraw/zinc/47/09/07/1027470907.db2.gz IGWMYMJFQJTUHQ-INIZCTEOSA-N 1 1 317.776 3.884 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+](Cc1cccc(F)c1)C1CCC1 ZINC000932402093 1027481440 /nfs/dbraw/zinc/48/14/40/1027481440.db2.gz HFPVIVKVIMDETP-UHFFFAOYSA-N 1 1 315.348 3.684 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+](Cc1cccc(F)c1)C1CCC1 ZINC000932402093 1027481450 /nfs/dbraw/zinc/48/14/50/1027481450.db2.gz HFPVIVKVIMDETP-UHFFFAOYSA-N 1 1 315.348 3.684 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ccncc3)C2)cc1F ZINC000296001360 1027515077 /nfs/dbraw/zinc/51/50/77/1027515077.db2.gz PUVGTIPZMGCORW-HNNXBMFYSA-N 1 1 315.348 3.509 20 5 DHBDMO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000297056722 1027788795 /nfs/dbraw/zinc/78/87/95/1027788795.db2.gz VTSMXCZZRDQEOE-OLZOCXBDSA-N 1 1 302.378 3.531 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1OCc1c(C)cc(C)[nH+]c1C ZINC000601075996 1027972202 /nfs/dbraw/zinc/97/22/02/1027972202.db2.gz JNNWHAWFBLDQTL-UHFFFAOYSA-N 1 1 302.330 3.503 20 5 DHBDMO C[C@@]12CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C[C@@H]1C2(F)F ZINC000601167980 1028010144 /nfs/dbraw/zinc/01/01/44/1028010144.db2.gz KCZPLCAXZAOWQA-LSDHHAIUSA-N 1 1 319.311 3.625 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C)o2)cc1[N+](=O)[O-] ZINC000601304081 1028068144 /nfs/dbraw/zinc/06/81/44/1028068144.db2.gz LOKWCAMHRJFLTC-LBPRGKRZSA-N 1 1 304.346 3.746 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H](c2ccncc2)C2CC2)c1 ZINC000934692130 1028073749 /nfs/dbraw/zinc/07/37/49/1028073749.db2.gz MRFCLHWANFCTGC-MRXNPFEDSA-N 1 1 317.776 3.884 20 5 DHBDMO C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC000369560535 1028502832 /nfs/dbraw/zinc/50/28/32/1028502832.db2.gz HIUHLWRCURRBFA-WBMJQRKESA-N 1 1 317.414 3.761 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@]2(C1)CCc1ccccc1O2 ZINC000565860960 1028645653 /nfs/dbraw/zinc/64/56/53/1028645653.db2.gz IJPXJAOXQHCCQJ-IBGZPJMESA-N 1 1 324.380 3.565 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C/C=C\c3ccncc3)C2)cc1 ZINC000449496269 1028709677 /nfs/dbraw/zinc/70/96/77/1028709677.db2.gz GLONTQKYXYMCKX-PFOXWKGBSA-N 1 1 323.396 3.883 20 5 DHBDMO CCc1nocc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449503848 1028723828 /nfs/dbraw/zinc/72/38/28/1028723828.db2.gz UXDFRUONKLHGEU-CQSZACIVSA-N 1 1 315.373 3.525 20 5 DHBDMO Cc1ncccc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449506717 1028728542 /nfs/dbraw/zinc/72/85/42/1028728542.db2.gz ZLKWTBXZXMZWDS-QGZVFWFLSA-N 1 1 311.385 3.678 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000449681482 1028907379 /nfs/dbraw/zinc/90/73/79/1028907379.db2.gz LXXQWNBIWMHBAH-QWSHFYNQSA-N 1 1 316.401 3.501 20 5 DHBDMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000373019692 1028936504 /nfs/dbraw/zinc/93/65/04/1028936504.db2.gz ORLNJQRBWUETDA-NSHDSACASA-N 1 1 301.346 3.501 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000449731144 1028941570 /nfs/dbraw/zinc/94/15/70/1028941570.db2.gz HKQMCAXDZWBTIT-GPCFVJJQSA-N 1 1 318.442 3.827 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H]1c1cccc(F)c1 ZINC000411131475 1029040387 /nfs/dbraw/zinc/04/03/87/1029040387.db2.gz JPZVTHQCKFDERB-DOTOQJQBSA-N 1 1 300.333 3.722 20 5 DHBDMO Cc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])ccc1F ZINC000568445157 1029070041 /nfs/dbraw/zinc/07/00/41/1029070041.db2.gz PXWBSZLABCUJPV-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO C[C@H]1CC(C)(C)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000412033163 1029297652 /nfs/dbraw/zinc/29/76/52/1029297652.db2.gz CMSQOYLNZNGMSL-LBPRGKRZSA-N 1 1 315.373 3.870 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](O)c2ccccc2C1 ZINC000374806656 1029463748 /nfs/dbraw/zinc/46/37/48/1029463748.db2.gz MUFCOEFAANMEKX-SCLBCKFNSA-N 1 1 312.369 3.595 20 5 DHBDMO CC(C)OCCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451551334 1029910606 /nfs/dbraw/zinc/91/06/06/1029910606.db2.gz UIWNGYUHVXMAIL-INIZCTEOSA-N 1 1 306.406 3.589 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc(F)cn3)C2)cc1 ZINC000451552096 1029911574 /nfs/dbraw/zinc/91/15/74/1029911574.db2.gz VLTQQOFISDBVBE-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO Cc1nc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)oc1C ZINC000451553630 1029918405 /nfs/dbraw/zinc/91/84/05/1029918405.db2.gz YFFPRDHVWGTIKZ-OAHLLOKOSA-N 1 1 315.373 3.579 20 5 DHBDMO Cc1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)oc1C ZINC000451553630 1029918424 /nfs/dbraw/zinc/91/84/24/1029918424.db2.gz YFFPRDHVWGTIKZ-OAHLLOKOSA-N 1 1 315.373 3.579 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451963646 1030068362 /nfs/dbraw/zinc/06/83/62/1030068362.db2.gz HTBWHROUPGRXLH-CJNGLKHVSA-N 1 1 306.431 3.875 20 5 DHBDMO C[N@H+]1CCC[C@@H](CCNc2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865872468 1030072718 /nfs/dbraw/zinc/07/27/18/1030072718.db2.gz RZRGXEDVUVCBSX-NSHDSACASA-N 1 1 313.348 3.676 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451966714 1030074557 /nfs/dbraw/zinc/07/45/57/1030074557.db2.gz POUKIVDFJDMIJO-CJNGLKHVSA-N 1 1 306.431 3.875 20 5 DHBDMO CSc1ccccc1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000358053612 1030299334 /nfs/dbraw/zinc/29/93/34/1030299334.db2.gz VUGBMKOOMHIYQQ-UHFFFAOYSA-N 1 1 314.410 3.875 20 5 DHBDMO CSc1ccccc1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000358053612 1030299342 /nfs/dbraw/zinc/29/93/42/1030299342.db2.gz VUGBMKOOMHIYQQ-UHFFFAOYSA-N 1 1 314.410 3.875 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCCc2c(Cl)ccnc21 ZINC000925311237 1030338786 /nfs/dbraw/zinc/33/87/86/1030338786.db2.gz RKISOMINBPQLLK-AWEZNQCLSA-N 1 1 317.776 3.810 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2cccnc2Cl)cc1[N+](=O)[O-] ZINC000866539783 1030360589 /nfs/dbraw/zinc/36/05/89/1030360589.db2.gz GOOZYRBOPJSRKW-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H]1CCOC(C)(C)C1 ZINC000291575525 1030554771 /nfs/dbraw/zinc/55/47/71/1030554771.db2.gz OGLMWLZOPCUETN-HNNXBMFYSA-N 1 1 306.406 3.683 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCc2c1nccc2Cl)c1ccc([N+](=O)[O-])cc1 ZINC000926891746 1030972280 /nfs/dbraw/zinc/97/22/80/1030972280.db2.gz JSXGONBTNDOOLI-MEBBXXQBSA-N 1 1 317.776 3.981 20 5 DHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)C1 ZINC000359558465 1031030680 /nfs/dbraw/zinc/03/06/80/1031030680.db2.gz OJTVDFYGBXGOOS-YVEFUNNKSA-N 1 1 315.373 3.748 20 5 DHBDMO CC(C)[N@@H+](CC[C@H]1CCCCO1)Cc1ccc([N+](=O)[O-])cc1 ZINC000347392386 1031216126 /nfs/dbraw/zinc/21/61/26/1031216126.db2.gz LCBMRXYNYALYEF-QGZVFWFLSA-N 1 1 306.406 3.764 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H]1C[C@@H]1c1ccccc1)CC2 ZINC000536677280 1031384814 /nfs/dbraw/zinc/38/48/14/1031384814.db2.gz IKIBCHOMUBJWHX-IEBWSBKVSA-N 1 1 308.381 3.757 20 5 DHBDMO CC(C)[N@H+]1CCC[C@H](CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872035586 1031420024 /nfs/dbraw/zinc/42/00/24/1031420024.db2.gz XIENAQMDRLSAAG-UONOGXRCSA-N 1 1 323.412 3.505 20 5 DHBDMO CC[NH+]1CCC(CCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872039716 1031423682 /nfs/dbraw/zinc/42/36/82/1031423682.db2.gz UTFCDWWYDUVPNI-CYBMUJFWSA-N 1 1 323.412 3.507 20 5 DHBDMO COc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1C ZINC000872087581 1031483031 /nfs/dbraw/zinc/48/30/31/1031483031.db2.gz FNVMVESIKLTLCV-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)cc1 ZINC000872260177 1031565134 /nfs/dbraw/zinc/56/51/34/1031565134.db2.gz KLKHDAYUZDWAIS-KRWDZBQOSA-N 1 1 304.390 3.518 20 5 DHBDMO CCc1noc(C)c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000293846174 1031655723 /nfs/dbraw/zinc/65/57/23/1031655723.db2.gz YARHQAWSDPVECW-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cc(C(C)C)no1 ZINC000873050273 1031698157 /nfs/dbraw/zinc/69/81/57/1031698157.db2.gz LSLHYHFFBQRIOS-UHFFFAOYSA-N 1 1 303.362 3.613 20 5 DHBDMO Cc1c(C[NH2+]Cc2nc(C3CC3)cs2)cccc1[N+](=O)[O-] ZINC000873081251 1031705155 /nfs/dbraw/zinc/70/51/55/1031705155.db2.gz YTDSFWOSQTUKHP-UHFFFAOYSA-N 1 1 303.387 3.527 20 5 DHBDMO Cc1cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cnc1Cl ZINC000873184105 1031745586 /nfs/dbraw/zinc/74/55/86/1031745586.db2.gz CBLNWRUPDHGDNR-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO Cc1nccnc1[C@H](C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000873189457 1031747460 /nfs/dbraw/zinc/74/74/60/1031747460.db2.gz PHNPCZACXJAMBL-ZDUSSCGKSA-N 1 1 314.389 3.667 20 5 DHBDMO CC(C)O[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000846015333 1031809229 /nfs/dbraw/zinc/80/92/29/1031809229.db2.gz LRCIJXZSKIQFOI-CYBMUJFWSA-N 1 1 312.797 3.638 20 5 DHBDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000846015333 1031809248 /nfs/dbraw/zinc/80/92/48/1031809248.db2.gz LRCIJXZSKIQFOI-CYBMUJFWSA-N 1 1 312.797 3.638 20 5 DHBDMO CC(C)O[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000846015334 1031809854 /nfs/dbraw/zinc/80/98/54/1031809854.db2.gz LRCIJXZSKIQFOI-ZDUSSCGKSA-N 1 1 312.797 3.638 20 5 DHBDMO CC(C)O[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000846015334 1031809872 /nfs/dbraw/zinc/80/98/72/1031809872.db2.gz LRCIJXZSKIQFOI-ZDUSSCGKSA-N 1 1 312.797 3.638 20 5 DHBDMO CC[N@@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)[C@H](C)C(C)C ZINC000777955022 1032037766 /nfs/dbraw/zinc/03/77/66/1032037766.db2.gz SFYTXNMVSASTFF-CQSZACIVSA-N 1 1 316.405 3.782 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000877603634 1033376512 /nfs/dbraw/zinc/37/65/12/1033376512.db2.gz RKUKFBMKZGJUDQ-YJBOKZPZSA-N 1 1 318.417 3.603 20 5 DHBDMO C[C@@H]1CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172903280 1033437206 /nfs/dbraw/zinc/43/72/06/1033437206.db2.gz GJXOYQUVZNYNLE-RHSMWYFYSA-N 1 1 302.418 3.964 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@H](CF)C1)CC2 ZINC001172916528 1033465079 /nfs/dbraw/zinc/46/50/79/1033465079.db2.gz TXCOHBFKUBVYKL-CZUORRHYSA-N 1 1 306.381 3.524 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc(Cl)nc2)C2CC2)c1 ZINC000153255027 1033569423 /nfs/dbraw/zinc/56/94/23/1033569423.db2.gz NBOCPGAYVILMOY-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(Cl)nc2)C2CC2)c1 ZINC000153255027 1033569430 /nfs/dbraw/zinc/56/94/30/1033569430.db2.gz NBOCPGAYVILMOY-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2C[C@H](C)C[C@H](C)C2)c1F ZINC001173192052 1033583496 /nfs/dbraw/zinc/58/34/96/1033583496.db2.gz HUTIWTZNPMHBJJ-FRRDWIJNSA-N 1 1 324.396 3.651 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2C[C@H](C)C[C@H](C)C2)c1F ZINC001173192056 1033583648 /nfs/dbraw/zinc/58/36/48/1033583648.db2.gz HUTIWTZNPMHBJJ-XQQFMLRXSA-N 1 1 324.396 3.651 20 5 DHBDMO CC[N@@H+](CC(C)C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000153738878 1033591377 /nfs/dbraw/zinc/59/13/77/1033591377.db2.gz WOHHHCYNILLRJF-LBPRGKRZSA-N 1 1 318.377 3.684 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](F)C(F)(F)CC1 ZINC001173224255 1033603830 /nfs/dbraw/zinc/60/38/30/1033603830.db2.gz DDMOHYXSQJCQOK-SMDDNHRTSA-N 1 1 316.323 3.595 20 5 DHBDMO Cc1cccc2c1CC[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173230414 1033604884 /nfs/dbraw/zinc/60/48/84/1033604884.db2.gz XXJZBFWGCWHQLH-OAHLLOKOSA-N 1 1 310.397 3.893 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCOc1ccccc1 ZINC001173228258 1033606059 /nfs/dbraw/zinc/60/60/59/1033606059.db2.gz UVGHAHQYFBWDNZ-OAHLLOKOSA-N 1 1 314.385 3.537 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc(F)cc1 ZINC001173229404 1033606556 /nfs/dbraw/zinc/60/65/56/1033606556.db2.gz UGOMYSWZWQSFPQ-CYBMUJFWSA-N 1 1 302.349 3.797 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1nccs1 ZINC001173233980 1033609167 /nfs/dbraw/zinc/60/91/67/1033609167.db2.gz NLKLRRSGGCZPCX-SWLSCSKDSA-N 1 1 317.414 3.819 20 5 DHBDMO CCN(CC)[C@H](C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000479479925 1033773510 /nfs/dbraw/zinc/77/35/10/1033773510.db2.gz MAELNNRNWGPQKZ-DYVFJYSZSA-N 1 1 319.449 3.637 20 5 DHBDMO CC1(C)CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000173817787 1033883849 /nfs/dbraw/zinc/88/38/49/1033883849.db2.gz GQSDEDKTCHTUKA-UHFFFAOYSA-N 1 1 315.373 3.524 20 5 DHBDMO Cc1cncc([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000879747201 1034109603 /nfs/dbraw/zinc/10/96/03/1034109603.db2.gz KHAHCUUPDMBBCW-SFHVURJKSA-N 1 1 311.385 3.678 20 5 DHBDMO Cc1csc([C@@H]2CC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000880010430 1034183355 /nfs/dbraw/zinc/18/33/55/1034183355.db2.gz UEKLCQWLWFWZRN-GXTWGEPZSA-N 1 1 317.414 3.910 20 5 DHBDMO C[C@@H](c1cccc(F)c1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554848575 1034371039 /nfs/dbraw/zinc/37/10/39/1034371039.db2.gz NQDQWDDHXVBSGR-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO CCc1ccc([C@H](COC)[NH2+]Cc2ccc([N+](=O)[O-])cc2C)o1 ZINC000183479235 1034390436 /nfs/dbraw/zinc/39/04/36/1034390436.db2.gz NCRYNEFCTZVUJR-INIZCTEOSA-N 1 1 318.373 3.536 20 5 DHBDMO CCC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cccnc1 ZINC000185350439 1034542739 /nfs/dbraw/zinc/54/27/39/1034542739.db2.gz RUSFSVSJHXEPHW-INIZCTEOSA-N 1 1 315.373 3.629 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1cccnc1F)c1cccc([N+](=O)[O-])c1 ZINC000794835154 1034596729 /nfs/dbraw/zinc/59/67/29/1034596729.db2.gz KSSFHTCTEUAZNP-OAHLLOKOSA-N 1 1 303.337 3.760 20 5 DHBDMO Cc1c([C@H](C)N[C@H](C)C[N@@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000481183181 1034635317 /nfs/dbraw/zinc/63/53/17/1034635317.db2.gz QPBAFBTYTVQATP-LZWOXQAQSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c([C@H](C)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000481183181 1034635321 /nfs/dbraw/zinc/63/53/21/1034635321.db2.gz QPBAFBTYTVQATP-LZWOXQAQSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1cc([C@H]2CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)no1 ZINC000865432879 1034643229 /nfs/dbraw/zinc/64/32/29/1034643229.db2.gz UTJJQGXSRMLBNH-QGZVFWFLSA-N 1 1 324.340 3.781 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2ccc(Cn3c[nH+]c4c3CCCC4)o2)c1 ZINC000600179304 1034793246 /nfs/dbraw/zinc/79/32/46/1034793246.db2.gz MTLWVUBKRYBBFK-UHFFFAOYSA-N 1 1 323.352 3.978 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c(F)c1 ZINC000555582986 1034826888 /nfs/dbraw/zinc/82/68/88/1034826888.db2.gz KIJYUUBLXYIBPA-GFCCVEGCSA-N 1 1 318.323 3.863 20 5 DHBDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000481768364 1034969901 /nfs/dbraw/zinc/96/99/01/1034969901.db2.gz MNZHOGHAZULYKR-FZMZJTMJSA-N 1 1 316.323 3.800 20 5 DHBDMO Cc1c([C@H](C)NC2CC(C)(C)[NH2+]C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000159615031 1035074263 /nfs/dbraw/zinc/07/42/63/1035074263.db2.gz JGEAWTYSNYSCIU-ZDUSSCGKSA-N 1 1 319.449 3.863 20 5 DHBDMO Cc1cccc([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)n1 ZINC000160059570 1035131655 /nfs/dbraw/zinc/13/16/55/1035131655.db2.gz SDWRNDRZYAHXQU-SFHVURJKSA-N 1 1 311.385 3.678 20 5 DHBDMO Cc1c([C@H](C)NCC[N@H+]2[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000482627046 1035149394 /nfs/dbraw/zinc/14/93/94/1035149394.db2.gz GRGBGVUPQOVPRP-LZWOXQAQSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1c([C@H](C)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000482627046 1035149400 /nfs/dbraw/zinc/14/94/00/1035149400.db2.gz GRGBGVUPQOVPRP-LZWOXQAQSA-N 1 1 319.449 3.817 20 5 DHBDMO C[C@H]([NH2+]CCN1[C@@H](C)CCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000482631586 1035151790 /nfs/dbraw/zinc/15/17/90/1035151790.db2.gz SNLBIKNEEMLHGM-KKUMJFAQSA-N 1 1 305.422 3.508 20 5 DHBDMO CC[C@H](C)C[N@@H+](CC)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000482870843 1035191032 /nfs/dbraw/zinc/19/10/32/1035191032.db2.gz QBNIMXCQCGCLMR-ZDUSSCGKSA-N 1 1 321.421 3.600 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1CCN[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000482941708 1035203204 /nfs/dbraw/zinc/20/32/04/1035203204.db2.gz AKGVETSGRMDNTD-JKSUJKDBSA-N 1 1 319.449 3.818 20 5 DHBDMO CC[C@@H]1CCCCN1CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000482941708 1035203206 /nfs/dbraw/zinc/20/32/06/1035203206.db2.gz AKGVETSGRMDNTD-JKSUJKDBSA-N 1 1 319.449 3.818 20 5 DHBDMO COc1cc(C[N@@H+](CC2CC2)CC2CCC2)ccc1[N+](=O)[O-] ZINC000483272491 1035245888 /nfs/dbraw/zinc/24/58/88/1035245888.db2.gz QGYDJXVNQNVYDE-UHFFFAOYSA-N 1 1 304.390 3.616 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3ccc(C)c([N+](=O)[O-])c3)nc2c1 ZINC000483859213 1035305577 /nfs/dbraw/zinc/30/55/77/1035305577.db2.gz XKCCDPYRFCDRQF-CYBMUJFWSA-N 1 1 324.384 3.939 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@H](C)c3ccc(C)c([N+](=O)[O-])c3)[nH]c2c1 ZINC000483859213 1035305580 /nfs/dbraw/zinc/30/55/80/1035305580.db2.gz XKCCDPYRFCDRQF-CYBMUJFWSA-N 1 1 324.384 3.939 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2cccc(O)c2)o1 ZINC001177645843 1035386678 /nfs/dbraw/zinc/38/66/78/1035386678.db2.gz AGJMYQNGYLIHBU-UHFFFAOYSA-N 1 1 324.336 3.850 20 5 DHBDMO CC(C)[N@@H+](C)CCNc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000485126575 1035476111 /nfs/dbraw/zinc/47/61/11/1035476111.db2.gz RMJNKNRPCFAOFK-UHFFFAOYSA-N 1 1 309.410 3.524 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2cc(O)ccc2Cl)cc1[N+](=O)[O-] ZINC001179457184 1035479012 /nfs/dbraw/zinc/47/90/12/1035479012.db2.gz CDQIPNCSTDUVAS-UHFFFAOYSA-N 1 1 306.749 3.552 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCCC2(CCC2)O1 ZINC001194262534 1035894049 /nfs/dbraw/zinc/89/40/49/1035894049.db2.gz PAWKJGCUKHUBDC-MRXNPFEDSA-N 1 1 318.417 3.561 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000485719870 1035901554 /nfs/dbraw/zinc/90/15/54/1035901554.db2.gz WPLMDJMZUFFEAI-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cccc(C)c1C ZINC001194616245 1035982831 /nfs/dbraw/zinc/98/28/31/1035982831.db2.gz SIEWZIGRLDDDST-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc(C)c1C ZINC001194616245 1035982855 /nfs/dbraw/zinc/98/28/55/1035982855.db2.gz SIEWZIGRLDDDST-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)S1 ZINC000541998433 1036486207 /nfs/dbraw/zinc/48/62/07/1036486207.db2.gz QPCCJDCJPLBJOG-AOOOYVTPSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)S1 ZINC000541998433 1036486219 /nfs/dbraw/zinc/48/62/19/1036486219.db2.gz QPCCJDCJPLBJOG-AOOOYVTPSA-N 1 1 300.811 3.574 20 5 DHBDMO Cc1c(C[N@@H+]2CCOc3ccccc3[C@@H]2C)cccc1[N+](=O)[O-] ZINC000609145591 1036503850 /nfs/dbraw/zinc/50/38/50/1036503850.db2.gz JJVXYTZVJJZLLA-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1c(C[N@H+]2CCOc3ccccc3[C@@H]2C)cccc1[N+](=O)[O-] ZINC000609145591 1036503856 /nfs/dbraw/zinc/50/38/56/1036503856.db2.gz JJVXYTZVJJZLLA-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH+]1CC(CC2CC2)C1 ZINC001183054409 1036513208 /nfs/dbraw/zinc/51/32/08/1036513208.db2.gz XQGWDFOZIMGONZ-UHFFFAOYSA-N 1 1 314.307 3.846 20 5 DHBDMO CC(C)CC[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774628859 1036592922 /nfs/dbraw/zinc/59/29/22/1036592922.db2.gz XYWGOMRMXLVVEG-UHFFFAOYSA-N 1 1 310.785 3.533 20 5 DHBDMO COc1ccccc1C[N@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000487858312 1036746115 /nfs/dbraw/zinc/74/61/15/1036746115.db2.gz MMYRCXWZWQUZSF-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1ccccc1C[N@@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000487858312 1036746129 /nfs/dbraw/zinc/74/61/29/1036746129.db2.gz MMYRCXWZWQUZSF-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1ccc(C)cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000492377851 1036849510 /nfs/dbraw/zinc/84/95/10/1036849510.db2.gz QSLHSTLCOIRHGN-UHFFFAOYSA-N 1 1 314.385 3.937 20 5 DHBDMO CCOc1cc(C[N@H+](C)Cc2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000492373333 1036853489 /nfs/dbraw/zinc/85/34/89/1036853489.db2.gz DYMTZASHIGESLB-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000492373333 1036853510 /nfs/dbraw/zinc/85/35/10/1036853510.db2.gz DYMTZASHIGESLB-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CCOc1cc(C[N@@H+](C)C(C2CC2)C2CC2)ccc1[N+](=O)[O-] ZINC000492695616 1036967388 /nfs/dbraw/zinc/96/73/88/1036967388.db2.gz JSJWYZQTCZFDQU-UHFFFAOYSA-N 1 1 304.390 3.614 20 5 DHBDMO Cc1cccnc1[C@H](C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001198641366 1037089296 /nfs/dbraw/zinc/08/92/96/1037089296.db2.gz PYAAPGDOSPEDJR-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000488710675 1037113860 /nfs/dbraw/zinc/11/38/60/1037113860.db2.gz GDKSCJUBLHCDOK-GFCCVEGCSA-N 1 1 323.824 3.559 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000489179481 1037298455 /nfs/dbraw/zinc/29/84/55/1037298455.db2.gz ZIACYALUIWGJMC-INIZCTEOSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccc(F)cc1 ZINC000490354601 1037691626 /nfs/dbraw/zinc/69/16/26/1037691626.db2.gz RKDAGGFPRMBCQO-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000490397654 1037703102 /nfs/dbraw/zinc/70/31/02/1037703102.db2.gz IUZBMXYUNNEFTG-CQSZACIVSA-N 1 1 312.410 3.842 20 5 DHBDMO Cc1nn(C[N@@H+]2CCC[C@H]2c2cccc(C)c2)c(C)c1[N+](=O)[O-] ZINC000055034065 1038024881 /nfs/dbraw/zinc/02/48/81/1038024881.db2.gz UNLFJDRMDNBOLN-INIZCTEOSA-N 1 1 314.389 3.511 20 5 DHBDMO Cc1nn(C[N@H+]2CCC[C@H]2c2cccc(C)c2)c(C)c1[N+](=O)[O-] ZINC000055034065 1038024891 /nfs/dbraw/zinc/02/48/91/1038024891.db2.gz UNLFJDRMDNBOLN-INIZCTEOSA-N 1 1 314.389 3.511 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](C)C(C)(C)C ZINC000164536916 1038205543 /nfs/dbraw/zinc/20/55/43/1038205543.db2.gz VUZIYMUQISHFSZ-ZDUSSCGKSA-N 1 1 321.421 3.598 20 5 DHBDMO CCC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@@H](CC)c1ccccc1 ZINC001190582074 1038351214 /nfs/dbraw/zinc/35/12/14/1038351214.db2.gz OIJWXVREOSOORV-INIZCTEOSA-N 1 1 316.405 3.692 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cs1 ZINC000589743973 1038535956 /nfs/dbraw/zinc/53/59/56/1038535956.db2.gz VKOWHAMJPSQMSM-KFWWJZLASA-N 1 1 324.446 3.562 20 5 DHBDMO CCC1(CC)[C@H](OC)C[C@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001191744088 1038541316 /nfs/dbraw/zinc/54/13/16/1038541316.db2.gz YJPCMWJIDNJDDP-HZPDHXFCSA-N 1 1 306.406 3.620 20 5 DHBDMO CO[C@@H](CC(C)C)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001192080640 1038583389 /nfs/dbraw/zinc/58/33/89/1038583389.db2.gz MMIFGLCIHVBKLJ-AWEZNQCLSA-N 1 1 314.813 3.741 20 5 DHBDMO CO[C@@H](CC(C)C)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001192080640 1038583396 /nfs/dbraw/zinc/58/33/96/1038583396.db2.gz MMIFGLCIHVBKLJ-AWEZNQCLSA-N 1 1 314.813 3.741 20 5 DHBDMO COc1cccc2c1C[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000590759695 1038699589 /nfs/dbraw/zinc/69/95/89/1038699589.db2.gz IKSWNKKDZQOIFB-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc2c1C[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000590759695 1038699591 /nfs/dbraw/zinc/69/95/91/1038699591.db2.gz IKSWNKKDZQOIFB-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc2c1C[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000590759694 1038700085 /nfs/dbraw/zinc/70/00/85/1038700085.db2.gz IKSWNKKDZQOIFB-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc2c1C[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000590759694 1038700097 /nfs/dbraw/zinc/70/00/97/1038700097.db2.gz IKSWNKKDZQOIFB-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO C[C@@H](c1ccncc1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590757331 1038700275 /nfs/dbraw/zinc/70/02/75/1038700275.db2.gz PXFPTEAHWGEMIS-YOEHRIQHSA-N 1 1 311.385 3.930 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000598678937 1038819553 /nfs/dbraw/zinc/81/95/53/1038819553.db2.gz AXIGATKIPRLWNP-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000598679543 1038822335 /nfs/dbraw/zinc/82/23/35/1038822335.db2.gz JCMARDANZCMLPJ-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO CCCCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131281 1039127730 /nfs/dbraw/zinc/12/77/30/1039127730.db2.gz WGDDPTIKNGLFNC-QAQDUYKDSA-N 1 1 320.433 3.891 20 5 DHBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC2CC2)cn1 ZINC000592144472 1039137777 /nfs/dbraw/zinc/13/77/77/1039137777.db2.gz GHFMLNDUIVATSF-UHFFFAOYSA-N 1 1 311.385 3.710 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592183971 1039172720 /nfs/dbraw/zinc/17/27/20/1039172720.db2.gz MQCNYCKYRDTVQG-LSDHHAIUSA-N 1 1 318.417 3.855 20 5 DHBDMO C[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]12 ZINC000603847237 1039183627 /nfs/dbraw/zinc/18/36/27/1039183627.db2.gz KRFHLEZWGCYHIN-BZUAXINKSA-N 1 1 318.417 3.874 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](C1CC1)C1CCCCC1 ZINC000603848768 1039183901 /nfs/dbraw/zinc/18/39/01/1039183901.db2.gz MWBMYTGQXASVLR-UHFFFAOYSA-N 1 1 304.390 3.771 20 5 DHBDMO CCOc1ccccc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000603856648 1039189018 /nfs/dbraw/zinc/18/90/18/1039189018.db2.gz PYUAGEXXGYIXJX-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO CCOc1ccccc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000603856648 1039189028 /nfs/dbraw/zinc/18/90/28/1039189028.db2.gz PYUAGEXXGYIXJX-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO C/C=C\C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000599691853 1039261532 /nfs/dbraw/zinc/26/15/32/1039261532.db2.gz UAGJPOMHWDABDF-XQJDBVBESA-N 1 1 315.373 3.914 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000604016863 1039283484 /nfs/dbraw/zinc/28/34/84/1039283484.db2.gz JMKYPXBCHRXPRI-QGZVFWFLSA-N 1 1 314.360 3.941 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](OC(C)C)C1 ZINC000593053775 1039377965 /nfs/dbraw/zinc/37/79/65/1039377965.db2.gz MGVLPUWRFBJBQZ-GDBMZVCRSA-N 1 1 306.406 3.854 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ccc([N+](=O)[O-])s2)C1 ZINC000604409263 1039457566 /nfs/dbraw/zinc/45/75/66/1039457566.db2.gz LNHQNTFKDCLEIR-BETUJISGSA-N 1 1 311.451 3.826 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ccsc2[N+](=O)[O-])C1 ZINC000604433443 1039475430 /nfs/dbraw/zinc/47/54/30/1039475430.db2.gz BXQXWBKXFVHDDY-BETUJISGSA-N 1 1 311.451 3.826 20 5 DHBDMO CC(C)c1ccc(CNCC[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000604532804 1039496297 /nfs/dbraw/zinc/49/62/97/1039496297.db2.gz KXRFOENBUFAGJO-OAHLLOKOSA-N 1 1 319.449 3.540 20 5 DHBDMO CC(C)c1ccc(CNCC[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000604532804 1039496302 /nfs/dbraw/zinc/49/63/02/1039496302.db2.gz KXRFOENBUFAGJO-OAHLLOKOSA-N 1 1 319.449 3.540 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2c2ccccc2)c1 ZINC000058932562 1039633110 /nfs/dbraw/zinc/63/31/10/1039633110.db2.gz FYDAIYBKVQJBDZ-GOSISDBHSA-N 1 1 312.369 3.811 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CC(Cc3ccccc3)C2)c1 ZINC000761060558 1039761363 /nfs/dbraw/zinc/76/13/63/1039761363.db2.gz LKAHMCDGTQAKBY-UHFFFAOYSA-N 1 1 316.788 3.923 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1c(C)noc1C ZINC000595008383 1040021015 /nfs/dbraw/zinc/02/10/15/1040021015.db2.gz OISLSHXWZMBNJA-ZJUUUORDSA-N 1 1 319.361 3.620 20 5 DHBDMO CCC[C@@H]([NH2+][C@@H](C)c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000595109951 1040070354 /nfs/dbraw/zinc/07/03/54/1040070354.db2.gz XPFLCZSXVMPHTD-SWLSCSKDSA-N 1 1 302.378 3.520 20 5 DHBDMO C[C@H](N[C@H]1CC[N@H+](C2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000595078770 1040071820 /nfs/dbraw/zinc/07/18/20/1040071820.db2.gz ATVWWVAOXSQJDT-HOCLYGCPSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCN(C2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000595078770 1040071834 /nfs/dbraw/zinc/07/18/34/1040071834.db2.gz ATVWWVAOXSQJDT-HOCLYGCPSA-N 1 1 317.433 3.652 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@H]2c2ccc(C)c(C)c2)c1[N+](=O)[O-] ZINC000595295281 1040090826 /nfs/dbraw/zinc/09/08/26/1040090826.db2.gz WWVKBKSKWPLQST-HNNXBMFYSA-N 1 1 315.373 3.845 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2c2ccc(C)c(C)c2)c1[N+](=O)[O-] ZINC000595295281 1040090844 /nfs/dbraw/zinc/09/08/44/1040090844.db2.gz WWVKBKSKWPLQST-HNNXBMFYSA-N 1 1 315.373 3.845 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](Cc1cccs1)C1CC1 ZINC000595286572 1040096314 /nfs/dbraw/zinc/09/63/14/1040096314.db2.gz IARAHBCWBNTOPJ-UHFFFAOYSA-N 1 1 306.362 3.960 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](Cc1cccs1)C1CC1 ZINC000595286572 1040096333 /nfs/dbraw/zinc/09/63/33/1040096333.db2.gz IARAHBCWBNTOPJ-UHFFFAOYSA-N 1 1 306.362 3.960 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCc2sccc2C1 ZINC000595310674 1040105467 /nfs/dbraw/zinc/10/54/67/1040105467.db2.gz CQTOURPUKZKOON-UHFFFAOYSA-N 1 1 306.362 3.744 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCc2sccc2C1 ZINC000595310674 1040105474 /nfs/dbraw/zinc/10/54/74/1040105474.db2.gz CQTOURPUKZKOON-UHFFFAOYSA-N 1 1 306.362 3.744 20 5 DHBDMO Cc1cccnc1[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])C(C)C ZINC000595373207 1040126164 /nfs/dbraw/zinc/12/61/64/1040126164.db2.gz YLGGVXZXJINWSJ-MRXNPFEDSA-N 1 1 317.364 3.924 20 5 DHBDMO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595423550 1040132499 /nfs/dbraw/zinc/13/24/99/1040132499.db2.gz ALENEUNLIVJWDA-LLVKDONJSA-N 1 1 303.337 3.542 20 5 DHBDMO CC[C@H](C[N@@H+](CC)Cc1onc(C)c1[N+](=O)[O-])c1ccccc1 ZINC000595448153 1040142173 /nfs/dbraw/zinc/14/21/73/1040142173.db2.gz JQIQTMKHPFREQC-CQSZACIVSA-N 1 1 317.389 3.907 20 5 DHBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595469126 1040146657 /nfs/dbraw/zinc/14/66/57/1040146657.db2.gz MUPZTFFMMGGRFX-KWQFWETISA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595469126 1040146663 /nfs/dbraw/zinc/14/66/63/1040146663.db2.gz MUPZTFFMMGGRFX-KWQFWETISA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC000595822384 1040247968 /nfs/dbraw/zinc/24/79/68/1040247968.db2.gz SJSNPSYZIHMFFV-CYBMUJFWSA-N 1 1 316.401 3.547 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC000595822384 1040247977 /nfs/dbraw/zinc/24/79/77/1040247977.db2.gz SJSNPSYZIHMFFV-CYBMUJFWSA-N 1 1 316.401 3.547 20 5 DHBDMO Cc1cc(NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c(F)cc1[N+](=O)[O-] ZINC000596307321 1040375731 /nfs/dbraw/zinc/37/57/31/1040375731.db2.gz KNSXBSBEZGCVSA-LBPRGKRZSA-N 1 1 309.385 3.575 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C(C)C)no2)cc1[N+](=O)[O-] ZINC000169238173 1040387631 /nfs/dbraw/zinc/38/76/31/1040387631.db2.gz BCVLSSXUVJBPNR-GFCCVEGCSA-N 1 1 303.362 3.865 20 5 DHBDMO C[C@@H](C[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000608976677 1040656483 /nfs/dbraw/zinc/65/64/83/1040656483.db2.gz GTCGJGGUXCGQFW-HNNXBMFYSA-N 1 1 314.385 3.709 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000534331860 1040807409 /nfs/dbraw/zinc/80/74/09/1040807409.db2.gz AZGVTRZSXPUFEC-MOTZXUDYSA-N 1 1 309.369 3.840 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(C(F)F)nc1 ZINC000602657381 1041144672 /nfs/dbraw/zinc/14/46/72/1041144672.db2.gz FXCBRLRIRSAAQJ-UHFFFAOYSA-N 1 1 321.327 3.602 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC4(CCC4)[C@H]3C3CC3)nc2c1 ZINC000602667241 1041149131 /nfs/dbraw/zinc/14/91/31/1041149131.db2.gz OXOVEASWAFRPQR-MRXNPFEDSA-N 1 1 313.357 3.501 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC4(CCC4)[C@H]3C3CC3)nc2c1 ZINC000602667241 1041149137 /nfs/dbraw/zinc/14/91/37/1041149137.db2.gz OXOVEASWAFRPQR-MRXNPFEDSA-N 1 1 313.357 3.501 20 5 DHBDMO Cc1scc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1C ZINC000602732269 1041185588 /nfs/dbraw/zinc/18/55/88/1041185588.db2.gz GEJHNUSMDOMODL-UHFFFAOYSA-N 1 1 317.370 3.704 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cc2cnccc2o1)C1CC1 ZINC000593567327 1041340301 /nfs/dbraw/zinc/34/03/01/1041340301.db2.gz QDJYIUIXHWLHLT-UHFFFAOYSA-N 1 1 323.352 3.901 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cc2cnccc2o1)C1CC1 ZINC000593567327 1041340310 /nfs/dbraw/zinc/34/03/10/1041340310.db2.gz QDJYIUIXHWLHLT-UHFFFAOYSA-N 1 1 323.352 3.901 20 5 DHBDMO CC[N@H+](Cc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083128698 185213576 /nfs/dbraw/zinc/21/35/76/185213576.db2.gz YBZZNESGTZHSMW-UHFFFAOYSA-N 1 1 317.370 3.820 20 5 DHBDMO CC[N@@H+](Cc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083128698 185213577 /nfs/dbraw/zinc/21/35/77/185213577.db2.gz YBZZNESGTZHSMW-UHFFFAOYSA-N 1 1 317.370 3.820 20 5 DHBDMO CC1(C)CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104694719 194027651 /nfs/dbraw/zinc/02/76/51/194027651.db2.gz FCYOMSCXLNESHN-UHFFFAOYSA-N 1 1 315.373 3.667 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3cccc(F)c3)CC2)c(F)c1 ZINC000271755388 129957086 /nfs/dbraw/zinc/95/70/86/129957086.db2.gz GRCHTNKLHSTAOF-UHFFFAOYSA-N 1 1 304.296 3.652 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000293163446 131713491 /nfs/dbraw/zinc/71/34/91/131713491.db2.gz FUJIBZXRMASYNQ-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@](F)(c3ccccc3)C2)cc1 ZINC000563861022 335068361 /nfs/dbraw/zinc/06/83/61/335068361.db2.gz BQVZNQQWVDOXOO-GOSISDBHSA-N 1 1 314.360 3.708 20 5 DHBDMO COC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000530968305 331715705 /nfs/dbraw/zinc/71/57/05/331715705.db2.gz IFRKUSFQSBVQIR-MRXNPFEDSA-N 1 1 318.348 3.520 20 5 DHBDMO Cc1cccc(CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)n1 ZINC000569599562 332192420 /nfs/dbraw/zinc/19/24/20/332192420.db2.gz CMFUAIRXCVKHKH-UHFFFAOYSA-N 1 1 311.385 3.505 20 5 DHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000559431923 332258571 /nfs/dbraw/zinc/25/85/71/332258571.db2.gz MHKLYXURHBLFSG-KBPBESRZSA-N 1 1 304.390 3.614 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH+]2CC(Cc3ccc(F)c(F)c3)C2)c1 ZINC000559993544 332300308 /nfs/dbraw/zinc/30/03/08/332300308.db2.gz WPNRRYPPPHSGQQ-UHFFFAOYSA-N 1 1 318.323 3.548 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C[C@@H]3CCSC3)C2)cc1 ZINC000449495442 332308103 /nfs/dbraw/zinc/30/81/03/332308103.db2.gz DHVCOTQJOBMSBY-ZFWWWQNUSA-N 1 1 306.431 3.527 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C(C)(C)c1ccccc1F ZINC000292081915 334184224 /nfs/dbraw/zinc/18/42/24/334184224.db2.gz FWXULBIFBRRVCB-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000301073685 336288480 /nfs/dbraw/zinc/28/84/80/336288480.db2.gz BBNAFQJYCTWFOQ-UHFFFAOYSA-N 1 1 313.401 3.967 20 5 DHBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])cc2F)C1 ZINC000301091066 336289486 /nfs/dbraw/zinc/28/94/86/336289486.db2.gz LCDNJDAJLLQEOX-ZDUSSCGKSA-N 1 1 309.385 3.658 20 5 DHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C3CCCC3)C2)c(Cl)c1 ZINC000301183404 336293763 /nfs/dbraw/zinc/29/37/63/336293763.db2.gz IWMKDWVZVCPMOS-LLVKDONJSA-N 1 1 309.797 3.677 20 5 DHBDMO O=[N+]([O-])c1ccsc1N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000301978222 336341099 /nfs/dbraw/zinc/34/10/99/336341099.db2.gz DYHJPVJOJXWFHZ-CQSZACIVSA-N 1 1 317.414 3.733 20 5 DHBDMO C[C@H](Nc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302052747 336345644 /nfs/dbraw/zinc/34/56/44/336345644.db2.gz OYLSVPROBGKCFC-STQMWFEESA-N 1 1 321.396 3.799 20 5 DHBDMO Cc1cc(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000302058281 336346118 /nfs/dbraw/zinc/34/61/18/336346118.db2.gz RMHVQGVPKOCZMR-LSDHHAIUSA-N 1 1 317.433 3.968 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCc3c(O)cccc32)c(F)c1 ZINC000359807650 336688178 /nfs/dbraw/zinc/68/81/78/336688178.db2.gz UXCZJLCCKRRZQP-INIZCTEOSA-N 1 1 316.332 3.607 20 5 DHBDMO CCC[C@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000361971893 336780600 /nfs/dbraw/zinc/78/06/00/336780600.db2.gz NWTDHFHPPIUYJL-JZXOWHBKSA-N 1 1 319.449 3.898 20 5 DHBDMO CCC[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000361971886 336780607 /nfs/dbraw/zinc/78/06/07/336780607.db2.gz NWTDHFHPPIUYJL-BQFCYCMXSA-N 1 1 319.449 3.898 20 5 DHBDMO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000376551863 337036653 /nfs/dbraw/zinc/03/66/53/337036653.db2.gz JFDQXWPSCWOEPG-YVEFUNNKSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000376551863 337036654 /nfs/dbraw/zinc/03/66/54/337036654.db2.gz JFDQXWPSCWOEPG-YVEFUNNKSA-N 1 1 315.348 3.712 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1sc(C)nc1C ZINC000194385499 338519381 /nfs/dbraw/zinc/51/93/81/338519381.db2.gz VRVOJJYLHPMUMI-VIFPVBQESA-N 1 1 321.402 3.528 20 5 DHBDMO Cc1c(C[NH2+][C@H](C)c2ccncc2Cl)cccc1[N+](=O)[O-] ZINC000421835650 337652147 /nfs/dbraw/zinc/65/21/47/337652147.db2.gz FKOQZSVLRFEKGV-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO C[NH2+]CCCN[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423207652 337704010 /nfs/dbraw/zinc/70/40/10/337704010.db2.gz XYWLYWQCUXZAJW-GFCCVEGCSA-N 1 1 319.430 3.583 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H]4CCC[C@@H]43)co2)cc1 ZINC000426473124 338033172 /nfs/dbraw/zinc/03/31/72/338033172.db2.gz QNAQDRQHPIIIJQ-WBMJQRKESA-N 1 1 313.357 3.624 20 5 DHBDMO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H](C)CO ZINC000430084754 338095388 /nfs/dbraw/zinc/09/53/88/338095388.db2.gz LVMBRZLNHKMRFX-GFCCVEGCSA-N 1 1 320.414 3.526 20 5 DHBDMO COCC(C)(C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000430143097 338098997 /nfs/dbraw/zinc/09/89/97/338098997.db2.gz WQSSWIYGLCWVCX-UHFFFAOYSA-N 1 1 318.373 3.712 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430232221 338102345 /nfs/dbraw/zinc/10/23/45/338102345.db2.gz FWGQEWVMCGWENA-UKRRQHHQSA-N 1 1 324.446 3.709 20 5 DHBDMO O=[N+]([O-])c1cc(CNC[C@@H]2CCC[N@H+]2C2CCCCC2)cs1 ZINC000435726556 338246358 /nfs/dbraw/zinc/24/63/58/338246358.db2.gz QTCGQJWWPVXLSO-HNNXBMFYSA-N 1 1 323.462 3.543 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000439288465 338366069 /nfs/dbraw/zinc/36/60/69/338366069.db2.gz VDMXYOYDVMYNBZ-INIZCTEOSA-N 1 1 324.808 3.639 20 5 DHBDMO CSCCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000439480098 338371140 /nfs/dbraw/zinc/37/11/40/338371140.db2.gz WUOKDRSVHAELIQ-UHFFFAOYSA-N 1 1 312.435 3.567 20 5 DHBDMO CC(C)OC1CC([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000459524961 339034116 /nfs/dbraw/zinc/03/41/16/339034116.db2.gz XANUNLYLRGTSFI-FAEJEUNOSA-N 1 1 318.417 3.730 20 5 DHBDMO C[C@H](C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000459785317 339048494 /nfs/dbraw/zinc/04/84/94/339048494.db2.gz ARKWXSHHWSNXTI-OLZOCXBDSA-N 1 1 322.405 3.565 20 5 DHBDMO CN(CC[C@@H]1CCCC[N@H+]1C)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000463075105 339104397 /nfs/dbraw/zinc/10/43/97/339104397.db2.gz WWJBFRRUNCTWAB-ZDUSSCGKSA-N 1 1 311.813 3.559 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1C[C@H]1c1ccccc1)CC2 ZINC000463086594 339105309 /nfs/dbraw/zinc/10/53/09/339105309.db2.gz IKIBCHOMUBJWHX-HKUYNNGSSA-N 1 1 308.381 3.757 20 5 DHBDMO Cc1ccc(F)c(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000466463856 339206147 /nfs/dbraw/zinc/20/61/47/339206147.db2.gz KGSLQYIWKLTHLT-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO C[C@H]([NH2+]CCN1[C@H](C)CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000467857773 339247752 /nfs/dbraw/zinc/24/77/52/339247752.db2.gz BSDSPJYRFKJDKU-KFWWJZLASA-N 1 1 305.422 3.508 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](OCC(C)C)C1 ZINC000470184664 339313334 /nfs/dbraw/zinc/31/33/34/339313334.db2.gz SUFOFGUUVUGPAH-IKFRKZOMSA-N 1 1 318.417 3.745 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOCC2(CCC2)C1 ZINC000470206047 339314356 /nfs/dbraw/zinc/31/43/56/339314356.db2.gz HRFSDXGIHMGFGD-XNTDXEJSSA-N 1 1 316.401 3.501 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000470931338 339331436 /nfs/dbraw/zinc/33/14/36/339331436.db2.gz NJLYBHNUIPOGAL-LDYMZIIASA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000470931338 339331437 /nfs/dbraw/zinc/33/14/37/339331437.db2.gz NJLYBHNUIPOGAL-LDYMZIIASA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000470949214 339332307 /nfs/dbraw/zinc/33/23/07/339332307.db2.gz WBPZSNDJOSTFHS-GBIKHYSHSA-N 1 1 302.296 3.929 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000470949216 339332466 /nfs/dbraw/zinc/33/24/66/339332466.db2.gz WBPZSNDJOSTFHS-GIPNMCIBSA-N 1 1 302.296 3.929 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)C1CCCCC1 ZINC000473736238 339391082 /nfs/dbraw/zinc/39/10/82/339391082.db2.gz PBSQPVWEXQZQBX-SFHVURJKSA-N 1 1 320.433 3.746 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)CC1CCCC1 ZINC000473733448 339391093 /nfs/dbraw/zinc/39/10/93/339391093.db2.gz IFOUHIQXPJTDMH-GOSISDBHSA-N 1 1 320.433 3.746 20 5 DHBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000505608363 340172760 /nfs/dbraw/zinc/17/27/60/340172760.db2.gz LAKQYZSDNGLSIT-VXGBXAGGSA-N 1 1 311.813 3.781 20 5 DHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000505636361 340173783 /nfs/dbraw/zinc/17/37/83/340173783.db2.gz QHMGAULMDNFCHT-YVMONPNESA-N 1 1 300.333 3.879 20 5 DHBDMO COC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000537984376 340795648 /nfs/dbraw/zinc/79/56/48/340795648.db2.gz SITNTKUSQKBYFY-SJCJKPOMSA-N 1 1 318.348 3.772 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCSC1 ZINC000130531021 341026692 /nfs/dbraw/zinc/02/66/92/341026692.db2.gz PMIFKISZZHYTCW-AWEZNQCLSA-N 1 1 318.398 3.792 20 5 DHBDMO COc1cccc2c1CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000543105618 341032214 /nfs/dbraw/zinc/03/22/14/341032214.db2.gz KQDPDOVDXAIIRO-VMPITWQZSA-N 1 1 324.380 3.675 20 5 DHBDMO COc1cccc2c1CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000543105618 341032215 /nfs/dbraw/zinc/03/22/15/341032215.db2.gz KQDPDOVDXAIIRO-VMPITWQZSA-N 1 1 324.380 3.675 20 5 DHBDMO C[C@@H]1CCC[C@H](CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000543481239 341046627 /nfs/dbraw/zinc/04/66/27/341046627.db2.gz SHHUHDRNERMLNJ-ZIAGYGMSSA-N 1 1 303.406 3.564 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000075831257 341185058 /nfs/dbraw/zinc/18/50/58/341185058.db2.gz XGJJAERVWACGRZ-CQSZACIVSA-N 1 1 322.380 3.658 20 5 DHBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000549770658 341302748 /nfs/dbraw/zinc/30/27/48/341302748.db2.gz WAYNGOWQRFFIAK-UHFFFAOYSA-N 1 1 302.296 3.986 20 5 DHBDMO C[N@@H+](CCOc1cccc(Cl)c1)Cc1cccc([N+](=O)[O-])c1 ZINC000248010470 341372182 /nfs/dbraw/zinc/37/21/82/341372182.db2.gz BRWAAGVDBRVXGB-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCc2ccc(F)cc2C1 ZINC000552242550 341380650 /nfs/dbraw/zinc/38/06/50/341380650.db2.gz VDQKCMJTUVGUML-HWKANZROSA-N 1 1 312.344 3.805 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCc2ccc(F)cc2C1 ZINC000552242550 341380651 /nfs/dbraw/zinc/38/06/51/341380651.db2.gz VDQKCMJTUVGUML-HWKANZROSA-N 1 1 312.344 3.805 20 5 DHBDMO Cc1csc([C@H](C)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000565213454 341520252 /nfs/dbraw/zinc/52/02/52/341520252.db2.gz AOYWSMJCQMDXLR-GWCFXTLKSA-N 1 1 303.387 3.698 20 5 DHBDMO CCC(C)(C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000265204145 521304319 /nfs/dbraw/zinc/30/43/19/521304319.db2.gz KLUQFAQOCDDJND-UHFFFAOYSA-N 1 1 317.389 3.913 20 5 DHBDMO CN(C)c1ccccc1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000267858534 522290894 /nfs/dbraw/zinc/29/08/94/522290894.db2.gz FUGMFNDPLAFBEG-UHFFFAOYSA-N 1 1 319.792 3.604 20 5 DHBDMO COC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000156427858 522375324 /nfs/dbraw/zinc/37/53/24/522375324.db2.gz YLPSCAHZKKCAJP-DZGCQCFKSA-N 1 1 318.373 3.843 20 5 DHBDMO COC1CCC([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000265446624 522684608 /nfs/dbraw/zinc/68/46/08/522684608.db2.gz JMIMSOBJEZAZBJ-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000182126371 525734570 /nfs/dbraw/zinc/73/45/70/525734570.db2.gz SQNKLFLLELGZDV-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000266563106 526117882 /nfs/dbraw/zinc/11/78/82/526117882.db2.gz YMXGZKTYIDCWTF-MNOVXSKESA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000266563106 526117890 /nfs/dbraw/zinc/11/78/90/526117890.db2.gz YMXGZKTYIDCWTF-MNOVXSKESA-N 1 1 302.296 3.930 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccc(Cl)n2)C2CC2)cc1 ZINC000130866960 527349776 /nfs/dbraw/zinc/34/97/76/527349776.db2.gz WLDDTGPFRAMZCV-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(Cl)n2)C2CC2)cc1 ZINC000130866960 527349780 /nfs/dbraw/zinc/34/97/80/527349780.db2.gz WLDDTGPFRAMZCV-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO COCC[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000272389140 536809921 /nfs/dbraw/zinc/80/99/21/536809921.db2.gz CMQBMQGRQHWJGJ-TZMCWYRMSA-N 1 1 304.346 3.616 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)CCc2ccccn2)cc1[N+](=O)[O-] ZINC000120799965 1013342921 /nfs/dbraw/zinc/34/29/21/1013342921.db2.gz CXTGLXVBRUWYPG-UHFFFAOYSA-N 1 1 313.401 3.788 20 5 DHBDMO Cc1cccnc1[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000118839918 1013729761 /nfs/dbraw/zinc/72/97/61/1013729761.db2.gz GPTMWZUDEJBZOZ-MRXNPFEDSA-N 1 1 317.364 3.924 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)cc1[N+](=O)[O-] ZINC000109781000 1013749807 /nfs/dbraw/zinc/74/98/07/1013749807.db2.gz ZZRFKLSIFPORIY-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@@H](CCO)c2ccco2)cc1[N+](=O)[O-] ZINC000184510332 1013783714 /nfs/dbraw/zinc/78/37/14/1013783714.db2.gz GDFALFQTHDNVAK-HNNXBMFYSA-N 1 1 318.373 3.525 20 5 DHBDMO CC(C)[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC001167424527 1014257872 /nfs/dbraw/zinc/25/78/72/1014257872.db2.gz KZNILSSWQWIYDI-OAHLLOKOSA-N 1 1 306.406 3.732 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC(C)(C)[C@@H]1[C@@H]1CCCO1 ZINC000580802736 1014356199 /nfs/dbraw/zinc/35/61/99/1014356199.db2.gz OYXZRLTZQHDGRC-JQFCIGGWSA-N 1 1 318.417 3.854 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000610476369 1014544345 /nfs/dbraw/zinc/54/43/45/1014544345.db2.gz AYIPXIFYYSAREU-ZDUSSCGKSA-N 1 1 316.357 3.576 20 5 DHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000443069028 1014799289 /nfs/dbraw/zinc/79/92/89/1014799289.db2.gz ODUUIMRBRLJJDU-HIFRSBDPSA-N 1 1 306.406 3.718 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CC[C@H]2c2cccc(F)c2)cc1 ZINC000610504859 1014817430 /nfs/dbraw/zinc/81/74/30/1014817430.db2.gz CIGUUOWGSKTIHG-KRWDZBQOSA-N 1 1 316.332 3.560 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H]2c2cccc(F)c2)cc1 ZINC000610504859 1014817446 /nfs/dbraw/zinc/81/74/46/1014817446.db2.gz CIGUUOWGSKTIHG-KRWDZBQOSA-N 1 1 316.332 3.560 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@H]2c2cccc(F)c2)c1 ZINC000610505321 1014810365 /nfs/dbraw/zinc/81/03/65/1014810365.db2.gz GXLYOFGKXCCKNT-KRWDZBQOSA-N 1 1 316.332 3.560 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H]2c2cccc(F)c2)c1 ZINC000610505321 1014810376 /nfs/dbraw/zinc/81/03/76/1014810376.db2.gz GXLYOFGKXCCKNT-KRWDZBQOSA-N 1 1 316.332 3.560 20 5 DHBDMO Cc1c(C[N@@H+]2CC[C@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000610505389 1014811093 /nfs/dbraw/zinc/81/10/93/1014811093.db2.gz JYCZIXGNKVCENU-KRWDZBQOSA-N 1 1 300.333 3.989 20 5 DHBDMO Cc1c(C[N@H+]2CC[C@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000610505389 1014811104 /nfs/dbraw/zinc/81/11/04/1014811104.db2.gz JYCZIXGNKVCENU-KRWDZBQOSA-N 1 1 300.333 3.989 20 5 DHBDMO Cc1c(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000443326380 1014872549 /nfs/dbraw/zinc/87/25/49/1014872549.db2.gz BLLXKBFDUHMAIN-UHFFFAOYSA-N 1 1 318.417 3.827 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccc3ncccc3c1)C2 ZINC000126971260 1015034427 /nfs/dbraw/zinc/03/44/27/1015034427.db2.gz DROONYADMZUZBB-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccc3ncccc3c1)C2 ZINC000126971260 1015034437 /nfs/dbraw/zinc/03/44/37/1015034437.db2.gz DROONYADMZUZBB-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])s2)CC1 ZINC000610515114 1015065649 /nfs/dbraw/zinc/06/56/49/1015065649.db2.gz NRWWKXGZKYXEOL-UHFFFAOYSA-N 1 1 311.451 3.605 20 5 DHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000185644535 1015606480 /nfs/dbraw/zinc/60/64/80/1015606480.db2.gz VJKYQOQMLLSHCO-LRDDRELGSA-N 1 1 315.373 3.870 20 5 DHBDMO C[C@H](c1cccs1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581164 1015629061 /nfs/dbraw/zinc/62/90/61/1015629061.db2.gz HMIIJSBZFGNOLT-SNVBAGLBSA-N 1 1 317.370 3.991 20 5 DHBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581164 1015629065 /nfs/dbraw/zinc/62/90/65/1015629065.db2.gz HMIIJSBZFGNOLT-SNVBAGLBSA-N 1 1 317.370 3.991 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3C3CCCC3)nc2c1 ZINC000610581218 1015629714 /nfs/dbraw/zinc/62/97/14/1015629714.db2.gz NONPHSWTVAHYJI-OAHLLOKOSA-N 1 1 315.373 3.891 20 5 DHBDMO CC1CCC([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000610580767 1015629865 /nfs/dbraw/zinc/62/98/65/1015629865.db2.gz GGEOIQBLICIDKE-UHFFFAOYSA-N 1 1 303.362 3.747 20 5 DHBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])s2)C[N@H+]1Cc1ccccc1 ZINC000610709510 1015729714 /nfs/dbraw/zinc/72/97/14/1015729714.db2.gz VDWRHFMMYWTTLC-GXTWGEPZSA-N 1 1 317.414 3.731 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2c(F)cccc2[N+](=O)[O-])c1 ZINC000341839319 1015763915 /nfs/dbraw/zinc/76/39/15/1015763915.db2.gz GCFFLWBRIXQJAI-UHFFFAOYSA-N 1 1 317.364 3.798 20 5 DHBDMO CC[C@H](NCC1([NH+](C)C)CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000320228988 1015850370 /nfs/dbraw/zinc/85/03/70/1015850370.db2.gz WNBCLLFYOJLFFK-KRWDZBQOSA-N 1 1 319.449 3.900 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1nc(C)cs1)c1cccc([N+](=O)[O-])c1 ZINC000038090887 1015961003 /nfs/dbraw/zinc/96/10/03/1015961003.db2.gz AFVKLPRIEHEPOG-CQSZACIVSA-N 1 1 305.403 3.991 20 5 DHBDMO C[C@H]1c2ccsc2CC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000065209048 1015971230 /nfs/dbraw/zinc/97/12/30/1015971230.db2.gz XGYBHJNHWVKIJR-LBPRGKRZSA-N 1 1 318.398 3.654 20 5 DHBDMO C[C@H](c1ccccc1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000065208892 1015971316 /nfs/dbraw/zinc/97/13/16/1015971316.db2.gz MCIYCXLABPRVMC-CQSZACIVSA-N 1 1 300.358 3.667 20 5 DHBDMO C[C@@H]([NH2+]C[C@@]1(N(C)C)CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000320290607 1016077867 /nfs/dbraw/zinc/07/78/67/1016077867.db2.gz YOUKQHJLCQKCGT-IIDMSEBBSA-N 1 1 319.449 3.756 20 5 DHBDMO CCC[C@H](N[C@H](C)C[N@@H+](C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000320343926 1016102574 /nfs/dbraw/zinc/10/25/74/1016102574.db2.gz JSNSAPAWDDDAPL-PBHICJAKSA-N 1 1 307.438 3.754 20 5 DHBDMO CCC[C@H]([NH2+][C@H](C)CN(C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000320343926 1016102578 /nfs/dbraw/zinc/10/25/78/1016102578.db2.gz JSNSAPAWDDDAPL-PBHICJAKSA-N 1 1 307.438 3.754 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2ccccc2)C2CC2)cc1 ZINC000065532974 1016213309 /nfs/dbraw/zinc/21/33/09/1016213309.db2.gz FDWGAGCTJGTPMW-UHFFFAOYSA-N 1 1 312.369 3.638 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000076416455 1016461237 /nfs/dbraw/zinc/46/12/37/1016461237.db2.gz XIRVZHIVXIVFJR-CYBMUJFWSA-N 1 1 322.405 3.710 20 5 DHBDMO Cc1nn(C(C)C)cc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000281472914 1016533482 /nfs/dbraw/zinc/53/34/82/1016533482.db2.gz UWOZAIUUZCMPGI-CYBMUJFWSA-N 1 1 302.378 3.531 20 5 DHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCc2ccccc21 ZINC000347141938 1016756203 /nfs/dbraw/zinc/75/62/03/1016756203.db2.gz ICJSPZPIDITPTE-QGZVFWFLSA-N 1 1 322.368 3.590 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCc2ccccc21 ZINC000347141938 1016756215 /nfs/dbraw/zinc/75/62/15/1016756215.db2.gz ICJSPZPIDITPTE-QGZVFWFLSA-N 1 1 322.368 3.590 20 5 DHBDMO Cc1c([C@H](C)NCC(C)(C)[NH+]2CCCCC2)cccc1[N+](=O)[O-] ZINC000479857103 1017103334 /nfs/dbraw/zinc/10/33/34/1017103334.db2.gz ARFKKQWXPGHDAA-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H]1CCCC(F)(F)C1)CC2 ZINC000514080842 1012262684 /nfs/dbraw/zinc/26/26/84/1012262684.db2.gz YCOTULSVUOYAMI-LBPRGKRZSA-N 1 1 310.344 3.778 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000515184685 1012570824 /nfs/dbraw/zinc/57/08/24/1012570824.db2.gz IJPCXCGUVFJWTL-GDBMZVCRSA-N 1 1 318.417 3.713 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000515190867 1012575197 /nfs/dbraw/zinc/57/51/97/1012575197.db2.gz PEWMJFIKTBMAHR-CABCVRRESA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000515190867 1012575207 /nfs/dbraw/zinc/57/52/07/1012575207.db2.gz PEWMJFIKTBMAHR-CABCVRRESA-N 1 1 307.438 3.674 20 5 DHBDMO CC[C@H](C)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425416237 1012617714 /nfs/dbraw/zinc/61/77/14/1012617714.db2.gz KYOOEOGINMLUEB-VIFPVBQESA-N 1 1 301.184 3.588 20 5 DHBDMO Cc1ccccc1OCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000515550912 1012658559 /nfs/dbraw/zinc/65/85/59/1012658559.db2.gz WWLYQSPNTTZMOO-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO Cc1noc(C)c1CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000339645711 1012729230 /nfs/dbraw/zinc/72/92/30/1012729230.db2.gz JRCKHYFHQIHYQX-UHFFFAOYSA-N 1 1 317.389 3.653 20 5 DHBDMO COCc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000154461904 1012731104 /nfs/dbraw/zinc/73/11/04/1012731104.db2.gz PEAZRODJKSWYFQ-UHFFFAOYSA-N 1 1 318.373 3.745 20 5 DHBDMO CC(C)c1ccc(C[NH+]2CC3(CCC3(F)F)C2)cc1[N+](=O)[O-] ZINC000562213016 1017205706 /nfs/dbraw/zinc/20/57/06/1017205706.db2.gz BDXQTQVEDBQANX-UHFFFAOYSA-N 1 1 310.344 3.949 20 5 DHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444652758 1017606399 /nfs/dbraw/zinc/60/63/99/1017606399.db2.gz KCDVPQGGMZGSOM-MLGOLLRUSA-N 1 1 316.405 3.872 20 5 DHBDMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444652725 1017606417 /nfs/dbraw/zinc/60/64/17/1017606417.db2.gz JYSWVYFZIHFVSJ-ZDUSSCGKSA-N 1 1 316.405 3.872 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC2(CCC2(F)F)C1 ZINC000573146031 1018118515 /nfs/dbraw/zinc/11/85/15/1018118515.db2.gz HHBNJSZWKSFLSN-GHXNOFRVSA-N 1 1 308.328 3.729 20 5 DHBDMO COc1ccc(-c2ccc(C[N@@H+]3[C@H](C)C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000527238455 1018535777 /nfs/dbraw/zinc/53/57/77/1018535777.db2.gz DIWQGKXSTJJHHJ-TXEJJXNPSA-N 1 1 316.357 3.846 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000706480078 1018718288 /nfs/dbraw/zinc/71/82/88/1018718288.db2.gz YTIPVSFYBDKNSD-AOOOYVTPSA-N 1 1 313.195 3.730 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000706480078 1018718294 /nfs/dbraw/zinc/71/82/94/1018718294.db2.gz YTIPVSFYBDKNSD-AOOOYVTPSA-N 1 1 313.195 3.730 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCC2(CCCC2)O1 ZINC000584104264 1018956139 /nfs/dbraw/zinc/95/61/39/1018956139.db2.gz FVVPJEFIFLMPTK-MRXNPFEDSA-N 1 1 318.417 3.561 20 5 DHBDMO CC[C@H](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2 ZINC001168695087 1019101214 /nfs/dbraw/zinc/10/12/14/1019101214.db2.gz SSSQQGQWBSWMEX-STQMWFEESA-N 1 1 305.422 3.819 20 5 DHBDMO CC[C@H](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2 ZINC001168695087 1019101216 /nfs/dbraw/zinc/10/12/16/1019101216.db2.gz SSSQQGQWBSWMEX-STQMWFEESA-N 1 1 305.422 3.819 20 5 DHBDMO CC[C@@H](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2 ZINC001168695079 1019101903 /nfs/dbraw/zinc/10/19/03/1019101903.db2.gz SSSQQGQWBSWMEX-OLZOCXBDSA-N 1 1 305.422 3.819 20 5 DHBDMO CC[C@@H](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2 ZINC001168695079 1019101912 /nfs/dbraw/zinc/10/19/12/1019101912.db2.gz SSSQQGQWBSWMEX-OLZOCXBDSA-N 1 1 305.422 3.819 20 5 DHBDMO COc1ccc(C[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000080962628 1019133295 /nfs/dbraw/zinc/13/32/95/1019133295.db2.gz HSRBIHBEDFWTFY-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000080962628 1019133303 /nfs/dbraw/zinc/13/33/03/1019133303.db2.gz HSRBIHBEDFWTFY-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO Cc1ccccc1C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083127955 1019257153 /nfs/dbraw/zinc/25/71/53/1019257153.db2.gz OHIVEUGDKYUUCC-UHFFFAOYSA-N 1 1 311.341 3.676 20 5 DHBDMO Cc1ccccc1C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083127955 1019257160 /nfs/dbraw/zinc/25/71/60/1019257160.db2.gz OHIVEUGDKYUUCC-UHFFFAOYSA-N 1 1 311.341 3.676 20 5 DHBDMO CC(C)(C)OCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000611211312 1019410836 /nfs/dbraw/zinc/41/08/36/1019410836.db2.gz CMAQBGONEHUYAT-UHFFFAOYSA-N 1 1 306.406 3.764 20 5 DHBDMO CC(C)CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000611254175 1019422227 /nfs/dbraw/zinc/42/22/27/1019422227.db2.gz DGJPOETZJPBRCP-UHFFFAOYSA-N 1 1 302.321 3.674 20 5 DHBDMO CC[N@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C[C@@H]1CCOC1 ZINC000611256775 1019424355 /nfs/dbraw/zinc/42/43/55/1019424355.db2.gz YIJINCIRTFSABV-HNNXBMFYSA-N 1 1 306.406 3.577 20 5 DHBDMO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCC(F)(F)F ZINC000611266881 1019427512 /nfs/dbraw/zinc/42/75/12/1019427512.db2.gz HPCCAQAAYMTLED-ALCCZGGFSA-N 1 1 302.296 3.882 20 5 DHBDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000611554733 1019515199 /nfs/dbraw/zinc/51/51/99/1019515199.db2.gz XEZLUECIXDSFET-JQWIXIFHSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000611554733 1019515202 /nfs/dbraw/zinc/51/52/02/1019515202.db2.gz XEZLUECIXDSFET-JQWIXIFHSA-N 1 1 302.296 3.758 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000552940711 1019610075 /nfs/dbraw/zinc/61/00/75/1019610075.db2.gz HDINYUUGGXUPIK-UHFFFAOYSA-N 1 1 323.412 3.682 20 5 DHBDMO CCCCC[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000750092031 1019718190 /nfs/dbraw/zinc/71/81/90/1019718190.db2.gz LYUZTLYUODIDIQ-WBVHZDCISA-N 1 1 306.406 3.673 20 5 DHBDMO Cc1ccncc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000611939553 1019906333 /nfs/dbraw/zinc/90/63/33/1019906333.db2.gz RJUYTJKZXTUDHY-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@@H](Nc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000553184238 1020217937 /nfs/dbraw/zinc/21/79/37/1020217937.db2.gz ADWKBELWAFWDBU-CHWSQXEVSA-N 1 1 321.396 3.799 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000330711155 1020240001 /nfs/dbraw/zinc/24/00/01/1020240001.db2.gz PSEHKBWKZBGJJS-HOCLYGCPSA-N 1 1 318.417 3.713 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCCc2scnc21)c1ccc([N+](=O)[O-])cc1 ZINC000858420372 1032886482 /nfs/dbraw/zinc/88/64/82/1032886482.db2.gz BWBGYMHOYGZIHU-GXFFZTMASA-N 1 1 303.387 3.780 20 5 DHBDMO CC1(C)CCC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000732980005 1020310118 /nfs/dbraw/zinc/31/01/18/1020310118.db2.gz PVJBVOYOEWUUOB-UHFFFAOYSA-N 1 1 321.402 3.951 20 5 DHBDMO CC1(C)CCC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000732980005 1020310129 /nfs/dbraw/zinc/31/01/29/1020310129.db2.gz PVJBVOYOEWUUOB-UHFFFAOYSA-N 1 1 321.402 3.951 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c1 ZINC000281038454 1020322302 /nfs/dbraw/zinc/32/23/02/1020322302.db2.gz PWEAWKPTHJLBPH-KSZLIROESA-N 1 1 318.417 3.500 20 5 DHBDMO Cc1ncsc1CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000172528807 1020404935 /nfs/dbraw/zinc/40/49/35/1020404935.db2.gz YDPQYZDCLMSAHK-UHFFFAOYSA-N 1 1 319.430 3.813 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000179680380 1020429998 /nfs/dbraw/zinc/42/99/98/1020429998.db2.gz LVANXZMYOYQGRQ-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO C[C@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC[C@@H]1C ZINC000123100198 1020510131 /nfs/dbraw/zinc/51/01/31/1020510131.db2.gz PEJYWBCYMGZTIS-STQMWFEESA-N 1 1 315.373 3.728 20 5 DHBDMO CC[C@@H](N[C@@H]1CC[N@@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000153770479 1020581479 /nfs/dbraw/zinc/58/14/79/1020581479.db2.gz FCJIZHJQKLZKMY-CRAIPNDOSA-N 1 1 317.433 3.652 20 5 DHBDMO CC[C@@H](N[C@@H]1CC[N@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000153770479 1020581485 /nfs/dbraw/zinc/58/14/85/1020581485.db2.gz FCJIZHJQKLZKMY-CRAIPNDOSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1sccc1[N+](=O)[O-] ZINC000613184893 1020845595 /nfs/dbraw/zinc/84/55/95/1020845595.db2.gz SKIGMMJKWRUZNB-GXTWGEPZSA-N 1 1 317.414 3.589 20 5 DHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000738052042 1020859145 /nfs/dbraw/zinc/85/91/45/1020859145.db2.gz BWTUXHQVBYZTPL-CJNGLKHVSA-N 1 1 316.405 3.803 20 5 DHBDMO Cc1cccc(F)c1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000742380777 1021108700 /nfs/dbraw/zinc/10/87/00/1021108700.db2.gz KVJIZGQEJDPLJF-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2ccsc2)cc1 ZINC000776273851 1021215600 /nfs/dbraw/zinc/21/56/00/1021215600.db2.gz AZCGGTHKQWXVTC-CVEARBPZSA-N 1 1 318.398 3.527 20 5 DHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776279134 1021231582 /nfs/dbraw/zinc/23/15/82/1021231582.db2.gz VPFUCQMFDKULDI-IAOVAPTHSA-N 1 1 306.406 3.529 20 5 DHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@H]3C3CCCC3)c2c1 ZINC000917619759 1021323146 /nfs/dbraw/zinc/32/31/46/1021323146.db2.gz MRGIEIVMPOYMTG-MRXNPFEDSA-N 1 1 314.389 3.557 20 5 DHBDMO CC(C)CC[C@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154470020 1021334687 /nfs/dbraw/zinc/33/46/87/1021334687.db2.gz CPQREOUOUPMZFX-WBVHZDCISA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)cc1[N+](=O)[O-] ZINC000069752536 1021345990 /nfs/dbraw/zinc/34/59/90/1021345990.db2.gz WDALJSFOSTYZCY-IUODEOHRSA-N 1 1 300.358 3.909 20 5 DHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])s2)[C@H]1c1ccccc1 ZINC000618679583 1021483620 /nfs/dbraw/zinc/48/36/20/1021483620.db2.gz VOFOSCJTMOMLFG-IUODEOHRSA-N 1 1 303.387 3.514 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H]2CCCC[N@H+]2C(C)C)cc1[N+](=O)[O-] ZINC000556124192 1021536000 /nfs/dbraw/zinc/53/60/00/1021536000.db2.gz YKEQQYMVVFWZIQ-RDJZCZTQSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H]2CCCC[N@@H+]2C(C)C)cc1[N+](=O)[O-] ZINC000556124192 1021536011 /nfs/dbraw/zinc/53/60/11/1021536011.db2.gz YKEQQYMVVFWZIQ-RDJZCZTQSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1cccc([N+](=O)[O-])c1N1CCC[C@@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000565532055 1021648308 /nfs/dbraw/zinc/64/83/08/1021648308.db2.gz NVJJANZSQUHADW-OWCLPIDISA-N 1 1 317.433 3.745 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](CC3CC3)C3CCC3)nc2c1 ZINC000619516995 1021783318 /nfs/dbraw/zinc/78/33/18/1021783318.db2.gz SRRCHUCQRBFVEP-UHFFFAOYSA-N 1 1 301.346 3.501 20 5 DHBDMO CCCC[N@@H+](Cn1nc(C)c([N+](=O)[O-])c1C)C1CCCCC1 ZINC000746044198 1021830742 /nfs/dbraw/zinc/83/07/42/1021830742.db2.gz KBGOJOCGYAJLLW-UHFFFAOYSA-N 1 1 308.426 3.800 20 5 DHBDMO CC[N@@H+](CCc1cccs1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746168920 1021887146 /nfs/dbraw/zinc/88/71/46/1021887146.db2.gz ZSWGRPOIWWCAKW-UHFFFAOYSA-N 1 1 308.378 3.860 20 5 DHBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccsc1 ZINC000619782859 1021897237 /nfs/dbraw/zinc/89/72/37/1021897237.db2.gz MEADGZWRQOLZRG-SECBINFHSA-N 1 1 303.343 3.648 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]2CF)o1 ZINC000556950130 1021967435 /nfs/dbraw/zinc/96/74/35/1021967435.db2.gz NMHQJZXDWFUGPJ-GFCCVEGCSA-N 1 1 304.321 3.789 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]2CF)o1 ZINC000556950130 1021967445 /nfs/dbraw/zinc/96/74/45/1021967445.db2.gz NMHQJZXDWFUGPJ-GFCCVEGCSA-N 1 1 304.321 3.789 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC1(Cl)Cl ZINC000920206117 1022077751 /nfs/dbraw/zinc/07/77/51/1022077751.db2.gz BTJVOSBQDKWHEJ-LBPRGKRZSA-N 1 1 317.216 3.999 20 5 DHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580129 1022099113 /nfs/dbraw/zinc/09/91/13/1022099113.db2.gz RKSMMOGEFRYPMQ-CVEARBPZSA-N 1 1 306.406 3.529 20 5 DHBDMO C[N@@H+](CCC1CCCCC1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581895 1022100467 /nfs/dbraw/zinc/10/04/67/1022100467.db2.gz OKVJRQNDYYIEOH-KRWDZBQOSA-N 1 1 306.406 3.530 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC3(CCCCC3)C2)cc1 ZINC000776581643 1022100760 /nfs/dbraw/zinc/10/07/60/1022100760.db2.gz FSUXUVVQWQLHBY-KRWDZBQOSA-N 1 1 318.417 3.675 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H](CCF)C1 ZINC000852532168 1022134738 /nfs/dbraw/zinc/13/47/38/1022134738.db2.gz CSBZMLZVFKFMJT-NSHDSACASA-N 1 1 300.761 3.820 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCC2CC2)CC2CC2)c([N+](=O)[O-])c1 ZINC000852716835 1022168421 /nfs/dbraw/zinc/16/84/21/1022168421.db2.gz SNTRPAJZOZANIZ-UHFFFAOYSA-N 1 1 319.361 3.515 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)cc1Cl)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169005940 1022213074 /nfs/dbraw/zinc/21/30/74/1022213074.db2.gz DKNYITMXFMWXRM-GWCFXTLKSA-N 1 1 317.216 3.871 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCOC2CCCCC2)C2CC2)c1 ZINC001167734875 1022215915 /nfs/dbraw/zinc/21/59/15/1022215915.db2.gz QCBJPWMCCKCMHP-UHFFFAOYSA-N 1 1 318.417 3.909 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCCC[C@@H]2c2ccccc2F)C1 ZINC001169030157 1022220132 /nfs/dbraw/zinc/22/01/32/1022220132.db2.gz XAZPJCZDPWPBBP-CKEIUWERSA-N 1 1 306.381 3.798 20 5 DHBDMO C[C@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CCc2ccc(Cl)cc21 ZINC001169038873 1022222809 /nfs/dbraw/zinc/22/28/09/1022222809.db2.gz LBVKWXQNSWXWCB-ZENOOKHLSA-N 1 1 322.836 3.747 20 5 DHBDMO COc1cccc([C@@H]2CCCC[N@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)c1 ZINC001169036526 1022223107 /nfs/dbraw/zinc/22/31/07/1022223107.db2.gz PCJZZPGYDFJHLL-LESCRADOSA-N 1 1 318.417 3.668 20 5 DHBDMO CC[N@@H+](Cc1c(F)cccc1Cl)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169041647 1022223648 /nfs/dbraw/zinc/22/36/48/1022223648.db2.gz BTTZIWQKHYEUGD-VXGBXAGGSA-N 1 1 314.788 3.746 20 5 DHBDMO Cc1c(CO[NH+]=C(N)CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000921189128 1022228921 /nfs/dbraw/zinc/22/89/21/1022228921.db2.gz ITTHLKRLHGVQET-UHFFFAOYSA-N 1 1 313.357 3.534 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H]2CC[C@@H](C3CC3)O2)C2CC2)c1 ZINC001167735352 1022229497 /nfs/dbraw/zinc/22/94/97/1022229497.db2.gz ZUEZOMHFZJCUDS-MSOLQXFVSA-N 1 1 316.401 3.517 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)C1 ZINC001169050177 1022231073 /nfs/dbraw/zinc/23/10/73/1022231073.db2.gz ZDQDLMOLRKYMBW-DETPVDSQSA-N 1 1 310.344 3.547 20 5 DHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1Br)C(C)C ZINC000233482758 1022348292 /nfs/dbraw/zinc/34/82/92/1022348292.db2.gz OROATTVQRQUODS-UHFFFAOYSA-N 1 1 301.184 3.588 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1Br)C(C)C ZINC000233482758 1022348306 /nfs/dbraw/zinc/34/83/06/1022348306.db2.gz OROATTVQRQUODS-UHFFFAOYSA-N 1 1 301.184 3.588 20 5 DHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000610133446 1022424386 /nfs/dbraw/zinc/42/43/86/1022424386.db2.gz PBDRAJSKEBUNMU-ZACQAIPSSA-N 1 1 318.417 3.620 20 5 DHBDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000616123421 1022648169 /nfs/dbraw/zinc/64/81/69/1022648169.db2.gz GCXDAYOQMNJFAX-WOPDTQHZSA-N 1 1 303.362 3.602 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000584836612 1022800033 /nfs/dbraw/zinc/80/00/33/1022800033.db2.gz MGTGPCHFRGWNDI-KBPBESRZSA-N 1 1 304.390 3.608 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000584836612 1022800046 /nfs/dbraw/zinc/80/00/46/1022800046.db2.gz MGTGPCHFRGWNDI-KBPBESRZSA-N 1 1 304.390 3.608 20 5 DHBDMO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCC(F)(F)F ZINC000092737666 1023073744 /nfs/dbraw/zinc/07/37/44/1023073744.db2.gz HPCCAQAAYMTLED-FNORWQNLSA-N 1 1 302.296 3.882 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cc(O)cc(F)c1 ZINC000925690860 1023168823 /nfs/dbraw/zinc/16/88/23/1023168823.db2.gz HVNCAODMFXNGQD-QWRGUYRKSA-N 1 1 304.321 3.851 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccnc(F)c3)C2)cc1 ZINC000859324116 1033123696 /nfs/dbraw/zinc/12/36/96/1033123696.db2.gz INGWXCNKMZQTAG-HNNXBMFYSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000538717422 1033143386 /nfs/dbraw/zinc/14/33/86/1033143386.db2.gz ZZFRFIUYSDIFIR-NEPJUHHUSA-N 1 1 317.414 3.949 20 5 DHBDMO CC(C)[C@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CCS1 ZINC000538728386 1033149138 /nfs/dbraw/zinc/14/91/38/1033149138.db2.gz QPSOXRQIFXOILV-GMNBZTITSA-N 1 1 306.431 3.681 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000787327929 1023788288 /nfs/dbraw/zinc/78/82/88/1023788288.db2.gz PPLFMXKQCLNPQX-GFCCVEGCSA-N 1 1 320.286 3.897 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000787327929 1023788290 /nfs/dbraw/zinc/78/82/90/1023788290.db2.gz PPLFMXKQCLNPQX-GFCCVEGCSA-N 1 1 320.286 3.897 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1c(C)noc1C ZINC000787405479 1023793213 /nfs/dbraw/zinc/79/32/13/1023793213.db2.gz CHGCTOQKYDALQR-XYOKQWHBSA-N 1 1 315.373 3.735 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccc(F)cc1F ZINC000788487583 1023894180 /nfs/dbraw/zinc/89/41/80/1023894180.db2.gz CMFPTCYIPNLRBD-SECBINFHSA-N 1 1 310.275 3.863 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788482753 1023900172 /nfs/dbraw/zinc/90/01/72/1023900172.db2.gz NKOPNOXAINIQMA-CYBMUJFWSA-N 1 1 312.410 3.842 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC3(CCCCC3)C2)cc1F ZINC000788483953 1023900541 /nfs/dbraw/zinc/90/05/41/1023900541.db2.gz ZYWXCDCKEDFORA-UHFFFAOYSA-N 1 1 324.421 3.986 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)c1 ZINC000053814843 1023929629 /nfs/dbraw/zinc/92/96/29/1023929629.db2.gz HUOXOQKTQUUOLQ-UHFFFAOYSA-N 1 1 310.353 3.590 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000051404503 1023996584 /nfs/dbraw/zinc/99/65/84/1023996584.db2.gz CFIBFJHOZONYPG-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000532192717 1024572585 /nfs/dbraw/zinc/57/25/85/1024572585.db2.gz DWFDZRPKVVNCGZ-JYJNAYRXSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000532192717 1024572592 /nfs/dbraw/zinc/57/25/92/1024572592.db2.gz DWFDZRPKVVNCGZ-JYJNAYRXSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](CC(C)C)[NH+](C)C ZINC000532202582 1024575052 /nfs/dbraw/zinc/57/50/52/1024575052.db2.gz XHFZFRTXRXKGFH-HOCLYGCPSA-N 1 1 307.438 3.530 20 5 DHBDMO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000317742242 1024625671 /nfs/dbraw/zinc/62/56/71/1024625671.db2.gz QJKQYGKKVRMGNU-MNOVXSKESA-N 1 1 303.362 3.920 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCCSCC2)o1 ZINC000349074359 1024669684 /nfs/dbraw/zinc/66/96/84/1024669684.db2.gz MKKCPZIEXYYXFP-UHFFFAOYSA-N 1 1 318.398 3.794 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC3(CCC3)C2)c([N+](=O)[O-])c1 ZINC001170355327 1024751653 /nfs/dbraw/zinc/75/16/53/1024751653.db2.gz ZVAILUVBFUIHQE-AWEZNQCLSA-N 1 1 318.417 3.801 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+](CC2CC2)C(C)C)c([N+](=O)[O-])c1 ZINC001170348485 1024756530 /nfs/dbraw/zinc/75/65/30/1024756530.db2.gz XOZBNPLRBJSYAY-CYBMUJFWSA-N 1 1 306.406 3.655 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])c1 ZINC001170348017 1024757073 /nfs/dbraw/zinc/75/70/73/1024757073.db2.gz URYCOZBPIMDGBO-ZQIUZPCESA-N 1 1 318.417 3.799 20 5 DHBDMO COCC[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000349838794 1024761351 /nfs/dbraw/zinc/76/13/51/1024761351.db2.gz YJPXLWSHGQJPJC-UHFFFAOYSA-N 1 1 314.385 3.552 20 5 DHBDMO CCCC[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CC1 ZINC000728895905 1024781520 /nfs/dbraw/zinc/78/15/20/1024781520.db2.gz DIZGXBBMJMUIGZ-UHFFFAOYSA-N 1 1 314.389 3.680 20 5 DHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000792868213 1024811208 /nfs/dbraw/zinc/81/12/08/1024811208.db2.gz SDTICLKYVXYNEK-VXGBXAGGSA-N 1 1 321.377 3.902 20 5 DHBDMO C[C@@]12CC[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]1C2(Cl)Cl ZINC000792901118 1024830328 /nfs/dbraw/zinc/83/03/28/1024830328.db2.gz KDZJWGVHEPEMCP-QWHCGFSZSA-N 1 1 315.200 3.611 20 5 DHBDMO C[C@@]12CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]1C2(Cl)Cl ZINC000792901118 1024830349 /nfs/dbraw/zinc/83/03/49/1024830349.db2.gz KDZJWGVHEPEMCP-QWHCGFSZSA-N 1 1 315.200 3.611 20 5 DHBDMO COc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000015309511 1025379933 /nfs/dbraw/zinc/37/99/33/1025379933.db2.gz OCFPEAXFRQUUSW-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO COc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000015309511 1025379946 /nfs/dbraw/zinc/37/99/46/1025379946.db2.gz OCFPEAXFRQUUSW-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000885938039 1025411687 /nfs/dbraw/zinc/41/16/87/1025411687.db2.gz QDIMUFHUZBCWMV-LLVKDONJSA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000885938039 1025411699 /nfs/dbraw/zinc/41/16/99/1025411699.db2.gz QDIMUFHUZBCWMV-LLVKDONJSA-N 1 1 305.765 3.836 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000886005730 1025434198 /nfs/dbraw/zinc/43/41/98/1025434198.db2.gz IUGVPBINLCGHCK-ZDUSSCGKSA-N 1 1 317.776 3.633 20 5 DHBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886012222 1025439413 /nfs/dbraw/zinc/43/94/13/1025439413.db2.gz CHWSMRJVDFRFBU-KRWDZBQOSA-N 1 1 311.385 3.505 20 5 DHBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000886350555 1025600630 /nfs/dbraw/zinc/60/06/30/1025600630.db2.gz YNXYAWDEUJUABK-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)C12CCC2 ZINC000355156788 1025619606 /nfs/dbraw/zinc/61/96/06/1025619606.db2.gz DPLFDNMEIDNVHM-SJORKVTESA-N 1 1 318.417 3.683 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cc(C3CC3)no1)CCC2 ZINC000886684175 1025786852 /nfs/dbraw/zinc/78/68/52/1025786852.db2.gz GPKXTOOSGWZEHZ-INIZCTEOSA-N 1 1 313.357 3.627 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089883528 1026073799 /nfs/dbraw/zinc/07/37/99/1026073799.db2.gz PSXZGMONEDZKQM-GFCCVEGCSA-N 1 1 301.346 3.624 20 5 DHBDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2C)on1 ZINC000052010712 1026151174 /nfs/dbraw/zinc/15/11/74/1026151174.db2.gz YLIODZYNFWXZGL-OAHLLOKOSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1cc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)on1 ZINC000052010712 1026151181 /nfs/dbraw/zinc/15/11/81/1026151181.db2.gz YLIODZYNFWXZGL-OAHLLOKOSA-N 1 1 301.346 3.537 20 5 DHBDMO CC(C)C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)C ZINC000052589169 1026303229 /nfs/dbraw/zinc/30/32/29/1026303229.db2.gz CTCXOFCCYXVJTQ-UHFFFAOYSA-N 1 1 318.377 3.511 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC000513472608 1026518655 /nfs/dbraw/zinc/51/86/55/1026518655.db2.gz IBNFULHKRKNJBK-OAHLLOKOSA-N 1 1 300.333 3.723 20 5 DHBDMO CCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000513510022 1026527996 /nfs/dbraw/zinc/52/79/96/1026527996.db2.gz XRBOAEVSSLTYNM-LKUPDRCFSA-N 1 1 318.417 3.889 20 5 DHBDMO CCC[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)CC(C)(C)O ZINC000513708587 1026750998 /nfs/dbraw/zinc/75/09/98/1026750998.db2.gz UMEWIAFXIUGSME-UHFFFAOYSA-N 1 1 308.422 3.701 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1 ZINC000420951116 1026889972 /nfs/dbraw/zinc/88/99/72/1026889972.db2.gz QMQQFMPHTOTEMM-LBPRGKRZSA-N 1 1 302.296 3.759 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c(F)c1 ZINC000420951869 1026890939 /nfs/dbraw/zinc/89/09/39/1026890939.db2.gz RHTZPDZFFYDCFG-JTQLQIEISA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c(F)c1 ZINC000420951869 1026890945 /nfs/dbraw/zinc/89/09/45/1026890945.db2.gz RHTZPDZFFYDCFG-JTQLQIEISA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@H]2CC[N@@H+](C3CC3)C2)c(Cl)c1 ZINC000228844270 1027125581 /nfs/dbraw/zinc/12/55/81/1027125581.db2.gz JWVRAWGFQJAMMV-QMMMGPOBSA-N 1 1 316.188 3.550 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@H]2CC[N@H+](C3CC3)C2)c(Cl)c1 ZINC000228844270 1027125588 /nfs/dbraw/zinc/12/55/88/1027125588.db2.gz JWVRAWGFQJAMMV-QMMMGPOBSA-N 1 1 316.188 3.550 20 5 DHBDMO CCCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H]1CCC[C@@H](C)C1 ZINC001170684913 1027383988 /nfs/dbraw/zinc/38/39/88/1027383988.db2.gz YYZPPIPXWVWZRT-GDBMZVCRSA-N 1 1 322.453 3.781 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@@H]2[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000932274824 1027438934 /nfs/dbraw/zinc/43/89/34/1027438934.db2.gz KQUFMIWVWIPPCU-IUODEOHRSA-N 1 1 315.373 3.659 20 5 DHBDMO C[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000932276675 1027440859 /nfs/dbraw/zinc/44/08/59/1027440859.db2.gz VLTFUPLVQLFSTL-PBHICJAKSA-N 1 1 311.385 3.758 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812850525 1027445950 /nfs/dbraw/zinc/44/59/50/1027445950.db2.gz UTBAIRUGXXAXPI-KSSFIOAISA-N 1 1 314.385 3.539 20 5 DHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812848637 1027446731 /nfs/dbraw/zinc/44/67/31/1027446731.db2.gz LKJXPVPUZPHMHW-RDTXWAMCSA-N 1 1 314.385 3.539 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@]2(C)Cc2cccs2)c1[N+](=O)[O-] ZINC000932924086 1027652990 /nfs/dbraw/zinc/65/29/90/1027652990.db2.gz WAWXYYDPOFMHJX-HNNXBMFYSA-N 1 1 321.402 3.550 20 5 DHBDMO CC(C)c1ccc(C[N@@H+]2CCCC[C@H]2C[C@H](C)O)cc1[N+](=O)[O-] ZINC000448361127 1027757683 /nfs/dbraw/zinc/75/76/83/1027757683.db2.gz VWWGJIGLTGOWPT-HOCLYGCPSA-N 1 1 320.433 3.844 20 5 DHBDMO CO[C@@H]1CC[C@H]1[N@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000934111843 1027905772 /nfs/dbraw/zinc/90/57/72/1027905772.db2.gz PRSGUAADJJJCRC-VXGBXAGGSA-N 1 1 319.188 3.511 20 5 DHBDMO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000934111843 1027905784 /nfs/dbraw/zinc/90/57/84/1027905784.db2.gz PRSGUAADJJJCRC-VXGBXAGGSA-N 1 1 319.188 3.511 20 5 DHBDMO Cc1cccnc1[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C(C)(C)C ZINC000934285528 1027952400 /nfs/dbraw/zinc/95/24/00/1027952400.db2.gz AHFBOAQWYRPDPI-HNNXBMFYSA-N 1 1 314.389 3.570 20 5 DHBDMO CC(C)OC1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601114051 1027990923 /nfs/dbraw/zinc/99/09/23/1027990923.db2.gz VKIKBYGSKOESPP-UHFFFAOYSA-N 1 1 315.373 3.537 20 5 DHBDMO CC(C)O[C@@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601184074 1028016200 /nfs/dbraw/zinc/01/62/00/1028016200.db2.gz GOSLDICPRKKKOH-CQSZACIVSA-N 1 1 315.373 3.537 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC(c4ccon4)CC3)c2c1 ZINC000601196522 1028021851 /nfs/dbraw/zinc/02/18/51/1028021851.db2.gz NFFQPOSSIIKLLX-UHFFFAOYSA-N 1 1 324.340 3.515 20 5 DHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCCc2cccnc21 ZINC000367213776 1028148345 /nfs/dbraw/zinc/14/83/45/1028148345.db2.gz PUCHAEDWYZQIFD-INIZCTEOSA-N 1 1 315.348 3.638 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCCc2cccnc21 ZINC000367213776 1028148351 /nfs/dbraw/zinc/14/83/51/1028148351.db2.gz PUCHAEDWYZQIFD-INIZCTEOSA-N 1 1 315.348 3.638 20 5 DHBDMO Cc1cccc2nc(C[NH2+][C@H](C)Cc3ccccc3[N+](=O)[O-])[nH]c21 ZINC000449207982 1028445716 /nfs/dbraw/zinc/44/57/16/1028445716.db2.gz OSKUWDBWPMWWSF-CYBMUJFWSA-N 1 1 324.384 3.500 20 5 DHBDMO C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccs1 ZINC000369560524 1028503768 /nfs/dbraw/zinc/50/37/68/1028503768.db2.gz HIUHLWRCURRBFA-BLLLJJGKSA-N 1 1 317.414 3.761 20 5 DHBDMO Cc1ccncc1C1=CC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000369849391 1028538535 /nfs/dbraw/zinc/53/85/35/1028538535.db2.gz BPXMCRTZWPNCHO-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO Cc1ccncc1C1=CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000369849391 1028538550 /nfs/dbraw/zinc/53/85/50/1028538550.db2.gz BPXMCRTZWPNCHO-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@@H]3C3CC3)cs2)c1 ZINC000449424529 1028633075 /nfs/dbraw/zinc/63/30/75/1028633075.db2.gz FDZQOFALZMTSED-OAHLLOKOSA-N 1 1 315.398 3.703 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H]3C3CC3)cs2)c1 ZINC000449424529 1028633086 /nfs/dbraw/zinc/63/30/86/1028633086.db2.gz FDZQOFALZMTSED-OAHLLOKOSA-N 1 1 315.398 3.703 20 5 DHBDMO CS[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449445036 1028648247 /nfs/dbraw/zinc/64/82/47/1028648247.db2.gz GNLYYZBKGLSYMK-ZDUSSCGKSA-N 1 1 318.398 3.792 20 5 DHBDMO Cc1ccncc1C1=CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000371477539 1028718331 /nfs/dbraw/zinc/71/83/31/1028718331.db2.gz MVOZLMJWMKHEIW-UHFFFAOYSA-N 1 1 323.396 3.630 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC=C(c2ccco2)C1 ZINC000566646183 1028757780 /nfs/dbraw/zinc/75/77/80/1028757780.db2.gz DNSUELMVLLIPBI-CLTKARDFSA-N 1 1 310.353 3.990 20 5 DHBDMO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000816649567 1028977124 /nfs/dbraw/zinc/97/71/24/1028977124.db2.gz CPVDBFHDEJGXLT-WDEREUQCSA-N 1 1 303.387 3.559 20 5 DHBDMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000816649567 1028977140 /nfs/dbraw/zinc/97/71/40/1028977140.db2.gz CPVDBFHDEJGXLT-WDEREUQCSA-N 1 1 303.387 3.559 20 5 DHBDMO CCC(CC)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000570122922 1029318010 /nfs/dbraw/zinc/31/80/10/1029318010.db2.gz UHXIUTLHILITMW-UHFFFAOYSA-N 1 1 302.378 3.624 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2ccncc2)C1 ZINC000451000649 1029762627 /nfs/dbraw/zinc/76/26/27/1029762627.db2.gz GGZPZANJVSZHBU-ZBFHGGJFSA-N 1 1 311.385 3.930 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC3(CCCCC3)C2)cc1 ZINC000530952636 1030094598 /nfs/dbraw/zinc/09/45/98/1030094598.db2.gz SXNFHAHQBIROBB-UHFFFAOYSA-N 1 1 306.431 3.847 20 5 DHBDMO COCCCCc1ccc[nH+]c1NCc1csc([N+](=O)[O-])c1 ZINC000291066460 1030321866 /nfs/dbraw/zinc/32/18/66/1030321866.db2.gz KWNQVSGDZSHXFR-UHFFFAOYSA-N 1 1 321.402 3.633 20 5 DHBDMO Cc1nc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(C)s1 ZINC000866539551 1030360549 /nfs/dbraw/zinc/36/05/49/1030360549.db2.gz CRWLIVGDWIYQAZ-SNVBAGLBSA-N 1 1 305.403 3.827 20 5 DHBDMO CCC1([NH3+])CCN([C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000925760345 1030485400 /nfs/dbraw/zinc/48/54/00/1030485400.db2.gz PTEFRXBICGPCCI-INIZCTEOSA-N 1 1 317.433 3.521 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(C3CC3)cc2F)c1 ZINC000291801810 1030649475 /nfs/dbraw/zinc/64/94/75/1030649475.db2.gz XJRJLKBGDSFAHP-UHFFFAOYSA-N 1 1 300.333 3.901 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCC2(CCCC2)O1 ZINC000558740488 1030760348 /nfs/dbraw/zinc/76/03/48/1030760348.db2.gz LRMSQPNWYIVVJP-QGZVFWFLSA-N 1 1 318.417 3.561 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(c2cccc(C)c2[N+](=O)[O-])CC1 ZINC000558890486 1030908214 /nfs/dbraw/zinc/90/82/14/1030908214.db2.gz QUTNFERGOQTDHO-UHFFFAOYSA-N 1 1 319.449 3.852 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000611579723 1031108272 /nfs/dbraw/zinc/10/82/72/1031108272.db2.gz NRIXTWXRFQJGAR-WCQYABFASA-N 1 1 314.332 3.668 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)c(Cl)c1 ZINC000844441850 1031145913 /nfs/dbraw/zinc/14/59/13/1031145913.db2.gz UUOAXDJGMWZODJ-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)c(Cl)c1 ZINC000844441850 1031145917 /nfs/dbraw/zinc/14/59/17/1031145917.db2.gz UUOAXDJGMWZODJ-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO CCOc1cc(Nc2ccc3[nH+]c(C)cn3c2)ccc1[N+](=O)[O-] ZINC000536646638 1031362974 /nfs/dbraw/zinc/36/29/74/1031362974.db2.gz HPBBNWWBYJMFAH-UHFFFAOYSA-N 1 1 312.329 3.693 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(O)c1 ZINC000872030219 1031414164 /nfs/dbraw/zinc/41/41/64/1031414164.db2.gz BHBMGMAXNLRXIH-LLVKDONJSA-N 1 1 318.398 3.873 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1C ZINC001171156460 1031429727 /nfs/dbraw/zinc/42/97/27/1031429727.db2.gz MESWGGASSOCHFG-UHFFFAOYSA-N 1 1 314.385 3.722 20 5 DHBDMO CC(C)[N@@H+](CCCc1ccncc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000360450861 1031432973 /nfs/dbraw/zinc/43/29/73/1031432973.db2.gz XPSKDMBPSAWVCN-UHFFFAOYSA-N 1 1 313.401 3.833 20 5 DHBDMO C[C@@H](NCCCCC[NH+]1CCCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872072256 1031466974 /nfs/dbraw/zinc/46/69/74/1031466974.db2.gz FQHJQEVXSMQRRE-CQSZACIVSA-N 1 1 323.412 3.651 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2cc(O)ccc2F)cc1[N+](=O)[O-] ZINC000872090395 1031488192 /nfs/dbraw/zinc/48/81/92/1031488192.db2.gz AJICFZWMHLYYOS-NSHDSACASA-N 1 1 304.321 3.599 20 5 DHBDMO CC(C)[N@@H+](CCc1ccns1)Cc1ccc([N+](=O)[O-])cc1 ZINC000929338240 1031498177 /nfs/dbraw/zinc/49/81/77/1031498177.db2.gz REOFTFPURPJXJV-UHFFFAOYSA-N 1 1 305.403 3.504 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000360686011 1031522097 /nfs/dbraw/zinc/52/20/97/1031522097.db2.gz PEOGJIIBKDGGJC-IBGZPJMESA-N 1 1 324.380 3.616 20 5 DHBDMO CSCC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000719316313 1031567056 /nfs/dbraw/zinc/56/70/56/1031567056.db2.gz OXKGSASWDGZKCJ-UHFFFAOYSA-N 1 1 314.838 3.823 20 5 DHBDMO COc1ccccc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035368077 1031634955 /nfs/dbraw/zinc/63/49/55/1031634955.db2.gz FWQYBKIHIFJABC-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO CCc1noc(C)c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000293846178 1031654671 /nfs/dbraw/zinc/65/46/71/1031654671.db2.gz YARHQAWSDPVECW-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO Cc1cc(Cl)nc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000873121506 1031717946 /nfs/dbraw/zinc/71/79/46/1031717946.db2.gz IULWESDYJNZWIM-UHFFFAOYSA-N 1 1 319.792 3.858 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3C[C@H]4[C@@H](C3)C4(F)F)o2)c1 ZINC000846111230 1031862349 /nfs/dbraw/zinc/86/23/49/1031862349.db2.gz KOPBJXAHDQWSIM-OKILXGFUSA-N 1 1 320.295 3.552 20 5 DHBDMO CCCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](C)c1ccccc1 ZINC000478033320 1033398610 /nfs/dbraw/zinc/39/86/10/1033398610.db2.gz LKKRDOMJPDCVKN-HNNXBMFYSA-N 1 1 316.405 3.655 20 5 DHBDMO C[C@]1(F)CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172906117 1033437609 /nfs/dbraw/zinc/43/76/09/1033437609.db2.gz WILNKDKVPPEXOL-WBVHZDCISA-N 1 1 306.381 3.666 20 5 DHBDMO CC(C)[N@@H+](CC1CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172917701 1033464590 /nfs/dbraw/zinc/46/45/90/1033464590.db2.gz WNCUWDFOVUJVDC-KRWDZBQOSA-N 1 1 302.418 3.963 20 5 DHBDMO Cc1csc([C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000877814849 1033465502 /nfs/dbraw/zinc/46/55/02/1033465502.db2.gz YPBDCWQLVCPNJJ-AWEZNQCLSA-N 1 1 317.414 3.658 20 5 DHBDMO CC(C)[C@H]1CCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922626 1033469020 /nfs/dbraw/zinc/46/90/20/1033469020.db2.gz ZIZJOKBTVUSWIQ-FUHWJXTLSA-N 1 1 302.418 3.963 20 5 DHBDMO C[C@@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001172909716 1033483106 /nfs/dbraw/zinc/48/31/06/1033483106.db2.gz VFHYIQSCOHAMFA-DOMZBBRYSA-N 1 1 324.371 3.819 20 5 DHBDMO CCC[N@@H+](CC1CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910018 1033483207 /nfs/dbraw/zinc/48/32/07/1033483207.db2.gz WMWXAQIZCASUQH-KRWDZBQOSA-N 1 1 302.418 3.964 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1Cc2ccc(F)cc2C1 ZINC001173224925 1033603985 /nfs/dbraw/zinc/60/39/85/1033603985.db2.gz AAANUOKKKPEEGD-GFCCVEGCSA-N 1 1 300.333 3.681 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1Cc2ccc(F)cc2C1 ZINC001173224925 1033603990 /nfs/dbraw/zinc/60/39/90/1033603990.db2.gz AAANUOKKKPEEGD-GFCCVEGCSA-N 1 1 300.333 3.681 20 5 DHBDMO Cc1cc([C@H]2CCC[N@@H+]2[C@H](C)Cc2ccc([N+](=O)[O-])cc2)no1 ZINC001173229217 1033606035 /nfs/dbraw/zinc/60/60/35/1033606035.db2.gz RPZJNGSXEIUDDN-SJKOYZFVSA-N 1 1 315.373 3.659 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C1CCC1)C1CCOCC1 ZINC001173238515 1033647869 /nfs/dbraw/zinc/64/78/69/1033647869.db2.gz UPJOXJXSDYUEHV-AWEZNQCLSA-N 1 1 318.417 3.559 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])nc1Cl ZINC000878373795 1033682199 /nfs/dbraw/zinc/68/21/99/1033682199.db2.gz OTDSAIXPXCUYNV-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)O[NH+]=C(N)CCC(F)(F)F ZINC000863490967 1034110811 /nfs/dbraw/zinc/11/08/11/1034110811.db2.gz UPQDRVSRNRVJTF-SECBINFHSA-N 1 1 319.283 3.805 20 5 DHBDMO Cc1csc([C@@H]2CC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000880008869 1034181170 /nfs/dbraw/zinc/18/11/70/1034181170.db2.gz FEUVCIYZTSUUGC-CHWSQXEVSA-N 1 1 317.414 3.910 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3nccs3)C2)c(Cl)c1 ZINC000880320469 1034296040 /nfs/dbraw/zinc/29/60/40/1034296040.db2.gz TUXYVZXFICFQJJ-LLVKDONJSA-N 1 1 323.805 3.694 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880318464 1034296738 /nfs/dbraw/zinc/29/67/38/1034296738.db2.gz ZLAMFFQTHGRZOV-JTQLQIEISA-N 1 1 323.805 3.694 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880318354 1034297731 /nfs/dbraw/zinc/29/77/31/1034297731.db2.gz YCVSEPOFYWYQKR-NEPJUHHUSA-N 1 1 303.387 3.602 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC2(CCCCO2)CC1 ZINC000880455810 1034335361 /nfs/dbraw/zinc/33/53/61/1034335361.db2.gz XUSFZXNJSYXYRK-UHFFFAOYSA-N 1 1 324.808 3.783 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H](C)[N@@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000480619909 1034355502 /nfs/dbraw/zinc/35/55/02/1034355502.db2.gz BLHQOLWCUVTHIU-FMKPAKJESA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000480619909 1034355511 /nfs/dbraw/zinc/35/55/11/1034355511.db2.gz BLHQOLWCUVTHIU-FMKPAKJESA-N 1 1 319.449 3.674 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)C2CCC(CO)CC2)cc1[N+](=O)[O-] ZINC000554887762 1034389085 /nfs/dbraw/zinc/38/90/85/1034389085.db2.gz PCNRJRABYKDKAC-UHFFFAOYSA-N 1 1 320.433 3.701 20 5 DHBDMO C[C@@H]([NH2+]C[C@@H](C1CCCCC1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000480693190 1034404384 /nfs/dbraw/zinc/40/43/84/1034404384.db2.gz JSSHHIMPOABZKA-KDOFPFPSSA-N 1 1 319.449 3.756 20 5 DHBDMO Cc1cc(Nc2ccc3cc4ccc(N)cc4nc3c2)cc[nH+]1 ZINC001174656495 1034556507 /nfs/dbraw/zinc/55/65/07/1034556507.db2.gz OETJWGSSELPWHR-UHFFFAOYSA-N 1 1 300.365 3.839 20 5 DHBDMO Cc1ccc([C@H](C)N[C@@H](C)C[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000481169730 1034627618 /nfs/dbraw/zinc/62/76/18/1034627618.db2.gz FKCLYFVFWIARNR-BPUTZDHNSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([C@H](C)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000481169730 1034627624 /nfs/dbraw/zinc/62/76/24/1034627624.db2.gz FKCLYFVFWIARNR-BPUTZDHNSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c([C@H](C)N[C@@H](C)C[N@@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000481183179 1034637032 /nfs/dbraw/zinc/63/70/32/1034637032.db2.gz QPBAFBTYTVQATP-DZKIICNBSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c([C@H](C)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000481183179 1034637034 /nfs/dbraw/zinc/63/70/34/1034637034.db2.gz QPBAFBTYTVQATP-DZKIICNBSA-N 1 1 319.449 3.674 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc3n[nH]cc32)C2CC2)c1 ZINC000600111576 1034746056 /nfs/dbraw/zinc/74/60/56/1034746056.db2.gz JIPYDYOVODTQPA-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO CC[C@@H]1CCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159419608 1035052546 /nfs/dbraw/zinc/05/25/46/1035052546.db2.gz FTEJJVSMRPWNAQ-LLVKDONJSA-N 1 1 313.195 3.732 20 5 DHBDMO CC[C@@H]1CCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159419608 1035052558 /nfs/dbraw/zinc/05/25/58/1035052558.db2.gz FTEJJVSMRPWNAQ-LLVKDONJSA-N 1 1 313.195 3.732 20 5 DHBDMO CC1(C)CCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159427980 1035053193 /nfs/dbraw/zinc/05/31/93/1035053193.db2.gz YSEAZLUBUBTTST-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO CC1(C)CCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159427980 1035053196 /nfs/dbraw/zinc/05/31/96/1035053196.db2.gz YSEAZLUBUBTTST-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000482685751 1035161673 /nfs/dbraw/zinc/16/16/73/1035161673.db2.gz YVBAHYDIFBWDQA-ZDUSSCGKSA-N 1 1 324.384 3.973 20 5 DHBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000482685751 1035161677 /nfs/dbraw/zinc/16/16/77/1035161677.db2.gz YVBAHYDIFBWDQA-ZDUSSCGKSA-N 1 1 324.384 3.973 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1CCN[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000482947474 1035203852 /nfs/dbraw/zinc/20/38/52/1035203852.db2.gz KGSNXVDEYXTLQE-WBVHZDCISA-N 1 1 319.449 3.818 20 5 DHBDMO CC[C@H]1CCCCN1CC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000482947474 1035203857 /nfs/dbraw/zinc/20/38/57/1035203857.db2.gz KGSNXVDEYXTLQE-WBVHZDCISA-N 1 1 319.449 3.818 20 5 DHBDMO CC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)CC1CCC1 ZINC000483131814 1035231542 /nfs/dbraw/zinc/23/15/42/1035231542.db2.gz RTYMBNAYPOSIBN-UHFFFAOYSA-N 1 1 315.373 3.872 20 5 DHBDMO COC1(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCC1 ZINC000483174328 1035235637 /nfs/dbraw/zinc/23/56/37/1035235637.db2.gz QTPFBFTWYDVMAW-UHFFFAOYSA-N 1 1 318.417 3.909 20 5 DHBDMO CCCC[N@@H+](CCOC)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470177003 1035324364 /nfs/dbraw/zinc/32/43/64/1035324364.db2.gz ZVBYJWQIQVSTAT-NTCAYCPXSA-N 1 1 306.406 3.747 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@]23CCCOC3)c(Cl)c1 ZINC001177009104 1035342907 /nfs/dbraw/zinc/34/29/07/1035342907.db2.gz XJYYUTGKNMOYNZ-MRXNPFEDSA-N 1 1 324.808 3.783 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@]23CCCOC3)c(Cl)c1 ZINC001177009104 1035342911 /nfs/dbraw/zinc/34/29/11/1035342911.db2.gz XJYYUTGKNMOYNZ-MRXNPFEDSA-N 1 1 324.808 3.783 20 5 DHBDMO CCN(CC)C[C@H](C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC001177733859 1035390633 /nfs/dbraw/zinc/39/06/33/1035390633.db2.gz VGVUIZUGTMZKNS-AWEZNQCLSA-N 1 1 307.438 3.538 20 5 DHBDMO CC[C@@H](C)[C@H](C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)OC ZINC001179945665 1035540674 /nfs/dbraw/zinc/54/06/74/1035540674.db2.gz IXNVZORFTFACAG-ABAIWWIYSA-N 1 1 314.813 3.741 20 5 DHBDMO CC[C@@H](C)[C@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)OC ZINC001179945665 1035540683 /nfs/dbraw/zinc/54/06/83/1035540683.db2.gz IXNVZORFTFACAG-ABAIWWIYSA-N 1 1 314.813 3.741 20 5 DHBDMO COc1ccc(C[N@H+]2CCCC23CCCCC3)cc1[N+](=O)[O-] ZINC000535381209 1035604634 /nfs/dbraw/zinc/60/46/34/1035604634.db2.gz ADBYIUGTOXTWKJ-UHFFFAOYSA-N 1 1 304.390 3.902 20 5 DHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[C@H]1C ZINC001193413515 1035633547 /nfs/dbraw/zinc/63/35/47/1035633547.db2.gz OBXDTOQRCIHZPM-RHSMWYFYSA-N 1 1 306.406 3.874 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCc2sccc2C1 ZINC001180514945 1035695675 /nfs/dbraw/zinc/69/56/75/1035695675.db2.gz XNZDVKCWGHBVIW-UHFFFAOYSA-N 1 1 302.399 3.831 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCc2sccc2C1 ZINC001180514945 1035695682 /nfs/dbraw/zinc/69/56/82/1035695682.db2.gz XNZDVKCWGHBVIW-UHFFFAOYSA-N 1 1 302.399 3.831 20 5 DHBDMO CCCC[N@@H+](CC)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089882927 1035757889 /nfs/dbraw/zinc/75/78/89/1035757889.db2.gz ZWTAWHZSMXAXOB-UHFFFAOYSA-N 1 1 303.362 3.872 20 5 DHBDMO C[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089888652 1035766015 /nfs/dbraw/zinc/76/60/15/1035766015.db2.gz YDCHOYQJCZRFFA-CYBMUJFWSA-N 1 1 315.373 3.872 20 5 DHBDMO C[N@@H+](CCc1cccc(Cl)c1)CCc1cccc([N+](=O)[O-])c1 ZINC001181153886 1035852130 /nfs/dbraw/zinc/85/21/30/1035852130.db2.gz HZNOZACTVQXLIQ-UHFFFAOYSA-N 1 1 318.804 3.965 20 5 DHBDMO CCc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485738325 1035926321 /nfs/dbraw/zinc/92/63/21/1035926321.db2.gz NPRLNUCTWQAXDI-UHFFFAOYSA-N 1 1 314.385 3.798 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](CCCCC(F)(F)F)C2 ZINC000153253195 1036160809 /nfs/dbraw/zinc/16/08/09/1036160809.db2.gz DWFWUGWYGOYGCQ-UHFFFAOYSA-N 1 1 302.296 3.686 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCCC(F)(F)F)C2 ZINC000153253195 1036160824 /nfs/dbraw/zinc/16/08/24/1036160824.db2.gz DWFWUGWYGOYGCQ-UHFFFAOYSA-N 1 1 302.296 3.686 20 5 DHBDMO Cc1c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000271696986 1036481211 /nfs/dbraw/zinc/48/12/11/1036481211.db2.gz GPIUNDFCVGGUOG-GFCCVEGCSA-N 1 1 315.329 3.662 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(C(F)F)CC2)c(Cl)c1 ZINC000542003382 1036482006 /nfs/dbraw/zinc/48/20/06/1036482006.db2.gz VUJSWTFTNXSFKL-UHFFFAOYSA-N 1 1 304.724 3.725 20 5 DHBDMO C[N@H+](CCOc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542000182 1036486887 /nfs/dbraw/zinc/48/68/87/1036486887.db2.gz JECTUMOZSWIGET-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542000182 1036486895 /nfs/dbraw/zinc/48/68/95/1036486895.db2.gz JECTUMOZSWIGET-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO CS[C@@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000542000488 1036487417 /nfs/dbraw/zinc/48/74/17/1036487417.db2.gz NHHGADYUPTYJNJ-CYBMUJFWSA-N 1 1 314.838 3.966 20 5 DHBDMO COc1ccc2c(c1)C[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000491430558 1036573075 /nfs/dbraw/zinc/57/30/75/1036573075.db2.gz JFHKJZWLHMPFTB-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc2c(c1)C[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000491430558 1036573087 /nfs/dbraw/zinc/57/30/87/1036573087.db2.gz JFHKJZWLHMPFTB-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO CCCC[N@@H+](CC)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636138 1036598531 /nfs/dbraw/zinc/59/85/31/1036598531.db2.gz UHVLRGLPXHLZCC-UHFFFAOYSA-N 1 1 310.785 3.677 20 5 DHBDMO CC(C)[C@@H](C)[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000915207966 1036708460 /nfs/dbraw/zinc/70/84/60/1036708460.db2.gz AHCJEWVYRLKDFH-SNVBAGLBSA-N 1 1 309.391 3.806 20 5 DHBDMO Cn1c2ccccc2[nH+]c1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000762539440 1036817021 /nfs/dbraw/zinc/81/70/21/1036817021.db2.gz BAKPEZUOPJPKCT-UHFFFAOYSA-N 1 1 316.748 3.747 20 5 DHBDMO CCOc1ccc(Cl)cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC001199583748 1037292940 /nfs/dbraw/zinc/29/29/40/1037292940.db2.gz YYHATFGOWFKYDU-UHFFFAOYSA-N 1 1 320.776 3.937 20 5 DHBDMO CC[NH+](CC)c1ccc(Nc2cc(O)cc([N+](=O)[O-])c2)cc1 ZINC001199828577 1037352673 /nfs/dbraw/zinc/35/26/73/1037352673.db2.gz NGRMYZQIBPSFEO-UHFFFAOYSA-N 1 1 301.346 3.890 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCOC2(CCCCC2)C1 ZINC000490090477 1037608996 /nfs/dbraw/zinc/60/89/96/1037608996.db2.gz QUFIYOCPTOVOGY-HNNXBMFYSA-N 1 1 318.417 3.999 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCOC2(CCCCC2)C1 ZINC000490090477 1037609004 /nfs/dbraw/zinc/60/90/04/1037609004.db2.gz QUFIYOCPTOVOGY-HNNXBMFYSA-N 1 1 318.417 3.999 20 5 DHBDMO Cc1cnc(NC[C@@H]2CC[N@H+]2C2CCCCCC2)c([N+](=O)[O-])c1 ZINC001187361322 1037620409 /nfs/dbraw/zinc/62/04/09/1037620409.db2.gz JTGAJVKVFQQKGN-HNNXBMFYSA-N 1 1 318.421 3.507 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]2Cc2ccccc2)c(F)c1 ZINC000490402604 1037706681 /nfs/dbraw/zinc/70/66/81/1037706681.db2.gz QTJPXDCYPJEEOG-HNNXBMFYSA-N 1 1 300.333 3.551 20 5 DHBDMO CCc1ccc(C[N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000917004660 1038111892 /nfs/dbraw/zinc/11/18/92/1038111892.db2.gz BGFLVXDVKYEXLT-UHFFFAOYSA-N 1 1 302.349 3.928 20 5 DHBDMO CCc1ccc(C[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000917004660 1038111903 /nfs/dbraw/zinc/11/19/03/1038111903.db2.gz BGFLVXDVKYEXLT-UHFFFAOYSA-N 1 1 302.349 3.928 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000917007013 1038113680 /nfs/dbraw/zinc/11/36/80/1038113680.db2.gz VXRVHQWERNRISC-KRWDZBQOSA-N 1 1 314.360 3.941 20 5 DHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1cccs1 ZINC000055898033 1038280614 /nfs/dbraw/zinc/28/06/14/1038280614.db2.gz ATGVOUSESLOADP-UHFFFAOYSA-N 1 1 306.387 3.557 20 5 DHBDMO CCC[N@H+]1CC[C@H](CNc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000589111280 1038434427 /nfs/dbraw/zinc/43/44/27/1038434427.db2.gz URUVXYVNEYYZSM-LLVKDONJSA-N 1 1 313.348 3.676 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000589199938 1038448827 /nfs/dbraw/zinc/44/88/27/1038448827.db2.gz NPLXEGQBYGPFOE-RDJZCZTQSA-N 1 1 318.417 3.542 20 5 DHBDMO CCC1(CC)[C@H](OC)C[C@@H]1[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001191743974 1038541759 /nfs/dbraw/zinc/54/17/59/1038541759.db2.gz XSWAZFNWUIJSAQ-JKSUJKDBSA-N 1 1 306.406 3.620 20 5 DHBDMO C[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590154567 1038592520 /nfs/dbraw/zinc/59/25/20/1038592520.db2.gz OVCVVFKAHNQAGT-JTQLQIEISA-N 1 1 302.296 3.846 20 5 DHBDMO C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590154567 1038592530 /nfs/dbraw/zinc/59/25/30/1038592530.db2.gz OVCVVFKAHNQAGT-JTQLQIEISA-N 1 1 302.296 3.846 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000590601958 1038674454 /nfs/dbraw/zinc/67/44/54/1038674454.db2.gz UFHIDMTXLRNZMG-HOCLYGCPSA-N 1 1 311.385 3.930 20 5 DHBDMO CC(C)[C@@H]1CCCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001192652855 1038686962 /nfs/dbraw/zinc/68/69/62/1038686962.db2.gz ISZSMZNVGGVBNP-HNNXBMFYSA-N 1 1 306.406 3.874 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000590724002 1038689592 /nfs/dbraw/zinc/68/95/92/1038689592.db2.gz XFKPDUDWWNKIGU-YOGCLGLASA-N 1 1 309.797 3.594 20 5 DHBDMO COc1cccc2c1C[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000590759932 1038699092 /nfs/dbraw/zinc/69/90/92/1038699092.db2.gz UYZZAWMHAJDCJH-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc2c1C[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000590759932 1038699097 /nfs/dbraw/zinc/69/90/97/1038699097.db2.gz UYZZAWMHAJDCJH-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO Cc1ccnc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000590757596 1038700308 /nfs/dbraw/zinc/70/03/08/1038700308.db2.gz BODZMGWSENSQID-INIZCTEOSA-N 1 1 311.385 3.678 20 5 DHBDMO CC[C@H](C)C[N@@H+](CC)Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761294732 1038943418 /nfs/dbraw/zinc/94/34/18/1038943418.db2.gz ZORDTKGHJBPOCS-LBPRGKRZSA-N 1 1 304.394 3.578 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC23CCCC3)c1 ZINC000593645722 1038943686 /nfs/dbraw/zinc/94/36/86/1038943686.db2.gz OOXGXPSLQFOHEX-UHFFFAOYSA-N 1 1 312.316 3.715 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC23CCCC3)c1 ZINC000593645722 1038943701 /nfs/dbraw/zinc/94/37/01/1038943701.db2.gz OOXGXPSLQFOHEX-UHFFFAOYSA-N 1 1 312.316 3.715 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599073969 1039028285 /nfs/dbraw/zinc/02/82/85/1039028285.db2.gz OTGBNEZDUGHOPW-YOEHRIQHSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599073969 1039028304 /nfs/dbraw/zinc/02/83/04/1039028304.db2.gz OTGBNEZDUGHOPW-YOEHRIQHSA-N 1 1 317.433 3.571 20 5 DHBDMO CCn1cc(C[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C(C)C)cn1 ZINC000593677211 1039042909 /nfs/dbraw/zinc/04/29/09/1039042909.db2.gz UNUHXHKIGFNOFS-UHFFFAOYSA-N 1 1 316.405 3.530 20 5 DHBDMO CC(C)[N@@H+](CCC[C@H]1CCOC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000592061251 1039105419 /nfs/dbraw/zinc/10/54/19/1039105419.db2.gz CFOOKLIJDAOIPQ-INIZCTEOSA-N 1 1 306.406 3.622 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592183969 1039171858 /nfs/dbraw/zinc/17/18/58/1039171858.db2.gz MQCNYCKYRDTVQG-GJZGRUSLSA-N 1 1 318.417 3.855 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000599511912 1039183105 /nfs/dbraw/zinc/18/31/05/1039183105.db2.gz CXAMJPMMNMOXBG-AOOOYVTPSA-N 1 1 318.751 3.971 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000599511912 1039183112 /nfs/dbraw/zinc/18/31/12/1039183112.db2.gz CXAMJPMMNMOXBG-AOOOYVTPSA-N 1 1 318.751 3.971 20 5 DHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000603859744 1039193802 /nfs/dbraw/zinc/19/38/02/1039193802.db2.gz OYMYCJWOCHWAOQ-CYBMUJFWSA-N 1 1 309.385 3.658 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000604012866 1039279525 /nfs/dbraw/zinc/27/95/25/1039279525.db2.gz BRCSISJUIHWVNS-OAHLLOKOSA-N 1 1 304.390 3.628 20 5 DHBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])cc1F)Cc1ccccc1 ZINC000058733837 1039500344 /nfs/dbraw/zinc/50/03/44/1039500344.db2.gz HIIJSXWRBRJYSV-UHFFFAOYSA-N 1 1 317.364 3.668 20 5 DHBDMO Cc1ccc([C@@H](C)[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000059038171 1039716327 /nfs/dbraw/zinc/71/63/27/1039716327.db2.gz DITRWTGUEXLVSX-OAHLLOKOSA-N 1 1 314.385 3.975 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCCc2occc21 ZINC000595006829 1040016145 /nfs/dbraw/zinc/01/61/45/1040016145.db2.gz JSJLNWCKLQXPQQ-XHDPSFHLSA-N 1 1 316.357 3.925 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@H](c3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000595324891 1040107466 /nfs/dbraw/zinc/10/74/66/1040107466.db2.gz CRBJREOPFBZFGH-WFASDCNBSA-N 1 1 315.373 3.517 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)c1[N+](=O)[O-] ZINC000595409457 1040130384 /nfs/dbraw/zinc/13/03/84/1040130384.db2.gz QGLDUMQOFREAHU-CQSZACIVSA-N 1 1 321.764 3.786 20 5 DHBDMO COc1ccc(C2([NH2+]Cc3ccc(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000595415564 1040133003 /nfs/dbraw/zinc/13/30/03/1040133003.db2.gz DRULSTSRIVOECY-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(C3CC3)no2)cc1[N+](=O)[O-] ZINC000595421148 1040133465 /nfs/dbraw/zinc/13/34/65/1040133465.db2.gz SHFNYNZVQLEENV-NSHDSACASA-N 1 1 301.346 3.619 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000595432533 1040135777 /nfs/dbraw/zinc/13/57/77/1040135777.db2.gz WMCHXWVUXWZGRN-FJVVXJACSA-N 1 1 313.357 3.569 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000595432533 1040135779 /nfs/dbraw/zinc/13/57/79/1040135779.db2.gz WMCHXWVUXWZGRN-FJVVXJACSA-N 1 1 313.357 3.569 20 5 DHBDMO CC(C)Oc1ccnc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000593019781 1040147223 /nfs/dbraw/zinc/14/72/23/1040147223.db2.gz LDHFFJQTBVNONL-CYBMUJFWSA-N 1 1 315.373 3.628 20 5 DHBDMO Cc1noc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000595501319 1040155380 /nfs/dbraw/zinc/15/53/80/1040155380.db2.gz OCCFUNSGWCSJNI-LBPRGKRZSA-N 1 1 321.764 3.534 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000595501319 1040155392 /nfs/dbraw/zinc/15/53/92/1040155392.db2.gz OCCFUNSGWCSJNI-LBPRGKRZSA-N 1 1 321.764 3.534 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@H](c3ccccc3)C2(C)C)c1[N+](=O)[O-] ZINC000595544928 1040170154 /nfs/dbraw/zinc/17/01/54/1040170154.db2.gz BYOSKGPFJNLJHZ-CQSZACIVSA-N 1 1 315.373 3.659 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595904468 1040272918 /nfs/dbraw/zinc/27/29/18/1040272918.db2.gz DELKUNBGLAIJPE-OLMNPRSZSA-N 1 1 316.401 3.548 20 5 DHBDMO Cc1ncc(-c2ccc(C[N@@H+]3CCC[C@@H]3C)cc2)cc1[N+](=O)[O-] ZINC000596631666 1040528966 /nfs/dbraw/zinc/52/89/66/1040528966.db2.gz XBTYSANMDWKNQZ-ZDUSSCGKSA-N 1 1 311.385 3.950 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)cc1[N+](=O)[O-] ZINC000597224011 1040704298 /nfs/dbraw/zinc/70/42/98/1040704298.db2.gz ARRNSUAXFAXBFG-SJLPKXTDSA-N 1 1 318.417 3.684 20 5 DHBDMO CC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])Cc1ccc2ccccc2c1 ZINC000602445546 1041035868 /nfs/dbraw/zinc/03/58/68/1041035868.db2.gz XJVPBDJEXDPJCC-UHFFFAOYSA-N 1 1 324.384 3.504 20 5 DHBDMO CC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])Cc1ccc2ccccc2c1 ZINC000602445546 1041035880 /nfs/dbraw/zinc/03/58/80/1041035880.db2.gz XJVPBDJEXDPJCC-UHFFFAOYSA-N 1 1 324.384 3.504 20 5 DHBDMO C[C@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602540583 1041084421 /nfs/dbraw/zinc/08/44/21/1041084421.db2.gz QRIRRWNYXABGNL-BBATYDOGSA-N 1 1 323.352 3.759 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CC4(C3)CCCCC4)nc2c1 ZINC000602691562 1041152846 /nfs/dbraw/zinc/15/28/46/1041152846.db2.gz WYIUUSYOLMBQNK-UHFFFAOYSA-N 1 1 301.346 3.502 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@H]1C1CC1 ZINC000602679831 1041162279 /nfs/dbraw/zinc/16/22/79/1041162279.db2.gz SEPDBQAASFRNRI-LBPRGKRZSA-N 1 1 300.280 3.598 20 5 DHBDMO CS[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602679436 1041162590 /nfs/dbraw/zinc/16/25/90/1041162590.db2.gz KZBHAONRRHRRAW-LLVKDONJSA-N 1 1 320.336 3.551 20 5 DHBDMO Cc1nn(C[N@H+](CCC(C)C)C2CC2)c2cc([N+](=O)[O-])ccc12 ZINC000761279130 1041278550 /nfs/dbraw/zinc/27/85/50/1041278550.db2.gz DCKFRDPRDZQUIY-UHFFFAOYSA-N 1 1 316.405 3.721 20 5 DHBDMO CC(C)([NH2+]Cc1cncc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000598616692 1041362677 /nfs/dbraw/zinc/36/26/77/1041362677.db2.gz DYVJRHWTLZJZDX-UHFFFAOYSA-N 1 1 305.765 3.668 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000084138233 192405647 /nfs/dbraw/zinc/40/56/47/192405647.db2.gz PHRNZLDMHZKJDM-UHFFFAOYSA-N 1 1 302.296 3.759 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)N[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353480658 131107088 /nfs/dbraw/zinc/10/70/88/131107088.db2.gz CGWRCWGYHYDUQA-YOEHRIQHSA-N 1 1 307.438 3.756 20 5 DHBDMO CCCN(CC)C[C@H](C)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353480658 131107090 /nfs/dbraw/zinc/10/70/90/131107090.db2.gz CGWRCWGYHYDUQA-YOEHRIQHSA-N 1 1 307.438 3.756 20 5 DHBDMO C[C@@]12CC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C[C@@H]1C2(F)F ZINC000298195025 132050195 /nfs/dbraw/zinc/05/01/95/132050195.db2.gz BUDBJPGHVZKBPK-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@@]12CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C[C@@H]1C2(F)F ZINC000298195025 132050197 /nfs/dbraw/zinc/05/01/97/132050197.db2.gz BUDBJPGHVZKBPK-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO COc1ccc(C[N@@H+](Cc2ccco2)C(C)C)cc1[N+](=O)[O-] ZINC000299408559 132103925 /nfs/dbraw/zinc/10/39/25/132103925.db2.gz YVPLAWAUYMREDS-UHFFFAOYSA-N 1 1 304.346 3.607 20 5 DHBDMO Cc1ccc([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-] ZINC000131806320 332037245 /nfs/dbraw/zinc/03/72/45/332037245.db2.gz CGPQOUMAURDTBI-LNRIEFBSSA-N 1 1 317.433 3.569 20 5 DHBDMO Cc1ccc([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000131806320 332037246 /nfs/dbraw/zinc/03/72/46/332037246.db2.gz CGPQOUMAURDTBI-LNRIEFBSSA-N 1 1 317.433 3.569 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)cc1[N+](=O)[O-] ZINC000131806320 332037248 /nfs/dbraw/zinc/03/72/48/332037248.db2.gz CGPQOUMAURDTBI-LNRIEFBSSA-N 1 1 317.433 3.569 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1c2ccc(F)cc2O[C@H]1C ZINC000569405708 332076839 /nfs/dbraw/zinc/07/68/39/332076839.db2.gz QJDCNIRZTJTEHB-GTNSWQLSSA-N 1 1 316.332 3.654 20 5 DHBDMO O=[N+]([O-])c1ccc(OCCNc2cc[nH+]c3ccsc32)cc1 ZINC000525705929 332648478 /nfs/dbraw/zinc/64/84/78/332648478.db2.gz FUOFXUMACBGSIS-UHFFFAOYSA-N 1 1 315.354 3.695 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2cccnc21 ZINC000365003393 333334311 /nfs/dbraw/zinc/33/43/11/333334311.db2.gz WOJOZSPICIMQSZ-KRWDZBQOSA-N 1 1 311.385 3.889 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000526063207 333390309 /nfs/dbraw/zinc/39/03/09/333390309.db2.gz QDAXVEIQMDNKKN-SOVRZDNNSA-N 1 1 306.431 3.824 20 5 DHBDMO CC1=C[C@H](C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000430265068 334042024 /nfs/dbraw/zinc/04/20/24/334042024.db2.gz UGUQMDUBHDPBAI-LBPRGKRZSA-N 1 1 313.357 3.648 20 5 DHBDMO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000276365622 334075978 /nfs/dbraw/zinc/07/59/78/334075978.db2.gz ZXHLNSUKVKYZLY-NSHDSACASA-N 1 1 304.321 3.633 20 5 DHBDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000276365622 334075980 /nfs/dbraw/zinc/07/59/80/334075980.db2.gz ZXHLNSUKVKYZLY-NSHDSACASA-N 1 1 304.321 3.633 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000286204878 334151803 /nfs/dbraw/zinc/15/18/03/334151803.db2.gz RTZFWQBUCXUFEA-INIZCTEOSA-N 1 1 314.389 3.729 20 5 DHBDMO CC[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000297509416 334241954 /nfs/dbraw/zinc/24/19/54/334241954.db2.gz CKWPXJIRMYRIDV-UGFHNGPFSA-N 1 1 300.362 3.538 20 5 DHBDMO C[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000388773364 334270014 /nfs/dbraw/zinc/27/00/14/334270014.db2.gz GFWUWAVVRHWXPO-GXSJLCMTSA-N 1 1 317.311 3.508 20 5 DHBDMO Cc1sc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)nc1C(C)C ZINC000344149427 335222031 /nfs/dbraw/zinc/22/20/31/335222031.db2.gz HRNHHKHMPQBKHE-UHFFFAOYSA-N 1 1 305.403 3.773 20 5 DHBDMO Cc1cc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C)o1 ZINC000444680527 338481956 /nfs/dbraw/zinc/48/19/56/338481956.db2.gz PPGYLOCGMQAAAN-SNVBAGLBSA-N 1 1 314.345 3.532 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@H](CO)c2ccsc2)cc1[N+](=O)[O-] ZINC000349645193 335687978 /nfs/dbraw/zinc/68/79/78/335687978.db2.gz KELLUUKRGOTTSI-OAHLLOKOSA-N 1 1 320.414 3.603 20 5 DHBDMO COc1cc(C[N@H+](C)Cc2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000351970469 336184281 /nfs/dbraw/zinc/18/42/81/336184281.db2.gz CNNTZRJLLIGQJS-UHFFFAOYSA-N 1 1 322.311 3.514 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000351970469 336184282 /nfs/dbraw/zinc/18/42/82/336184282.db2.gz CNNTZRJLLIGQJS-UHFFFAOYSA-N 1 1 322.311 3.514 20 5 DHBDMO C[C@@H]([N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)(C)C ZINC000532489316 336250395 /nfs/dbraw/zinc/25/03/95/336250395.db2.gz AAOIAHLKBGQESG-LLVKDONJSA-N 1 1 318.377 3.511 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](C)[NH+]1CCC(C)CC1 ZINC000532492296 336250499 /nfs/dbraw/zinc/25/04/99/336250499.db2.gz LSMXOJFWMVQYSV-JKSUJKDBSA-N 1 1 319.449 3.674 20 5 DHBDMO C[C@@H](C1CC1)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104677108 336263587 /nfs/dbraw/zinc/26/35/87/336263587.db2.gz FTSUDMQZGUITHU-LBPRGKRZSA-N 1 1 315.373 3.523 20 5 DHBDMO CCC[N@H+]1CC[C@H](CNc2cc(C)c([N+](=O)[O-])cc2Cl)C1 ZINC000301973883 336340727 /nfs/dbraw/zinc/34/07/27/336340727.db2.gz BCGQZJLMCHTFOR-GFCCVEGCSA-N 1 1 311.813 3.700 20 5 DHBDMO COc1ccc(CNc2cccc3cc[nH+]cc32)cc1[N+](=O)[O-] ZINC000532892357 336398442 /nfs/dbraw/zinc/39/84/42/336398442.db2.gz TVVDPGKTOQPYPX-UHFFFAOYSA-N 1 1 309.325 3.764 20 5 DHBDMO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000375395219 337010308 /nfs/dbraw/zinc/01/03/08/337010308.db2.gz XBRYYSORHFZSSK-WBVHZDCISA-N 1 1 314.389 3.580 20 5 DHBDMO CC[C@H](c1ccccc1)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000375395215 337010351 /nfs/dbraw/zinc/01/03/51/337010351.db2.gz XBRYYSORHFZSSK-DOTOQJQBSA-N 1 1 314.389 3.580 20 5 DHBDMO COC[C@@H]1CCCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000376389885 337032443 /nfs/dbraw/zinc/03/24/43/337032443.db2.gz YKZFMFOGKPUCRN-HUUCEWRRSA-N 1 1 306.406 3.713 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000376624244 337038412 /nfs/dbraw/zinc/03/84/12/337038412.db2.gz XQPOOMILBHQRMK-AWEZNQCLSA-N 1 1 322.368 3.631 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000321156386 337202729 /nfs/dbraw/zinc/20/27/29/337202729.db2.gz WBOQRQAQBRIVCA-LBPRGKRZSA-N 1 1 310.357 3.630 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186705807 337258932 /nfs/dbraw/zinc/25/89/32/337258932.db2.gz JOUOSQBQAJLPGC-AUUYWEPGSA-N 1 1 324.380 3.787 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCc3c(O)cccc32)cs1 ZINC000191654826 337298312 /nfs/dbraw/zinc/29/83/12/337298312.db2.gz CQPXFQDGKAEXHZ-ZDUSSCGKSA-N 1 1 304.371 3.529 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCCC4(CCCC4)C3)nc2c1 ZINC000583791607 337333609 /nfs/dbraw/zinc/33/36/09/337333609.db2.gz YEWBWGWOKATWDS-UHFFFAOYSA-N 1 1 314.389 3.627 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCCC4(CCCC4)C3)nc2c1 ZINC000583791607 337333610 /nfs/dbraw/zinc/33/36/10/337333610.db2.gz YEWBWGWOKATWDS-UHFFFAOYSA-N 1 1 314.389 3.627 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCS[C@@H](C)CC1 ZINC000426389400 338030162 /nfs/dbraw/zinc/03/01/62/338030162.db2.gz FDFXPWIBAVPHFZ-ZVHGMHCTSA-N 1 1 306.431 3.826 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426456835 338032665 /nfs/dbraw/zinc/03/26/65/338032665.db2.gz FISJWOTWGLFNIG-XJKSGUPXSA-N 1 1 304.390 3.756 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(SCC[N@H+](C)Cc2ccccc2)n1 ZINC000432915967 338172988 /nfs/dbraw/zinc/17/29/88/338172988.db2.gz IHYQXKJVAULKLK-UHFFFAOYSA-N 1 1 317.414 3.522 20 5 DHBDMO CC[N@@H+](CCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(C)C ZINC000433160456 338183488 /nfs/dbraw/zinc/18/34/88/338183488.db2.gz ONYMCWNCHHJHSQ-KRWDZBQOSA-N 1 1 319.449 3.637 20 5 DHBDMO CCN(CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(C)C ZINC000433160456 338183489 /nfs/dbraw/zinc/18/34/89/338183489.db2.gz ONYMCWNCHHJHSQ-KRWDZBQOSA-N 1 1 319.449 3.637 20 5 DHBDMO CCC(CC)C[N@@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000434682829 338223308 /nfs/dbraw/zinc/22/33/08/338223308.db2.gz BEORDTKWTALULJ-UHFFFAOYSA-N 1 1 321.421 3.600 20 5 DHBDMO CCOc1cc(C[N@H+]2CCSC(C)(C)CC2)ccc1[N+](=O)[O-] ZINC000434692204 338223769 /nfs/dbraw/zinc/22/37/69/338223769.db2.gz WPPGXDAJUYUMNS-UHFFFAOYSA-N 1 1 324.446 3.711 20 5 DHBDMO CC1(C)CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCS1 ZINC000434709897 338223852 /nfs/dbraw/zinc/22/38/52/338223852.db2.gz HQJFUEWKQFASFH-UHFFFAOYSA-N 1 1 324.446 3.581 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000439288466 338366167 /nfs/dbraw/zinc/36/61/67/338366167.db2.gz VDMXYOYDVMYNBZ-MRXNPFEDSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]Cc2cnc(C3CC3)o2)cccc1[N+](=O)[O-] ZINC000453347918 338829074 /nfs/dbraw/zinc/82/90/74/338829074.db2.gz IVYIJTDFHIHQET-LLVKDONJSA-N 1 1 301.346 3.619 20 5 DHBDMO CCc1ncc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000453350521 338829473 /nfs/dbraw/zinc/82/94/73/338829473.db2.gz BMMUOSJYSWGNEF-HNNXBMFYSA-N 1 1 315.373 3.657 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]2CC(C)C)c([N+](=O)[O-])cc1F ZINC000463509946 339119875 /nfs/dbraw/zinc/11/98/75/339119875.db2.gz UTSVGZZNDSSKAO-ZDUSSCGKSA-N 1 1 310.369 3.753 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]2CC(C)C)c([N+](=O)[O-])cc1F ZINC000463509945 339119883 /nfs/dbraw/zinc/11/98/83/339119883.db2.gz UTSVGZZNDSSKAO-CYBMUJFWSA-N 1 1 310.369 3.753 20 5 DHBDMO COc1cc(C[N@@H+](C)C[C@@H]2CC=CCC2)c([N+](=O)[O-])cc1F ZINC000464501412 339143772 /nfs/dbraw/zinc/14/37/72/339143772.db2.gz VLYRBAIHLJZPMY-GFCCVEGCSA-N 1 1 308.353 3.531 20 5 DHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2C(C)C)c([N+](=O)[O-])cc1F ZINC000464686501 339148731 /nfs/dbraw/zinc/14/87/31/339148731.db2.gz CNOROBLHXKUWJY-CQSZACIVSA-N 1 1 310.369 3.753 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCOCc1ccccc1 ZINC000464859809 339158472 /nfs/dbraw/zinc/15/84/72/339158472.db2.gz YTIQZFXERBNORM-OAHLLOKOSA-N 1 1 314.385 3.804 20 5 DHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CCCO1 ZINC000467562023 339242948 /nfs/dbraw/zinc/24/29/48/339242948.db2.gz IQUDMJOZCVJNQM-OAHLLOKOSA-N 1 1 306.406 3.719 20 5 DHBDMO C[C@@H](N[C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467834822 339247186 /nfs/dbraw/zinc/24/71/86/339247186.db2.gz MSHSWVVQQGYMDC-XUWVNRHRSA-N 1 1 319.449 3.612 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)CN1C[C@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467834822 339247187 /nfs/dbraw/zinc/24/71/87/339247187.db2.gz MSHSWVVQQGYMDC-XUWVNRHRSA-N 1 1 319.449 3.612 20 5 DHBDMO C[C@H](NCC[N@@H+]1[C@H](C)CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000467857776 339247784 /nfs/dbraw/zinc/24/77/84/339247784.db2.gz BSDSPJYRFKJDKU-ZNMIVQPWSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H]([NH2+]CCN1[C@H](C)CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000467857776 339247785 /nfs/dbraw/zinc/24/77/85/339247785.db2.gz BSDSPJYRFKJDKU-ZNMIVQPWSA-N 1 1 305.422 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)cc1 ZINC000469449357 339289875 /nfs/dbraw/zinc/28/98/75/339289875.db2.gz AZLVPTVLYHUOTH-ZDUSSCGKSA-N 1 1 318.323 3.863 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000469988416 339306949 /nfs/dbraw/zinc/30/69/49/339306949.db2.gz AUZODTZRJVASFN-GFCCVEGCSA-N 1 1 302.296 3.758 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCSC(C)(C)C1 ZINC000470169665 339312566 /nfs/dbraw/zinc/31/25/66/339312566.db2.gz HFAJBZLBQVKBJA-UKTHLTGXSA-N 1 1 306.431 3.826 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOCC2(CCC2)C1 ZINC000470206046 339314360 /nfs/dbraw/zinc/31/43/60/339314360.db2.gz HRFSDXGIHMGFGD-GDNBJRDFSA-N 1 1 316.401 3.501 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000471029994 339335019 /nfs/dbraw/zinc/33/50/19/339335019.db2.gz JBYLSIUDVLGBTB-UGSOOPFHSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000471029994 339335020 /nfs/dbraw/zinc/33/50/20/339335020.db2.gz JBYLSIUDVLGBTB-UGSOOPFHSA-N 1 1 312.369 3.796 20 5 DHBDMO CCn1nc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000472055950 339361293 /nfs/dbraw/zinc/36/12/93/339361293.db2.gz RCXSKCIAOALSGQ-ZDUSSCGKSA-N 1 1 324.384 3.815 20 5 DHBDMO CC(C)c1ccc(CN2CCC[N@H+](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000505265829 340165165 /nfs/dbraw/zinc/16/51/65/340165165.db2.gz MUYDZMMZPVUWLD-UHFFFAOYSA-N 1 1 319.449 3.634 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000506204118 340188704 /nfs/dbraw/zinc/18/87/04/340188704.db2.gz OGVKIOLLMQJZSR-UHFFFAOYSA-N 1 1 306.312 3.813 20 5 DHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000506204118 340188705 /nfs/dbraw/zinc/18/87/05/340188705.db2.gz OGVKIOLLMQJZSR-UHFFFAOYSA-N 1 1 306.312 3.813 20 5 DHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000506761582 340201122 /nfs/dbraw/zinc/20/11/22/340201122.db2.gz ZTBLTRAMQOCVQZ-XQRVVYSFSA-N 1 1 300.333 3.879 20 5 DHBDMO CCC[C@H](C)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000507022313 340205696 /nfs/dbraw/zinc/20/56/96/340205696.db2.gz NSIHWJGFYFJFFM-ZDUSSCGKSA-N 1 1 316.405 3.616 20 5 DHBDMO COc1c(C)cc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1C ZINC000507592594 340225757 /nfs/dbraw/zinc/22/57/57/340225757.db2.gz WTMVJOYROWCHLT-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO CC[C@@H](C)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000509359857 340267210 /nfs/dbraw/zinc/26/72/10/340267210.db2.gz SZYOFLQNQIJWHS-SNVBAGLBSA-N 1 1 302.321 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](COC(F)F)C1 ZINC000512844225 340380489 /nfs/dbraw/zinc/38/04/89/340380489.db2.gz MCBXRHZWJBREKE-RYUDHWBXSA-N 1 1 314.332 3.525 20 5 DHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(O)c1 ZINC000174620986 340393278 /nfs/dbraw/zinc/39/32/78/340393278.db2.gz CCFMIJQEXDBDNT-AWEZNQCLSA-N 1 1 314.385 3.926 20 5 DHBDMO Cc1c(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)cccc1[N+](=O)[O-] ZINC000237462149 340671050 /nfs/dbraw/zinc/67/10/50/340671050.db2.gz XVCCQGCXLAQSSC-IAQYHMDHSA-N 1 1 300.358 3.909 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCSC1 ZINC000130575276 341028760 /nfs/dbraw/zinc/02/87/60/341028760.db2.gz PPSRCNPFMZIHIX-AWEZNQCLSA-N 1 1 318.398 3.792 20 5 DHBDMO C[N@@H+](CCc1ccccc1O)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000544190749 341073917 /nfs/dbraw/zinc/07/39/17/341073917.db2.gz ZIQZAECJMLOLRN-UHFFFAOYSA-N 1 1 320.776 3.628 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000548508510 341265011 /nfs/dbraw/zinc/26/50/11/341265011.db2.gz JIPODKRWNVFSGX-HSMVNMDESA-N 1 1 314.389 3.624 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H]3CF)o2)c1 ZINC000552391944 341390921 /nfs/dbraw/zinc/39/09/21/341390921.db2.gz DKVBBGPJYKIBBR-CQSZACIVSA-N 1 1 304.321 3.789 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCO[C@H](C(C)C)C1 ZINC000552443814 341394133 /nfs/dbraw/zinc/39/41/33/341394133.db2.gz AWMQZGFNFKSRTE-BXBOZWQASA-N 1 1 318.417 3.745 20 5 DHBDMO Cc1c(C[NH2+]Cc2ncc(C(C)(C)C)s2)cccc1[N+](=O)[O-] ZINC000565872699 341540980 /nfs/dbraw/zinc/54/09/80/341540980.db2.gz GEJCKOLTFDJFBC-UHFFFAOYSA-N 1 1 319.430 3.947 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cscn1 ZINC000566501830 341560198 /nfs/dbraw/zinc/56/01/98/341560198.db2.gz UKZQXAIRNRQMKX-YGRLFVJLSA-N 1 1 303.387 3.780 20 5 DHBDMO CC(C)c1[nH+]ccn1C[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1 ZINC000364910870 519879946 /nfs/dbraw/zinc/87/99/46/519879946.db2.gz SOJMUNJDUDUXSJ-MRXNPFEDSA-N 1 1 314.389 3.584 20 5 DHBDMO CCCO[C@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000108392739 520286372 /nfs/dbraw/zinc/28/63/72/520286372.db2.gz WSAXBULWCCNWRB-ZDUSSCGKSA-N 1 1 310.369 3.515 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc2ccccc2c1 ZINC000338362005 522946649 /nfs/dbraw/zinc/94/66/49/522946649.db2.gz SFRANPOVOJJQGS-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cn3c(cccc3C)n2)cc1[N+](=O)[O-] ZINC000160310683 525931332 /nfs/dbraw/zinc/93/13/32/525931332.db2.gz AKKBPKGPWGLPGF-AWEZNQCLSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1ccncc1F ZINC000338016710 526089448 /nfs/dbraw/zinc/08/94/48/526089448.db2.gz VFHKNDCWOSBNKO-VXGBXAGGSA-N 1 1 303.337 3.849 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2coc3ccccc23)c(F)c1 ZINC000339414490 527350439 /nfs/dbraw/zinc/35/04/39/527350439.db2.gz CQVRABJRARYGPW-UHFFFAOYSA-N 1 1 300.289 3.770 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCC4(CCC4)C3)nc2c1 ZINC000366339180 527381601 /nfs/dbraw/zinc/38/16/01/527381601.db2.gz ARKPUIDVSNFMBF-UHFFFAOYSA-N 1 1 301.346 3.502 20 5 DHBDMO CCOC1CC2(C1)CC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000285429351 535398571 /nfs/dbraw/zinc/39/85/71/535398571.db2.gz HFDHCPNRXWIELW-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO CCOC1CC2(C1)CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000285429351 535398574 /nfs/dbraw/zinc/39/85/74/535398574.db2.gz HFDHCPNRXWIELW-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]4CCC[C@@H]43)nc2c1 ZINC000083213184 1014001246 /nfs/dbraw/zinc/00/12/46/1014001246.db2.gz AQNUDDXRQQGNAJ-RISCZKNCSA-N 1 1 301.346 3.501 20 5 DHBDMO CC[C@@H](NC[C@@H](C(C)C)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000319960198 1014303300 /nfs/dbraw/zinc/30/33/00/1014303300.db2.gz HEIBWRQENOMSPF-MSOLQXFVSA-N 1 1 319.449 3.756 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(C(F)(F)F)cc2)cs1 ZINC000060390855 1014462051 /nfs/dbraw/zinc/46/20/51/1014462051.db2.gz PMMBBBYIUFBKII-UHFFFAOYSA-N 1 1 316.304 3.965 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c(F)c1 ZINC000610481016 1014575219 /nfs/dbraw/zinc/57/52/19/1014575219.db2.gz KAHOLNCDLBPJPS-KRWDZBQOSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)c(F)c1 ZINC000610481016 1014575224 /nfs/dbraw/zinc/57/52/24/1014575224.db2.gz KAHOLNCDLBPJPS-KRWDZBQOSA-N 1 1 316.332 3.777 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]C[C@H](C(C)C)N2CCCC2)cc1[N+](=O)[O-] ZINC000320113494 1014587946 /nfs/dbraw/zinc/58/79/46/1014587946.db2.gz CMGOSGNWCYZIAQ-MAUKXSAKSA-N 1 1 319.449 3.674 20 5 DHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001167457843 1014773155 /nfs/dbraw/zinc/77/31/55/1014773155.db2.gz LYIOMEUPFNRSAJ-YOEHRIQHSA-N 1 1 306.406 3.874 20 5 DHBDMO CCN(CC)[C@@H](C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)CC(C)C ZINC000521818972 1014807585 /nfs/dbraw/zinc/80/75/85/1014807585.db2.gz JJNOMIGWKWEDKW-QGZVFWFLSA-N 1 1 321.465 3.749 20 5 DHBDMO CC[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1nccs1 ZINC000276324041 1014955085 /nfs/dbraw/zinc/95/50/85/1014955085.db2.gz PJDVDHPZQFQYPP-AWEZNQCLSA-N 1 1 309.366 3.605 20 5 DHBDMO CC[C@@H]1CCC[N@H+]1[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173188179 1033584389 /nfs/dbraw/zinc/58/43/89/1033584389.db2.gz CZNZDQTZAPZBDP-NWDGAFQWSA-N 1 1 310.369 3.548 20 5 DHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000581576851 1015008705 /nfs/dbraw/zinc/00/87/05/1015008705.db2.gz ADWWOAZBKTVSAY-GFCCVEGCSA-N 1 1 318.377 3.655 20 5 DHBDMO C[N@@H+](CCc1ccccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000519160279 1015070298 /nfs/dbraw/zinc/07/02/98/1015070298.db2.gz FHUVGFJTIQQWAG-UHFFFAOYSA-N 1 1 304.777 3.923 20 5 DHBDMO C[C@]1([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])CCOc2ccccc21 ZINC000933366004 1015190975 /nfs/dbraw/zinc/19/09/75/1015190975.db2.gz LHWGISJJFVGGNZ-KRWDZBQOSA-N 1 1 316.332 3.521 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc(C2CC2)ccc1F ZINC000294688385 1032113376 /nfs/dbraw/zinc/11/33/76/1032113376.db2.gz BQDJHJOYVKIHOM-UHFFFAOYSA-N 1 1 300.333 3.901 20 5 DHBDMO C[N@H+](C/C=C\c1ccc(F)cc1)CCc1cccc([N+](=O)[O-])c1 ZINC000581837554 1015367207 /nfs/dbraw/zinc/36/72/07/1015367207.db2.gz YHKFFZJTSCUDMM-HYXAFXHYSA-N 1 1 314.360 3.922 20 5 DHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581548 1015627687 /nfs/dbraw/zinc/62/76/87/1015627687.db2.gz SAZDPSXXUYQCOX-LBPRGKRZSA-N 1 1 303.362 3.747 20 5 DHBDMO COc1ccc(CNc2[nH+]cccc2C(C)C)cc1[N+](=O)[O-] ZINC000341949165 1015855961 /nfs/dbraw/zinc/85/59/61/1015855961.db2.gz MCXNSPCJNAMKEV-UHFFFAOYSA-N 1 1 301.346 3.734 20 5 DHBDMO CC[C@@H](C)C[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000247741763 1015965129 /nfs/dbraw/zinc/96/51/29/1015965129.db2.gz XCSHBYUYNSVHJO-VXGBXAGGSA-N 1 1 318.377 3.684 20 5 DHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000538736459 1016163254 /nfs/dbraw/zinc/16/32/54/1016163254.db2.gz GFMXRYXUGSWJCJ-CQSZACIVSA-N 1 1 322.405 3.767 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cccc3cc[nH]c31)C2 ZINC000539824693 1016401305 /nfs/dbraw/zinc/40/13/05/1016401305.db2.gz HLLOIXVNCIHRLV-UHFFFAOYSA-N 1 1 307.353 3.634 20 5 DHBDMO CC(C)c1csc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)n1 ZINC000294900116 1032199772 /nfs/dbraw/zinc/19/97/72/1032199772.db2.gz VVJDXDHKEXUSSY-JTQLQIEISA-N 1 1 320.418 3.608 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000514947801 1012509900 /nfs/dbraw/zinc/50/99/00/1012509900.db2.gz KSEIAIUZRPCVRP-ZDUSSCGKSA-N 1 1 317.776 3.633 20 5 DHBDMO C[C@@H](c1ccccc1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000515123776 1012563067 /nfs/dbraw/zinc/56/30/67/1012563067.db2.gz RCQQGCJAEMZLSV-AWEZNQCLSA-N 1 1 300.358 3.667 20 5 DHBDMO CCC[N@@H+](CCc1ccccn1)Cc1ccc([N+](=O)[O-])cc1F ZINC000349060853 1012604923 /nfs/dbraw/zinc/60/49/23/1012604923.db2.gz GOBFVRQFEWHGIK-UHFFFAOYSA-N 1 1 317.364 3.584 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCC[C@H]2C)CC1 ZINC000134739619 1012949930 /nfs/dbraw/zinc/94/99/30/1012949930.db2.gz COSYOLHEBYMCOA-CABCVRRESA-N 1 1 317.433 3.605 20 5 DHBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000065586762 1017141563 /nfs/dbraw/zinc/14/15/63/1017141563.db2.gz LAKQYZSDNGLSIT-NEPJUHHUSA-N 1 1 311.813 3.781 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000128080534 1017155741 /nfs/dbraw/zinc/15/57/41/1017155741.db2.gz RUCNELTWKPZNFZ-QGZVFWFLSA-N 1 1 300.333 3.975 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(C(F)F)CC2)cc1Cl ZINC000783575279 1017194894 /nfs/dbraw/zinc/19/48/94/1017194894.db2.gz WZBZNRNERWJLRB-UHFFFAOYSA-N 1 1 304.724 3.725 20 5 DHBDMO CC[C@H]([NH2+]CCc1ccc2cn[nH]c2c1)c1cccc([N+](=O)[O-])c1 ZINC000342830557 1017521200 /nfs/dbraw/zinc/52/12/00/1017521200.db2.gz WZAQZLJBLZGIIW-KRWDZBQOSA-N 1 1 324.384 3.755 20 5 DHBDMO C[C@@H](C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444611104 1017592614 /nfs/dbraw/zinc/59/26/14/1017592614.db2.gz PWTLOIJOGJOVKI-ZDUSSCGKSA-N 1 1 324.384 3.707 20 5 DHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCCC[C@@H]1C ZINC000444673654 1017625864 /nfs/dbraw/zinc/62/58/64/1017625864.db2.gz IITMKKQMGSHJPO-BLLLJJGKSA-N 1 1 316.405 3.872 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444697495 1017637518 /nfs/dbraw/zinc/63/75/18/1017637518.db2.gz KRDLEXTUEKNWCI-VIFPVBQESA-N 1 1 306.259 3.508 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444697495 1017637525 /nfs/dbraw/zinc/63/75/25/1017637525.db2.gz KRDLEXTUEKNWCI-VIFPVBQESA-N 1 1 306.259 3.508 20 5 DHBDMO CC[C@H](NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125909817 1032724801 /nfs/dbraw/zinc/72/48/01/1032724801.db2.gz QEVPBCUAWFOHBF-YJBOKZPZSA-N 1 1 319.449 3.756 20 5 DHBDMO CC[C@H](NC[C@@H]1CCC[N@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125909817 1032724817 /nfs/dbraw/zinc/72/48/17/1032724817.db2.gz QEVPBCUAWFOHBF-YJBOKZPZSA-N 1 1 319.449 3.756 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@H]3c3ccccc3)nc2c1 ZINC000342964829 1017908408 /nfs/dbraw/zinc/90/84/08/1017908408.db2.gz ZPYWDUHHMIMUMX-KRWDZBQOSA-N 1 1 322.368 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H]3c3ccccc3)nc2c1 ZINC000342964829 1017908416 /nfs/dbraw/zinc/90/84/16/1017908416.db2.gz ZPYWDUHHMIMUMX-KRWDZBQOSA-N 1 1 322.368 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2cccc(F)c2)C2CC2)cc1 ZINC000524426345 1017992587 /nfs/dbraw/zinc/99/25/87/1017992587.db2.gz HZAXJLQQKXIRBR-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO C[C@@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000278080678 1018048021 /nfs/dbraw/zinc/04/80/21/1018048021.db2.gz GHRVOFGQJDSGDD-BBBLOLIVSA-N 1 1 322.390 3.640 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCC[C@@H]3C3CC3)c2c1 ZINC000728563417 1018357210 /nfs/dbraw/zinc/35/72/10/1018357210.db2.gz UVYDAUUNSMHGCP-GFCCVEGCSA-N 1 1 319.386 3.704 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000447827489 1018483248 /nfs/dbraw/zinc/48/32/48/1018483248.db2.gz BOVRKQZFSFMUJK-CJNGLKHVSA-N 1 1 306.406 3.711 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000447827489 1018483250 /nfs/dbraw/zinc/48/32/50/1018483250.db2.gz BOVRKQZFSFMUJK-CJNGLKHVSA-N 1 1 306.406 3.711 20 5 DHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1Br)C1CCC1 ZINC000706763609 1018752208 /nfs/dbraw/zinc/75/22/08/1018752208.db2.gz SYOKPGGTBZHUQC-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1Br)C1CCC1 ZINC000706763609 1018752228 /nfs/dbraw/zinc/75/22/28/1018752228.db2.gz SYOKPGGTBZHUQC-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO Cc1nc(F)ccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000278496897 1018752142 /nfs/dbraw/zinc/75/21/42/1018752142.db2.gz UZOGJHJLDDFCMA-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cc1nc(F)ccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000278496897 1018752151 /nfs/dbraw/zinc/75/21/51/1018752151.db2.gz UZOGJHJLDDFCMA-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1ccccc1[N+](=O)[O-] ZINC000338717812 1018796941 /nfs/dbraw/zinc/79/69/41/1018796941.db2.gz NNMJNUNFWQYMAD-UHFFFAOYSA-N 1 1 308.341 3.701 20 5 DHBDMO CS[C@H]1CCCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000708322060 1018839814 /nfs/dbraw/zinc/83/98/14/1018839814.db2.gz XNHXNVGQITWYGY-LBPRGKRZSA-N 1 1 314.838 3.966 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1cnc(C)s1 ZINC000601299942 1019199346 /nfs/dbraw/zinc/19/93/46/1019199346.db2.gz RLVRTFBIZYUKDQ-ZJUUUORDSA-N 1 1 321.402 3.780 20 5 DHBDMO CCn1nc(C)c(C[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000611252955 1019421251 /nfs/dbraw/zinc/42/12/51/1019421251.db2.gz UCFWTKIJUCWEIE-ZDUSSCGKSA-N 1 1 316.405 3.621 20 5 DHBDMO CCn1nc(C)c(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000611252955 1019421262 /nfs/dbraw/zinc/42/12/62/1019421262.db2.gz UCFWTKIJUCWEIE-ZDUSSCGKSA-N 1 1 316.405 3.621 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000611350961 1019451659 /nfs/dbraw/zinc/45/16/59/1019451659.db2.gz VVZPWLPCPJVZGV-BZUAXINKSA-N 1 1 318.417 3.794 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(Cl)cn1 ZINC000611439034 1019485184 /nfs/dbraw/zinc/48/51/84/1019485184.db2.gz GLLHRYFAQNLHDT-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000750053919 1019583852 /nfs/dbraw/zinc/58/38/52/1019583852.db2.gz AGVIORIPGPXWSI-HZPDHXFCSA-N 1 1 306.406 3.529 20 5 DHBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCCCC1 ZINC000750059688 1019593564 /nfs/dbraw/zinc/59/35/64/1019593564.db2.gz YFJAJURSDUSMQT-KRWDZBQOSA-N 1 1 306.406 3.673 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC[C@H]2CCCCO2)C2CC2)cc1 ZINC000347550788 1019621727 /nfs/dbraw/zinc/62/17/27/1019621727.db2.gz QNLQAIZYPVOHLF-QGZVFWFLSA-N 1 1 304.390 3.518 20 5 DHBDMO C[C@H](C[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000727429302 1019713130 /nfs/dbraw/zinc/71/31/30/1019713130.db2.gz UWUKWTHECSROGY-CQSZACIVSA-N 1 1 324.384 3.638 20 5 DHBDMO CC[C@H](NCC[NH+]1CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000316041245 1019896244 /nfs/dbraw/zinc/89/62/44/1019896244.db2.gz GSEGMSRJTKBUMN-KRWDZBQOSA-N 1 1 305.422 3.512 20 5 DHBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C ZINC000316791926 1019938279 /nfs/dbraw/zinc/93/82/79/1019938279.db2.gz NWIVUCTWTJBQJP-GXSJLCMTSA-N 1 1 317.311 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000730432215 1019987877 /nfs/dbraw/zinc/98/78/77/1019987877.db2.gz AEORMBHOQYQHEQ-GFCCVEGCSA-N 1 1 318.323 3.863 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1ccccc1F ZINC000731670869 1020134091 /nfs/dbraw/zinc/13/40/91/1020134091.db2.gz DNWXPWULRWPSFZ-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000093324672 1020146704 /nfs/dbraw/zinc/14/67/04/1020146704.db2.gz YKCSATWOLSEIQT-AWEZNQCLSA-N 1 1 314.385 3.672 20 5 DHBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000125381715 1020296971 /nfs/dbraw/zinc/29/69/71/1020296971.db2.gz NSBJWXIPLOEGPV-LBPRGKRZSA-N 1 1 318.348 3.503 20 5 DHBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000125381953 1020297320 /nfs/dbraw/zinc/29/73/20/1020297320.db2.gz NSBJWXIPLOEGPV-GFCCVEGCSA-N 1 1 318.348 3.503 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1ncc(C)s1)c1cccc([N+](=O)[O-])c1 ZINC000122949865 1020325272 /nfs/dbraw/zinc/32/52/72/1020325272.db2.gz RKHVLSDPIHGZEM-CQSZACIVSA-N 1 1 305.403 3.991 20 5 DHBDMO CCC[C@H](NCC1([NH+](C)C)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000318319051 1020460709 /nfs/dbraw/zinc/46/07/09/1020460709.db2.gz VXPSXBJMYHXFCA-INIZCTEOSA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)cc1 ZINC000065967497 1020610149 /nfs/dbraw/zinc/61/01/49/1020610149.db2.gz KIHYVQJYPGGLLK-SFYZZRBRSA-N 1 1 300.402 3.648 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000612578847 1020630903 /nfs/dbraw/zinc/63/09/03/1020630903.db2.gz URCXEKKUYXYUBL-QGZVFWFLSA-N 1 1 300.333 3.989 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000612578847 1020630906 /nfs/dbraw/zinc/63/09/06/1020630906.db2.gz URCXEKKUYXYUBL-QGZVFWFLSA-N 1 1 300.333 3.989 20 5 DHBDMO C[C@@H]1CCCCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000738227103 1020865362 /nfs/dbraw/zinc/86/53/62/1020865362.db2.gz RGTUWVFOXZIQOD-CQSZACIVSA-N 1 1 314.389 3.680 20 5 DHBDMO Cc1ccc([C@H]2[C@@H](C)CCC[N@@H+]2Cn2nccc2[N+](=O)[O-])cc1 ZINC000738282639 1020867315 /nfs/dbraw/zinc/86/73/15/1020867315.db2.gz AJEMPBHEBAJMQT-WMLDXEAASA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1ccc([C@H]2[C@@H](C)CCC[N@H+]2Cn2nccc2[N+](=O)[O-])cc1 ZINC000738282639 1020867321 /nfs/dbraw/zinc/86/73/21/1020867321.db2.gz AJEMPBHEBAJMQT-WMLDXEAASA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1ccc([C@@H]2[C@@H](C)CCC[N@@H+]2Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000738284087 1020868135 /nfs/dbraw/zinc/86/81/35/1020868135.db2.gz JIKFJIPZXWGXAR-YOEHRIQHSA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000738284087 1020868143 /nfs/dbraw/zinc/86/81/43/1020868143.db2.gz JIKFJIPZXWGXAR-YOEHRIQHSA-N 1 1 314.389 3.530 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000170688868 1021001653 /nfs/dbraw/zinc/00/16/53/1021001653.db2.gz RHNORRUFCPBXTA-YOEHRIQHSA-N 1 1 311.385 3.842 20 5 DHBDMO C[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000742589422 1021139810 /nfs/dbraw/zinc/13/98/10/1021139810.db2.gz HQSYUDNPWLYRSU-CQSZACIVSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]12 ZINC000776277477 1021208365 /nfs/dbraw/zinc/20/83/65/1021208365.db2.gz PYLGHFCCYMCCEU-RNJTYBCJSA-N 1 1 318.417 3.529 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](CC2CCCCC2)C2CC2)cc1 ZINC000776277391 1021208704 /nfs/dbraw/zinc/20/87/04/1021208704.db2.gz OENRMYMTZIQWRX-SFHVURJKSA-N 1 1 318.417 3.673 20 5 DHBDMO Cc1ccc([C@H](C)[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776274232 1021218397 /nfs/dbraw/zinc/21/83/97/1021218397.db2.gz CHQRWECPMMJREC-KBXCAEBGSA-N 1 1 314.385 3.630 20 5 DHBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCC(C)(C)CC1 ZINC000154436550 1021287221 /nfs/dbraw/zinc/28/72/21/1021287221.db2.gz MQRBWKSPLMGTAS-INIZCTEOSA-N 1 1 306.406 3.529 20 5 DHBDMO COC[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000181664108 1021308561 /nfs/dbraw/zinc/30/85/61/1021308561.db2.gz NKRKYCMNEDZGJD-HNNXBMFYSA-N 1 1 320.776 3.726 20 5 DHBDMO CCC(CC)[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000918179638 1021476856 /nfs/dbraw/zinc/47/68/56/1021476856.db2.gz STMVORDWASECAR-UHFFFAOYSA-N 1 1 302.378 3.555 20 5 DHBDMO C[N@@H+](CCCOCc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000182193891 1021533896 /nfs/dbraw/zinc/53/38/96/1021533896.db2.gz ISVROYGWEHBLDI-UHFFFAOYSA-N 1 1 314.385 3.634 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@@H]2CCCC[N@H+]2C(C)C)cc1[N+](=O)[O-] ZINC000556124193 1021536831 /nfs/dbraw/zinc/53/68/31/1021536831.db2.gz YKEQQYMVVFWZIQ-WBVHZDCISA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@@H]2CCCC[N@@H+]2C(C)C)cc1[N+](=O)[O-] ZINC000556124193 1021536839 /nfs/dbraw/zinc/53/68/39/1021536839.db2.gz YKEQQYMVVFWZIQ-WBVHZDCISA-N 1 1 319.449 3.817 20 5 DHBDMO COc1cccc([C@H](C)[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000194984285 1021831462 /nfs/dbraw/zinc/83/14/62/1021831462.db2.gz JZSXDQXNLMDEBF-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1cccc([C@H](C)[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000194984285 1021831474 /nfs/dbraw/zinc/83/14/74/1021831474.db2.gz JZSXDQXNLMDEBF-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccsc1 ZINC000619782860 1021896037 /nfs/dbraw/zinc/89/60/37/1021896037.db2.gz MEADGZWRQOLZRG-VIFPVBQESA-N 1 1 303.343 3.648 20 5 DHBDMO CC(C)C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC(C)(C)C ZINC000776585835 1022105542 /nfs/dbraw/zinc/10/55/42/1022105542.db2.gz AJHPAZTYHVNLRW-INIZCTEOSA-N 1 1 308.422 3.632 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(c3ccon3)CC2)c1 ZINC000852672554 1022154451 /nfs/dbraw/zinc/15/44/51/1022154451.db2.gz GEXVMYSACNXVHU-UHFFFAOYSA-N 1 1 321.764 3.616 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3ccon3)CC2)ccc1Cl ZINC000852673720 1022156779 /nfs/dbraw/zinc/15/67/79/1022156779.db2.gz XALZDKMHLCVNGP-UHFFFAOYSA-N 1 1 321.764 3.616 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H]2c2ccc(Cl)s2)C1 ZINC001169033310 1022219333 /nfs/dbraw/zinc/21/93/33/1022219333.db2.gz BUFNJMKWNTZNRP-UTUOFQBUSA-N 1 1 314.838 3.984 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H]2c2ccc(Cl)s2)C1 ZINC001169033311 1022220023 /nfs/dbraw/zinc/22/00/23/1022220023.db2.gz BUFNJMKWNTZNRP-WOPDTQHZSA-N 1 1 314.838 3.984 20 5 DHBDMO COc1cccc([C@@H]2CCCC[N@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c1 ZINC001169036524 1022221461 /nfs/dbraw/zinc/22/14/61/1022221461.db2.gz PCJZZPGYDFJHLL-KYJSFNMBSA-N 1 1 318.417 3.668 20 5 DHBDMO COc1cccc([C@@H]2CCCC[N@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)c1 ZINC001169036527 1022221933 /nfs/dbraw/zinc/22/19/33/1022221933.db2.gz PCJZZPGYDFJHLL-ZVZYQTTQSA-N 1 1 318.417 3.668 20 5 DHBDMO C[N@@H+](Cc1c(Cl)cccc1Cl)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169038561 1022222694 /nfs/dbraw/zinc/22/26/94/1022222694.db2.gz ZPIJDGDBNBZHMY-QWRGUYRKSA-N 1 1 317.216 3.871 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)C1 ZINC001169039793 1022224091 /nfs/dbraw/zinc/22/40/91/1022224091.db2.gz UBDYVHANYWMHCE-IVMMDQJWSA-N 1 1 308.809 3.575 20 5 DHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000610133443 1022425539 /nfs/dbraw/zinc/42/55/39/1022425539.db2.gz PBDRAJSKEBUNMU-BBWFWOEESA-N 1 1 318.417 3.620 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000876585263 1033097420 /nfs/dbraw/zinc/09/74/20/1033097420.db2.gz GHGWUIQCMITAGX-SFHVURJKSA-N 1 1 311.385 3.944 20 5 DHBDMO CSC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000312743960 1023143135 /nfs/dbraw/zinc/14/31/35/1023143135.db2.gz VWURQOKBCYGFFX-NSHDSACASA-N 1 1 314.838 3.823 20 5 DHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000150749195 1023186318 /nfs/dbraw/zinc/18/63/18/1023186318.db2.gz APYVACLCNFQHEG-OAHLLOKOSA-N 1 1 320.389 3.616 20 5 DHBDMO Cc1c([C@@H](C)Nc2ccc3c(c2)[nH+]cn3C)cccc1[N+](=O)[O-] ZINC000538636552 1033121474 /nfs/dbraw/zinc/12/14/74/1033121474.db2.gz AMILEIQEFUETIT-GFCCVEGCSA-N 1 1 310.357 3.963 20 5 DHBDMO Cc1nc(F)ccc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000787088845 1023755107 /nfs/dbraw/zinc/75/51/07/1023755107.db2.gz UOBGLISYTLTGOA-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cc1nc(F)ccc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000787088845 1023755114 /nfs/dbraw/zinc/75/51/14/1023755114.db2.gz UOBGLISYTLTGOA-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO CC[N@@H+](CCc1ccccn1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746663342 1023773407 /nfs/dbraw/zinc/77/34/07/1023773407.db2.gz QALVIGLZFZXGOB-UHFFFAOYSA-N 1 1 319.792 3.708 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCC(F)(F)CC1 ZINC000859536357 1033163070 /nfs/dbraw/zinc/16/30/70/1033163070.db2.gz YOSZKWPWLQUZTB-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCC(F)(F)CC1 ZINC000859536357 1033163072 /nfs/dbraw/zinc/16/30/72/1033163072.db2.gz YOSZKWPWLQUZTB-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)cc1F ZINC000788487019 1023893387 /nfs/dbraw/zinc/89/33/87/1023893387.db2.gz BCFCSAIJRVFGET-GJZGRUSLSA-N 1 1 310.394 3.594 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]1c1ccccc1 ZINC000788483918 1023900644 /nfs/dbraw/zinc/90/06/44/1023900644.db2.gz YVQMCWFZOBPEPJ-SJKOYZFVSA-N 1 1 300.333 3.927 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]1c1ccccc1 ZINC000788483918 1023900648 /nfs/dbraw/zinc/90/06/48/1023900648.db2.gz YVQMCWFZOBPEPJ-SJKOYZFVSA-N 1 1 300.333 3.927 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)nc1 ZINC000789588543 1024122013 /nfs/dbraw/zinc/12/20/13/1024122013.db2.gz DPNQVUXGJUNJCF-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)nc1 ZINC000789588543 1024122019 /nfs/dbraw/zinc/12/20/19/1024122019.db2.gz DPNQVUXGJUNJCF-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO Cc1ccn2cc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)nc2c1 ZINC000268868598 1024183582 /nfs/dbraw/zinc/18/35/82/1024183582.db2.gz KXLYTAFNUMYPRR-AWEZNQCLSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)C[N@@H+]1CCC[C@H](C)C1 ZINC000531697435 1024271386 /nfs/dbraw/zinc/27/13/86/1024271386.db2.gz RALLRBHMZQZYLA-IMJJTQAJSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000531697435 1024271397 /nfs/dbraw/zinc/27/13/97/1024271397.db2.gz RALLRBHMZQZYLA-IMJJTQAJSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)C[N@@H+]1CCC[C@H](C)C1 ZINC000531697434 1024272151 /nfs/dbraw/zinc/27/21/51/1024272151.db2.gz RALLRBHMZQZYLA-BPUTZDHNSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000531697434 1024272157 /nfs/dbraw/zinc/27/21/57/1024272157.db2.gz RALLRBHMZQZYLA-BPUTZDHNSA-N 1 1 319.449 3.674 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCc2c1c(F)ccc2F ZINC000269815566 1024316605 /nfs/dbraw/zinc/31/66/05/1024316605.db2.gz HYHJRSNWTBMNDE-AWEZNQCLSA-N 1 1 304.296 3.650 20 5 DHBDMO Cc1c(C[NH2+][C@H]2COc3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000790695419 1024356790 /nfs/dbraw/zinc/35/67/90/1024356790.db2.gz OKNKDQLSLREGQJ-AWEZNQCLSA-N 1 1 318.760 3.780 20 5 DHBDMO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000790697321 1024358320 /nfs/dbraw/zinc/35/83/20/1024358320.db2.gz ZFHPYYRJLGOUDB-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO CCC[N@@H+](CC(C)C)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170355298 1024751832 /nfs/dbraw/zinc/75/18/32/1024751832.db2.gz ZFHFLQPJHDADMB-CQSZACIVSA-N 1 1 308.422 3.902 20 5 DHBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(C)C ZINC000114725536 1024819251 /nfs/dbraw/zinc/81/92/51/1024819251.db2.gz MPTLXOKBYQBCEH-UHFFFAOYSA-N 1 1 317.389 3.770 20 5 DHBDMO CC1(C)CC[C@H](C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)O1 ZINC001170424646 1024866307 /nfs/dbraw/zinc/86/63/07/1024866307.db2.gz OGIGWHLLLVIHQZ-NVXWUHKLSA-N 1 1 318.417 3.732 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000170719144 1024867217 /nfs/dbraw/zinc/86/72/17/1024867217.db2.gz SGFUPQRHINDYCH-JQWIXIFHSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000170719144 1024867235 /nfs/dbraw/zinc/86/72/35/1024867235.db2.gz SGFUPQRHINDYCH-JQWIXIFHSA-N 1 1 302.296 3.930 20 5 DHBDMO CCC(CC)([NH2+]Cn1nccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000728900486 1024891223 /nfs/dbraw/zinc/89/12/23/1024891223.db2.gz KCCHBPYOVHZIPK-UHFFFAOYSA-N 1 1 322.796 3.707 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000353698539 1025204272 /nfs/dbraw/zinc/20/42/72/1025204272.db2.gz MZJYZUBQIXJFLC-KRWDZBQOSA-N 1 1 311.385 3.881 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000353698539 1025204282 /nfs/dbraw/zinc/20/42/82/1025204282.db2.gz MZJYZUBQIXJFLC-KRWDZBQOSA-N 1 1 311.385 3.881 20 5 DHBDMO C[C@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1cccnc1[N+](=O)[O-] ZINC000885956735 1025420307 /nfs/dbraw/zinc/42/03/07/1025420307.db2.gz XOBIJKAODFDINE-CQSZACIVSA-N 1 1 311.385 3.791 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cn2)cc1[N+](=O)[O-] ZINC000090217528 1025455166 /nfs/dbraw/zinc/45/51/66/1025455166.db2.gz WABAERLVZAHBFQ-NEPJUHHUSA-N 1 1 303.337 3.849 20 5 DHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000886209194 1025558435 /nfs/dbraw/zinc/55/84/35/1025558435.db2.gz HBUNFGAYORRXJB-TXEJJXNPSA-N 1 1 317.311 3.543 20 5 DHBDMO COc1cccc(NCCCC[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000355331460 1025680567 /nfs/dbraw/zinc/68/05/67/1025680567.db2.gz FSWLNKRDHOBXLQ-AWEZNQCLSA-N 1 1 321.421 3.527 20 5 DHBDMO CCCC[N@H+](C)CC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000052208639 1026258398 /nfs/dbraw/zinc/25/83/98/1026258398.db2.gz RHVNYVJEWUBIDM-UHFFFAOYSA-N 1 1 319.449 3.539 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000052208639 1026258416 /nfs/dbraw/zinc/25/84/16/1026258416.db2.gz RHVNYVJEWUBIDM-UHFFFAOYSA-N 1 1 319.449 3.539 20 5 DHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513490097 1026521349 /nfs/dbraw/zinc/52/13/49/1026521349.db2.gz LZXCMSDPIUCHOL-CQSZACIVSA-N 1 1 314.385 3.666 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cc1 ZINC000420951114 1026890130 /nfs/dbraw/zinc/89/01/30/1026890130.db2.gz QMQQFMPHTOTEMM-GFCCVEGCSA-N 1 1 302.296 3.759 20 5 DHBDMO CC(C)(C)c1n[nH]cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000183802781 1027231783 /nfs/dbraw/zinc/23/17/83/1027231783.db2.gz SQIMSYUKJUZBAP-UHFFFAOYSA-N 1 1 322.796 3.559 20 5 DHBDMO CC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCOC1 ZINC000812780650 1027401132 /nfs/dbraw/zinc/40/11/32/1027401132.db2.gz LYOJDBVEPYDLPX-NSHDSACASA-N 1 1 319.188 3.512 20 5 DHBDMO CC[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCOC1 ZINC000812780650 1027401140 /nfs/dbraw/zinc/40/11/40/1027401140.db2.gz LYOJDBVEPYDLPX-NSHDSACASA-N 1 1 319.188 3.512 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](Cc3nccs3)C2)cs1 ZINC000932200809 1027410762 /nfs/dbraw/zinc/41/07/62/1027410762.db2.gz ZFOXUEFTGSOMTF-NSHDSACASA-N 1 1 323.443 3.568 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)cs1 ZINC000932200809 1027410775 /nfs/dbraw/zinc/41/07/75/1027410775.db2.gz ZFOXUEFTGSOMTF-NSHDSACASA-N 1 1 323.443 3.568 20 5 DHBDMO C[C@@H](c1ccccc1)[C@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000932276677 1027443285 /nfs/dbraw/zinc/44/32/85/1027443285.db2.gz VLTFUPLVQLFSTL-WMLDXEAASA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@]1([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])CCOc2ccccc21 ZINC000933368434 1027724048 /nfs/dbraw/zinc/72/40/48/1027724048.db2.gz DNZMMWKGNGYDCL-KRWDZBQOSA-N 1 1 316.332 3.521 20 5 DHBDMO CCOC1(C)CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000814170451 1027924508 /nfs/dbraw/zinc/92/45/08/1027924508.db2.gz WIDKKIGZMCLXHJ-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000217198333 1028218634 /nfs/dbraw/zinc/21/86/34/1028218634.db2.gz YRWPFXZXMIAHDB-KRWDZBQOSA-N 1 1 314.360 3.723 20 5 DHBDMO CCC[N@@H+](CCc1ccccn1)Cc1ccc([N+](=O)[O-])cc1C ZINC000579175109 1028339398 /nfs/dbraw/zinc/33/93/98/1028339398.db2.gz LGQRRDZJRYDZLL-UHFFFAOYSA-N 1 1 313.401 3.753 20 5 DHBDMO CO[C@H]1CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1(C)C ZINC000449499313 1028712150 /nfs/dbraw/zinc/71/21/50/1028712150.db2.gz LSXYFOSUFVJAKU-SHRNQRGKSA-N 1 1 318.417 3.745 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cncc(F)c3)C2)cc1 ZINC000449500877 1028718012 /nfs/dbraw/zinc/71/80/12/1028718012.db2.gz ONYDZMGHMCDIKY-HNNXBMFYSA-N 1 1 315.348 3.509 20 5 DHBDMO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000449563058 1028805887 /nfs/dbraw/zinc/80/58/87/1028805887.db2.gz QSXHRZJRXLBQOB-ZDUSSCGKSA-N 1 1 316.405 3.785 20 5 DHBDMO CC(=O)c1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000450649110 1029595430 /nfs/dbraw/zinc/59/54/30/1029595430.db2.gz QAGMQEXDESKXFZ-UHFFFAOYSA-N 1 1 324.380 3.962 20 5 DHBDMO CC(=O)c1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000450649110 1029595434 /nfs/dbraw/zinc/59/54/34/1029595434.db2.gz QAGMQEXDESKXFZ-UHFFFAOYSA-N 1 1 324.380 3.962 20 5 DHBDMO CC(C)[N@@H+]1CCCC[C@@H]1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451101743 1029795679 /nfs/dbraw/zinc/79/56/79/1029795679.db2.gz FVAFFHPQAIBSCP-WMLDXEAASA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)[N@H+]1CCCC[C@@H]1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451101743 1029795685 /nfs/dbraw/zinc/79/56/85/1029795685.db2.gz FVAFFHPQAIBSCP-WMLDXEAASA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1cnc([C@@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451545911 1029907372 /nfs/dbraw/zinc/90/73/72/1029907372.db2.gz HVDKQKGEEXJSRT-HIFRSBDPSA-N 1 1 315.373 3.832 20 5 DHBDMO C[C@@H](c1cccnc1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451547182 1029910777 /nfs/dbraw/zinc/91/07/77/1029910777.db2.gz KMHICDFBWBYUJH-YOEHRIQHSA-N 1 1 311.385 3.930 20 5 DHBDMO O=C1CCC(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451547626 1029912282 /nfs/dbraw/zinc/91/22/82/1029912282.db2.gz LGIGDYKOXVFOFY-INIZCTEOSA-N 1 1 316.401 3.534 20 5 DHBDMO O=C1CCC(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451547627 1029913829 /nfs/dbraw/zinc/91/38/29/1029913829.db2.gz LGIGDYKOXVFOFY-MRXNPFEDSA-N 1 1 316.401 3.534 20 5 DHBDMO C[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC[C@H]1C ZINC000467839485 1029975343 /nfs/dbraw/zinc/97/53/43/1029975343.db2.gz MXOKHFPCAXTRHV-KFWWJZLASA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000467839485 1029975353 /nfs/dbraw/zinc/97/53/53/1029975353.db2.gz MXOKHFPCAXTRHV-KFWWJZLASA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1nc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(C)s1 ZINC000866539550 1030358363 /nfs/dbraw/zinc/35/83/63/1030358363.db2.gz CRWLIVGDWIYQAZ-JTQLQIEISA-N 1 1 305.403 3.827 20 5 DHBDMO CC(C)([NH2+]Cc1ccc(F)cc1F)c1ccccc1[N+](=O)[O-] ZINC000291719881 1030617459 /nfs/dbraw/zinc/61/74/59/1030617459.db2.gz MIYFNFJYWBVAHC-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000558577427 1030657367 /nfs/dbraw/zinc/65/73/67/1030657367.db2.gz MEUHGRXPPDDAAS-GFCCVEGCSA-N 1 1 310.394 3.623 20 5 DHBDMO CC[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC1CC1 ZINC000123017600 1030952001 /nfs/dbraw/zinc/95/20/01/1030952001.db2.gz CFIHRBGTSCXDGC-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO CC(C)[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1cnn(C)c1 ZINC000927067504 1031064512 /nfs/dbraw/zinc/06/45/12/1031064512.db2.gz RKDQMTDQDIJJKL-ZBEGNZNMSA-N 1 1 320.368 3.515 20 5 DHBDMO Cc1c(C[NH2+]Cc2ncc(C(C)C)s2)cccc1[N+](=O)[O-] ZINC000359790826 1031140465 /nfs/dbraw/zinc/14/04/65/1031140465.db2.gz DZGMKMQUQGZZFO-UHFFFAOYSA-N 1 1 305.403 3.773 20 5 DHBDMO COc1ccccc1/C=C/C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536672634 1031381235 /nfs/dbraw/zinc/38/12/35/1031381235.db2.gz ZHLXMVYZGYEZLH-VMPITWQZSA-N 1 1 324.380 3.675 20 5 DHBDMO COc1ccccc1/C=C/C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536672634 1031381246 /nfs/dbraw/zinc/38/12/46/1031381246.db2.gz ZHLXMVYZGYEZLH-VMPITWQZSA-N 1 1 324.380 3.675 20 5 DHBDMO Cc1nc(C)c(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])s1 ZINC000872038789 1031424362 /nfs/dbraw/zinc/42/43/62/1031424362.db2.gz OKDYBDZXRHCCGH-VIFPVBQESA-N 1 1 309.366 3.658 20 5 DHBDMO COc1ccc([C@H](C)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000537206325 1031532335 /nfs/dbraw/zinc/53/23/35/1031532335.db2.gz IHTRMIMXFFGXRD-CQSZACIVSA-N 1 1 314.385 3.839 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872282453 1031576692 /nfs/dbraw/zinc/57/66/92/1031576692.db2.gz KWGBRLDKVKDYFE-INIZCTEOSA-N 1 1 322.380 3.658 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(C(F)F)cc2)c(F)c1 ZINC000360833158 1031582258 /nfs/dbraw/zinc/58/22/58/1031582258.db2.gz MNRPTRJQAYULAL-UHFFFAOYSA-N 1 1 310.275 3.961 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000361023672 1031683849 /nfs/dbraw/zinc/68/38/49/1031683849.db2.gz XSEAAZUODFNFID-UHFFFAOYSA-N 1 1 324.380 3.656 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000361023672 1031683854 /nfs/dbraw/zinc/68/38/54/1031683854.db2.gz XSEAAZUODFNFID-UHFFFAOYSA-N 1 1 324.380 3.656 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cccc(F)c1F ZINC000873147682 1031724140 /nfs/dbraw/zinc/72/41/40/1031724140.db2.gz YCOQXOVPYLWKKB-UHFFFAOYSA-N 1 1 306.312 3.780 20 5 DHBDMO CCc1cnccc1[C@@H](C)[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000361121007 1031741091 /nfs/dbraw/zinc/74/10/91/1031741091.db2.gz TTWAALWZAQHNLG-LLVKDONJSA-N 1 1 303.337 3.542 20 5 DHBDMO Cc1c(C[N@@H+]2Cc3ccc(O)cc3C3(CC3)C2)cccc1[N+](=O)[O-] ZINC000361560899 1031985731 /nfs/dbraw/zinc/98/57/31/1031985731.db2.gz HSYMZZXXQFIUIE-UHFFFAOYSA-N 1 1 324.380 3.656 20 5 DHBDMO Cc1c(C[N@H+]2Cc3ccc(O)cc3C3(CC3)C2)cccc1[N+](=O)[O-] ZINC000361560899 1031985751 /nfs/dbraw/zinc/98/57/51/1031985751.db2.gz HSYMZZXXQFIUIE-UHFFFAOYSA-N 1 1 324.380 3.656 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1cnccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000294480579 1032020924 /nfs/dbraw/zinc/02/09/24/1032020924.db2.gz XGXMRSNRQCPXPS-MRXNPFEDSA-N 1 1 315.373 3.629 20 5 DHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777957504 1032042717 /nfs/dbraw/zinc/04/27/17/1032042717.db2.gz RITQDLCOJHQUAV-BBRMVZONSA-N 1 1 314.389 3.536 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294542491 1032053722 /nfs/dbraw/zinc/05/37/22/1032053722.db2.gz AKXVODXPDHUNTK-NXEZZACHSA-N 1 1 321.327 3.867 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000877522899 1033332535 /nfs/dbraw/zinc/33/25/35/1033332535.db2.gz DXPJGAISNGMDAG-GOSISDBHSA-N 1 1 311.385 3.944 20 5 DHBDMO C[C@@]1(F)CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172906110 1033437529 /nfs/dbraw/zinc/43/75/29/1033437529.db2.gz WILNKDKVPPEXOL-DOTOQJQBSA-N 1 1 306.381 3.666 20 5 DHBDMO C[C@]1(F)CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C[C@@H]1F ZINC001172905815 1033438245 /nfs/dbraw/zinc/43/82/45/1033438245.db2.gz UUHYVNNSNZLTPG-PVAVHDDUSA-N 1 1 324.371 3.614 20 5 DHBDMO C[C@@]1(CF)CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172906706 1033440915 /nfs/dbraw/zinc/44/09/15/1033440915.db2.gz YAYJPEFNKBWDMG-WBVHZDCISA-N 1 1 306.381 3.524 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC3CCC1CC3)CC2 ZINC001172914145 1033462702 /nfs/dbraw/zinc/46/27/02/1033462702.db2.gz DAEPKXSVYWGXAO-IMRCBTMISA-N 1 1 300.402 3.717 20 5 DHBDMO CC[C@@H]1CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172919318 1033467478 /nfs/dbraw/zinc/46/74/78/1033467478.db2.gz FVNDVBMDCYMMAN-RHSMWYFYSA-N 1 1 302.418 3.964 20 5 DHBDMO Cc1cc2c(cn1)C[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172919888 1033467607 /nfs/dbraw/zinc/46/76/07/1033467607.db2.gz HTPWIVFQMRLZJS-SFHVURJKSA-N 1 1 323.396 3.561 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000152554297 1033526832 /nfs/dbraw/zinc/52/68/32/1033526832.db2.gz SZPOJHHVZSJORF-CHWSQXEVSA-N 1 1 315.373 3.800 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccccc2F)cc1[N+](=O)[O-] ZINC000152569120 1033529669 /nfs/dbraw/zinc/52/96/69/1033529669.db2.gz DEKUPBTXHVGLTM-LBPRGKRZSA-N 1 1 318.348 3.983 20 5 DHBDMO COC1(CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCC1 ZINC000339022156 1033560042 /nfs/dbraw/zinc/56/00/42/1033560042.db2.gz KYDMHGSPYHLIHV-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2sccc2C1 ZINC001173221193 1033599560 /nfs/dbraw/zinc/59/95/60/1033599560.db2.gz GEPGCMHZCJGDMA-LBPRGKRZSA-N 1 1 302.399 3.646 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(F)(F)C(C)(C)C1 ZINC001173220777 1033600659 /nfs/dbraw/zinc/60/06/59/1033600659.db2.gz CISAEKWDGMPUDT-GFCCVEGCSA-N 1 1 312.360 3.893 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccc(F)cc2C1 ZINC001173234639 1033609485 /nfs/dbraw/zinc/60/94/85/1033609485.db2.gz SXLZGHFYZGUMEN-ZDUSSCGKSA-N 1 1 314.360 3.723 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)nc1Cl ZINC000878355076 1033669889 /nfs/dbraw/zinc/66/98/89/1033669889.db2.gz CXXGVHAHVWLQIO-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO Cc1c(F)nccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000862220537 1033784024 /nfs/dbraw/zinc/78/40/24/1033784024.db2.gz WCJRLNMUVAVAIJ-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cc1c(F)nccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000862220537 1033784036 /nfs/dbraw/zinc/78/40/36/1033784036.db2.gz WCJRLNMUVAVAIJ-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cc1c([C@@H](C)NCCC[N@H+]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000479885820 1033947600 /nfs/dbraw/zinc/94/76/00/1033947600.db2.gz PGTGYGCEPNOWRC-GOEBONIOSA-N 1 1 319.449 3.818 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC000880000800 1034178622 /nfs/dbraw/zinc/17/86/22/1034178622.db2.gz KXFPYIRUCCRRGU-GXFFZTMASA-N 1 1 302.296 3.930 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000880316704 1034291263 /nfs/dbraw/zinc/29/12/63/1034291263.db2.gz GBOOQVVJZREQMY-NSHDSACASA-N 1 1 323.805 3.694 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880316704 1034291277 /nfs/dbraw/zinc/29/12/77/1034291277.db2.gz GBOOQVVJZREQMY-NSHDSACASA-N 1 1 323.805 3.694 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccnc(Cl)c2)C2CC2)cc1 ZINC000179518663 1034312715 /nfs/dbraw/zinc/31/27/15/1034312715.db2.gz ZGYGYDICKINISE-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccnc(Cl)c2)C2CC2)cc1 ZINC000179518663 1034312727 /nfs/dbraw/zinc/31/27/27/1034312727.db2.gz ZGYGYDICKINISE-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@H]2CCC(C)(C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000794683322 1034340373 /nfs/dbraw/zinc/34/03/73/1034340373.db2.gz DFXFKWCQWNXWHX-AWEZNQCLSA-N 1 1 316.405 3.721 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H](C)[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000480619830 1034354177 /nfs/dbraw/zinc/35/41/77/1034354177.db2.gz BHYAQNAHDNOUKT-BMFZPTHFSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000480619830 1034354184 /nfs/dbraw/zinc/35/41/84/1034354184.db2.gz BHYAQNAHDNOUKT-BMFZPTHFSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000480658308 1034377550 /nfs/dbraw/zinc/37/75/50/1034377550.db2.gz AWQRZOPEQBDETG-HZPDHXFCSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1cnc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2C)s1 ZINC000183538044 1034397292 /nfs/dbraw/zinc/39/72/92/1034397292.db2.gz QEKUBCWWHZMBPH-UHFFFAOYSA-N 1 1 305.403 3.693 20 5 DHBDMO Cc1c([C@H](C)[NH2+][C@H](C)CN2CCCCCC2)cccc1[N+](=O)[O-] ZINC000480700334 1034412389 /nfs/dbraw/zinc/41/23/89/1034412389.db2.gz QPTSYBMXRUUJET-ZBFHGGJFSA-N 1 1 319.449 3.818 20 5 DHBDMO CC[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865480495 1034669768 /nfs/dbraw/zinc/66/97/68/1034669768.db2.gz NUNOPGZHSPQGAZ-NSHDSACASA-N 1 1 313.348 3.676 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc2n[nH]cc21)C1CC1 ZINC000600111762 1034746515 /nfs/dbraw/zinc/74/65/15/1034746515.db2.gz LWEUQOQQZMVKKN-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(Cn3c[nH+]c4c3CCCC4)o2)cc1 ZINC000600179867 1034793205 /nfs/dbraw/zinc/79/32/05/1034793205.db2.gz ZPLKJHKZZPIBPP-UHFFFAOYSA-N 1 1 323.352 3.978 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@@H](c2ccc(O)cc2)C1 ZINC000600213446 1034808899 /nfs/dbraw/zinc/80/88/99/1034808899.db2.gz FSTCMECIOWSGJD-NJELEJDNSA-N 1 1 324.380 3.803 20 5 DHBDMO Cc1ccc([C@H](C)NCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000481408208 1034817960 /nfs/dbraw/zinc/81/79/60/1034817960.db2.gz SYKSAXUBGDTDDN-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]CCN(C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000481408208 1034817976 /nfs/dbraw/zinc/81/79/76/1034817976.db2.gz SYKSAXUBGDTDDN-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO CCc1cnc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000192910921 1034822151 /nfs/dbraw/zinc/82/21/51/1034822151.db2.gz JUUOHGLTJIXFJJ-OAHLLOKOSA-N 1 1 317.414 3.781 20 5 DHBDMO CC(C)[N@H+](CCc1nccs1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000159832163 1035095489 /nfs/dbraw/zinc/09/54/89/1035095489.db2.gz AUTZXFFBNFYGDN-UHFFFAOYSA-N 1 1 323.393 3.644 20 5 DHBDMO CC(C)[N@@H+](CCc1nccs1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000159832163 1035095496 /nfs/dbraw/zinc/09/54/96/1035095496.db2.gz AUTZXFFBNFYGDN-UHFFFAOYSA-N 1 1 323.393 3.644 20 5 DHBDMO Cc1ccc([C@@H](C)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000482630805 1035149751 /nfs/dbraw/zinc/14/97/51/1035149751.db2.gz MVVDWHQVVZKENP-OWCLPIDISA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]CCN2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000482630805 1035149755 /nfs/dbraw/zinc/14/97/55/1035149755.db2.gz MVVDWHQVVZKENP-OWCLPIDISA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1c([C@@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000483195226 1035238806 /nfs/dbraw/zinc/23/88/06/1035238806.db2.gz JMEGLCSUBKEEFX-PBHICJAKSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1c([C@@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000483195226 1035238810 /nfs/dbraw/zinc/23/88/10/1035238810.db2.gz JMEGLCSUBKEEFX-PBHICJAKSA-N 1 1 321.465 3.920 20 5 DHBDMO CC1(C)C[C@@H](c2ccccc2)C[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001176657008 1035315712 /nfs/dbraw/zinc/31/57/12/1035315712.db2.gz MXUQCFQVSJGABW-MRXNPFEDSA-N 1 1 311.385 3.758 20 5 DHBDMO Cc1cc(C)c2c(c1)CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C2 ZINC001177033682 1035341563 /nfs/dbraw/zinc/34/15/63/1035341563.db2.gz ORWAZXFFHKALDE-UHFFFAOYSA-N 1 1 314.360 3.909 20 5 DHBDMO Cc1cc(C)c2c(c1)CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C2 ZINC001177033682 1035341569 /nfs/dbraw/zinc/34/15/69/1035341569.db2.gz ORWAZXFFHKALDE-UHFFFAOYSA-N 1 1 314.360 3.909 20 5 DHBDMO Cc1ccnc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)c1 ZINC001179473119 1035479836 /nfs/dbraw/zinc/47/98/36/1035479836.db2.gz NKVPPTBHCUTYNK-UHFFFAOYSA-N 1 1 323.352 3.848 20 5 DHBDMO Cc1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc(C)n1 ZINC001179909919 1035547166 /nfs/dbraw/zinc/54/71/66/1035547166.db2.gz WXDHHWYEJUPYRK-UHFFFAOYSA-N 1 1 311.385 3.771 20 5 DHBDMO Cc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc(C)n1 ZINC001179909919 1035547180 /nfs/dbraw/zinc/54/71/80/1035547180.db2.gz WXDHHWYEJUPYRK-UHFFFAOYSA-N 1 1 311.385 3.771 20 5 DHBDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)C1(C)C ZINC001179962934 1035563047 /nfs/dbraw/zinc/56/30/47/1035563047.db2.gz UPDWRBTUXOVUOX-FUHWJXTLSA-N 1 1 320.433 3.847 20 5 DHBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)C1(C)C ZINC001179962933 1035563090 /nfs/dbraw/zinc/56/30/90/1035563090.db2.gz UPDWRBTUXOVUOX-AEFFLSMTSA-N 1 1 320.433 3.847 20 5 DHBDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089904021 1035784109 /nfs/dbraw/zinc/78/41/09/1035784109.db2.gz IJNBQLTZYIPSSE-QWHCGFSZSA-N 1 1 315.373 3.870 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)C2 ZINC000539829627 1035888197 /nfs/dbraw/zinc/88/81/97/1035888197.db2.gz PUWYCCHLTAAPSH-WMZOPIPTSA-N 1 1 308.381 3.757 20 5 DHBDMO C[C@H]1CSCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000539841154 1035898416 /nfs/dbraw/zinc/89/84/16/1035898416.db2.gz RHVHFHMJWCJAGU-LBPRGKRZSA-N 1 1 318.398 3.792 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000485733594 1035921380 /nfs/dbraw/zinc/92/13/80/1035921380.db2.gz BBYXSXCEJSRCOK-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@H]([C@@H]3CCCC3(C)C)C2)c1[N+](=O)[O-] ZINC000595558962 1036233925 /nfs/dbraw/zinc/23/39/25/1036233925.db2.gz RMDKHNONOLJFMC-STQMWFEESA-N 1 1 307.394 3.539 20 5 DHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)C[C@@H]1CCCCO1 ZINC000541773699 1036429593 /nfs/dbraw/zinc/42/95/93/1036429593.db2.gz JIECYZXGXATJST-KRWDZBQOSA-N 1 1 306.406 3.684 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000464782367 1036454794 /nfs/dbraw/zinc/45/47/94/1036454794.db2.gz YLYJJKHJEXRBGA-HOCLYGCPSA-N 1 1 324.446 3.580 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000464782356 1036455100 /nfs/dbraw/zinc/45/51/00/1036455100.db2.gz YLYJJKHJEXRBGA-GDBMZVCRSA-N 1 1 324.446 3.580 20 5 DHBDMO CS[C@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000542000489 1036485654 /nfs/dbraw/zinc/48/56/54/1036485654.db2.gz NHHGADYUPTYJNJ-ZDUSSCGKSA-N 1 1 314.838 3.966 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC001182948712 1036487027 /nfs/dbraw/zinc/48/70/27/1036487027.db2.gz CTADSULCFUZZCQ-KGLIPLIRSA-N 1 1 306.431 3.682 20 5 DHBDMO C/C=C/C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001196606747 1036572549 /nfs/dbraw/zinc/57/25/49/1036572549.db2.gz WOEHUBWSFRODOM-RDFMZFSFSA-N 1 1 304.390 3.782 20 5 DHBDMO CCOc1cc(C[N@@H+](C)C[C@H]2CC=CCC2)ccc1[N+](=O)[O-] ZINC000491651944 1036618221 /nfs/dbraw/zinc/61/82/21/1036618221.db2.gz DICVEWFJVFCMBQ-AWEZNQCLSA-N 1 1 304.390 3.782 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](C3CCC3)CC2)cc1 ZINC001197202079 1036707629 /nfs/dbraw/zinc/70/76/29/1036707629.db2.gz LORFEQRAMPSWAC-CRAIPNDOSA-N 1 1 318.417 3.530 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(F)cc1C ZINC000487962286 1036843067 /nfs/dbraw/zinc/84/30/67/1036843067.db2.gz XZUJULKLSDNTTQ-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(F)cc1C ZINC000487962286 1036843084 /nfs/dbraw/zinc/84/30/84/1036843084.db2.gz XZUJULKLSDNTTQ-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000492626172 1036946786 /nfs/dbraw/zinc/94/67/86/1036946786.db2.gz ADUDZTSSWMVBJP-LSDHHAIUSA-N 1 1 304.390 3.758 20 5 DHBDMO CCOc1cc(C[N@@H+]2CC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000492650215 1036959129 /nfs/dbraw/zinc/95/91/29/1036959129.db2.gz IVZDPRIFBWPRJL-INIZCTEOSA-N 1 1 312.369 3.941 20 5 DHBDMO CCOc1cc(C[N@H+]2CC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000492650215 1036959145 /nfs/dbraw/zinc/95/91/45/1036959145.db2.gz IVZDPRIFBWPRJL-INIZCTEOSA-N 1 1 312.369 3.941 20 5 DHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2C[C@@H](C3CC3)C[C@H]2C2CC2)c(F)c1 ZINC001198277154 1036988443 /nfs/dbraw/zinc/98/84/43/1036988443.db2.gz BANSMONXXSGPNP-SJCJKPOMSA-N 1 1 322.355 3.884 20 5 DHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])CC1CCCCC1 ZINC000774826006 1037018993 /nfs/dbraw/zinc/01/89/93/1037018993.db2.gz JZFNQSQCKPFORH-UHFFFAOYSA-N 1 1 307.350 3.515 20 5 DHBDMO C[C@H]1CSCCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001198517079 1037053790 /nfs/dbraw/zinc/05/37/90/1037053790.db2.gz JNASKYPKICTDKV-JTQLQIEISA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@H]1CSCCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001198517079 1037053806 /nfs/dbraw/zinc/05/38/06/1037053806.db2.gz JNASKYPKICTDKV-JTQLQIEISA-N 1 1 300.811 3.576 20 5 DHBDMO CC(C)CCOCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490042578 1037593956 /nfs/dbraw/zinc/59/39/56/1037593956.db2.gz IWUVJKUASFMMMK-UHFFFAOYSA-N 1 1 306.406 3.622 20 5 DHBDMO CC(C)[N@H+]1CC[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301124891 1037661747 /nfs/dbraw/zinc/66/17/47/1037661747.db2.gz PILWUYKQBZKHAO-NSHDSACASA-N 1 1 317.311 3.508 20 5 DHBDMO Cc1ccc(F)cc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC001201424901 1037665370 /nfs/dbraw/zinc/66/53/70/1037665370.db2.gz IMHKBFWYANTWKW-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO CC[C@H](C)[C@@H](C)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000154010724 1037769930 /nfs/dbraw/zinc/76/99/30/1037769930.db2.gz HLPGKZISNNWETR-AHIWAGSCSA-N 1 1 306.406 3.527 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000609195608 1038073080 /nfs/dbraw/zinc/07/30/80/1038073080.db2.gz RZFHFKTWGCHWFM-MRXNPFEDSA-N 1 1 304.390 3.756 20 5 DHBDMO COc1cc(F)cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000776253254 1038074819 /nfs/dbraw/zinc/07/48/19/1038074819.db2.gz UIKIEGIXCNFFLU-UHFFFAOYSA-N 1 1 324.739 3.686 20 5 DHBDMO Cc1ccc(OCC[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000917021524 1038120797 /nfs/dbraw/zinc/12/07/97/1038120797.db2.gz YUYNHMYXCAJADE-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO Cc1ccc(OCC[N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000917021524 1038120803 /nfs/dbraw/zinc/12/08/03/1038120803.db2.gz YUYNHMYXCAJADE-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc2cnccc21 ZINC000589183805 1038444468 /nfs/dbraw/zinc/44/44/68/1038444468.db2.gz QTADRDMJZQMWDA-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC(C)(C)[C@H]2CCC[C@H]21 ZINC000590203762 1038604640 /nfs/dbraw/zinc/60/46/40/1038604640.db2.gz ZCOTXRDAFDVAOK-LSDHHAIUSA-N 1 1 304.390 3.614 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000590601957 1038676400 /nfs/dbraw/zinc/67/64/00/1038676400.db2.gz UFHIDMTXLRNZMG-GOEBONIOSA-N 1 1 311.385 3.930 20 5 DHBDMO C[C@H](c1ccncc1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590757329 1038699573 /nfs/dbraw/zinc/69/95/73/1038699573.db2.gz PXFPTEAHWGEMIS-RHSMWYFYSA-N 1 1 311.385 3.930 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cnc(C2CC2)o1 ZINC000590780116 1038703980 /nfs/dbraw/zinc/70/39/80/1038703980.db2.gz JIAQZBNSGYXFRA-LLVKDONJSA-N 1 1 301.346 3.619 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C2CC2)cc1 ZINC001192927888 1038721923 /nfs/dbraw/zinc/72/19/23/1038721923.db2.gz CZNQAGMOGGTJFX-OAGGEKHMSA-N 1 1 300.402 3.995 20 5 DHBDMO CC[N@@H+](Cn1nc(C)c2ccc([N+](=O)[O-])cc21)[C@H](C)C(C)C ZINC000761290084 1038884048 /nfs/dbraw/zinc/88/40/48/1038884048.db2.gz KVKYMBCRTXXOEG-CYBMUJFWSA-N 1 1 304.394 3.577 20 5 DHBDMO C[C@H](NC[C@H]1CC[N@@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000599064135 1039020657 /nfs/dbraw/zinc/02/06/57/1039020657.db2.gz KHLGSEVHASXTMG-KBXCAEBGSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H](NC[C@H]1CC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000599064135 1039020677 /nfs/dbraw/zinc/02/06/77/1039020677.db2.gz KHLGSEVHASXTMG-KBXCAEBGSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H](NC[C@@H]1CC[N@@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599065721 1039021486 /nfs/dbraw/zinc/02/14/86/1039021486.db2.gz PWZYYUYQJMSBEL-KSSFIOAISA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H](NC[C@@H]1CC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599065721 1039021504 /nfs/dbraw/zinc/02/15/04/1039021504.db2.gz PWZYYUYQJMSBEL-KSSFIOAISA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H](NC[C@H]1CC[N@@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599065717 1039022358 /nfs/dbraw/zinc/02/23/58/1039022358.db2.gz PWZYYUYQJMSBEL-KBXCAEBGSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H](NC[C@H]1CC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599065717 1039022378 /nfs/dbraw/zinc/02/23/78/1039022378.db2.gz PWZYYUYQJMSBEL-KBXCAEBGSA-N 1 1 317.433 3.652 20 5 DHBDMO CCC[C@H](NC[C@H]1CCCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068649 1039024237 /nfs/dbraw/zinc/02/42/37/1039024237.db2.gz BLMKLBMPQPQHJZ-QAPCUYQASA-N 1 1 319.449 3.758 20 5 DHBDMO CCC[C@H](NC[C@H]1CCCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068649 1039024257 /nfs/dbraw/zinc/02/42/57/1039024257.db2.gz BLMKLBMPQPQHJZ-QAPCUYQASA-N 1 1 319.449 3.758 20 5 DHBDMO COc1ccccc1C1([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000592393104 1039176056 /nfs/dbraw/zinc/17/60/56/1039176056.db2.gz DIJVKQICWXZPAU-CYBMUJFWSA-N 1 1 312.369 3.943 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000592193762 1039185079 /nfs/dbraw/zinc/18/50/79/1039185079.db2.gz NDLAOFYQAUATIN-KBPBESRZSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000592193762 1039185089 /nfs/dbraw/zinc/18/50/89/1039185089.db2.gz NDLAOFYQAUATIN-KBPBESRZSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ccccc2[N+](=O)[O-])C1 ZINC000603860658 1039195353 /nfs/dbraw/zinc/19/53/53/1039195353.db2.gz OPZFRJIMWPAWMC-GASCZTMLSA-N 1 1 305.422 3.765 20 5 DHBDMO CCn1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C(C)C)cn1 ZINC000593081304 1039426677 /nfs/dbraw/zinc/42/66/77/1039426677.db2.gz LZCGBIBYTCHFEF-UHFFFAOYSA-N 1 1 316.405 3.530 20 5 DHBDMO C[C@H]([NH2+][C@@H](CCO)c1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000592404264 1039449041 /nfs/dbraw/zinc/44/90/41/1039449041.db2.gz WMZXGFRHCKWQIB-SJCJKPOMSA-N 1 1 318.348 3.508 20 5 DHBDMO COc1ccccc1CC[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000075716790 1039483129 /nfs/dbraw/zinc/48/31/29/1039483129.db2.gz RNSPRZHETKNQOT-AWEZNQCLSA-N 1 1 314.385 3.839 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594026293 1039950715 /nfs/dbraw/zinc/95/07/15/1039950715.db2.gz IJASOMHFLJLWRP-UKRRQHHQSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594026291 1039951300 /nfs/dbraw/zinc/95/13/00/1039951300.db2.gz IJASOMHFLJLWRP-DZGCQCFKSA-N 1 1 304.390 3.689 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594027744 1039954623 /nfs/dbraw/zinc/95/46/23/1039954623.db2.gz ZFXLKPYNJPRCOU-WMLDXEAASA-N 1 1 318.417 3.998 20 5 DHBDMO COc1ccc([C@H](C)[N@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000595288715 1040099197 /nfs/dbraw/zinc/09/91/97/1040099197.db2.gz KSLUOBNTUXYRHH-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000595288715 1040099216 /nfs/dbraw/zinc/09/92/16/1040099216.db2.gz KSLUOBNTUXYRHH-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO Cc1noc(C[N@@H+](C)[C@@H](C)Cc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000595320245 1040109176 /nfs/dbraw/zinc/10/91/76/1040109176.db2.gz GUEZOXWPAFABQG-JTQLQIEISA-N 1 1 323.780 3.608 20 5 DHBDMO Cc1noc(C[N@H+](C)[C@@H](C)Cc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000595320245 1040109181 /nfs/dbraw/zinc/10/91/81/1040109181.db2.gz GUEZOXWPAFABQG-JTQLQIEISA-N 1 1 323.780 3.608 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000595318222 1040109289 /nfs/dbraw/zinc/10/92/89/1040109289.db2.gz SLXWRFKCBVXFRO-GFCCVEGCSA-N 1 1 321.764 3.534 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000595371319 1040126390 /nfs/dbraw/zinc/12/63/90/1040126390.db2.gz BGVBBASRJJNPMT-UHFFFAOYSA-N 1 1 304.296 3.652 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(c2cccnc2)CC1 ZINC000595407770 1040130574 /nfs/dbraw/zinc/13/05/74/1040130574.db2.gz LAHWUHQVPYHUKE-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1cccc([N+](=O)[O-])c1 ZINC000595421774 1040133551 /nfs/dbraw/zinc/13/35/51/1040133551.db2.gz UWWOOQCGUSMVLV-OAHLLOKOSA-N 1 1 301.346 3.701 20 5 DHBDMO CC(C)([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1F ZINC000595511840 1040157041 /nfs/dbraw/zinc/15/70/41/1040157041.db2.gz RTKVVDOAMMNIKW-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000595788267 1040252331 /nfs/dbraw/zinc/25/23/31/1040252331.db2.gz HXAVPYIEVWQWRP-HFTRVMKXSA-N 1 1 318.417 3.937 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H](C4CCC4)C3)nc2c1 ZINC000595831556 1040264614 /nfs/dbraw/zinc/26/46/14/1040264614.db2.gz FTHDUDGOCWYCML-CYBMUJFWSA-N 1 1 315.373 3.748 20 5 DHBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])s1)Cc1ccccc1 ZINC000064029297 1040642237 /nfs/dbraw/zinc/64/22/37/1040642237.db2.gz UFKFJUVJYNKGPP-UHFFFAOYSA-N 1 1 305.403 3.590 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC3(CCSCC3)CC2)cs1 ZINC000602737822 1041190676 /nfs/dbraw/zinc/19/06/76/1041190676.db2.gz XVOASVOXMXNELP-UHFFFAOYSA-N 1 1 312.460 3.766 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000016419948 182044268 /nfs/dbraw/zinc/04/42/68/182044268.db2.gz SDQVJPMYVIZPBB-LBPRGKRZSA-N 1 1 315.329 3.696 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000016419948 182044269 /nfs/dbraw/zinc/04/42/69/182044269.db2.gz SDQVJPMYVIZPBB-LBPRGKRZSA-N 1 1 315.329 3.696 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCOCC1 ZINC000119651846 195010284 /nfs/dbraw/zinc/01/02/84/195010284.db2.gz OJWCGXHDACQDOO-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO Cc1ccc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000353176714 130156440 /nfs/dbraw/zinc/15/64/40/130156440.db2.gz YLHOUQGTDSYNPZ-UHFFFAOYSA-N 1 1 319.792 3.977 20 5 DHBDMO COC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000288482385 131327472 /nfs/dbraw/zinc/32/74/72/131327472.db2.gz GPMKGTNJTXQVFL-INIZCTEOSA-N 1 1 320.776 3.726 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCOC(C)(C)C1 ZINC000289365416 131379065 /nfs/dbraw/zinc/37/90/65/131379065.db2.gz ATMUBYBWVAHOIL-CQSZACIVSA-N 1 1 310.369 3.513 20 5 DHBDMO CCc1[nH+]ccn1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000289426124 131385346 /nfs/dbraw/zinc/38/53/46/131385346.db2.gz WYQWEWDARHUKIN-UHFFFAOYSA-N 1 1 300.145 3.709 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)cnc2Cl)cc1[N+](=O)[O-] ZINC000297264110 132006694 /nfs/dbraw/zinc/00/66/94/132006694.db2.gz KHBOWDVPRUXMOK-JTQLQIEISA-N 1 1 323.755 3.942 20 5 DHBDMO Cc1c(C[NH2+]C2(c3nccs3)CCCC2)cccc1[N+](=O)[O-] ZINC000081577856 331985829 /nfs/dbraw/zinc/98/58/29/331985829.db2.gz PEEBFCSCQQSXAP-UHFFFAOYSA-N 1 1 317.414 3.919 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000126057921 331992751 /nfs/dbraw/zinc/99/27/51/331992751.db2.gz NDWGEAVXLJAXLS-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO C[C@@H](c1ccco1)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000086235954 332019659 /nfs/dbraw/zinc/01/96/59/332019659.db2.gz MFLKQMYGTQDPJL-ZDUSSCGKSA-N 1 1 300.358 3.956 20 5 DHBDMO C[C@@H]1COCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000091814856 332112556 /nfs/dbraw/zinc/11/25/56/332112556.db2.gz PYYJHNBDHXZZDT-GFCCVEGCSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@@H]1COCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000091814856 332112557 /nfs/dbraw/zinc/11/25/57/332112557.db2.gz PYYJHNBDHXZZDT-GFCCVEGCSA-N 1 1 318.398 3.544 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C[C@H]3CCSC3)C2)cc1 ZINC000449495440 332308011 /nfs/dbraw/zinc/30/80/11/332308011.db2.gz DHVCOTQJOBMSBY-HIFRSBDPSA-N 1 1 306.431 3.527 20 5 DHBDMO CC(C)[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000535556158 335125446 /nfs/dbraw/zinc/12/54/46/335125446.db2.gz MXMCQHSEPFETEE-CQSZACIVSA-N 1 1 315.373 3.728 20 5 DHBDMO Cc1cnc(CC[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000182933529 333181532 /nfs/dbraw/zinc/18/15/32/333181532.db2.gz DEZQIHLSYKEGRZ-ZDUSSCGKSA-N 1 1 319.430 3.904 20 5 DHBDMO COc1ccc(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000531378409 333347484 /nfs/dbraw/zinc/34/74/84/333347484.db2.gz ITQGUHQGJULZMN-FZKQIMNGSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1ccc(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000531378409 333347485 /nfs/dbraw/zinc/34/74/85/333347485.db2.gz ITQGUHQGJULZMN-FZKQIMNGSA-N 1 1 312.369 3.796 20 5 DHBDMO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000571018717 333479598 /nfs/dbraw/zinc/47/95/98/333479598.db2.gz XLNDOROPRPLACI-STQMWFEESA-N 1 1 302.378 3.531 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)CC[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000343458260 335166043 /nfs/dbraw/zinc/16/60/43/335166043.db2.gz CAGFWZHMFKMUKF-HNNXBMFYSA-N 1 1 306.406 3.719 20 5 DHBDMO C[N@H+](CCCOCc1ccccc1)Cc1csc([N+](=O)[O-])c1 ZINC000343669145 335181481 /nfs/dbraw/zinc/18/14/81/335181481.db2.gz CEJFYBZHDSKNTO-UHFFFAOYSA-N 1 1 320.414 3.695 20 5 DHBDMO C[N@@H+](CCCOCc1ccccc1)Cc1csc([N+](=O)[O-])c1 ZINC000343669145 335181483 /nfs/dbraw/zinc/18/14/83/335181483.db2.gz CEJFYBZHDSKNTO-UHFFFAOYSA-N 1 1 320.414 3.695 20 5 DHBDMO CC[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000297509396 334242092 /nfs/dbraw/zinc/24/20/92/334242092.db2.gz CKWPXJIRMYRIDV-CQDKDKBSSA-N 1 1 300.362 3.538 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1cc(CC)no1)c1cccc([N+](=O)[O-])c1 ZINC000531976926 334347971 /nfs/dbraw/zinc/34/79/71/334347971.db2.gz RJCSIQUFJNATGS-MRXNPFEDSA-N 1 1 303.362 3.776 20 5 DHBDMO Cc1ccc(C)n1C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000331967210 336154656 /nfs/dbraw/zinc/15/46/56/336154656.db2.gz UBKOUFUWBMNTNY-UHFFFAOYSA-N 1 1 319.430 3.912 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCc2ccc(O)cc2C1 ZINC000332545401 336174177 /nfs/dbraw/zinc/17/41/77/336174177.db2.gz MPOZPYFRZLUJON-ZDUSSCGKSA-N 1 1 312.369 3.728 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCc2ccc(O)cc2C1 ZINC000332545401 336174179 /nfs/dbraw/zinc/17/41/79/336174179.db2.gz MPOZPYFRZLUJON-ZDUSSCGKSA-N 1 1 312.369 3.728 20 5 DHBDMO CC[N@@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000351970729 336184377 /nfs/dbraw/zinc/18/43/77/336184377.db2.gz ICPYBEUIUKUCJL-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO Cc1cc([C@H]2CCC[N@@H+]2C/C=C\c2ccccc2[N+](=O)[O-])on1 ZINC000352087509 336194279 /nfs/dbraw/zinc/19/42/79/336194279.db2.gz OGDOVMOANWKYBY-HQQUCIOCSA-N 1 1 313.357 3.742 20 5 DHBDMO Cc1cc([C@H]2CCC[N@H+]2C/C=C\c2ccccc2[N+](=O)[O-])on1 ZINC000352087509 336194280 /nfs/dbraw/zinc/19/42/80/336194280.db2.gz OGDOVMOANWKYBY-HQQUCIOCSA-N 1 1 313.357 3.742 20 5 DHBDMO Cc1cc([C@H]2CCC[N@@H+]2C/C=C/c2ccccc2[N+](=O)[O-])on1 ZINC000352087510 336194285 /nfs/dbraw/zinc/19/42/85/336194285.db2.gz OGDOVMOANWKYBY-IEXSPKMKSA-N 1 1 313.357 3.742 20 5 DHBDMO Cc1cc([C@H]2CCC[N@H+]2C/C=C/c2ccccc2[N+](=O)[O-])on1 ZINC000352087510 336194286 /nfs/dbraw/zinc/19/42/86/336194286.db2.gz OGDOVMOANWKYBY-IEXSPKMKSA-N 1 1 313.357 3.742 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000352546539 336223929 /nfs/dbraw/zinc/22/39/29/336223929.db2.gz WRBFQRBAVPKMGZ-CRAIPNDOSA-N 1 1 318.417 3.857 20 5 DHBDMO C[C@H](C1CC1)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104677111 336263571 /nfs/dbraw/zinc/26/35/71/336263571.db2.gz FTSUDMQZGUITHU-GFCCVEGCSA-N 1 1 315.373 3.523 20 5 DHBDMO C[N@H+]1CC[C@@H](Nc2ccc(F)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000301823997 336332486 /nfs/dbraw/zinc/33/24/86/336332486.db2.gz CWJXOKGXMVIJPK-NVXWUHKLSA-N 1 1 315.348 3.591 20 5 DHBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302067079 336346599 /nfs/dbraw/zinc/34/65/99/336346599.db2.gz WNAAUNNKWOBGDD-STQMWFEESA-N 1 1 321.396 3.799 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OC3CCC3)CC2)c(Cl)c1 ZINC000418092583 336399241 /nfs/dbraw/zinc/39/92/41/336399241.db2.gz PDYYMMCDLZMUGP-UHFFFAOYSA-N 1 1 324.808 3.782 20 5 DHBDMO Cc1cc[nH+]c(NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000362658588 336808180 /nfs/dbraw/zinc/80/81/80/336808180.db2.gz RRNXZVVWWMECMM-UHFFFAOYSA-N 1 1 311.263 3.929 20 5 DHBDMO Cc1nc(SCC[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000193744409 337079363 /nfs/dbraw/zinc/07/93/63/337079363.db2.gz AVSHDGIVSMTKSA-UHFFFAOYSA-N 1 1 317.414 3.522 20 5 DHBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+]Cc2cccnc2)c2ccccc2)c1 ZINC000179962962 337172782 /nfs/dbraw/zinc/17/27/82/337172782.db2.gz HJOFTDPBEVCSGM-IBGZPJMESA-N 1 1 319.364 3.869 20 5 DHBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccccc1F ZINC000180447004 337174701 /nfs/dbraw/zinc/17/47/01/337174701.db2.gz XNSSIBXUQQEBON-INIZCTEOSA-N 1 1 318.348 3.983 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccccc1F ZINC000180447022 337174719 /nfs/dbraw/zinc/17/47/19/337174719.db2.gz XNSSIBXUQQEBON-MRXNPFEDSA-N 1 1 318.348 3.983 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cc(O)cc(F)c2)C2CC2)cc1 ZINC000186182891 337254384 /nfs/dbraw/zinc/25/43/84/337254384.db2.gz WWLZQQOUWQRVNT-UHFFFAOYSA-N 1 1 316.332 3.604 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cc(O)cc(F)c2)C2CC2)cc1 ZINC000186182891 337254385 /nfs/dbraw/zinc/25/43/85/337254385.db2.gz WWLZQQOUWQRVNT-UHFFFAOYSA-N 1 1 316.332 3.604 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CSC)C1 ZINC000429295695 337271815 /nfs/dbraw/zinc/27/18/15/337271815.db2.gz QQMPFVPPSCYJDD-ZDUSSCGKSA-N 1 1 324.446 3.569 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000284203779 337575025 /nfs/dbraw/zinc/57/50/25/337575025.db2.gz SOWYAEWDQJVUPX-GFCCVEGCSA-N 1 1 315.329 3.662 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429137305 338071618 /nfs/dbraw/zinc/07/16/18/338071618.db2.gz SANBMMFFUGSSTJ-KBPBESRZSA-N 1 1 312.369 3.939 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429137305 338071619 /nfs/dbraw/zinc/07/16/19/338071619.db2.gz SANBMMFFUGSSTJ-KBPBESRZSA-N 1 1 312.369 3.939 20 5 DHBDMO CSC[C@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000430192894 338100554 /nfs/dbraw/zinc/10/05/54/338100554.db2.gz DRCSSUOYQRFSPH-PODYEWJSSA-N 1 1 306.431 3.683 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000430208711 338101421 /nfs/dbraw/zinc/10/14/21/338101421.db2.gz VGEASOHEFASLQC-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCc2ccccc2C1 ZINC000430211090 338101602 /nfs/dbraw/zinc/10/16/02/338101602.db2.gz WVUNUBDOTWOCHH-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H]3Cc3ccccc3)nc2c1 ZINC000437827963 338322785 /nfs/dbraw/zinc/32/27/85/338322785.db2.gz IEEMTUPYSBLTIS-CQSZACIVSA-N 1 1 323.352 3.553 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1C[C@H]1c1ccccc1 ZINC000463196835 339108851 /nfs/dbraw/zinc/10/88/51/339108851.db2.gz FZBXVNDDHYIXQW-ROUUACIJSA-N 1 1 310.397 3.873 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCC2(CCCCC2)O1 ZINC000467200640 339228077 /nfs/dbraw/zinc/22/80/77/339228077.db2.gz JCRBNZYGSWMQLF-MRXNPFEDSA-N 1 1 318.417 3.909 20 5 DHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCC2(CCCCC2)O1 ZINC000467200640 339228078 /nfs/dbraw/zinc/22/80/78/339228078.db2.gz JCRBNZYGSWMQLF-MRXNPFEDSA-N 1 1 318.417 3.909 20 5 DHBDMO CO[C@H]1C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC[C@@H]1C ZINC000467386259 339235994 /nfs/dbraw/zinc/23/59/94/339235994.db2.gz UWHIITPQOGRUDO-GUYCJALGSA-N 1 1 306.406 3.575 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCSC(C)(C)C1 ZINC000470169664 339312487 /nfs/dbraw/zinc/31/24/87/339312487.db2.gz HFAJBZLBQVKBJA-LCYFTJDESA-N 1 1 306.431 3.826 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2ccc(O)cc2C1 ZINC000470169976 339312597 /nfs/dbraw/zinc/31/25/97/339312597.db2.gz MSDYSFZMOMPOQH-ZROIWOOFSA-N 1 1 324.380 3.762 20 5 DHBDMO COC1CCC([N@@H+](C)C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000470173775 339312781 /nfs/dbraw/zinc/31/27/81/339312781.db2.gz FJORQVTZZKDCFX-KAMYIIQDSA-N 1 1 318.417 3.888 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000473162743 339383400 /nfs/dbraw/zinc/38/34/00/339383400.db2.gz QAALWRSBNJFNHL-LIRRHRJNSA-N 1 1 324.380 3.787 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000505612106 340173053 /nfs/dbraw/zinc/17/30/53/340173053.db2.gz OJSWMHTVICHEPR-HNNXBMFYSA-N 1 1 314.360 3.941 20 5 DHBDMO COc1ccc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1 ZINC000505770869 340177245 /nfs/dbraw/zinc/17/72/45/340177245.db2.gz ISKWAFGUHGCLHB-FNORWQNLSA-N 1 1 312.369 3.749 20 5 DHBDMO CC[C@H]1C[C@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000507793630 340231733 /nfs/dbraw/zinc/23/17/33/340231733.db2.gz HURPCPBVKZMFJD-PBHICJAKSA-N 1 1 318.417 3.764 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCSCC3)o2)cc1 ZINC000508632123 340248957 /nfs/dbraw/zinc/24/89/57/340248957.db2.gz SVJLKVMTLFPDFO-UHFFFAOYSA-N 1 1 318.398 3.794 20 5 DHBDMO COC[C@@H](C)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000510467225 340300423 /nfs/dbraw/zinc/30/04/23/340300423.db2.gz IOEYVONNVWSSGF-GFCCVEGCSA-N 1 1 320.414 3.790 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000511667951 340334668 /nfs/dbraw/zinc/33/46/68/340334668.db2.gz QNQBZYWJZWLLOI-HNNXBMFYSA-N 1 1 306.406 3.719 20 5 DHBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000511954933 340343763 /nfs/dbraw/zinc/34/37/63/340343763.db2.gz COYSBKQXWUHYRA-GFCCVEGCSA-N 1 1 316.357 3.705 20 5 DHBDMO Cc1c(C[NH2+]Cc2ccc(Cl)cc2F)cccc1[N+](=O)[O-] ZINC000231883936 340627182 /nfs/dbraw/zinc/62/71/82/340627182.db2.gz IZSDGOFLLRSVSO-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO CC(C)COc1ccccc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000236654793 340663377 /nfs/dbraw/zinc/66/33/77/340663377.db2.gz YLTONRXMMIYVRT-UHFFFAOYSA-N 1 1 314.385 3.919 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCOCc1ccccc1 ZINC000542702877 341018198 /nfs/dbraw/zinc/01/81/98/341018198.db2.gz XRPWXMOCFQUQKF-UHFFFAOYSA-N 1 1 314.385 3.552 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCOC1 ZINC000132093169 341116259 /nfs/dbraw/zinc/11/62/59/341116259.db2.gz MMKGZXPGKDGBNU-GFCCVEGCSA-N 1 1 318.398 3.544 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000547979690 341241854 /nfs/dbraw/zinc/24/18/54/341241854.db2.gz WNGOPCIWKDELPW-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]3C3CCCC3)nc2c1 ZINC000548508991 341265068 /nfs/dbraw/zinc/26/50/68/341265068.db2.gz QGSYOCCHTBUTOB-MRXNPFEDSA-N 1 1 314.389 3.626 20 5 DHBDMO Cn1c2ccccc2nc1C[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000080347072 341273032 /nfs/dbraw/zinc/27/30/32/341273032.db2.gz MKDMJYOZFBIIAD-UHFFFAOYSA-N 1 1 324.384 3.506 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(O)c1 ZINC000080932028 341276871 /nfs/dbraw/zinc/27/68/71/341276871.db2.gz PFZVXDKTAGCRRG-CYBMUJFWSA-N 1 1 300.358 3.884 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cc(C)cc(Cl)c1 ZINC000549733488 341301806 /nfs/dbraw/zinc/30/18/06/341301806.db2.gz GDBHZLUBLUIFJA-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000246076724 341323895 /nfs/dbraw/zinc/32/38/95/341323895.db2.gz DKXNPEXPBXIETC-CABCVRRESA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000246076724 341323896 /nfs/dbraw/zinc/32/38/96/341323896.db2.gz DKXNPEXPBXIETC-CABCVRRESA-N 1 1 310.394 3.594 20 5 DHBDMO CC(C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000552049210 341364957 /nfs/dbraw/zinc/36/49/57/341364957.db2.gz PDOSRVFRHMCFBD-UHFFFAOYSA-N 1 1 320.414 3.946 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@H]2CCCc3cn[nH]c32)cc1[N+](=O)[O-] ZINC000363826613 519836232 /nfs/dbraw/zinc/83/62/32/519836232.db2.gz NOXRZPIGYGYYRG-HNNXBMFYSA-N 1 1 314.389 3.609 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)cc1[N+](=O)[O-] ZINC000363826613 519836233 /nfs/dbraw/zinc/83/62/33/519836233.db2.gz NOXRZPIGYGYYRG-HNNXBMFYSA-N 1 1 314.389 3.609 20 5 DHBDMO CC(C)c1[nH+]ccn1C[C@H]1CCCN1c1ccccc1[N+](=O)[O-] ZINC000364828451 519880153 /nfs/dbraw/zinc/88/01/53/519880153.db2.gz DRMRDBJANRVVPB-CQSZACIVSA-N 1 1 314.389 3.584 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCc2cccnc21 ZINC000364998082 521354781 /nfs/dbraw/zinc/35/47/81/521354781.db2.gz FDYUDOYBFHVTHS-KRWDZBQOSA-N 1 1 311.385 3.889 20 5 DHBDMO CCc1noc(CC)c1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000124815899 522894238 /nfs/dbraw/zinc/89/42/38/522894238.db2.gz AMVLLWGJLPWMSF-NSHDSACASA-N 1 1 303.362 3.558 20 5 DHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000158093515 524759931 /nfs/dbraw/zinc/75/99/31/524759931.db2.gz PTSXUWRIXWMNAE-CYBMUJFWSA-N 1 1 318.398 3.654 20 5 DHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000158004148 524760346 /nfs/dbraw/zinc/76/03/46/524760346.db2.gz LWIHAAGYLDLIEY-CQSZACIVSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000366002071 525295391 /nfs/dbraw/zinc/29/53/91/525295391.db2.gz UJOYAVZFCFDDPN-PXAZEXFGSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000366002071 525295397 /nfs/dbraw/zinc/29/53/97/525295397.db2.gz UJOYAVZFCFDDPN-PXAZEXFGSA-N 1 1 315.348 3.712 20 5 DHBDMO Cc1c([C@@H](C)[NH2+][C@H](C)c2ccncc2F)cccc1[N+](=O)[O-] ZINC000338006525 525903677 /nfs/dbraw/zinc/90/36/77/525903677.db2.gz DIGQHMDOZLPGCH-VXGBXAGGSA-N 1 1 303.337 3.849 20 5 DHBDMO Cc1c([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cnn1C(C)(C)C ZINC000191350724 525919986 /nfs/dbraw/zinc/91/99/86/525919986.db2.gz XFMQHMBZQQPVDW-LBPRGKRZSA-N 1 1 316.405 3.706 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cccc(Cl)n2)cc1[N+](=O)[O-] ZINC000181819286 525927529 /nfs/dbraw/zinc/92/75/29/525927529.db2.gz IBGABGIEHMULIV-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCC1CCOCC1 ZINC000182843835 526089504 /nfs/dbraw/zinc/08/95/04/526089504.db2.gz DVSHFALZPYYHPI-AWEZNQCLSA-N 1 1 306.406 3.713 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H]3CCCO3)CC2)c(Cl)c1 ZINC000189130560 527348866 /nfs/dbraw/zinc/34/88/66/527348866.db2.gz HZBOZVCRUPPXNK-MRXNPFEDSA-N 1 1 324.808 3.639 20 5 DHBDMO CC(C)(CO)[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000340564301 535171857 /nfs/dbraw/zinc/17/18/57/535171857.db2.gz ZBUQXMUDCKLFSD-HNNXBMFYSA-N 1 1 320.414 3.506 20 5 DHBDMO COc1ncc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1Cl ZINC000284420962 537141622 /nfs/dbraw/zinc/14/16/22/537141622.db2.gz QTOCDFFFBVNNMK-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO CCOc1ncccc1C[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000151200029 1013068707 /nfs/dbraw/zinc/06/87/07/1013068707.db2.gz MXAMIGBGMNFXIL-MRXNPFEDSA-N 1 1 315.373 3.629 20 5 DHBDMO CC(C)[N@@H+](C)C[C@H](C)Nc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000314606413 1013560120 /nfs/dbraw/zinc/56/01/20/1013560120.db2.gz YMBYXWINCAJXIM-JTQLQIEISA-N 1 1 301.337 3.673 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCCc4ccccc4C3)nc2c1 ZINC000177062872 1013701492 /nfs/dbraw/zinc/70/14/92/1013701492.db2.gz XKLZQAOFBWXBRY-UHFFFAOYSA-N 1 1 323.352 3.684 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCc4ccccc4C3)nc2c1 ZINC000177062872 1013701496 /nfs/dbraw/zinc/70/14/96/1013701496.db2.gz XKLZQAOFBWXBRY-UHFFFAOYSA-N 1 1 323.352 3.684 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000706476944 1014042456 /nfs/dbraw/zinc/04/24/56/1014042456.db2.gz OHBJBYRKTMJXQM-AOOOYVTPSA-N 1 1 313.195 3.730 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000706476944 1014042461 /nfs/dbraw/zinc/04/24/61/1014042461.db2.gz OHBJBYRKTMJXQM-AOOOYVTPSA-N 1 1 313.195 3.730 20 5 DHBDMO CC[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000091929205 1014103317 /nfs/dbraw/zinc/10/33/17/1014103317.db2.gz JSVBGDUGNBJZQN-GFCCVEGCSA-N 1 1 317.414 3.950 20 5 DHBDMO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000610133477 1014206561 /nfs/dbraw/zinc/20/65/61/1014206561.db2.gz RVOBAAVCRNJNHL-OIISXLGYSA-N 1 1 318.417 3.620 20 5 DHBDMO CC[C@H]([NH2+]Cc1nn(C)c2ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000610517417 1015078269 /nfs/dbraw/zinc/07/82/69/1015078269.db2.gz DXDWNUAEQAELGD-INIZCTEOSA-N 1 1 324.384 3.722 20 5 DHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1Br)C1CCCC1 ZINC000234322051 1015166381 /nfs/dbraw/zinc/16/63/81/1015166381.db2.gz IIGCNFWHGSXBOX-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC(F)CC3)cs2)c1 ZINC000895548701 1015195151 /nfs/dbraw/zinc/19/51/51/1015195151.db2.gz BFPYBVPSMUXXRG-UHFFFAOYSA-N 1 1 321.377 3.652 20 5 DHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000051180455 1015254115 /nfs/dbraw/zinc/25/41/15/1015254115.db2.gz ADHFVIUBSPRYIG-MRXNPFEDSA-N 1 1 312.369 3.941 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)cs1 ZINC000185303169 1015281484 /nfs/dbraw/zinc/28/14/84/1015281484.db2.gz FNVJDYWEOXDSBX-NSHDSACASA-N 1 1 324.352 3.924 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)cs1 ZINC000185303169 1015281490 /nfs/dbraw/zinc/28/14/90/1015281490.db2.gz FNVJDYWEOXDSBX-NSHDSACASA-N 1 1 324.352 3.924 20 5 DHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C)(C)C ZINC000581882698 1015443371 /nfs/dbraw/zinc/44/33/71/1015443371.db2.gz KJOFXEUJSGOIJU-UHFFFAOYSA-N 1 1 303.362 3.523 20 5 DHBDMO Cn1nc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000610575241 1015604007 /nfs/dbraw/zinc/60/40/07/1015604007.db2.gz QDYRWJCNBOTLFJ-UHFFFAOYSA-N 1 1 324.384 3.506 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]4CCC[C@H]43)nc2c1 ZINC000610582576 1015632789 /nfs/dbraw/zinc/63/27/89/1015632789.db2.gz AQNUDDXRQQGNAJ-SMDDNHRTSA-N 1 1 301.346 3.501 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2ccc(F)cc2)C2CC2)c1 ZINC000522660450 1015789305 /nfs/dbraw/zinc/78/93/05/1015789305.db2.gz WQKPGWKYAWPFLK-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1Cl ZINC000065208688 1015970902 /nfs/dbraw/zinc/97/09/02/1015970902.db2.gz DNADLDNWLYLCKO-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1Cl ZINC000065208688 1015970906 /nfs/dbraw/zinc/97/09/06/1015970906.db2.gz DNADLDNWLYLCKO-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1cccc(F)c1 ZINC000065208915 1015971373 /nfs/dbraw/zinc/97/13/73/1015971373.db2.gz ANOMTKFZAULPDD-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO COc1cccc(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000072555570 1016556703 /nfs/dbraw/zinc/55/67/03/1016556703.db2.gz FFVJMKXGQSOTCD-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1cccc(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000072555570 1016556711 /nfs/dbraw/zinc/55/67/11/1016556711.db2.gz FFVJMKXGQSOTCD-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO O=[N+]([O-])c1ccc(CN2C[C@H]3CCC[N@H+]3Cc3ccccc32)cc1 ZINC000342512307 1016639427 /nfs/dbraw/zinc/63/94/27/1016639427.db2.gz XZXHMQHWFJBSJM-GOSISDBHSA-N 1 1 323.396 3.579 20 5 DHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000051650475 1016696609 /nfs/dbraw/zinc/69/66/09/1016696609.db2.gz BCJVNCXYNFBALQ-INIZCTEOSA-N 1 1 312.369 3.593 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1cccc(O)c1 ZINC000537606525 1032215873 /nfs/dbraw/zinc/21/58/73/1032215873.db2.gz OXXNGRIUFCDKDQ-CYBMUJFWSA-N 1 1 300.358 3.802 20 5 DHBDMO C[C@@H]1C[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)c2ccccc2O1 ZINC000294972177 1032229838 /nfs/dbraw/zinc/22/98/38/1032229838.db2.gz FWCOZCBSMBDDIW-ZWNOBZJWSA-N 1 1 304.371 3.658 20 5 DHBDMO CSC[C@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119372437 1032287268 /nfs/dbraw/zinc/28/72/68/1032287268.db2.gz YGXNQCPOGLNONO-SNVBAGLBSA-N 1 1 300.811 3.576 20 5 DHBDMO Cc1cc(F)ccc1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000537632908 1032421801 /nfs/dbraw/zinc/42/18/01/1032421801.db2.gz YHWOFMBDJMVDFS-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cc(F)ccc1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000537632908 1032421806 /nfs/dbraw/zinc/42/18/06/1032421806.db2.gz YHWOFMBDJMVDFS-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)C2CC2)c(F)c1 ZINC000384352737 1017304281 /nfs/dbraw/zinc/30/42/81/1017304281.db2.gz IWYBADZRGOLCIE-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)C2CC2)c(F)c1 ZINC000384352737 1017304293 /nfs/dbraw/zinc/30/42/93/1017304293.db2.gz IWYBADZRGOLCIE-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1F ZINC000037562971 1032641820 /nfs/dbraw/zinc/64/18/20/1032641820.db2.gz YKKDXMXYGGKKFZ-SECBINFHSA-N 1 1 310.350 3.655 20 5 DHBDMO CC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000425408538 1012593398 /nfs/dbraw/zinc/59/33/98/1012593398.db2.gz SLBKCDIZTOUGPP-UHFFFAOYSA-N 1 1 301.184 3.588 20 5 DHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)s1 ZINC000609631011 1012998821 /nfs/dbraw/zinc/99/88/21/1012998821.db2.gz TVAHPUHPAWXDBT-AWEZNQCLSA-N 1 1 317.414 3.733 20 5 DHBDMO Cc1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)cc1[N+](=O)[O-] ZINC000475287029 1017117717 /nfs/dbraw/zinc/11/77/17/1017117717.db2.gz MMVJRIWNPFXZTI-JQWIXIFHSA-N 1 1 302.296 3.676 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000523104294 1017456577 /nfs/dbraw/zinc/45/65/77/1017456577.db2.gz HJVDULJFAHPKRO-UHFFFAOYSA-N 1 1 323.824 3.703 20 5 DHBDMO CC(C)C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444643237 1017616612 /nfs/dbraw/zinc/61/66/12/1017616612.db2.gz TXXZWNIPKYWNDY-CYBMUJFWSA-N 1 1 316.405 3.729 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000405020643 1017750125 /nfs/dbraw/zinc/75/01/25/1017750125.db2.gz QYQGUJJBYSSJHN-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000613180027 1017964157 /nfs/dbraw/zinc/96/41/57/1017964157.db2.gz FERIRVVAYBWUTC-ZBFHGGJFSA-N 1 1 311.385 3.615 20 5 DHBDMO Cc1[nH+]c2cc(Nc3ncc(Cl)cc3[N+](=O)[O-])ccc2n1C ZINC000153869613 1018053530 /nfs/dbraw/zinc/05/35/30/1018053530.db2.gz OYTHSZJZSKVGDF-UHFFFAOYSA-N 1 1 317.736 3.582 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](CCF)C2)c1 ZINC000701926036 1018123216 /nfs/dbraw/zinc/12/32/16/1018123216.db2.gz XUUUSXGFICOEKS-LLVKDONJSA-N 1 1 300.761 3.820 20 5 DHBDMO Cc1c(C[N@@H+]2CCc3ccc(F)cc3C2)cccc1[N+](=O)[O-] ZINC000441034473 1018152612 /nfs/dbraw/zinc/15/26/12/1018152612.db2.gz PIWOZDXBXADQDR-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1c(C[N@H+]2CCc3ccc(F)cc3C2)cccc1[N+](=O)[O-] ZINC000441034473 1018152618 /nfs/dbraw/zinc/15/26/18/1018152618.db2.gz PIWOZDXBXADQDR-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO COc1ccccc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000052183134 1018187321 /nfs/dbraw/zinc/18/73/21/1018187321.db2.gz DIVSQGQILJCGDI-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO COc1ccccc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000052183134 1018187329 /nfs/dbraw/zinc/18/73/29/1018187329.db2.gz DIVSQGQILJCGDI-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2ccc3nc[nH]c3c2)cc1 ZINC000525195087 1018204288 /nfs/dbraw/zinc/20/42/88/1018204288.db2.gz NCASWJAAYFBTLS-UHFFFAOYSA-N 1 1 324.384 3.584 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000525273813 1018220755 /nfs/dbraw/zinc/22/07/55/1018220755.db2.gz VXBQNQJADRPDRG-BETUJISGSA-N 1 1 324.446 3.708 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000525273813 1018220763 /nfs/dbraw/zinc/22/07/63/1018220763.db2.gz VXBQNQJADRPDRG-BETUJISGSA-N 1 1 324.446 3.708 20 5 DHBDMO Cc1nn(C[N@@H+](C)Cc2ccc(C)cc2)c2ccc([N+](=O)[O-])cc12 ZINC000764847683 1018395854 /nfs/dbraw/zinc/39/58/54/1018395854.db2.gz HKYIECPQBJLPQG-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1nn(C[N@H+](C)Cc2ccc(C)cc2)c2ccc([N+](=O)[O-])cc12 ZINC000764847683 1018395864 /nfs/dbraw/zinc/39/58/64/1018395864.db2.gz HKYIECPQBJLPQG-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@@H](C)C(C)(C)C)c2ccc([N+](=O)[O-])cc12 ZINC000764876880 1018413723 /nfs/dbraw/zinc/41/37/23/1018413723.db2.gz CIJVOYVHJZLADB-LBPRGKRZSA-N 1 1 304.394 3.577 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@H](C)C(C)(C)C)c2ccc([N+](=O)[O-])cc12 ZINC000764876878 1018414109 /nfs/dbraw/zinc/41/41/09/1018414109.db2.gz CIJVOYVHJZLADB-GFCCVEGCSA-N 1 1 304.394 3.577 20 5 DHBDMO CC(C)C[C@H](CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)[NH+](C)C ZINC000447542954 1018414952 /nfs/dbraw/zinc/41/49/52/1018414952.db2.gz QDDWSJNYCGZHPY-AEFFLSMTSA-N 1 1 319.449 3.538 20 5 DHBDMO COc1ccc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000583578392 1018570330 /nfs/dbraw/zinc/57/03/30/1018570330.db2.gz OPEJTUOMXSGLGO-UONOGXRCSA-N 1 1 304.390 3.614 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@H]2CCCC[C@H]12 ZINC000611802412 1018895106 /nfs/dbraw/zinc/89/51/06/1018895106.db2.gz NUHXKDYYIGJCKE-KYOSRNDESA-N 1 1 315.373 3.747 20 5 DHBDMO CC(C)(C)[N@H+]1CCCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000584209474 1019022730 /nfs/dbraw/zinc/02/27/30/1019022730.db2.gz FHTUKGJONJFDQE-UHFFFAOYSA-N 1 1 311.813 3.559 20 5 DHBDMO Cc1cnc(Cl)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000921553043 1019050960 /nfs/dbraw/zinc/05/09/60/1019050960.db2.gz PSTCHKQSRFUJRZ-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000611350526 1019451542 /nfs/dbraw/zinc/45/15/42/1019451542.db2.gz PUROKMXYMLLHJT-BZUAXINKSA-N 1 1 318.417 3.794 20 5 DHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2sccc2[N+](=O)[O-])C1 ZINC000611411630 1019476415 /nfs/dbraw/zinc/47/64/15/1019476415.db2.gz GKXMLSGOKYZQPM-OCCSQVGLSA-N 1 1 317.414 3.904 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccsc2[N+](=O)[O-])C1 ZINC000611509746 1019505762 /nfs/dbraw/zinc/50/57/62/1019505762.db2.gz ZQWUEZZHERODBW-KGLIPLIRSA-N 1 1 323.462 3.747 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000092471207 1019513005 /nfs/dbraw/zinc/51/30/05/1019513005.db2.gz VJGGOIKQOXETQD-NSHDSACASA-N 1 1 303.387 3.560 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C1CCC(F)(F)CC1 ZINC000347532839 1019576098 /nfs/dbraw/zinc/57/60/98/1019576098.db2.gz DNVBGTAWMMUXPQ-UHFFFAOYSA-N 1 1 314.332 3.613 20 5 DHBDMO Cc1[nH+]cn(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])c1C ZINC000290039643 1019629966 /nfs/dbraw/zinc/62/99/66/1019629966.db2.gz QUIWPGWIBBNGGO-UHFFFAOYSA-N 1 1 300.145 3.763 20 5 DHBDMO COc1ccc2c(c1)C[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000067462797 1019745849 /nfs/dbraw/zinc/74/58/49/1019745849.db2.gz JEQCGWRYADPKQS-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc2c(c1)C[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000067462797 1019745861 /nfs/dbraw/zinc/74/58/61/1019745861.db2.gz JEQCGWRYADPKQS-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCc2ccccc2C1 ZINC000730264299 1019967750 /nfs/dbraw/zinc/96/77/50/1019967750.db2.gz GPWWWUIHSGFDNS-UHFFFAOYSA-N 1 1 300.333 3.682 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCc2ccccc2C1 ZINC000730264299 1019967753 /nfs/dbraw/zinc/96/77/53/1019967753.db2.gz GPWWWUIHSGFDNS-UHFFFAOYSA-N 1 1 300.333 3.682 20 5 DHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000555099018 1020080783 /nfs/dbraw/zinc/08/07/83/1020080783.db2.gz JIDTYSHGHRFFDL-DZFYGRHCSA-N 1 1 318.417 3.888 20 5 DHBDMO CC(C)[N@@H+]1CCCC[C@@H]1CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000330658669 1020236244 /nfs/dbraw/zinc/23/62/44/1020236244.db2.gz QULQXDXQWNYAEB-RHSMWYFYSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)[N@H+]1CCCC[C@@H]1CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000330658669 1020236258 /nfs/dbraw/zinc/23/62/58/1020236258.db2.gz QULQXDXQWNYAEB-RHSMWYFYSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)c1[nH+]ccn1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000162476721 1020495657 /nfs/dbraw/zinc/49/56/57/1020495657.db2.gz PNBCGAVRMXBCGJ-UHFFFAOYSA-N 1 1 324.178 3.726 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000177205253 1020515125 /nfs/dbraw/zinc/51/51/25/1020515125.db2.gz QVQPZPDWOPGHLS-GJZGRUSLSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000177205253 1020515120 /nfs/dbraw/zinc/51/51/20/1020515120.db2.gz QVQPZPDWOPGHLS-GJZGRUSLSA-N 1 1 310.394 3.594 20 5 DHBDMO Cc1ccoc1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602674781 1020547500 /nfs/dbraw/zinc/54/75/00/1020547500.db2.gz ZTSYASORHBTPQH-UHFFFAOYSA-N 1 1 314.263 3.805 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc(Cl)cn2)C2CC2)c1 ZINC000554497513 1020548137 /nfs/dbraw/zinc/54/81/37/1020548137.db2.gz PPIATTPCJLIZMA-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(Cl)cn2)C2CC2)c1 ZINC000554497513 1020548141 /nfs/dbraw/zinc/54/81/41/1020548141.db2.gz PPIATTPCJLIZMA-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO C[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000163214497 1020583012 /nfs/dbraw/zinc/58/30/12/1020583012.db2.gz PYMPTJDPWQHANV-AWEZNQCLSA-N 1 1 322.368 3.631 20 5 DHBDMO COc1ccc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)cc1[N+](=O)[O-] ZINC000065967503 1020613247 /nfs/dbraw/zinc/61/32/47/1020613247.db2.gz MJHDDQGNSDXCNL-PJPHBNEVSA-N 1 1 316.401 3.614 20 5 DHBDMO CC(C)[C@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000738241277 1020867009 /nfs/dbraw/zinc/86/70/09/1020867009.db2.gz SNTZBSLKTIIMRK-AWEZNQCLSA-N 1 1 316.405 3.660 20 5 DHBDMO C[C@@H]1C[C@H](C)[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000740860736 1020954471 /nfs/dbraw/zinc/95/44/71/1020954471.db2.gz RJSVNIHYZCMGAE-ZJUUUORDSA-N 1 1 307.375 3.560 20 5 DHBDMO Cc1c(C[N@H+]2CC[C@H](Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000170688583 1021000219 /nfs/dbraw/zinc/00/02/19/1021000219.db2.gz PLXVXXHZGURJEP-KRWDZBQOSA-N 1 1 311.385 3.590 20 5 DHBDMO CC(C)C[C@@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277259 1021208816 /nfs/dbraw/zinc/20/88/16/1021208816.db2.gz MDQKKMJOLPDLPC-IRXDYDNUSA-N 1 1 306.406 3.529 20 5 DHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776278160 1021228085 /nfs/dbraw/zinc/22/80/85/1021228085.db2.gz RVTFIBQZNPFBSJ-JQFCIGGWSA-N 1 1 306.406 3.529 20 5 DHBDMO CCCc1[nH+]ccn1Cc1cc([N+](=O)[O-])ccc1Br ZINC000917321151 1021236197 /nfs/dbraw/zinc/23/61/97/1021236197.db2.gz LPQZYTXAIRQNBV-UHFFFAOYSA-N 1 1 324.178 3.555 20 5 DHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+](C2CC2)C2CCCCC2)c1 ZINC000917431198 1021265990 /nfs/dbraw/zinc/26/59/90/1021265990.db2.gz MLPURTAYJDKABE-UHFFFAOYSA-N 1 1 314.389 3.699 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(Cl)nc1 ZINC000850423517 1021523517 /nfs/dbraw/zinc/52/35/17/1021523517.db2.gz AVQWUYRSCPSVIT-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO COc1ccc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000541117831 1021662431 /nfs/dbraw/zinc/66/24/31/1021662431.db2.gz KGCYKZYAHSVMFI-AEGPPILISA-N 1 1 304.390 3.614 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCc2sccc2C1 ZINC000619531623 1021780631 /nfs/dbraw/zinc/78/06/31/1021780631.db2.gz RIWKWIAXFJVGBO-UHFFFAOYSA-N 1 1 318.398 3.613 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCc2sccc2C1 ZINC000619531623 1021780647 /nfs/dbraw/zinc/78/06/47/1021780647.db2.gz RIWKWIAXFJVGBO-UHFFFAOYSA-N 1 1 318.398 3.613 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CCc1ccccc1)C1CC1 ZINC000746119344 1021859761 /nfs/dbraw/zinc/85/97/61/1021859761.db2.gz UOJSYRUPSYPUGD-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](O)C23CCCC3)cc1[N+](=O)[O-] ZINC000556909174 1021940104 /nfs/dbraw/zinc/94/01/04/1021940104.db2.gz YOXLKQSDVBKXPC-KRWDZBQOSA-N 1 1 318.417 3.598 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc(C)oc1C ZINC000195270150 1022075144 /nfs/dbraw/zinc/07/51/44/1022075144.db2.gz QXVBDNIOFRMIEV-LLVKDONJSA-N 1 1 304.346 3.664 20 5 DHBDMO CCCCC[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587923 1022102922 /nfs/dbraw/zinc/10/29/22/1022102922.db2.gz ZMYPCGMBHYZMJH-WBVHZDCISA-N 1 1 306.406 3.673 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H](c3nccs3)C2)cccc1[N+](=O)[O-] ZINC000195340179 1022121097 /nfs/dbraw/zinc/12/10/97/1022121097.db2.gz LKWCUSBEIUBQDB-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)cc1F ZINC000852594145 1022146082 /nfs/dbraw/zinc/14/60/82/1022146082.db2.gz AASVSGBRFSWOGE-YOEHRIQHSA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000852598749 1022147896 /nfs/dbraw/zinc/14/78/96/1022147896.db2.gz YNXOJINPNQGFSP-GUYCJALGSA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)C1 ZINC001169005676 1022211655 /nfs/dbraw/zinc/21/16/55/1022211655.db2.gz BYMNTSNFZQRQBX-SUMWQHHRSA-N 1 1 320.820 3.875 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H](Cc3ccc(F)cc3)C2)C1 ZINC001169039254 1022221644 /nfs/dbraw/zinc/22/16/44/1022221644.db2.gz OPOQLNQEQRNXCK-LZLYRXPVSA-N 1 1 320.408 3.526 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+](Cc2ccccn2)C2CCCCC2)C1 ZINC001169039132 1022222123 /nfs/dbraw/zinc/22/21/23/1022222123.db2.gz NMNXDPBJGSETAA-YJBOKZPZSA-N 1 1 317.433 3.662 20 5 DHBDMO CSc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169041681 1022224367 /nfs/dbraw/zinc/22/43/67/1022224367.db2.gz CAGXBNJQFKFCTL-DZKIICNBSA-N 1 1 320.458 3.991 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H]2CC[C@H](C3CC3)O2)C2CC2)c1 ZINC001167735353 1022227964 /nfs/dbraw/zinc/22/79/64/1022227964.db2.gz ZUEZOMHFZJCUDS-QZTJIDSGSA-N 1 1 316.401 3.517 20 5 DHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Cc1cccnc1 ZINC000183657980 1022243964 /nfs/dbraw/zinc/24/39/64/1022243964.db2.gz SGKJVDKNERWWMM-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Cc1cccnc1 ZINC000183657980 1022243976 /nfs/dbraw/zinc/24/39/76/1022243976.db2.gz SGKJVDKNERWWMM-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccccc1 ZINC000064350238 1022278818 /nfs/dbraw/zinc/27/88/18/1022278818.db2.gz YTESIHADXLECAS-SFHVURJKSA-N 1 1 314.385 3.539 20 5 DHBDMO CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000190211357 1022342615 /nfs/dbraw/zinc/34/26/15/1022342615.db2.gz AWTVZYAOKCBTQL-GOSISDBHSA-N 1 1 320.433 3.703 20 5 DHBDMO C[N@@H+](CCSc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000609798228 1022349740 /nfs/dbraw/zinc/34/97/40/1022349740.db2.gz JXEUKILNCKXCHE-UHFFFAOYSA-N 1 1 302.399 3.819 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1 ZINC000609916584 1022383738 /nfs/dbraw/zinc/38/37/38/1022383738.db2.gz YKQFGKKWVBWKBR-INIZCTEOSA-N 1 1 314.360 3.799 20 5 DHBDMO C[C@H]1c2ccc(F)cc2CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000610004022 1022399078 /nfs/dbraw/zinc/39/90/78/1022399078.db2.gz ZEKYGCNMKOBVTL-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H]1c2ccc(F)cc2CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000610004022 1022399094 /nfs/dbraw/zinc/39/90/94/1022399094.db2.gz ZEKYGCNMKOBVTL-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO COc1c(C)cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1C ZINC000110284919 1022639998 /nfs/dbraw/zinc/63/99/98/1022639998.db2.gz DKMSPMIGHUBXKM-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO COc1c(C)cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1C ZINC000110284919 1022640001 /nfs/dbraw/zinc/64/00/01/1022640001.db2.gz DKMSPMIGHUBXKM-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cscn1 ZINC000566501825 1022833341 /nfs/dbraw/zinc/83/33/41/1022833341.db2.gz UKZQXAIRNRQMKX-HZMBPMFUSA-N 1 1 303.387 3.780 20 5 DHBDMO CCC[C@H](C)[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768339494 1022947829 /nfs/dbraw/zinc/94/78/29/1022947829.db2.gz RUQWMFIBGIWNRA-JTQLQIEISA-N 1 1 315.211 3.978 20 5 DHBDMO CCC[C@H](C)[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768339494 1022947839 /nfs/dbraw/zinc/94/78/39/1022947839.db2.gz RUQWMFIBGIWNRA-JTQLQIEISA-N 1 1 315.211 3.978 20 5 DHBDMO CCC[C@@H](C)[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768339495 1022947058 /nfs/dbraw/zinc/94/70/58/1022947058.db2.gz RUQWMFIBGIWNRA-SNVBAGLBSA-N 1 1 315.211 3.978 20 5 DHBDMO CCC[C@@H](C)[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768339495 1022947064 /nfs/dbraw/zinc/94/70/64/1022947064.db2.gz RUQWMFIBGIWNRA-SNVBAGLBSA-N 1 1 315.211 3.978 20 5 DHBDMO COCC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCC1 ZINC000768544865 1022992379 /nfs/dbraw/zinc/99/23/79/1022992379.db2.gz QYZKXZXMKNZRHO-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO Cc1ncc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000184664895 1023057180 /nfs/dbraw/zinc/05/71/80/1023057180.db2.gz KLAQPTRLKFOZLM-MRVPVSSYSA-N 1 1 311.794 3.864 20 5 DHBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[C@H]1C ZINC000781925393 1023087403 /nfs/dbraw/zinc/08/74/03/1023087403.db2.gz TVQDUNDYOHOJED-XYPHTWIQSA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1cc([C@H]2CCC[N@H+]2Cc2c(C)ccc([N+](=O)[O-])c2C)on1 ZINC000876617276 1033106909 /nfs/dbraw/zinc/10/69/09/1033106909.db2.gz JAZANYCGNXJVTN-MRXNPFEDSA-N 1 1 315.373 3.845 20 5 DHBDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000312726427 1023141669 /nfs/dbraw/zinc/14/16/69/1023141669.db2.gz RSFDPLAJZCNIAL-GFCCVEGCSA-N 1 1 314.838 3.823 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769471259 1023161891 /nfs/dbraw/zinc/16/18/91/1023161891.db2.gz RNMAZLFRYQOEAJ-VHSXEESVSA-N 1 1 313.195 3.588 20 5 DHBDMO Cc1cccc2c1C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC2 ZINC000759898579 1023204387 /nfs/dbraw/zinc/20/43/87/1023204387.db2.gz GXSPEJIGLFNAHF-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cccc2c1C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC2 ZINC000759898579 1023204393 /nfs/dbraw/zinc/20/43/93/1023204393.db2.gz GXSPEJIGLFNAHF-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1[nH+]c(N)ccc1CNc1ccc([N+](=O)[O-])c2ccccc12 ZINC001167786722 1023881514 /nfs/dbraw/zinc/88/15/14/1023881514.db2.gz KDFHJZIYMRRRCH-UHFFFAOYSA-N 1 1 308.341 3.646 20 5 DHBDMO Cc1ccc(OCC[N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788470263 1023890155 /nfs/dbraw/zinc/89/01/55/1023890155.db2.gz PABHWOPVVXCNOO-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccc(F)cc1F ZINC000788487584 1023894038 /nfs/dbraw/zinc/89/40/38/1023894038.db2.gz CMFPTCYIPNLRBD-VIFPVBQESA-N 1 1 310.275 3.863 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788482754 1023900369 /nfs/dbraw/zinc/90/03/69/1023900369.db2.gz NKOPNOXAINIQMA-ZDUSSCGKSA-N 1 1 312.410 3.842 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CCS1 ZINC000789339269 1024053557 /nfs/dbraw/zinc/05/35/57/1024053557.db2.gz BCMFAGVSZAHSRP-UHFFFAOYSA-N 1 1 314.838 3.966 20 5 DHBDMO Cc1ccn2cc(C[NH2+][C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)nc2c1 ZINC000268836668 1024174778 /nfs/dbraw/zinc/17/47/78/1024174778.db2.gz DNSGMNBQVHMEGO-AWEZNQCLSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)cn2c1 ZINC000268867099 1024182351 /nfs/dbraw/zinc/18/23/51/1024182351.db2.gz KTYDUPZJUPFHGO-CQSZACIVSA-N 1 1 324.384 3.710 20 5 DHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCc1cccs1 ZINC000520170729 1024182566 /nfs/dbraw/zinc/18/25/66/1024182566.db2.gz LTCAPQPSGPRZMO-UHFFFAOYSA-N 1 1 320.414 3.600 20 5 DHBDMO Cc1ccn2cc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)nc2c1 ZINC000268868600 1024185082 /nfs/dbraw/zinc/18/50/82/1024185082.db2.gz KXLYTAFNUMYPRR-CQSZACIVSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c(Cl)n1 ZINC000883294052 1024356442 /nfs/dbraw/zinc/35/64/42/1024356442.db2.gz NXVZGIHSQPGKAN-UHFFFAOYSA-N 1 1 319.792 3.858 20 5 DHBDMO Cc1ncsc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000271093062 1024455409 /nfs/dbraw/zinc/45/54/09/1024455409.db2.gz XDLDGSRVMQFYDU-UHFFFAOYSA-N 1 1 303.387 3.524 20 5 DHBDMO Cc1ncsc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000271093062 1024455416 /nfs/dbraw/zinc/45/54/16/1024455416.db2.gz XDLDGSRVMQFYDU-UHFFFAOYSA-N 1 1 303.387 3.524 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585765552 1024602995 /nfs/dbraw/zinc/60/29/95/1024602995.db2.gz PZTGVICTMWSJSA-ZDUSSCGKSA-N 1 1 324.384 3.673 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCCCC[C@H]2CCO)cc1[N+](=O)[O-] ZINC000585767877 1024604964 /nfs/dbraw/zinc/60/49/64/1024604964.db2.gz UJKZHKLCSTVEND-INIZCTEOSA-N 1 1 320.433 3.845 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1nc(C)cs1 ZINC000283229308 1024613707 /nfs/dbraw/zinc/61/37/07/1024613707.db2.gz UBUDXWOTEITGAD-LBPRGKRZSA-N 1 1 309.366 3.740 20 5 DHBDMO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000283505579 1024678286 /nfs/dbraw/zinc/67/82/86/1024678286.db2.gz MAMLUCWPRGLSND-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@]2(C)CCCO)cc1[N+](=O)[O-] ZINC000349157609 1024682378 /nfs/dbraw/zinc/68/23/78/1024682378.db2.gz ZCKJJPXAPAKEGU-SFHVURJKSA-N 1 1 320.433 3.845 20 5 DHBDMO CC(C)c1[nH+]c(/C=C\c2ccc([N+](=O)[O-])cn2)c2ccccn21 ZINC000475731089 1024687892 /nfs/dbraw/zinc/68/78/92/1024687892.db2.gz CHLUOOMCUSPSHN-CLFYSBASSA-N 1 1 308.341 3.931 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccccc1F ZINC000027539038 1024722170 /nfs/dbraw/zinc/72/21/70/1024722170.db2.gz BGQILCNYTCODNR-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H](C)CC2)c([N+](=O)[O-])c1 ZINC001170336392 1024745754 /nfs/dbraw/zinc/74/57/54/1024745754.db2.gz XKGRZGGRKRHIIS-UONOGXRCSA-N 1 1 306.406 3.656 20 5 DHBDMO CC[C@@H]1CCC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170353609 1024749552 /nfs/dbraw/zinc/74/95/52/1024749552.db2.gz ZXYCLSMDARBLAJ-UONOGXRCSA-N 1 1 306.406 3.656 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccco1)C(C)C ZINC000349819772 1024757036 /nfs/dbraw/zinc/75/70/36/1024757036.db2.gz QEPQBOXVAQZLKD-UHFFFAOYSA-N 1 1 318.373 3.997 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccco1)C(C)C ZINC000349819772 1024757043 /nfs/dbraw/zinc/75/70/43/1024757043.db2.gz QEPQBOXVAQZLKD-UHFFFAOYSA-N 1 1 318.373 3.997 20 5 DHBDMO CCCC[N@@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000792896387 1024827763 /nfs/dbraw/zinc/82/77/63/1024827763.db2.gz GLAYWGYASPDWSB-UHFFFAOYSA-N 1 1 313.195 3.516 20 5 DHBDMO CCCC[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000792896387 1024827774 /nfs/dbraw/zinc/82/77/74/1024827774.db2.gz GLAYWGYASPDWSB-UHFFFAOYSA-N 1 1 313.195 3.516 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000859926197 1033271055 /nfs/dbraw/zinc/27/10/55/1033271055.db2.gz AMIVOQMNWLPBKW-OKZBNKHCSA-N 1 1 308.381 3.830 20 5 DHBDMO CC(C)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cn1 ZINC000354023052 1025323286 /nfs/dbraw/zinc/32/32/86/1025323286.db2.gz WMBRADMZTAHLKL-INIZCTEOSA-N 1 1 303.337 3.616 20 5 DHBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000804576724 1025374404 /nfs/dbraw/zinc/37/44/04/1025374404.db2.gz CFGGDCKEXLCDCX-HNNXBMFYSA-N 1 1 317.776 3.847 20 5 DHBDMO Cc1ccccc1C[C@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886012223 1025438547 /nfs/dbraw/zinc/43/85/47/1025438547.db2.gz CHWSMRJVDFRFBU-QGZVFWFLSA-N 1 1 311.385 3.505 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000886112129 1025511398 /nfs/dbraw/zinc/51/13/98/1025511398.db2.gz QGWCFEVJEYTHLQ-CQSZACIVSA-N 1 1 307.300 3.509 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)c1cscn1 ZINC000573626203 1025737304 /nfs/dbraw/zinc/73/73/04/1025737304.db2.gz YOTZRZHSPZKXRZ-IGEMTJHASA-N 1 1 303.387 3.805 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000025448377 1026297284 /nfs/dbraw/zinc/29/72/84/1026297284.db2.gz YJOIARNXHGUKIL-GFCCVEGCSA-N 1 1 314.341 3.517 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc(O)c1)CC1CC1 ZINC000120629844 1026342523 /nfs/dbraw/zinc/34/25/23/1026342523.db2.gz JITMBYQVKDYEDN-UHFFFAOYSA-N 1 1 312.369 3.713 20 5 DHBDMO CC(C)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000178868623 1026432848 /nfs/dbraw/zinc/43/28/48/1026432848.db2.gz SIQILKYSVHXENX-KRWDZBQOSA-N 1 1 306.406 3.671 20 5 DHBDMO CCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000513510024 1026527444 /nfs/dbraw/zinc/52/74/44/1026527444.db2.gz XRBOAEVSSLTYNM-UGAXZCSASA-N 1 1 318.417 3.889 20 5 DHBDMO CC(C)CC[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768262904 1026686643 /nfs/dbraw/zinc/68/66/43/1026686643.db2.gz LSRCHUVEXUENRY-UHFFFAOYSA-N 1 1 315.211 3.835 20 5 DHBDMO CC(C)CC[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768262904 1026686637 /nfs/dbraw/zinc/68/66/37/1026686637.db2.gz LSRCHUVEXUENRY-UHFFFAOYSA-N 1 1 315.211 3.835 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000157724225 1027357853 /nfs/dbraw/zinc/35/78/53/1027357853.db2.gz ZTMAEMCYXLUWRT-WMZOPIPTSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000157724225 1027357870 /nfs/dbraw/zinc/35/78/70/1027357870.db2.gz ZTMAEMCYXLUWRT-WMZOPIPTSA-N 1 1 317.433 3.510 20 5 DHBDMO CCCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H]1CCC[C@H](C)C1 ZINC001170684914 1027384398 /nfs/dbraw/zinc/38/43/98/1027384398.db2.gz YYZPPIPXWVWZRT-GOEBONIOSA-N 1 1 322.453 3.781 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000932377588 1027470125 /nfs/dbraw/zinc/47/01/25/1027470125.db2.gz IGWMYMJFQJTUHQ-MRXNPFEDSA-N 1 1 317.776 3.884 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ccncc3)C2)c(F)c1 ZINC000296047854 1027525985 /nfs/dbraw/zinc/52/59/85/1027525985.db2.gz TXDBVNYAIYJALN-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO CCc1ccccc1[C@H](N)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423499718 1027563416 /nfs/dbraw/zinc/56/34/16/1027563416.db2.gz JLHJVPFZOBZUNB-FZKQIMNGSA-N 1 1 313.401 3.508 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000778949887 1027634637 /nfs/dbraw/zinc/63/46/37/1027634637.db2.gz DFQFQJNWURGQOX-WDEREUQCSA-N 1 1 302.296 3.848 20 5 DHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000023004777 1027765432 /nfs/dbraw/zinc/76/54/32/1027765432.db2.gz IEBBABXYRSAXNB-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934333887 1027968881 /nfs/dbraw/zinc/96/88/81/1027968881.db2.gz RIAQWTCLRDNOGV-CHWSQXEVSA-N 1 1 317.414 3.677 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449096459 1028348912 /nfs/dbraw/zinc/34/89/12/1028348912.db2.gz HXPWMFUDWBWWGQ-ZDUSSCGKSA-N 1 1 322.286 3.789 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]Cc2ccn(C(C)C)n2)cccc1[N+](=O)[O-] ZINC000579543845 1028433653 /nfs/dbraw/zinc/43/36/53/1028433653.db2.gz SHEQDGHMVAOXNO-CYBMUJFWSA-N 1 1 302.378 3.531 20 5 DHBDMO CS[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449444499 1028643818 /nfs/dbraw/zinc/64/38/18/1028643818.db2.gz AZHSOLGHTYPVCG-HNNXBMFYSA-N 1 1 318.398 3.792 20 5 DHBDMO C[C@@H]1C[C@H](C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449498904 1028712662 /nfs/dbraw/zinc/71/26/62/1028712662.db2.gz LKGWUYYGIUIHBI-INMHGKMJSA-N 1 1 318.417 3.589 20 5 DHBDMO CO[C@@H]1CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1(C)C ZINC000449499311 1028714765 /nfs/dbraw/zinc/71/47/65/1028714765.db2.gz LSXYFOSUFVJAKU-OOXMNIKJSA-N 1 1 318.417 3.745 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1noc3ccccc13)CCC2 ZINC000566475899 1028728735 /nfs/dbraw/zinc/72/87/35/1028728735.db2.gz QSXSHNPHJPOSLE-MRXNPFEDSA-N 1 1 323.352 3.903 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCC[C@H]2C)CC1 ZINC000372169027 1028818419 /nfs/dbraw/zinc/81/84/19/1028818419.db2.gz COSYOLHEBYMCOA-HUUCEWRRSA-N 1 1 317.433 3.605 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](O)CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000449617837 1028869008 /nfs/dbraw/zinc/86/90/08/1028869008.db2.gz IYONWJXNNAGAHT-HNNXBMFYSA-N 1 1 320.433 3.701 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCCc2cccnc21 ZINC000372764465 1028896724 /nfs/dbraw/zinc/89/67/24/1028896724.db2.gz LASUJBVYNLJFFB-KRWDZBQOSA-N 1 1 311.385 3.808 20 5 DHBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@H](C)[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000816646676 1028972959 /nfs/dbraw/zinc/97/29/59/1028972959.db2.gz HMJTWMZIHJDPJW-RYUDHWBXSA-N 1 1 316.357 3.704 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(OCC2CC2)CC1 ZINC000374124245 1029213464 /nfs/dbraw/zinc/21/34/64/1029213464.db2.gz XQJWCRRLBKOEFC-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO CC[C@H]([NH2+][C@@H]1COc2cccc(F)c21)c1cccc([N+](=O)[O-])c1 ZINC000374679706 1029429597 /nfs/dbraw/zinc/42/95/97/1029429597.db2.gz NXNGXEWSKXCGFG-LSDHHAIUSA-N 1 1 316.332 3.908 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)c1 ZINC000571008043 1029443412 /nfs/dbraw/zinc/44/34/12/1029443412.db2.gz JEVRQGIXHXTQRJ-LJQANCHMSA-N 1 1 324.380 3.565 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](O)c2ccccc2C1 ZINC000374806654 1029464557 /nfs/dbraw/zinc/46/45/57/1029464557.db2.gz MUFCOEFAANMEKX-ACJLOTCBSA-N 1 1 312.369 3.595 20 5 DHBDMO CC(C)(C)OCCCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000530389394 1029832512 /nfs/dbraw/zinc/83/25/12/1029832512.db2.gz OOWYGFYQBBRQNN-UHFFFAOYSA-N 1 1 306.406 3.548 20 5 DHBDMO C[C@H](c1cccnc1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451547177 1029914321 /nfs/dbraw/zinc/91/43/21/1029914321.db2.gz KMHICDFBWBYUJH-PBHICJAKSA-N 1 1 311.385 3.930 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2C(F)F)C[N@H+]1C1CC1 ZINC000865600421 1029934565 /nfs/dbraw/zinc/93/45/65/1029934565.db2.gz MSSCZHZOJOBLPH-NXEZZACHSA-N 1 1 311.332 3.570 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](CC[C@H]1CC1(Cl)Cl)C2 ZINC000822780855 1030120490 /nfs/dbraw/zinc/12/04/90/1030120490.db2.gz WQKZPAPDPXOCHS-NSHDSACASA-N 1 1 315.200 3.537 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CC[C@H]1CC1(Cl)Cl)C2 ZINC000822780855 1030120506 /nfs/dbraw/zinc/12/05/06/1030120506.db2.gz WQKZPAPDPXOCHS-NSHDSACASA-N 1 1 315.200 3.537 20 5 DHBDMO CCc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866539983 1030359384 /nfs/dbraw/zinc/35/93/84/1030359384.db2.gz IVAVHQGEHQLCMX-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO CC(C)([NH2+]Cc1cccc(Cl)n1)c1ccccc1[N+](=O)[O-] ZINC000292225578 1030891469 /nfs/dbraw/zinc/89/14/69/1030891469.db2.gz VHZLDHVTYJPCFJ-UHFFFAOYSA-N 1 1 305.765 3.668 20 5 DHBDMO Cc1ccc(C[NH2+][C@H]2CCc3c2nccc3Cl)cc1[N+](=O)[O-] ZINC000926795227 1030931613 /nfs/dbraw/zinc/93/16/13/1030931613.db2.gz IKMUPKHMPNPESX-AWEZNQCLSA-N 1 1 317.776 3.729 20 5 DHBDMO COc1ccnc([C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000925495181 1031274419 /nfs/dbraw/zinc/27/44/19/1031274419.db2.gz MHAPNYMPRIGEDJ-OLZOCXBDSA-N 1 1 315.373 3.719 20 5 DHBDMO COCC(C)(C)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000795187486 1031304435 /nfs/dbraw/zinc/30/44/35/1031304435.db2.gz IHCPWYVZJLFMLR-UHFFFAOYSA-N 1 1 321.204 3.758 20 5 DHBDMO COCc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872020660 1031402943 /nfs/dbraw/zinc/40/29/43/1031402943.db2.gz JZWJITOSQSOWTF-GFCCVEGCSA-N 1 1 318.348 3.731 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cc(O)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000872026734 1031410499 /nfs/dbraw/zinc/41/04/99/1031410499.db2.gz FGXKZAIANCWDQN-MNOVXSKESA-N 1 1 304.321 3.851 20 5 DHBDMO CCC[NH+]1CCC(CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872033177 1031417347 /nfs/dbraw/zinc/41/73/47/1031417347.db2.gz GFRJEJGRGXNTLM-CYBMUJFWSA-N 1 1 323.412 3.507 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(F)cn1 ZINC000872044355 1031430656 /nfs/dbraw/zinc/43/06/56/1031430656.db2.gz UGDLCQBXWMSXQD-JTQLQIEISA-N 1 1 321.377 3.702 20 5 DHBDMO C[C@H](O)[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872087470 1031483878 /nfs/dbraw/zinc/48/38/78/1031483878.db2.gz FFETUCRRNRBZRW-PRXAMGSTSA-N 1 1 318.348 3.507 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2cccc(O)c2F)cc1[N+](=O)[O-] ZINC000872092567 1031489822 /nfs/dbraw/zinc/48/98/22/1031489822.db2.gz PFVBEPLZEMNROK-LLVKDONJSA-N 1 1 304.321 3.599 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000293601689 1031533170 /nfs/dbraw/zinc/53/31/70/1031533170.db2.gz OYKWYDHUNXVQIB-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000872260147 1031564876 /nfs/dbraw/zinc/56/48/76/1031564876.db2.gz JJTMQFUQFCBHEN-KRWDZBQOSA-N 1 1 318.417 3.827 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCCc2cccnc2)C2CC2)c1 ZINC000929853690 1031626248 /nfs/dbraw/zinc/62/62/48/1031626248.db2.gz NXCRTOBINBAQCN-UHFFFAOYSA-N 1 1 311.385 3.587 20 5 DHBDMO C[C@H]([N@@H+](C)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C(C)(C)C ZINC000777955822 1032044277 /nfs/dbraw/zinc/04/42/77/1032044277.db2.gz YSFHCUIWMZBSNW-ZDUSSCGKSA-N 1 1 316.405 3.782 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294542500 1032054318 /nfs/dbraw/zinc/05/43/18/1032054318.db2.gz AKXVODXPDHUNTK-ZJUUUORDSA-N 1 1 321.327 3.867 20 5 DHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000136940553 1033318713 /nfs/dbraw/zinc/31/87/13/1033318713.db2.gz WGJREWZSSFLUMJ-HZPDHXFCSA-N 1 1 318.398 3.527 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@H](F)CC1)CC2 ZINC001172907096 1033439253 /nfs/dbraw/zinc/43/92/53/1033439253.db2.gz CVZOVIHBJDQWJZ-JKSUJKDBSA-N 1 1 306.381 3.666 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@]3(CC3(F)F)C1)CC2 ZINC001172917675 1033464033 /nfs/dbraw/zinc/46/40/33/1033464033.db2.gz WLAVDUHSEFJPKS-GDBMZVCRSA-N 1 1 322.355 3.573 20 5 DHBDMO CCC[N@@H+](CC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878002200 1033547540 /nfs/dbraw/zinc/54/75/40/1033547540.db2.gz QGBHMNSLDJDXCT-UHFFFAOYSA-N 1 1 324.768 3.530 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC3CCC2CC3)c1F ZINC001173195451 1033586953 /nfs/dbraw/zinc/58/69/53/1033586953.db2.gz GBYAIFVYYHRZCW-HIFPTAJRSA-N 1 1 322.380 3.548 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1Cc2ccccc2C[C@@H]1C ZINC001173231214 1033606196 /nfs/dbraw/zinc/60/61/96/1033606196.db2.gz KKJZBFJGIGYWKL-GJZGRUSLSA-N 1 1 310.397 3.973 20 5 DHBDMO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173226511 1033606523 /nfs/dbraw/zinc/60/65/23/1033606523.db2.gz MIZFYJXVCDPOGN-HNNXBMFYSA-N 1 1 310.397 3.893 20 5 DHBDMO C[C@H]1C[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C[C@H](C)C1(F)F ZINC000862444398 1033858342 /nfs/dbraw/zinc/85/83/42/1033858342.db2.gz WFPCCZGIUFIFEU-UWVGGRQHSA-N 1 1 318.751 3.971 20 5 DHBDMO Cc1c([C@@H](C)NCCC[N@H+]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000479885818 1033947560 /nfs/dbraw/zinc/94/75/60/1033947560.db2.gz PGTGYGCEPNOWRC-GDBMZVCRSA-N 1 1 319.449 3.818 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC000880000804 1034177700 /nfs/dbraw/zinc/17/77/00/1034177700.db2.gz KXFPYIRUCCRRGU-ZWNOBZJWSA-N 1 1 302.296 3.930 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC2(CCCCO2)CC1 ZINC000880454999 1034334149 /nfs/dbraw/zinc/33/41/49/1034334149.db2.gz MRIUPHDYZPNVDD-UHFFFAOYSA-N 1 1 324.808 3.783 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H](C)[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000480619844 1034354736 /nfs/dbraw/zinc/35/47/36/1034354736.db2.gz BHYAQNAHDNOUKT-KBMXLJTQSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000480619844 1034354749 /nfs/dbraw/zinc/35/47/49/1034354749.db2.gz BHYAQNAHDNOUKT-KBMXLJTQSA-N 1 1 319.449 3.674 20 5 DHBDMO CC[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1C)c1nccs1 ZINC000183481053 1034390714 /nfs/dbraw/zinc/39/07/14/1034390714.db2.gz OSYORYXWXNCERA-OAHLLOKOSA-N 1 1 305.403 3.775 20 5 DHBDMO Cc1c[nH+]ccc1Nc1ccc2cc3ccc(N)cc3nc2c1 ZINC001174539519 1034457036 /nfs/dbraw/zinc/45/70/36/1034457036.db2.gz JOBSVXUHSYNSCX-UHFFFAOYSA-N 1 1 300.365 3.839 20 5 DHBDMO CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1nc(C)cs1 ZINC000184390674 1034469405 /nfs/dbraw/zinc/46/94/05/1034469405.db2.gz QAWCVJUZCZFXMI-ZDUSSCGKSA-N 1 1 305.403 3.909 20 5 DHBDMO CC1(C)CCC(C)(C)[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001174724951 1034581559 /nfs/dbraw/zinc/58/15/59/1034581559.db2.gz LJENLZPIBBOTOC-OAHLLOKOSA-N 1 1 306.406 3.529 20 5 DHBDMO CCC[C@H]([NH2+][C@@H](CCO)c1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000186537928 1034640692 /nfs/dbraw/zinc/64/06/92/1034640692.db2.gz ZQJWUSSZBKQZPE-HOTGVXAUSA-N 1 1 318.373 3.742 20 5 DHBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(C(F)F)c1 ZINC000865504437 1034681332 /nfs/dbraw/zinc/68/13/32/1034681332.db2.gz OENKQWRPOYDWAC-SNVBAGLBSA-N 1 1 322.315 3.640 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H]2C2CCOCC2)c1 ZINC000777438763 1034743383 /nfs/dbraw/zinc/74/33/83/1034743383.db2.gz DHAAOVAMASMMPF-MRXNPFEDSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H](C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000481976070 1035038987 /nfs/dbraw/zinc/03/89/87/1035038987.db2.gz XROYFRFTWWSINV-CVEARBPZSA-N 1 1 319.449 3.674 20 5 DHBDMO C[C@@H]1CCC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000159412586 1035048773 /nfs/dbraw/zinc/04/87/73/1035048773.db2.gz QIARJUMZRKTRSW-SNVBAGLBSA-N 1 1 313.195 3.589 20 5 DHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000159412586 1035048778 /nfs/dbraw/zinc/04/87/78/1035048778.db2.gz QIARJUMZRKTRSW-SNVBAGLBSA-N 1 1 313.195 3.589 20 5 DHBDMO CCC(C)(C)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159429750 1035050688 /nfs/dbraw/zinc/05/06/88/1035050688.db2.gz UGUOCVDBWCCOGR-UHFFFAOYSA-N 1 1 315.211 3.978 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000159855745 1035097568 /nfs/dbraw/zinc/09/75/68/1035097568.db2.gz GZCPVAPJIBVGIT-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO CCCCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000482692274 1035163127 /nfs/dbraw/zinc/16/31/27/1035163127.db2.gz LUYLYDWVZOJNEA-UHFFFAOYSA-N 1 1 304.394 3.872 20 5 DHBDMO CCC(CC)[N@@H+](CCOC)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000042616369 1035228852 /nfs/dbraw/zinc/22/88/52/1035228852.db2.gz PKZBZRMCHNTYSC-UHFFFAOYSA-N 1 1 314.813 3.885 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(C(F)F)CC1 ZINC000483511855 1035275907 /nfs/dbraw/zinc/27/59/07/1035275907.db2.gz GPVQSDVCUNYVEU-UHFFFAOYSA-N 1 1 304.724 3.725 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)nc2c1 ZINC000483859215 1035306024 /nfs/dbraw/zinc/30/60/24/1035306024.db2.gz XKCCDPYRFCDRQF-ZDUSSCGKSA-N 1 1 324.384 3.939 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)[nH]c2c1 ZINC000483859215 1035306028 /nfs/dbraw/zinc/30/60/28/1035306028.db2.gz XKCCDPYRFCDRQF-ZDUSSCGKSA-N 1 1 324.384 3.939 20 5 DHBDMO CCC1(CC)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCS1 ZINC001193131570 1035575869 /nfs/dbraw/zinc/57/58/69/1035575869.db2.gz VDOWIMSXAFIWTN-UHFFFAOYSA-N 1 1 324.446 3.581 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)ccc1[N+](=O)[O-] ZINC000485470928 1035672565 /nfs/dbraw/zinc/67/25/65/1035672565.db2.gz AWEQJESSMCVJHS-SFHVURJKSA-N 1 1 316.401 3.926 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000535553046 1035688156 /nfs/dbraw/zinc/68/81/56/1035688156.db2.gz GIKNKLPDFYBBMY-CQSZACIVSA-N 1 1 313.401 3.854 20 5 DHBDMO C[C@H]1CCCC[C@@H]1OCC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001193743599 1035713323 /nfs/dbraw/zinc/71/33/23/1035713323.db2.gz QTJMDDUZPJXWLK-YJBOKZPZSA-N 1 1 320.433 3.664 20 5 DHBDMO CC[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089883217 1035760284 /nfs/dbraw/zinc/76/02/84/1035760284.db2.gz WEUAZJJLVQZTCQ-CYBMUJFWSA-N 1 1 315.373 3.872 20 5 DHBDMO Cc1ccc(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000539670002 1035821880 /nfs/dbraw/zinc/82/18/80/1035821880.db2.gz BUTYLNNDZZQCBA-UHFFFAOYSA-N 1 1 324.302 3.953 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000539670002 1035821911 /nfs/dbraw/zinc/82/19/11/1035821911.db2.gz BUTYLNNDZZQCBA-UHFFFAOYSA-N 1 1 324.302 3.953 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000485748449 1035937672 /nfs/dbraw/zinc/93/76/72/1035937672.db2.gz XDLPWHMJYLIFAE-MRXNPFEDSA-N 1 1 312.369 3.941 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000027211591 1036218046 /nfs/dbraw/zinc/21/80/46/1036218046.db2.gz AQLQYEKHUOOWAR-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC001182327982 1036230175 /nfs/dbraw/zinc/23/01/75/1036230175.db2.gz XDPMTGNXKLYVBW-QGZVFWFLSA-N 1 1 320.458 3.931 20 5 DHBDMO COc1ccc2c(c1)CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC000609133927 1036396092 /nfs/dbraw/zinc/39/60/92/1036396092.db2.gz LXQKNUWWZUIEMZ-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000541772463 1036429179 /nfs/dbraw/zinc/42/91/79/1036429179.db2.gz AIOMIDPWBQWKBL-SFHVURJKSA-N 1 1 318.417 3.827 20 5 DHBDMO COc1cccc2c1CC[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000542017966 1036485291 /nfs/dbraw/zinc/48/52/91/1036485291.db2.gz ZYSNSFXEFFMUBJ-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc2c1CC[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000542017966 1036485303 /nfs/dbraw/zinc/48/53/03/1036485303.db2.gz ZYSNSFXEFFMUBJ-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc2c1CC[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000542017967 1036487597 /nfs/dbraw/zinc/48/75/97/1036487597.db2.gz ZYSNSFXEFFMUBJ-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc2c1CC[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000542017967 1036487600 /nfs/dbraw/zinc/48/76/00/1036487600.db2.gz ZYSNSFXEFFMUBJ-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO CC[N@@H+](CCNc1cc(C)ccc1[N+](=O)[O-])CCC(F)(F)F ZINC000491800343 1036642385 /nfs/dbraw/zinc/64/23/85/1036642385.db2.gz ASGXKVJBKZVSPC-UHFFFAOYSA-N 1 1 319.327 3.589 20 5 DHBDMO CCCC[N@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])cc1F ZINC001185098250 1037024817 /nfs/dbraw/zinc/02/48/17/1037024817.db2.gz KISLLCCZTMOWBI-AWEZNQCLSA-N 1 1 309.385 3.800 20 5 DHBDMO CCC1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000774837466 1037056550 /nfs/dbraw/zinc/05/65/50/1037056550.db2.gz XTODSJJAWAWKBT-UHFFFAOYSA-N 1 1 321.377 3.904 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@@H](C(C)(C)C)CC1 ZINC001198800932 1037138483 /nfs/dbraw/zinc/13/84/83/1037138483.db2.gz NNWMITOICIVDKM-CZUORRHYSA-N 1 1 306.406 3.793 20 5 DHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774876770 1037141842 /nfs/dbraw/zinc/14/18/42/1037141842.db2.gz RXOKICIIRSGAHP-CQSZACIVSA-N 1 1 307.350 3.514 20 5 DHBDMO COc1cc(C[N@@H+]2CCc3ccccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000489157381 1037291636 /nfs/dbraw/zinc/29/16/36/1037291636.db2.gz WETMEMJFTZHKAS-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cc(C[N@H+]2CCc3ccccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000489157381 1037291650 /nfs/dbraw/zinc/29/16/50/1037291650.db2.gz WETMEMJFTZHKAS-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nc2ccccc2n1C ZINC000193901324 1037305811 /nfs/dbraw/zinc/30/58/11/1037305811.db2.gz LGHLUBAKFWPDGB-QWHCGFSZSA-N 1 1 324.384 3.893 20 5 DHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@H]23)c(Cl)c1 ZINC001186872267 1037508868 /nfs/dbraw/zinc/50/88/68/1037508868.db2.gz LQQSXBJBVNAUGU-LSDHHAIUSA-N 1 1 309.797 3.677 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1OC ZINC000775068480 1037537487 /nfs/dbraw/zinc/53/74/87/1037537487.db2.gz PHZWMZJMDKFPEU-OAHLLOKOSA-N 1 1 318.348 3.983 20 5 DHBDMO CC[N@@H+](CCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000491135801 1037916340 /nfs/dbraw/zinc/91/63/40/1037916340.db2.gz NQICRLDZEGCFKR-UHFFFAOYSA-N 1 1 302.349 3.799 20 5 DHBDMO C[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000917041074 1038123732 /nfs/dbraw/zinc/12/37/32/1038123732.db2.gz YBOXJZKEXUXTGD-CQSZACIVSA-N 1 1 312.369 3.593 20 5 DHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCC1CCCCC1 ZINC001190707684 1038367127 /nfs/dbraw/zinc/36/71/27/1038367127.db2.gz LQXGJGCIVNXYCW-UHFFFAOYSA-N 1 1 306.406 3.876 20 5 DHBDMO C[C@H]1[C@@H](Nc2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000588854689 1038387174 /nfs/dbraw/zinc/38/71/74/1038387174.db2.gz AMPDOGPEJFXCEI-JSGCOSHPSA-N 1 1 317.414 3.731 20 5 DHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])s1 ZINC000588858664 1038390498 /nfs/dbraw/zinc/39/04/98/1038390498.db2.gz XRBFURSIAGXIOQ-GFCCVEGCSA-N 1 1 305.403 3.589 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000588866414 1038390602 /nfs/dbraw/zinc/39/06/02/1038390602.db2.gz UONCBIKJVLJSQE-ZDUSSCGKSA-N 1 1 316.405 3.675 20 5 DHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001190911989 1038407153 /nfs/dbraw/zinc/40/71/53/1038407153.db2.gz AFPQGVUBKJXXKZ-ZIAGYGMSSA-N 1 1 306.406 3.873 20 5 DHBDMO C[C@@H](CF)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000588930878 1038409575 /nfs/dbraw/zinc/40/95/75/1038409575.db2.gz XHAOXROOQWPWIV-VIFPVBQESA-N 1 1 312.728 3.956 20 5 DHBDMO CCC1(CC)[C@H](OC)C[C@@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001191744089 1038541786 /nfs/dbraw/zinc/54/17/86/1038541786.db2.gz YJPCMWJIDNJDDP-JKSUJKDBSA-N 1 1 306.406 3.620 20 5 DHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001192173264 1038598667 /nfs/dbraw/zinc/59/86/67/1038598667.db2.gz HLALPGJZLCQODO-WMLDXEAASA-N 1 1 306.406 3.874 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC(C)(C)[C@H]2CCC[C@@H]21 ZINC000590203760 1038601858 /nfs/dbraw/zinc/60/18/58/1038601858.db2.gz ZCOTXRDAFDVAOK-GJZGRUSLSA-N 1 1 304.390 3.614 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000590601959 1038675696 /nfs/dbraw/zinc/67/56/96/1038675696.db2.gz UFHIDMTXLRNZMG-ZBFHGGJFSA-N 1 1 311.385 3.930 20 5 DHBDMO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(Cl)c(F)c1 ZINC001192833015 1038706069 /nfs/dbraw/zinc/70/60/69/1038706069.db2.gz JEGPSPGUUDPJSM-VIFPVBQESA-N 1 1 309.728 3.633 20 5 DHBDMO CC[N@@H+](Cn1nc(C)c2ccc([N+](=O)[O-])cc21)[C@@H](C)C(C)C ZINC000761290086 1038881684 /nfs/dbraw/zinc/88/16/84/1038881684.db2.gz KVKYMBCRTXXOEG-ZDUSSCGKSA-N 1 1 304.394 3.577 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c(F)c1 ZINC000598992737 1038984330 /nfs/dbraw/zinc/98/43/30/1038984330.db2.gz CFKHPHPGVJWMPX-QGZVFWFLSA-N 1 1 315.348 3.760 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000592140176 1039133377 /nfs/dbraw/zinc/13/33/77/1039133377.db2.gz NNLOFPASFWHBQZ-GDBMZVCRSA-N 1 1 311.385 3.849 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592183149 1039163212 /nfs/dbraw/zinc/16/32/12/1039163212.db2.gz RURKPMQXSBNOEL-ZIAGYGMSSA-N 1 1 304.390 3.547 20 5 DHBDMO C[C@@H]1CC2(C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl)CCOCC2 ZINC000592185088 1039173264 /nfs/dbraw/zinc/17/32/64/1039173264.db2.gz VICSQABDIPXDDF-GFCCVEGCSA-N 1 1 324.808 3.639 20 5 DHBDMO CC[N@@H+](CCSC)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000592201248 1039181085 /nfs/dbraw/zinc/18/10/85/1039181085.db2.gz DQLNSFHDBMSOET-UHFFFAOYSA-N 1 1 322.352 3.799 20 5 DHBDMO CC[N@@H+](CCc1ccccc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000603852399 1039186339 /nfs/dbraw/zinc/18/63/39/1039186339.db2.gz XETQSJDJVJOSGC-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553671 1039211520 /nfs/dbraw/zinc/21/15/20/1039211520.db2.gz YILPDCURSZKIRI-YUELXQCFSA-N 1 1 306.431 3.934 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594612899 1039872757 /nfs/dbraw/zinc/87/27/57/1039872757.db2.gz OUBJFSDCZQVKRV-BBOMDTFKSA-N 1 1 316.401 3.642 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594026275 1039951286 /nfs/dbraw/zinc/95/12/86/1039951286.db2.gz HYUUKDDALPPGGR-GUYCJALGSA-N 1 1 304.390 3.689 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccc(F)c1 ZINC000595005511 1040017498 /nfs/dbraw/zinc/01/74/98/1040017498.db2.gz ZLBPRGRYEKHNBU-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO CC[C@@H](N[C@H]1CC[N@@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056862 1040022130 /nfs/dbraw/zinc/02/21/30/1040022130.db2.gz RWNJGGCBOYGVDZ-GOEBONIOSA-N 1 1 305.422 3.508 20 5 DHBDMO CC[C@@H](N[C@H]1CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056862 1040022146 /nfs/dbraw/zinc/02/21/46/1040022146.db2.gz RWNJGGCBOYGVDZ-GOEBONIOSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000595078769 1040071695 /nfs/dbraw/zinc/07/16/95/1040071695.db2.gz ATVWWVAOXSQJDT-GOEBONIOSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCN(C2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000595078769 1040071706 /nfs/dbraw/zinc/07/17/06/1040071706.db2.gz ATVWWVAOXSQJDT-GOEBONIOSA-N 1 1 317.433 3.652 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000595296823 1040090915 /nfs/dbraw/zinc/09/09/15/1040090915.db2.gz LJJZLKMCIOVZNR-AWEZNQCLSA-N 1 1 300.333 3.723 20 5 DHBDMO CSc1cccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000595286621 1040094075 /nfs/dbraw/zinc/09/40/75/1040094075.db2.gz DNITWPJIKSMEFZ-UHFFFAOYSA-N 1 1 302.399 3.949 20 5 DHBDMO CSc1cccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000595286621 1040094089 /nfs/dbraw/zinc/09/40/89/1040094089.db2.gz DNITWPJIKSMEFZ-UHFFFAOYSA-N 1 1 302.399 3.949 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2CC2CCCCC2)c1[N+](=O)[O-] ZINC000595297401 1040096206 /nfs/dbraw/zinc/09/62/06/1040096206.db2.gz SQLBUFZIDSSHLO-CQSZACIVSA-N 1 1 307.394 3.826 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595326429 1040099307 /nfs/dbraw/zinc/09/93/07/1040099307.db2.gz KDNWGQLGICJBRS-HZMBPMFUSA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595326429 1040099326 /nfs/dbraw/zinc/09/93/26/1040099326.db2.gz KDNWGQLGICJBRS-HZMBPMFUSA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595338379 1040102112 /nfs/dbraw/zinc/10/21/12/1040102112.db2.gz RRLPMIJEUNIDOA-ZUZCIYMTSA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595338379 1040102114 /nfs/dbraw/zinc/10/21/14/1040102114.db2.gz RRLPMIJEUNIDOA-ZUZCIYMTSA-N 1 1 319.336 3.613 20 5 DHBDMO CC(C)Oc1ccnc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000593020931 1040141390 /nfs/dbraw/zinc/14/13/90/1040141390.db2.gz IKHHGVCBMUZAPG-ZDUSSCGKSA-N 1 1 315.373 3.628 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC=C(c2ccco2)C1 ZINC000595485068 1040142526 /nfs/dbraw/zinc/14/25/26/1040142526.db2.gz QSWHBJHDGRKIFS-UHFFFAOYSA-N 1 1 302.305 3.616 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC=C(c2ccco2)C1 ZINC000595485068 1040142527 /nfs/dbraw/zinc/14/25/27/1040142527.db2.gz QSWHBJHDGRKIFS-UHFFFAOYSA-N 1 1 302.305 3.616 20 5 DHBDMO Cc1noc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000595501317 1040154970 /nfs/dbraw/zinc/15/49/70/1040154970.db2.gz OCCFUNSGWCSJNI-GFCCVEGCSA-N 1 1 321.764 3.534 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000595501317 1040154975 /nfs/dbraw/zinc/15/49/75/1040154975.db2.gz OCCFUNSGWCSJNI-GFCCVEGCSA-N 1 1 321.764 3.534 20 5 DHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCc2ccccc21 ZINC000491205469 1040183877 /nfs/dbraw/zinc/18/38/77/1040183877.db2.gz OTJZHVXKENBLJQ-QGZVFWFLSA-N 1 1 300.333 3.853 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCc2ccccc21 ZINC000491205469 1040183881 /nfs/dbraw/zinc/18/38/81/1040183881.db2.gz OTJZHVXKENBLJQ-QGZVFWFLSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC000595822344 1040250037 /nfs/dbraw/zinc/25/00/37/1040250037.db2.gz RHRSJCYPFCVXPU-ZDUSSCGKSA-N 1 1 316.401 3.547 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC000595822344 1040250055 /nfs/dbraw/zinc/25/00/55/1040250055.db2.gz RHRSJCYPFCVXPU-ZDUSSCGKSA-N 1 1 316.401 3.547 20 5 DHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000595866169 1040265209 /nfs/dbraw/zinc/26/52/09/1040265209.db2.gz FSGOKDFLPUZMTH-UONOGXRCSA-N 1 1 319.405 3.576 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC000595831541 1040265950 /nfs/dbraw/zinc/26/59/50/1040265950.db2.gz JVCXIFXZPHJNPB-GDBMZVCRSA-N 1 1 312.369 3.809 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595907330 1040274592 /nfs/dbraw/zinc/27/45/92/1040274592.db2.gz AQVDJPFWLKTXNF-JCGIZDLHSA-N 1 1 316.401 3.548 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@H]4CCCC[C@@H]43)nc2c1 ZINC000595914190 1040278284 /nfs/dbraw/zinc/27/82/84/1040278284.db2.gz DKTCITVADFNHDT-LRDDRELGSA-N 1 1 314.389 3.626 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]4CCCC[C@@H]43)nc2c1 ZINC000595914190 1040278298 /nfs/dbraw/zinc/27/82/98/1040278298.db2.gz DKTCITVADFNHDT-LRDDRELGSA-N 1 1 314.389 3.626 20 5 DHBDMO Cc1nc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)s1 ZINC000231883776 1040450453 /nfs/dbraw/zinc/45/04/53/1040450453.db2.gz TWAFBMAZGZVNHY-JTQLQIEISA-N 1 1 305.403 3.827 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)CC2=CCSC2)cc1[N+](=O)[O-] ZINC000597246802 1040710824 /nfs/dbraw/zinc/71/08/24/1040710824.db2.gz ZHUZYPMGNFXGLN-UHFFFAOYSA-N 1 1 306.431 3.823 20 5 DHBDMO CC(C)[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccn1 ZINC000534347032 1040815023 /nfs/dbraw/zinc/81/50/23/1040815023.db2.gz XPKASFHYGNTCIQ-CLFYSBASSA-N 1 1 311.385 3.914 20 5 DHBDMO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602540585 1041082700 /nfs/dbraw/zinc/08/27/00/1041082700.db2.gz QRIRRWNYXABGNL-ZMZPIMSZSA-N 1 1 323.352 3.759 20 5 DHBDMO CS[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602679437 1041162165 /nfs/dbraw/zinc/16/21/65/1041162165.db2.gz KZBHAONRRHRRAW-NSHDSACASA-N 1 1 320.336 3.551 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761280110 1041280618 /nfs/dbraw/zinc/28/06/18/1041280618.db2.gz LTTZCOYXJQZQJK-TZMCWYRMSA-N 1 1 316.405 3.721 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3ccc(F)cn3)CC2)cs1 ZINC000602902817 1041302738 /nfs/dbraw/zinc/30/27/38/1041302738.db2.gz DVWITMNOTUKUHK-UHFFFAOYSA-N 1 1 321.377 3.570 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cncc(Cl)c2)C2CC2)c1 ZINC000598593583 1041355153 /nfs/dbraw/zinc/35/51/53/1041355153.db2.gz CJGYQJOAPFJYKM-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cncc(Cl)c2)C2CC2)c1 ZINC000598593583 1041355168 /nfs/dbraw/zinc/35/51/68/1041355168.db2.gz CJGYQJOAPFJYKM-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](c4ccccc4)C3)nc2c1 ZINC000083169747 185215488 /nfs/dbraw/zinc/21/54/88/185215488.db2.gz NEOQLJFXSOUUMG-AWEZNQCLSA-N 1 1 323.352 3.726 20 5 DHBDMO COc1ccccc1C[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000016419949 182043907 /nfs/dbraw/zinc/04/39/07/182043907.db2.gz VXFNCNBELNZOOE-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1ccccc1C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000016419949 182043910 /nfs/dbraw/zinc/04/39/10/182043910.db2.gz VXFNCNBELNZOOE-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO CO[C@@]1(C)CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000280497707 130804594 /nfs/dbraw/zinc/80/45/94/130804594.db2.gz MRWAAGZRCPRZKP-YOEHRIQHSA-N 1 1 306.406 3.855 20 5 DHBDMO C[C@@H](c1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284015535 131041102 /nfs/dbraw/zinc/04/11/02/131041102.db2.gz HONQCCOKSJJXTL-LBPRGKRZSA-N 1 1 315.329 3.696 20 5 DHBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284015535 131041103 /nfs/dbraw/zinc/04/11/03/131041103.db2.gz HONQCCOKSJJXTL-LBPRGKRZSA-N 1 1 315.329 3.696 20 5 DHBDMO COc1cc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(F)cn1 ZINC000287577991 131288147 /nfs/dbraw/zinc/28/81/47/131288147.db2.gz HESJJUSFHVWANI-QWRGUYRKSA-N 1 1 319.336 3.549 20 5 DHBDMO COC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000288742009 131338157 /nfs/dbraw/zinc/33/81/57/131338157.db2.gz HKRVRJNBILYTHN-HNNXBMFYSA-N 1 1 320.776 3.726 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(C)c(F)c1 ZINC000176127519 332925772 /nfs/dbraw/zinc/92/57/72/332925772.db2.gz KJLBTTXOAZNENJ-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000449463615 332237539 /nfs/dbraw/zinc/23/75/39/332237539.db2.gz WPTHBRPZDZPNJA-ZYHUDNBSSA-N 1 1 302.296 3.758 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc(Cl)c1 ZINC000048775981 332304947 /nfs/dbraw/zinc/30/49/47/332304947.db2.gz KMEZNPAZDHWJRI-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO CC[C@H]([NH2+]Cc1nccn1CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000164828127 334670386 /nfs/dbraw/zinc/67/03/86/334670386.db2.gz SXXLSBKOJFYINZ-INIZCTEOSA-N 1 1 316.405 3.688 20 5 DHBDMO Cc1c(C[NH2+][C@@H](C)c2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000120450374 333283617 /nfs/dbraw/zinc/28/36/17/333283617.db2.gz CMOCULHPOXYBMQ-ZDUSSCGKSA-N 1 1 324.384 3.641 20 5 DHBDMO CCN(Cc1ccc(C(C)C)c([N+](=O)[O-])c1)[C@H]1CCC[NH2+]CC1 ZINC000414709946 334072182 /nfs/dbraw/zinc/07/21/82/334072182.db2.gz FPSDWKNZYJPWBI-INIZCTEOSA-N 1 1 319.449 3.682 20 5 DHBDMO C[C@@H]1CCCC[C@H]1OCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000534509759 334279375 /nfs/dbraw/zinc/27/93/75/334279375.db2.gz NLOSPLIWFGEJLX-RDTXWAMCSA-N 1 1 318.417 3.548 20 5 DHBDMO C[C@@H]1CCCC[C@H]1OCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000534509759 334279376 /nfs/dbraw/zinc/27/93/76/334279376.db2.gz NLOSPLIWFGEJLX-RDTXWAMCSA-N 1 1 318.417 3.548 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCN(C)c1ccccc1 ZINC000303317511 334316428 /nfs/dbraw/zinc/31/64/28/334316428.db2.gz SNLJLTVFUZRKPU-HNNXBMFYSA-N 1 1 313.401 3.724 20 5 DHBDMO CC(C)[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)CC1CC1 ZINC000534843408 334339458 /nfs/dbraw/zinc/33/94/58/334339458.db2.gz WSWNSFASRIVTPI-UHFFFAOYSA-N 1 1 315.373 3.870 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cscn1)CCCC2 ZINC000417344160 334705957 /nfs/dbraw/zinc/70/59/57/334705957.db2.gz RWXNSUKUNMFTFY-OAHLLOKOSA-N 1 1 303.387 3.609 20 5 DHBDMO CCc1nc(C)c(C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)o1 ZINC000291983107 334908076 /nfs/dbraw/zinc/90/80/76/334908076.db2.gz VQLDEOIZDQVWKA-AWEZNQCLSA-N 1 1 303.362 3.695 20 5 DHBDMO Cc1sc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)nc1C(C)C ZINC000344168923 335227073 /nfs/dbraw/zinc/22/70/73/335227073.db2.gz VEMHOTOMHCHAOY-UHFFFAOYSA-N 1 1 305.403 3.773 20 5 DHBDMO COCC[C@@H]1CCCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000332338738 336169165 /nfs/dbraw/zinc/16/91/65/336169165.db2.gz QMVVWIOVHSQNFN-CABCVRRESA-N 1 1 306.406 3.794 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000352533929 336223029 /nfs/dbraw/zinc/22/30/29/336223029.db2.gz BEQLEUHSDJSFPJ-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000352609494 336226823 /nfs/dbraw/zinc/22/68/23/336226823.db2.gz UGVJMSDOWOHXDO-JSGCOSHPSA-N 1 1 312.410 3.840 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000352609496 336226866 /nfs/dbraw/zinc/22/68/66/336226866.db2.gz UGVJMSDOWOHXDO-TZMCWYRMSA-N 1 1 312.410 3.840 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](C)[NH+]1CCC(C)CC1 ZINC000532492295 336250555 /nfs/dbraw/zinc/25/05/55/336250555.db2.gz LSMXOJFWMVQYSV-HZPDHXFCSA-N 1 1 319.449 3.674 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1OC ZINC000192757549 336260618 /nfs/dbraw/zinc/26/06/18/336260618.db2.gz SEEIBOXYMHWGRZ-OAHLLOKOSA-N 1 1 300.358 3.844 20 5 DHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2cccc(F)c2[N+](=O)[O-])C1 ZINC000301117788 336290921 /nfs/dbraw/zinc/29/09/21/336290921.db2.gz WEOCOFIYQAOHLY-CYBMUJFWSA-N 1 1 309.385 3.658 20 5 DHBDMO Cc1ccc(N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302035171 336344570 /nfs/dbraw/zinc/34/45/70/336344570.db2.gz FFXSQYVNENUEST-HUUCEWRRSA-N 1 1 317.433 3.968 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186432195 337256019 /nfs/dbraw/zinc/25/60/19/337256019.db2.gz ICYRHZYMNXKEEZ-LJQANCHMSA-N 1 1 324.380 3.535 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000189239935 337277466 /nfs/dbraw/zinc/27/74/66/337277466.db2.gz FUQLNIMPJSXRPP-MRXNPFEDSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000192347216 337304647 /nfs/dbraw/zinc/30/46/47/337304647.db2.gz DAOODHFYARJWAH-OAHLLOKOSA-N 1 1 316.332 3.607 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(OC2CCCC2)CC1 ZINC000195326833 337467665 /nfs/dbraw/zinc/46/76/65/337467665.db2.gz UGLOTGWKGFKCNU-UHFFFAOYSA-N 1 1 322.380 3.658 20 5 DHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC1(O)CCCCCC1 ZINC000428454003 338052510 /nfs/dbraw/zinc/05/25/10/338052510.db2.gz QONWOZQQJYNCBQ-CSKARUKUSA-N 1 1 318.417 3.625 20 5 DHBDMO CCCc1nc(C)c(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])o1 ZINC000429268971 338075346 /nfs/dbraw/zinc/07/53/46/338075346.db2.gz APIRKCLSCISISZ-UHFFFAOYSA-N 1 1 317.389 3.869 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000430192471 338100389 /nfs/dbraw/zinc/10/03/89/338100389.db2.gz CFFBCBJDYCTZSC-FZKQIMNGSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000430192471 338100390 /nfs/dbraw/zinc/10/03/90/338100390.db2.gz CFFBCBJDYCTZSC-FZKQIMNGSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000430192752 338100560 /nfs/dbraw/zinc/10/05/60/338100560.db2.gz BPNMAYYIVYZTAD-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000430192752 338100561 /nfs/dbraw/zinc/10/05/61/338100561.db2.gz BPNMAYYIVYZTAD-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)c1ccccc1 ZINC000430193025 338100575 /nfs/dbraw/zinc/10/05/75/338100575.db2.gz CGXRCBYESRUNBZ-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccccc1)C1CC1 ZINC000430229911 338102287 /nfs/dbraw/zinc/10/22/87/338102287.db2.gz WIKPCYNHWVMAJS-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000430229911 338102288 /nfs/dbraw/zinc/10/22/88/338102288.db2.gz WIKPCYNHWVMAJS-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO CC1=CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000437355178 338307709 /nfs/dbraw/zinc/30/77/09/338307709.db2.gz UKIRTQIIRZHWKQ-UHFFFAOYSA-N 1 1 315.398 3.870 20 5 DHBDMO CC1=CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000437355178 338307710 /nfs/dbraw/zinc/30/77/10/338307710.db2.gz UKIRTQIIRZHWKQ-UHFFFAOYSA-N 1 1 315.398 3.870 20 5 DHBDMO CC1CCC(O)(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC000438616957 338350099 /nfs/dbraw/zinc/35/00/99/338350099.db2.gz DTSQPSSONMRTLR-UHFFFAOYSA-N 1 1 318.417 3.500 20 5 DHBDMO C[C@H](C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000459785316 339048511 /nfs/dbraw/zinc/04/85/11/339048511.db2.gz ARKWXSHHWSNXTI-CHWSQXEVSA-N 1 1 322.405 3.565 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459813084 339049521 /nfs/dbraw/zinc/04/95/21/339049521.db2.gz WFVPJASTTIPGTG-QANKJYHBSA-N 1 1 318.417 3.529 20 5 DHBDMO Cc1cc(NC[C@H]2CCC[N@H+](C(C)C)C2)c(F)cc1[N+](=O)[O-] ZINC000461787358 339067081 /nfs/dbraw/zinc/06/70/81/339067081.db2.gz UGTNRGVGIHQSLK-CYBMUJFWSA-N 1 1 309.385 3.575 20 5 DHBDMO COc1cc(NCCCC[N@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000462789915 339088731 /nfs/dbraw/zinc/08/87/31/339088731.db2.gz LKANHNHQQHJMIT-AWEZNQCLSA-N 1 1 321.421 3.670 20 5 DHBDMO CC[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H](C)OC ZINC000462830062 339093014 /nfs/dbraw/zinc/09/30/14/339093014.db2.gz SRHWANWPCDYYKK-ZDUSSCGKSA-N 1 1 318.373 3.712 20 5 DHBDMO COC[C@H]1CCCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000468693238 339268657 /nfs/dbraw/zinc/26/86/57/339268657.db2.gz IJQTULTVCIFYEI-INIZCTEOSA-N 1 1 320.433 3.967 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000469467989 339290639 /nfs/dbraw/zinc/29/06/39/339290639.db2.gz DGRUDQHGXKLOMR-ZDUSSCGKSA-N 1 1 318.323 3.863 20 5 DHBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](CC)c1ccccc1 ZINC000472455291 339372253 /nfs/dbraw/zinc/37/22/53/339372253.db2.gz SYVDBKBXRVWSNF-KRWDZBQOSA-N 1 1 316.405 3.655 20 5 DHBDMO COc1cc(C[NH2+][C@H](C)c2ccc(F)cc2F)ccc1[N+](=O)[O-] ZINC000492782516 339908728 /nfs/dbraw/zinc/90/87/28/339908728.db2.gz HKWVQVWBEFYPAS-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO CCCC[N@@H+](CC)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000505876666 340180420 /nfs/dbraw/zinc/18/04/20/340180420.db2.gz KSWHGXSVIBSERH-UHFFFAOYSA-N 1 1 302.321 3.818 20 5 DHBDMO CCOc1ccccc1C[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506188862 340188062 /nfs/dbraw/zinc/18/80/62/340188062.db2.gz AXJPZWUZHKRNJA-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO CCOc1ccccc1C[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506188862 340188063 /nfs/dbraw/zinc/18/80/63/340188063.db2.gz AXJPZWUZHKRNJA-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc3c(c2)CCO3)C2CC2)cc1 ZINC000507167818 340210668 /nfs/dbraw/zinc/21/06/68/340210668.db2.gz OBVKOSMPJPIMAL-UHFFFAOYSA-N 1 1 324.380 3.694 20 5 DHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000507209315 340213715 /nfs/dbraw/zinc/21/37/15/340213715.db2.gz IPSIWIKIRHCHPF-JTQLQIEISA-N 1 1 302.321 3.673 20 5 DHBDMO C[N@@H+](CCCCC1CCOCC1)CCc1ccccc1[N+](=O)[O-] ZINC000511120534 340321440 /nfs/dbraw/zinc/32/14/40/340321440.db2.gz BTQWBHBCVVHREZ-UHFFFAOYSA-N 1 1 320.433 3.666 20 5 DHBDMO CCOc1ccccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511136428 340322000 /nfs/dbraw/zinc/32/20/00/340322000.db2.gz AEBDKILFAZNKMC-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO C[N@@H+](CCCCOC(C)(C)C)CCc1ccccc1[N+](=O)[O-] ZINC000511137766 340322109 /nfs/dbraw/zinc/32/21/09/340322109.db2.gz CVHJBWGJMYRLOI-UHFFFAOYSA-N 1 1 308.422 3.664 20 5 DHBDMO Cc1cccc([C@@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000543246295 341037866 /nfs/dbraw/zinc/03/78/66/341037866.db2.gz AHSLPFMDHJNQGH-GOSISDBHSA-N 1 1 310.397 3.935 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000245383899 341290198 /nfs/dbraw/zinc/29/01/98/341290198.db2.gz SGFUPQRHINDYCH-ZYHUDNBSSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000245383899 341290199 /nfs/dbraw/zinc/29/01/99/341290199.db2.gz SGFUPQRHINDYCH-ZYHUDNBSSA-N 1 1 302.296 3.930 20 5 DHBDMO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1c(F)cccc1F ZINC000549947079 341307636 /nfs/dbraw/zinc/30/76/36/341307636.db2.gz LFKYWXHRCHOPBD-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1c(F)cccc1F ZINC000549947079 341307637 /nfs/dbraw/zinc/30/76/37/341307637.db2.gz LFKYWXHRCHOPBD-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H](C)CO ZINC000552381580 341390182 /nfs/dbraw/zinc/39/01/82/341390182.db2.gz VGGAWDAHNFPJLH-LBPRGKRZSA-N 1 1 320.414 3.526 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@@H]2COc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000552926028 341408963 /nfs/dbraw/zinc/40/89/63/341408963.db2.gz SNXQHVBCYJZCJT-XHDPSFHLSA-N 1 1 316.332 3.827 20 5 DHBDMO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000263661839 341574725 /nfs/dbraw/zinc/57/47/25/341574725.db2.gz HJQILQSUCJIOFK-ZDUSSCGKSA-N 1 1 300.358 3.844 20 5 DHBDMO CC(C)(C)OC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000162619801 518868308 /nfs/dbraw/zinc/86/83/08/518868308.db2.gz XHHDKYFIPSBLPH-UHFFFAOYSA-N 1 1 310.369 3.513 20 5 DHBDMO CCOC[C@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182789452 520170732 /nfs/dbraw/zinc/17/07/32/520170732.db2.gz SHLXBTAPFVQNBG-GJZGRUSLSA-N 1 1 306.406 3.713 20 5 DHBDMO Cc1ccc(C[NH2+]C2(c3ccccc3F)CC2)cc1[N+](=O)[O-] ZINC000130523948 524570475 /nfs/dbraw/zinc/57/04/75/524570475.db2.gz BWRDXLAAEVLDIO-UHFFFAOYSA-N 1 1 300.333 3.821 20 5 DHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000157962014 524757904 /nfs/dbraw/zinc/75/79/04/524757904.db2.gz VQMFHTOIVSNJAK-OAHLLOKOSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccncc1F ZINC000338018977 525613488 /nfs/dbraw/zinc/61/34/88/525613488.db2.gz GBUVXPXQIOKAGC-GTNSWQLSSA-N 1 1 315.348 3.857 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cnc(Cl)s2)cc1[N+](=O)[O-] ZINC000181824346 525930594 /nfs/dbraw/zinc/93/05/94/525930594.db2.gz MGIOFIBTLXJGOV-VIFPVBQESA-N 1 1 311.794 3.864 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]1c1cnn(C)c1 ZINC000245536636 526089309 /nfs/dbraw/zinc/08/93/09/526089309.db2.gz XPAQCXRGYUEYEQ-GUYCJALGSA-N 1 1 314.389 3.535 20 5 DHBDMO C[C@H](C1CC1)[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000158023595 526204011 /nfs/dbraw/zinc/20/40/11/526204011.db2.gz CWGFRQJVROWAKN-LLVKDONJSA-N 1 1 317.414 3.949 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(Cl)nc2)C2CC2)cc1 ZINC000130844489 527348964 /nfs/dbraw/zinc/34/89/64/527348964.db2.gz PXZUPGRWTSMHDK-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(Cl)nc2)C2CC2)cc1 ZINC000130844489 527348970 /nfs/dbraw/zinc/34/89/70/527348970.db2.gz PXZUPGRWTSMHDK-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO C[N@@H+]1CCC12CN(C(=O)c1cccc3cc4ccccc4cc31)C2 ZINC001270531915 1013251360 /nfs/dbraw/zinc/25/13/60/1013251360.db2.gz UWNPSWSCZRUCEL-UHFFFAOYSA-N 1 1 316.404 3.523 20 5 DHBDMO C[N@H+]1CCC12CN(C(=O)c1cccc3cc4ccccc4cc31)C2 ZINC001270531915 1013251367 /nfs/dbraw/zinc/25/13/67/1013251367.db2.gz UWNPSWSCZRUCEL-UHFFFAOYSA-N 1 1 316.404 3.523 20 5 DHBDMO O=[N+]([O-])c1cc(Nc2cccc(C[NH+]3CCCC3)c2)ccc1O ZINC001210400791 1013834142 /nfs/dbraw/zinc/83/41/42/1013834142.db2.gz LXPGMOPSIYDZIQ-UHFFFAOYSA-N 1 1 313.357 3.640 20 5 DHBDMO C[N@H+](CCCOc1ccccc1)Cc1csc([N+](=O)[O-])c1 ZINC000047266128 1013884463 /nfs/dbraw/zinc/88/44/63/1013884463.db2.gz MXUFGKBSLQSBOR-UHFFFAOYSA-N 1 1 306.387 3.557 20 5 DHBDMO C[N@@H+](CCCOc1ccccc1)Cc1csc([N+](=O)[O-])c1 ZINC000047266128 1013884467 /nfs/dbraw/zinc/88/44/67/1013884467.db2.gz MXUFGKBSLQSBOR-UHFFFAOYSA-N 1 1 306.387 3.557 20 5 DHBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000536023722 1013962134 /nfs/dbraw/zinc/96/21/34/1013962134.db2.gz WOMRNCROIFFNEF-OAHLLOKOSA-N 1 1 317.776 3.847 20 5 DHBDMO CCCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](C)c1ccc(C)o1 ZINC000610485006 1014605437 /nfs/dbraw/zinc/60/54/37/1014605437.db2.gz KDYIHXARQYYYKC-AWEZNQCLSA-N 1 1 320.393 3.556 20 5 DHBDMO CC(C)[N@H+]1CC[C@H](Oc2cc(Cl)c(Cl)cc2[N+](=O)[O-])C1 ZINC001227126003 1015500788 /nfs/dbraw/zinc/50/07/88/1015500788.db2.gz OACUBOPXWVGMKE-VIFPVBQESA-N 1 1 319.188 3.763 20 5 DHBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000185644496 1015607673 /nfs/dbraw/zinc/60/76/73/1015607673.db2.gz VJKYQOQMLLSHCO-WBMJQRKESA-N 1 1 315.373 3.870 20 5 DHBDMO CCOc1cc(C[N@H+](C)[C@@H](C)c2cccnc2)ccc1[N+](=O)[O-] ZINC000276886772 1015731057 /nfs/dbraw/zinc/73/10/57/1015731057.db2.gz JMQFXCPIBNSBQE-ZDUSSCGKSA-N 1 1 315.373 3.582 20 5 DHBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)c2cccnc2)ccc1[N+](=O)[O-] ZINC000276886772 1015731068 /nfs/dbraw/zinc/73/10/68/1015731068.db2.gz JMQFXCPIBNSBQE-ZDUSSCGKSA-N 1 1 315.373 3.582 20 5 DHBDMO O=[N+]([O-])c1ccccc1NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000380972303 1016258320 /nfs/dbraw/zinc/25/83/20/1016258320.db2.gz BBMNDNOVCRLDLV-INIZCTEOSA-N 1 1 311.385 3.529 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2ccncc2)C1 ZINC000451000648 1016377195 /nfs/dbraw/zinc/37/71/95/1016377195.db2.gz GGZPZANJVSZHBU-HOCLYGCPSA-N 1 1 311.385 3.930 20 5 DHBDMO CC[N@@H+](Cc1cccc(F)c1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000051564304 1016550102 /nfs/dbraw/zinc/55/01/02/1016550102.db2.gz OPEXHPVTRNUTQH-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CCCC2)CC1 ZINC000072667083 1016778986 /nfs/dbraw/zinc/77/89/86/1016778986.db2.gz CQZLKBZHXJPKAP-HNNXBMFYSA-N 1 1 317.433 3.606 20 5 DHBDMO Cc1ccc(C[N@H+]2CCSC[C@H]2C2CCC2)cc1[N+](=O)[O-] ZINC001171344446 1032500533 /nfs/dbraw/zinc/50/05/33/1032500533.db2.gz OOOCOUYWRGNIAW-INIZCTEOSA-N 1 1 306.431 3.621 20 5 DHBDMO Cc1ncc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000773041979 1032536905 /nfs/dbraw/zinc/53/69/05/1032536905.db2.gz UWZLDKHSQUOWDW-QMMMGPOBSA-N 1 1 311.794 3.864 20 5 DHBDMO CCc1ccc([C@@H]([NH2+][C@@H]2CC23CC3)c2ccc([N+](=O)[O-])cc2)o1 ZINC000424318798 1011979320 /nfs/dbraw/zinc/97/93/20/1011979320.db2.gz HSVGJSZKNAHKOT-SJORKVTESA-N 1 1 312.369 3.982 20 5 DHBDMO CC[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CCS1 ZINC000464794174 1012380911 /nfs/dbraw/zinc/38/09/11/1012380911.db2.gz WJMAGFLQOQHDMT-HNNXBMFYSA-N 1 1 324.446 3.709 20 5 DHBDMO CC[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CCS1 ZINC000464794174 1012380919 /nfs/dbraw/zinc/38/09/19/1012380919.db2.gz WJMAGFLQOQHDMT-HNNXBMFYSA-N 1 1 324.446 3.709 20 5 DHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1CC1 ZINC000122884553 1032625648 /nfs/dbraw/zinc/62/56/48/1032625648.db2.gz PYHDJNAOYUUDGZ-UHFFFAOYSA-N 1 1 303.387 3.560 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000515379583 1012613022 /nfs/dbraw/zinc/61/30/22/1012613022.db2.gz HJQOIASGPZGEKD-UKRRQHHQSA-N 1 1 324.808 3.639 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)cc1[N+](=O)[O-] ZINC000537689255 1032644786 /nfs/dbraw/zinc/64/47/86/1032644786.db2.gz JQEHYCODTUAPJO-RDJZCZTQSA-N 1 1 318.417 3.719 20 5 DHBDMO COc1ccc(C[N@@H+](C)C[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000608976716 1012780816 /nfs/dbraw/zinc/78/08/16/1012780816.db2.gz JTBTYGKEEQSEKJ-CQSZACIVSA-N 1 1 314.385 3.839 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCC[C@@H]2C)CC1 ZINC000134739640 1012950670 /nfs/dbraw/zinc/95/06/70/1012950670.db2.gz COSYOLHEBYMCOA-GJZGRUSLSA-N 1 1 317.433 3.605 20 5 DHBDMO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000165296315 1013038553 /nfs/dbraw/zinc/03/85/53/1013038553.db2.gz UFANZTXFAYBVDH-LRDDRELGSA-N 1 1 318.373 3.789 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC000075744907 1017327287 /nfs/dbraw/zinc/32/72/87/1017327287.db2.gz JVCXIFXZPHJNPB-HOCLYGCPSA-N 1 1 312.369 3.809 20 5 DHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000444771200 1017394458 /nfs/dbraw/zinc/39/44/58/1017394458.db2.gz INNJELWEZOJAID-LBPRGKRZSA-N 1 1 303.362 3.604 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCc2ccccc21 ZINC000083138847 1017579340 /nfs/dbraw/zinc/57/93/40/1017579340.db2.gz LNDNLFSARZKOOU-INIZCTEOSA-N 1 1 323.352 3.855 20 5 DHBDMO CC(C)CC[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444652723 1017607316 /nfs/dbraw/zinc/60/73/16/1017607316.db2.gz JYSWVYFZIHFVSJ-CYBMUJFWSA-N 1 1 316.405 3.872 20 5 DHBDMO C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000091483086 1017759391 /nfs/dbraw/zinc/75/93/91/1017759391.db2.gz AZVFCLUHXJQSSI-ZDUSSCGKSA-N 1 1 321.421 3.526 20 5 DHBDMO Cc1ccccc1OCCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000059393600 1017779537 /nfs/dbraw/zinc/77/95/37/1017779537.db2.gz CWBXTWDYTNXPBM-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC2(CCC2(F)F)C1 ZINC000573146032 1018119157 /nfs/dbraw/zinc/11/91/57/1018119157.db2.gz HHBNJSZWKSFLSN-KPKJPENVSA-N 1 1 308.328 3.729 20 5 DHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000446713780 1018211191 /nfs/dbraw/zinc/21/11/91/1018211191.db2.gz AIMULNRVWKAMCJ-LJQANCHMSA-N 1 1 310.397 3.801 20 5 DHBDMO C[C@@H]1CCCC[C@@H]1OCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000446715943 1018222298 /nfs/dbraw/zinc/22/22/98/1018222298.db2.gz WGIPGHGXKRWVLF-KDOFPFPSSA-N 1 1 318.417 3.548 20 5 DHBDMO C[C@@H]1CCCC[C@@H]1OCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000446715943 1018222308 /nfs/dbraw/zinc/22/23/08/1018222308.db2.gz WGIPGHGXKRWVLF-KDOFPFPSSA-N 1 1 318.417 3.548 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC(F)(F)CC2)ccc1Cl ZINC000702828840 1018241349 /nfs/dbraw/zinc/24/13/49/1018241349.db2.gz XTSLOJSLZJXCHV-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC(F)(F)CC2)ccc1Cl ZINC000702828840 1018241369 /nfs/dbraw/zinc/24/13/69/1018241369.db2.gz XTSLOJSLZJXCHV-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000526001433 1018436160 /nfs/dbraw/zinc/43/61/60/1018436160.db2.gz WVDIGYUPYUVGJX-AWEZNQCLSA-N 1 1 300.333 3.723 20 5 DHBDMO CC[C@@H](C)C[N@@H+](CC)Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000765062136 1018466656 /nfs/dbraw/zinc/46/66/56/1018466656.db2.gz POXFPFDDVCEJCG-GFCCVEGCSA-N 1 1 304.394 3.578 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000042976784 1018508000 /nfs/dbraw/zinc/50/80/00/1018508000.db2.gz XNDYIAUNPDEAOS-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO C[N@@H+](CCCc1ccsc1)CCc1cccc([N+](=O)[O-])c1 ZINC000554847212 1018740371 /nfs/dbraw/zinc/74/03/71/1018740371.db2.gz UASQRUIZZOKAGY-UHFFFAOYSA-N 1 1 304.415 3.763 20 5 DHBDMO CC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CCC1 ZINC000706763436 1018753098 /nfs/dbraw/zinc/75/30/98/1018753098.db2.gz ROTBVGYCKCLYLG-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278613684 1018928007 /nfs/dbraw/zinc/92/80/07/1018928007.db2.gz FQAZXPQOBRJMFV-QWRGUYRKSA-N 1 1 302.296 3.930 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000584111193 1018963663 /nfs/dbraw/zinc/96/36/63/1018963663.db2.gz QDGZNRBFIAXHBT-ZDUSSCGKSA-N 1 1 317.776 3.633 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cn2)cc1[N+](=O)[O-] ZINC000090217530 1019384362 /nfs/dbraw/zinc/38/43/62/1019384362.db2.gz WABAERLVZAHBFQ-VXGBXAGGSA-N 1 1 303.337 3.849 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(Cl)s1 ZINC000524425118 1019446471 /nfs/dbraw/zinc/44/64/71/1019446471.db2.gz GUTUOYQUSZGRQZ-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[N@@H+](C)C1CC1 ZINC000301825872 1019504827 /nfs/dbraw/zinc/50/48/27/1019504827.db2.gz MMOSNRLGXASNRI-SECBINFHSA-N 1 1 317.311 3.508 20 5 DHBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000611554734 1019515605 /nfs/dbraw/zinc/51/56/05/1019515605.db2.gz XEZLUECIXDSFET-PWSUYJOCSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000611554734 1019515613 /nfs/dbraw/zinc/51/56/13/1019515613.db2.gz XEZLUECIXDSFET-PWSUYJOCSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000611554552 1019520039 /nfs/dbraw/zinc/52/00/39/1019520039.db2.gz UWXURUAAAXVQAR-PWSUYJOCSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000611554552 1019520049 /nfs/dbraw/zinc/52/00/49/1019520049.db2.gz UWXURUAAAXVQAR-PWSUYJOCSA-N 1 1 302.296 3.758 20 5 DHBDMO COc1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)cc1Cl ZINC000132325435 1019585004 /nfs/dbraw/zinc/58/50/04/1019585004.db2.gz XXQPYCDZWCRXGY-UHFFFAOYSA-N 1 1 312.778 3.608 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cnc(C)s1 ZINC001119066976 1019654566 /nfs/dbraw/zinc/65/45/66/1019654566.db2.gz XVYBUUSEVFUHIM-VIFPVBQESA-N 1 1 323.443 3.932 20 5 DHBDMO CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)c1cccc(O)c1 ZINC000080933247 1019914868 /nfs/dbraw/zinc/91/48/68/1019914868.db2.gz KORBDTORZURDDX-ZDUSSCGKSA-N 1 1 300.358 3.884 20 5 DHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)c1cccc(O)c1 ZINC000080933247 1019914875 /nfs/dbraw/zinc/91/48/75/1019914875.db2.gz KORBDTORZURDDX-ZDUSSCGKSA-N 1 1 300.358 3.884 20 5 DHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1cc(F)c(F)c(F)c1 ZINC000154221858 1020080860 /nfs/dbraw/zinc/08/08/60/1020080860.db2.gz SBKYCFIYEYKCBV-UHFFFAOYSA-N 1 1 310.275 3.644 20 5 DHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1cc(F)c(F)c(F)c1 ZINC000154221858 1020080871 /nfs/dbraw/zinc/08/08/71/1020080871.db2.gz SBKYCFIYEYKCBV-UHFFFAOYSA-N 1 1 310.275 3.644 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC3(CCC3)C2)c1 ZINC000093456022 1020151654 /nfs/dbraw/zinc/15/16/54/1020151654.db2.gz UTUUYEVBWRYFBB-UHFFFAOYSA-N 1 1 312.316 3.572 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC3(CCC3)C2)c1 ZINC000093456022 1020151665 /nfs/dbraw/zinc/15/16/65/1020151665.db2.gz UTUUYEVBWRYFBB-UHFFFAOYSA-N 1 1 312.316 3.572 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1 ZINC000154912486 1020163706 /nfs/dbraw/zinc/16/37/06/1020163706.db2.gz YPVZVBHOMSSJLO-QGZVFWFLSA-N 1 1 311.385 3.671 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(C2CC2)s1 ZINC000555340187 1020215002 /nfs/dbraw/zinc/21/50/02/1020215002.db2.gz RVYKMXPKPCWBIJ-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(OC3CCCCC3)CC2)cs1 ZINC000125448585 1020309931 /nfs/dbraw/zinc/30/99/31/1020309931.db2.gz IANJMKHGLXADBM-UHFFFAOYSA-N 1 1 324.446 3.970 20 5 DHBDMO CC[C@H](N[C@H]1CC[N@@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000153770583 1020581400 /nfs/dbraw/zinc/58/14/00/1020581400.db2.gz FCJIZHJQKLZKMY-YJBOKZPZSA-N 1 1 317.433 3.652 20 5 DHBDMO CC[C@H](N[C@H]1CC[N@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000153770583 1020581405 /nfs/dbraw/zinc/58/14/05/1020581405.db2.gz FCJIZHJQKLZKMY-YJBOKZPZSA-N 1 1 317.433 3.652 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1nc(C2CC2)cs1 ZINC000581499168 1020892946 /nfs/dbraw/zinc/89/29/46/1020892946.db2.gz VTARGGJQSBEYMN-CYBMUJFWSA-N 1 1 315.398 3.706 20 5 DHBDMO C[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000581774659 1020901120 /nfs/dbraw/zinc/90/11/20/1020901120.db2.gz CHHSUPZTFFGBEJ-JTQLQIEISA-N 1 1 302.296 3.988 20 5 DHBDMO C[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000581774659 1020901124 /nfs/dbraw/zinc/90/11/24/1020901124.db2.gz CHHSUPZTFFGBEJ-JTQLQIEISA-N 1 1 302.296 3.988 20 5 DHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]12 ZINC000776277474 1021208732 /nfs/dbraw/zinc/20/87/32/1021208732.db2.gz PYLGHFCCYMCCEU-PILAGYSTSA-N 1 1 318.417 3.529 20 5 DHBDMO CC(C)[N@H+](Cc1cccs1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277439 1021208976 /nfs/dbraw/zinc/20/89/76/1021208976.db2.gz PKMKLFISMXKBRV-INIZCTEOSA-N 1 1 320.414 3.600 20 5 DHBDMO CC[C@]1(C)CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000177162077 1021220861 /nfs/dbraw/zinc/22/08/61/1021220861.db2.gz OHASXPCZORMQLU-MRXNPFEDSA-N 1 1 303.362 3.748 20 5 DHBDMO CC(C)c1[nH+]ccn1Cc1cc([N+](=O)[O-])ccc1Br ZINC000917363791 1021248099 /nfs/dbraw/zinc/24/80/99/1021248099.db2.gz OWOIZCRVKIUNJW-UHFFFAOYSA-N 1 1 324.178 3.726 20 5 DHBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000743381056 1021287417 /nfs/dbraw/zinc/28/74/17/1021287417.db2.gz TUDZNGAUMCHYJK-BBRMVZONSA-N 1 1 316.405 3.803 20 5 DHBDMO CC(C)[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC1CCC1 ZINC000618327859 1021353828 /nfs/dbraw/zinc/35/38/28/1021353828.db2.gz YKFLWPGHEKQHAS-UHFFFAOYSA-N 1 1 303.362 3.747 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)CN1CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000480697436 1021466936 /nfs/dbraw/zinc/46/69/36/1021466936.db2.gz KURZHENCZGHMQX-LSDHHAIUSA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000744201250 1021469701 /nfs/dbraw/zinc/46/97/01/1021469701.db2.gz VUARFPCIIRCQKH-INIZCTEOSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000744201250 1021469707 /nfs/dbraw/zinc/46/97/07/1021469707.db2.gz VUARFPCIIRCQKH-INIZCTEOSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCc3ccc(O)cc32)c1 ZINC000850386640 1021503658 /nfs/dbraw/zinc/50/36/58/1021503658.db2.gz KPFAJKJQYWURMC-INIZCTEOSA-N 1 1 318.760 3.731 20 5 DHBDMO O=[N+]([O-])c1ccsc1NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000619499430 1021773406 /nfs/dbraw/zinc/77/34/06/1021773406.db2.gz RHMWQXKKUWIFDA-AWEZNQCLSA-N 1 1 317.414 3.590 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](CCc2ccccc2)C2CC2)cc1 ZINC000746119353 1021858199 /nfs/dbraw/zinc/85/81/99/1021858199.db2.gz UWZIVICPYLQSAG-UHFFFAOYSA-N 1 1 310.397 3.844 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+](CCc2ccccc2)C2CC2)cs1 ZINC000746119146 1021862106 /nfs/dbraw/zinc/86/21/06/1021862106.db2.gz PHTHWLHATXEZHW-UHFFFAOYSA-N 1 1 302.399 3.863 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc2cnccc21 ZINC000619846240 1021921542 /nfs/dbraw/zinc/92/15/42/1021921542.db2.gz UYZDKSFTDOPOEG-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](O)C23CCCC3)cc1[N+](=O)[O-] ZINC000556909176 1021943823 /nfs/dbraw/zinc/94/38/23/1021943823.db2.gz YOXLKQSDVBKXPC-QGZVFWFLSA-N 1 1 318.417 3.598 20 5 DHBDMO CC[C@H](C)[C@H](C)[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776583136 1022094056 /nfs/dbraw/zinc/09/40/56/1022094056.db2.gz XQHNEDYDKVHNOY-GDZNZVCISA-N 1 1 306.406 3.527 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](CC2CC2)C2CCCCC2)cc1 ZINC000776582462 1022094462 /nfs/dbraw/zinc/09/44/62/1022094462.db2.gz URSLYDHYYDCTIF-GOSISDBHSA-N 1 1 318.417 3.673 20 5 DHBDMO Cc1cc2c(cc1[N+](=O)[O-])N(C[C@@H]1CCCC[N@@H+]1C(C)C)CC2 ZINC001168784653 1022101375 /nfs/dbraw/zinc/10/13/75/1022101375.db2.gz FYNXTCVWJLQQEO-INIZCTEOSA-N 1 1 317.433 3.529 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H](c3ccccc3Cl)C2)C1 ZINC001169034560 1022222323 /nfs/dbraw/zinc/22/23/23/1022222323.db2.gz HUURMWDZEYYJFA-RDBSUJKOSA-N 1 1 308.809 3.575 20 5 DHBDMO CSc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169041686 1022224439 /nfs/dbraw/zinc/22/44/39/1022224439.db2.gz CAGXBNJQFKFCTL-YCPHGPKFSA-N 1 1 320.458 3.991 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H]2c2ccccc2Cl)C1 ZINC001169025500 1022228207 /nfs/dbraw/zinc/22/82/07/1022228207.db2.gz JQUTUPUUFOVXSQ-IOASZLSFSA-N 1 1 308.809 3.922 20 5 DHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1ccsc1[N+](=O)[O-] ZINC000609560710 1022301103 /nfs/dbraw/zinc/30/11/03/1022301103.db2.gz YDABGKUPQKIEAW-UHFFFAOYSA-N 1 1 314.370 3.763 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)c1 ZINC000609800772 1022352622 /nfs/dbraw/zinc/35/26/22/1022352622.db2.gz SCNZCSYOUUONKF-QGZVFWFLSA-N 1 1 314.410 3.885 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000609916445 1022382673 /nfs/dbraw/zinc/38/26/73/1022382673.db2.gz ORYMVCPBNPBEMB-OAHLLOKOSA-N 1 1 314.360 3.799 20 5 DHBDMO C[C@H]1c2c(F)cccc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610004453 1022401472 /nfs/dbraw/zinc/40/14/72/1022401472.db2.gz KWGCHQNLBZSYPM-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H]1c2c(F)cccc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610004453 1022401479 /nfs/dbraw/zinc/40/14/79/1022401479.db2.gz KWGCHQNLBZSYPM-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000610133444 1022425455 /nfs/dbraw/zinc/42/54/55/1022425455.db2.gz PBDRAJSKEBUNMU-BRWVUGGUSA-N 1 1 318.417 3.620 20 5 DHBDMO CCOc1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000131050316 1022572635 /nfs/dbraw/zinc/57/26/35/1022572635.db2.gz CYJDUTQJOFYYRW-UHFFFAOYSA-N 1 1 320.776 3.937 20 5 DHBDMO CSC[C@H]1CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000767907957 1022839406 /nfs/dbraw/zinc/83/94/06/1022839406.db2.gz YISCMCCBENRBCI-GFCCVEGCSA-N 1 1 300.811 3.576 20 5 DHBDMO CC(C)[C@H](C)[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768270256 1022935378 /nfs/dbraw/zinc/93/53/78/1022935378.db2.gz XUAMTKHYXNGCMU-JTQLQIEISA-N 1 1 315.211 3.834 20 5 DHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768270256 1022935383 /nfs/dbraw/zinc/93/53/83/1022935383.db2.gz XUAMTKHYXNGCMU-JTQLQIEISA-N 1 1 315.211 3.834 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@]3(CCCOC3)C2)ccc1Cl ZINC000768548925 1022995747 /nfs/dbraw/zinc/99/57/47/1022995747.db2.gz LEKISLPVMWBQHR-INIZCTEOSA-N 1 1 324.808 3.641 20 5 DHBDMO COc1cc(NCCC[N@H+]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1C ZINC001167753546 1023041779 /nfs/dbraw/zinc/04/17/79/1023041779.db2.gz PNPACULDIOXKJC-ZDUSSCGKSA-N 1 1 321.421 3.588 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2c(C)ccc([N+](=O)[O-])c2C)on1 ZINC000876617275 1033106274 /nfs/dbraw/zinc/10/62/74/1033106274.db2.gz JAZANYCGNXJVTN-INIZCTEOSA-N 1 1 315.373 3.845 20 5 DHBDMO Cc1ccc(C(C)(C)[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])cn1 ZINC000759908529 1023224044 /nfs/dbraw/zinc/22/40/44/1023224044.db2.gz CJZAUZKDBCCAGK-UHFFFAOYSA-N 1 1 319.792 3.977 20 5 DHBDMO Cc1ncsc1C[N@@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000876686847 1033122846 /nfs/dbraw/zinc/12/28/46/1033122846.db2.gz BFTRIUWUAVQCCX-UHFFFAOYSA-N 1 1 305.403 3.609 20 5 DHBDMO Cc1ncsc1C[N@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000876686847 1033122856 /nfs/dbraw/zinc/12/28/56/1033122856.db2.gz BFTRIUWUAVQCCX-UHFFFAOYSA-N 1 1 305.403 3.609 20 5 DHBDMO CCC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000106866081 1023388682 /nfs/dbraw/zinc/38/86/82/1023388682.db2.gz WPSLJZRNQVOWRI-ZDUSSCGKSA-N 1 1 310.369 3.515 20 5 DHBDMO CCC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000106866081 1023388686 /nfs/dbraw/zinc/38/86/86/1023388686.db2.gz WPSLJZRNQVOWRI-ZDUSSCGKSA-N 1 1 310.369 3.515 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H](C)C1(F)F ZINC000859413448 1033135787 /nfs/dbraw/zinc/13/57/87/1033135787.db2.gz IEFRRTFEFWCJSW-AOOOYVTPSA-N 1 1 318.751 3.971 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H](C)C1(F)F ZINC000859413448 1033135796 /nfs/dbraw/zinc/13/57/96/1033135796.db2.gz IEFRRTFEFWCJSW-AOOOYVTPSA-N 1 1 318.751 3.971 20 5 DHBDMO CC(C)[C@@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CCS1 ZINC000538728388 1033149762 /nfs/dbraw/zinc/14/97/62/1033149762.db2.gz QPSOXRQIFXOILV-YERXGYGTSA-N 1 1 306.431 3.681 20 5 DHBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](C)C(C)C ZINC000112656961 1023815023 /nfs/dbraw/zinc/81/50/23/1023815023.db2.gz WMZPAVVMSGKQBY-GFCCVEGCSA-N 1 1 318.377 3.511 20 5 DHBDMO Cc1[nH+]c(N)ccc1CNc1cc2cccnc2c2ncccc12 ZINC001167786386 1023862053 /nfs/dbraw/zinc/86/20/53/1023862053.db2.gz FLMWRZOJPXPDHV-UHFFFAOYSA-N 1 1 315.380 3.681 20 5 DHBDMO C[N@@H+](CCCOc1ccccc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788471711 1023890187 /nfs/dbraw/zinc/89/01/87/1023890187.db2.gz YNFBOLLZCRJUPY-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1c1ccccc1 ZINC000788483917 1023899960 /nfs/dbraw/zinc/89/99/60/1023899960.db2.gz YVQMCWFZOBPEPJ-SJCJKPOMSA-N 1 1 300.333 3.927 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1c1ccccc1 ZINC000788483917 1023899965 /nfs/dbraw/zinc/89/99/65/1023899965.db2.gz YVQMCWFZOBPEPJ-SJCJKPOMSA-N 1 1 300.333 3.927 20 5 DHBDMO CCC[C@H]([NH2+]Cc1cn2ccccc2n1)c1cccc([N+](=O)[O-])c1 ZINC000268717898 1024145369 /nfs/dbraw/zinc/14/53/69/1024145369.db2.gz JHAJKGRRAJNUCH-KRWDZBQOSA-N 1 1 324.384 3.874 20 5 DHBDMO Cc1c([C@H](C)[NH2+]C2CCN(C3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000268975036 1024208057 /nfs/dbraw/zinc/20/80/57/1024208057.db2.gz GOBSOEZQJGPABY-AWEZNQCLSA-N 1 1 317.433 3.571 20 5 DHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000520183041 1024208646 /nfs/dbraw/zinc/20/86/46/1024208646.db2.gz CQYWHPODZGZFTO-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCc2c1c(F)ccc2F ZINC000269815568 1024315319 /nfs/dbraw/zinc/31/53/19/1024315319.db2.gz HYHJRSNWTBMNDE-CQSZACIVSA-N 1 1 304.296 3.650 20 5 DHBDMO Cc1cnc(CC[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000270119055 1024352348 /nfs/dbraw/zinc/35/23/48/1024352348.db2.gz NKYOXRWVKBCNBA-GFCCVEGCSA-N 1 1 305.403 3.595 20 5 DHBDMO Cc1c(C[N@H+]2CC=C(C(F)(F)F)CC2)cccc1[N+](=O)[O-] ZINC000270187902 1024363801 /nfs/dbraw/zinc/36/38/01/1024363801.db2.gz NAKUXTOYVJEPBZ-UHFFFAOYSA-N 1 1 300.280 3.598 20 5 DHBDMO Cc1c(C[N@@H+]2CC=C(C(F)(F)F)CC2)cccc1[N+](=O)[O-] ZINC000270187902 1024363815 /nfs/dbraw/zinc/36/38/15/1024363815.db2.gz NAKUXTOYVJEPBZ-UHFFFAOYSA-N 1 1 300.280 3.598 20 5 DHBDMO CC[N@@H+](CCc1nccs1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000270789634 1024429900 /nfs/dbraw/zinc/42/99/00/1024429900.db2.gz JQULAHDEHRGIKF-GFCCVEGCSA-N 1 1 305.403 3.677 20 5 DHBDMO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](CC[N+](=O)[O-])C1CC1 ZINC000791053644 1024433948 /nfs/dbraw/zinc/43/39/48/1024433948.db2.gz UYONJSAFQOLINA-JTQLQIEISA-N 1 1 302.296 3.508 20 5 DHBDMO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](CC[N+](=O)[O-])C1CC1 ZINC000791053644 1024433954 /nfs/dbraw/zinc/43/39/54/1024433954.db2.gz UYONJSAFQOLINA-JTQLQIEISA-N 1 1 302.296 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cnc(C3CC3)o1)CCC2 ZINC000453338900 1024470251 /nfs/dbraw/zinc/47/02/51/1024470251.db2.gz CSEBRWHFENASSQ-INIZCTEOSA-N 1 1 313.357 3.627 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCC[N@H+]1CCCC[C@H]1C ZINC000532188088 1024569783 /nfs/dbraw/zinc/56/97/83/1024569783.db2.gz AKRCRWMPHOMCKJ-CVEARBPZSA-N 1 1 319.449 3.818 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000348931358 1024651788 /nfs/dbraw/zinc/65/17/88/1024651788.db2.gz AWHSAAVBERRQFX-AUNFYEFLSA-N 1 1 309.369 3.840 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000348946444 1024654029 /nfs/dbraw/zinc/65/40/29/1024654029.db2.gz GJIDZDUPCIRGQC-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO CCc1noc(CC)c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000166965172 1024666679 /nfs/dbraw/zinc/66/66/79/1024666679.db2.gz MRMRDETWAVJCMA-GFCCVEGCSA-N 1 1 317.389 3.867 20 5 DHBDMO Cc1cc(N[C@@H](C)C[N@@H+](C)C(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000323983356 1024681532 /nfs/dbraw/zinc/68/15/32/1024681532.db2.gz AFFKOFIRSGRHEP-ZDUSSCGKSA-N 1 1 316.405 3.592 20 5 DHBDMO Cc1cc(N[C@@H](C)C[N@H+](C)C(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000323983356 1024681540 /nfs/dbraw/zinc/68/15/40/1024681540.db2.gz AFFKOFIRSGRHEP-ZDUSSCGKSA-N 1 1 316.405 3.592 20 5 DHBDMO Cc1c(C[N@H+](C)[C@H](C)c2cccc(O)c2)cccc1[N+](=O)[O-] ZINC000109780997 1024695634 /nfs/dbraw/zinc/69/56/34/1024695634.db2.gz DXLWAMIYQBMCGH-CYBMUJFWSA-N 1 1 300.358 3.802 20 5 DHBDMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC001170280170 1024734314 /nfs/dbraw/zinc/73/43/14/1024734314.db2.gz BYKOMIWRFZEFRI-NWDGAFQWSA-N 1 1 310.369 3.753 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H](C)CC2)c([N+](=O)[O-])c1 ZINC001170336394 1024746719 /nfs/dbraw/zinc/74/67/19/1024746719.db2.gz XKGRZGGRKRHIIS-ZIAGYGMSSA-N 1 1 306.406 3.656 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170352789 1024749397 /nfs/dbraw/zinc/74/93/97/1024749397.db2.gz QGXPRGNHOOCBNH-UKRRQHHQSA-N 1 1 306.406 3.799 20 5 DHBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111311334 1024752490 /nfs/dbraw/zinc/75/24/90/1024752490.db2.gz WKRPHYXXLJEKBQ-OAHLLOKOSA-N 1 1 317.414 3.869 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170345742 1024756136 /nfs/dbraw/zinc/75/61/36/1024756136.db2.gz LIUYOTNIDBNINF-RDBSUJKOSA-N 1 1 306.406 3.655 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCOc1ccccc1F ZINC000050507869 1024778152 /nfs/dbraw/zinc/77/81/52/1024778152.db2.gz GIRPTLJNRUFBJU-CYBMUJFWSA-N 1 1 318.348 3.806 20 5 DHBDMO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000350261127 1024799830 /nfs/dbraw/zinc/79/98/30/1024799830.db2.gz ZSHVECSOKAWTKT-LLVKDONJSA-N 1 1 303.337 3.542 20 5 DHBDMO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000342685394 1024847203 /nfs/dbraw/zinc/84/72/03/1024847203.db2.gz HPQVPCDXLMLTKL-OAGGEKHMSA-N 1 1 317.433 3.603 20 5 DHBDMO Cc1csc(C(C)(C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000116382998 1024859855 /nfs/dbraw/zinc/85/98/55/1024859855.db2.gz CAHHDMCANKAFRV-UHFFFAOYSA-N 1 1 305.403 3.693 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CCCO1 ZINC000170774071 1024873783 /nfs/dbraw/zinc/87/37/83/1024873783.db2.gz XWZVSHZMVDYJIL-CQSZACIVSA-N 1 1 323.392 3.557 20 5 DHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000793338183 1024996637 /nfs/dbraw/zinc/99/66/37/1024996637.db2.gz CYVFNUKEISMOCN-HNNXBMFYSA-N 1 1 312.797 3.639 20 5 DHBDMO C[C@H](NCC(C)(C)[N@H+]1CCC[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467839111 1025015116 /nfs/dbraw/zinc/01/51/16/1025015116.db2.gz MXKNJYRWWLRGKE-GJZGRUSLSA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@H]([NH2+]CC(C)(C)N1CCC[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467839111 1025015128 /nfs/dbraw/zinc/01/51/28/1025015128.db2.gz MXKNJYRWWLRGKE-GJZGRUSLSA-N 1 1 319.449 3.756 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000353746090 1025228325 /nfs/dbraw/zinc/22/83/25/1025228325.db2.gz KVMWYXZBRBPAIX-NTSMAEHXSA-N 1 1 316.401 3.501 20 5 DHBDMO CC[C@@H]([NH2+][C@H](c1nccn1C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000353883859 1025279795 /nfs/dbraw/zinc/27/97/95/1025279795.db2.gz VPAQOAGCHRWHTQ-CVEARBPZSA-N 1 1 314.389 3.520 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(C)cc1 ZINC000015298721 1025374971 /nfs/dbraw/zinc/37/49/71/1025374971.db2.gz BRPQEVXVEAVDKR-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(C)cc1 ZINC000015298721 1025374984 /nfs/dbraw/zinc/37/49/84/1025374984.db2.gz BRPQEVXVEAVDKR-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000885958837 1025419733 /nfs/dbraw/zinc/41/97/33/1025419733.db2.gz MPOGYRFVKBPICY-KRWDZBQOSA-N 1 1 311.385 3.587 20 5 DHBDMO CO[C@@H](C)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C(C)C ZINC000354474035 1025439314 /nfs/dbraw/zinc/43/93/14/1025439314.db2.gz ZPZLVMOFNQYUGH-AWEZNQCLSA-N 1 1 324.421 3.627 20 5 DHBDMO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cccnc2[N+](=O)[O-])o1 ZINC000886028858 1025445643 /nfs/dbraw/zinc/44/56/43/1025445643.db2.gz ZBTFCSCAYNWTNZ-IUODEOHRSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cccnc2[N+](=O)[O-])o1 ZINC000886028858 1025445650 /nfs/dbraw/zinc/44/56/50/1025445650.db2.gz ZBTFCSCAYNWTNZ-IUODEOHRSA-N 1 1 315.373 3.864 20 5 DHBDMO COc1cc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)ccn1 ZINC000805835482 1025679610 /nfs/dbraw/zinc/67/96/10/1025679610.db2.gz NIJUBXHCUDVRKN-JTQLQIEISA-N 1 1 321.764 3.503 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCOCC2(CCCC2)C1 ZINC000614253542 1025998465 /nfs/dbraw/zinc/99/84/65/1025998465.db2.gz IPZPGZLSDGNJCR-ALCCZGGFSA-N 1 1 316.401 3.501 20 5 DHBDMO Cc1cnc(CC[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])s1 ZINC000093773497 1026128821 /nfs/dbraw/zinc/12/88/21/1026128821.db2.gz CCDRQKYVTAFODF-FNORWQNLSA-N 1 1 317.414 3.547 20 5 DHBDMO C[C@H](c1ccccc1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000356813150 1026178237 /nfs/dbraw/zinc/17/82/37/1026178237.db2.gz KVWOMUOIBIYZTE-GFCCVEGCSA-N 1 1 310.357 3.664 20 5 DHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000356813150 1026178241 /nfs/dbraw/zinc/17/82/41/1026178241.db2.gz KVWOMUOIBIYZTE-GFCCVEGCSA-N 1 1 310.357 3.664 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC12CCC2 ZINC000357062498 1026300673 /nfs/dbraw/zinc/30/06/73/1026300673.db2.gz FKAZMSVEEYKVQA-GFCCVEGCSA-N 1 1 315.373 3.748 20 5 DHBDMO CSC1(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000809541343 1026548871 /nfs/dbraw/zinc/54/88/71/1026548871.db2.gz RWRRMVKOCUHMCA-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c(F)c1 ZINC000420951871 1026889934 /nfs/dbraw/zinc/88/99/34/1026889934.db2.gz RHTZPDZFFYDCFG-SNVBAGLBSA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c(F)c1 ZINC000420951871 1026889945 /nfs/dbraw/zinc/88/99/45/1026889945.db2.gz RHTZPDZFFYDCFG-SNVBAGLBSA-N 1 1 320.286 3.898 20 5 DHBDMO Cc1cc(F)ccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000183802896 1027230885 /nfs/dbraw/zinc/23/08/85/1027230885.db2.gz DUXRBHQMQZRNER-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO CC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000812780649 1027401023 /nfs/dbraw/zinc/40/10/23/1027401023.db2.gz LYOJDBVEPYDLPX-LLVKDONJSA-N 1 1 319.188 3.512 20 5 DHBDMO CC[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000812780649 1027401030 /nfs/dbraw/zinc/40/10/30/1027401030.db2.gz LYOJDBVEPYDLPX-LLVKDONJSA-N 1 1 319.188 3.512 20 5 DHBDMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000575929986 1027529270 /nfs/dbraw/zinc/52/92/70/1027529270.db2.gz YMEFHKYIYGIGSG-DYVFJYSZSA-N 1 1 314.385 3.986 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)Cc2ccccc21 ZINC000747841063 1027560491 /nfs/dbraw/zinc/56/04/91/1027560491.db2.gz NLEKUROOEOLXFP-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)Cc2ccccc21 ZINC000747841063 1027560499 /nfs/dbraw/zinc/56/04/99/1027560499.db2.gz NLEKUROOEOLXFP-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO CCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C ZINC000577002494 1027692137 /nfs/dbraw/zinc/69/21/37/1027692137.db2.gz FDYUURUBMTWVRI-UHFFFAOYSA-N 1 1 317.389 3.913 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1[N+](=O)[O-] ZINC000296787349 1027731995 /nfs/dbraw/zinc/73/19/95/1027731995.db2.gz SLYVOXAGFVDFOW-NWDGAFQWSA-N 1 1 315.329 3.915 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)c1 ZINC000778173326 1027739606 /nfs/dbraw/zinc/73/96/06/1027739606.db2.gz SQPOUOCCDLOFGZ-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c1 ZINC000778173326 1027739619 /nfs/dbraw/zinc/73/96/19/1027739619.db2.gz SQPOUOCCDLOFGZ-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO CC(C)c1ccc(C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)cc1[N+](=O)[O-] ZINC000448361125 1027757834 /nfs/dbraw/zinc/75/78/34/1027757834.db2.gz VWWGJIGLTGOWPT-GOEBONIOSA-N 1 1 320.433 3.844 20 5 DHBDMO C[C@@H]1[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCC12CCOCC2 ZINC000368834678 1028414942 /nfs/dbraw/zinc/41/49/42/1028414942.db2.gz PDRKFVNJOYEZBR-LBPRGKRZSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1noc(C)c1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449496227 1028711015 /nfs/dbraw/zinc/71/10/15/1028711015.db2.gz GEWIVPUEEDFBLG-OAHLLOKOSA-N 1 1 315.373 3.579 20 5 DHBDMO Cc1ccncc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449504325 1028723177 /nfs/dbraw/zinc/72/31/77/1028723177.db2.gz VTUCZVUTPOXRFV-INIZCTEOSA-N 1 1 311.385 3.678 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000568468268 1029076250 /nfs/dbraw/zinc/07/62/50/1029076250.db2.gz LTFLNZRXWAOHOW-HOCLYGCPSA-N 1 1 311.385 3.849 20 5 DHBDMO Cc1cnccc1CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000568862604 1029137335 /nfs/dbraw/zinc/13/73/35/1029137335.db2.gz QMUFKVPSHYHQFW-UHFFFAOYSA-N 1 1 311.385 3.505 20 5 DHBDMO Cc1cnc([C@H]2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)s1 ZINC000374231793 1029250351 /nfs/dbraw/zinc/25/03/51/1029250351.db2.gz XSFKMORIHSGIPF-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H]2CCC(F)(F)C2)C2CC2)c1 ZINC000450497908 1029503605 /nfs/dbraw/zinc/50/36/05/1029503605.db2.gz GZFFDJCTARTLHH-CYBMUJFWSA-N 1 1 310.344 3.995 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCCCC1(F)F ZINC000450932773 1029736276 /nfs/dbraw/zinc/73/62/76/1029736276.db2.gz COFZDCMDWYTXOC-CQSZACIVSA-N 1 1 312.360 3.895 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)cs1 ZINC000530280383 1029801024 /nfs/dbraw/zinc/80/10/24/1029801024.db2.gz GUVRKKBFMCZSQN-CYBMUJFWSA-N 1 1 306.362 3.785 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cccc(O)c1 ZINC000530342082 1029820859 /nfs/dbraw/zinc/82/08/59/1029820859.db2.gz VVYSVSNWXRWSCI-ZROIWOOFSA-N 1 1 312.369 3.836 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451332988 1029850668 /nfs/dbraw/zinc/85/06/68/1029850668.db2.gz ADZADYBRGRVGJP-VUNQQRPYSA-N 1 1 318.417 3.671 20 5 DHBDMO CC(C)(C)OCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451545932 1029908918 /nfs/dbraw/zinc/90/89/18/1029908918.db2.gz HYPGXCIKWFOQIX-HNNXBMFYSA-N 1 1 306.406 3.589 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCN(C)c2ccccc2C1 ZINC000533413958 1030338854 /nfs/dbraw/zinc/33/88/54/1030338854.db2.gz DWXORUGTHQHMKV-AWEZNQCLSA-N 1 1 311.385 3.608 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2ccncc2Cl)cc1[N+](=O)[O-] ZINC000866540186 1030358323 /nfs/dbraw/zinc/35/83/23/1030358323.db2.gz KPIKHHKEZPAMBA-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO Cc1c(C[NH2+][C@H](C)c2nc3c(s2)CCC3)cccc1[N+](=O)[O-] ZINC000358343825 1030447692 /nfs/dbraw/zinc/44/76/92/1030447692.db2.gz YEDCZXHXTXUQPR-LLVKDONJSA-N 1 1 317.414 3.699 20 5 DHBDMO CC[C@@H](NC[C@H]1CCCC[N@@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000358357027 1030453279 /nfs/dbraw/zinc/45/32/79/1030453279.db2.gz VTTDJXRTQULAPT-QZTJIDSGSA-N 1 1 319.449 3.898 20 5 DHBDMO CC[C@@H](NC[C@H]1CCCC[N@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000358357027 1030453286 /nfs/dbraw/zinc/45/32/86/1030453286.db2.gz VTTDJXRTQULAPT-QZTJIDSGSA-N 1 1 319.449 3.898 20 5 DHBDMO CC[C@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1cccc(OC)n1 ZINC000925693137 1030455117 /nfs/dbraw/zinc/45/51/17/1030455117.db2.gz OOWLJBFNTCKOJI-OCCSQVGLSA-N 1 1 315.373 3.800 20 5 DHBDMO CC(C)([NH2+]Cc1cc(F)ccc1F)c1ccccc1[N+](=O)[O-] ZINC000291667755 1030588789 /nfs/dbraw/zinc/58/87/89/1030588789.db2.gz FWKPDVWDKVHONT-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCSC[C@H]2C2CC2)cc1Cl ZINC000824913819 1030665165 /nfs/dbraw/zinc/66/51/65/1030665165.db2.gz GLSBLFWWHBNPMS-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC[C@H]2C2CC2)cc1Cl ZINC000824913819 1030665167 /nfs/dbraw/zinc/66/51/67/1030665167.db2.gz GLSBLFWWHBNPMS-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO CC(C)c1[nH+]ccn1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000292677385 1031125044 /nfs/dbraw/zinc/12/50/44/1031125044.db2.gz OQTUKPVYBLEXHK-UHFFFAOYSA-N 1 1 313.279 3.982 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)c1 ZINC000844437442 1031141361 /nfs/dbraw/zinc/14/13/61/1031141361.db2.gz LGZFZIPXGJXWPR-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c1 ZINC000844437442 1031141374 /nfs/dbraw/zinc/14/13/74/1031141374.db2.gz LGZFZIPXGJXWPR-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(CCCOC3)C2)c(Cl)c1 ZINC000360028656 1031248933 /nfs/dbraw/zinc/24/89/33/1031248933.db2.gz WCXAGYTVEVWXKQ-INIZCTEOSA-N 1 1 324.808 3.641 20 5 DHBDMO CCC[C@@H](NC[C@H](CC)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000360054401 1031259060 /nfs/dbraw/zinc/25/90/60/1031259060.db2.gz MRUBUMADUMXVDI-FUHWJXTLSA-N 1 1 319.449 3.900 20 5 DHBDMO COc1cccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872017853 1031400420 /nfs/dbraw/zinc/40/04/20/1031400420.db2.gz FXNLMRSFORMQRL-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO COc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872017855 1031401067 /nfs/dbraw/zinc/40/10/67/1031401067.db2.gz FXNLMRSFORMQRL-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1c(C)noc1C ZINC000872027467 1031412671 /nfs/dbraw/zinc/41/26/71/1031412671.db2.gz LLCSZDUCUVHYKQ-VIFPVBQESA-N 1 1 321.402 3.772 20 5 DHBDMO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccncc1 ZINC000872038550 1031422239 /nfs/dbraw/zinc/42/22/39/1031422239.db2.gz MLSUTOHBZBJBLH-RISCZKNCSA-N 1 1 303.337 3.931 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(F)n1 ZINC000872053867 1031443357 /nfs/dbraw/zinc/44/33/57/1031443357.db2.gz XRKJTIFAFRJIMM-JTQLQIEISA-N 1 1 321.377 3.702 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c(F)c1 ZINC000872261536 1031563781 /nfs/dbraw/zinc/56/37/81/1031563781.db2.gz HEGSJVIUYUGKHA-INIZCTEOSA-N 1 1 322.380 3.658 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c(F)c1 ZINC000872261537 1031565524 /nfs/dbraw/zinc/56/55/24/1031565524.db2.gz HEGSJVIUYUGKHA-MRXNPFEDSA-N 1 1 322.380 3.658 20 5 DHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCSC1 ZINC000293690083 1031572962 /nfs/dbraw/zinc/57/29/62/1031572962.db2.gz BTKQPRHHFLFSGN-LLVKDONJSA-N 1 1 320.336 3.551 20 5 DHBDMO CC[C@@H](CSC)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000124329282 1031685669 /nfs/dbraw/zinc/68/56/69/1031685669.db2.gz PBUPSEWFJSMJNQ-NSHDSACASA-N 1 1 302.827 3.822 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2c(F)cccc2[N+](=O)[O-])C1 ZINC000561133458 1031742255 /nfs/dbraw/zinc/74/22/55/1031742255.db2.gz PHUUZWAUXIILME-HZSPNIEDSA-N 1 1 321.396 3.576 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000476231305 1031772154 /nfs/dbraw/zinc/77/21/54/1031772154.db2.gz LJYKFCANXPXFEL-OAHLLOKOSA-N 1 1 312.369 3.593 20 5 DHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H]1CC[C@@H](C)C1 ZINC000361639569 1032027657 /nfs/dbraw/zinc/02/76/57/1032027657.db2.gz PIDQTGAZIPKYDX-CJNGLKHVSA-N 1 1 306.406 3.540 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000877604051 1033377668 /nfs/dbraw/zinc/37/76/68/1033377668.db2.gz HELOJZBUYPBKRS-INIZCTEOSA-N 1 1 311.385 3.596 20 5 DHBDMO C[C@]1(F)CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C[C@H]1F ZINC001172905813 1033437717 /nfs/dbraw/zinc/43/77/17/1033437717.db2.gz UUHYVNNSNZLTPG-OIISXLGYSA-N 1 1 324.371 3.614 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCCC[C@@H](F)C1)CC2 ZINC001172907130 1033439463 /nfs/dbraw/zinc/43/94/63/1033439463.db2.gz DIJVDOPQBFAKEO-HZPDHXFCSA-N 1 1 306.381 3.666 20 5 DHBDMO C[C@@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C[C@H]1F ZINC001172907467 1033440164 /nfs/dbraw/zinc/44/01/64/1033440164.db2.gz FGHGFYTVXVOZCM-ISTRZQFTSA-N 1 1 306.381 3.522 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H](C)C[C@@H]2C)c1F ZINC001173189889 1033585067 /nfs/dbraw/zinc/58/50/67/1033585067.db2.gz OICIJNPSJOJHKY-AGIUHOORSA-N 1 1 324.396 3.794 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001173223128 1033603933 /nfs/dbraw/zinc/60/39/33/1033603933.db2.gz YHJZPTRRBFUQLA-LNSITVRQSA-N 1 1 310.344 3.503 20 5 DHBDMO COC1(CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCC1 ZINC000339059478 1034142399 /nfs/dbraw/zinc/14/23/99/1034142399.db2.gz LCKKCCFXNBFLQJ-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880318360 1034295812 /nfs/dbraw/zinc/29/58/12/1034295812.db2.gz YCVSEPOFYWYQKR-VXGBXAGGSA-N 1 1 303.387 3.602 20 5 DHBDMO CC(C)n1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000179318247 1034298358 /nfs/dbraw/zinc/29/83/58/1034298358.db2.gz IWDYCJUPBNHOPO-UHFFFAOYSA-N 1 1 314.389 3.537 20 5 DHBDMO CC(C)n1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000179318247 1034298366 /nfs/dbraw/zinc/29/83/66/1034298366.db2.gz IWDYCJUPBNHOPO-UHFFFAOYSA-N 1 1 314.389 3.537 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H](c3ccccc3)C3CC3)nc2c1 ZINC000179695885 1034326325 /nfs/dbraw/zinc/32/63/25/1034326325.db2.gz XMKPISSLDRYNBR-SFHVURJKSA-N 1 1 323.352 3.977 20 5 DHBDMO Cc1cc(F)ccc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554849113 1034374110 /nfs/dbraw/zinc/37/41/10/1034374110.db2.gz VJAFCPJRBRLBEN-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO CCCC[NH+]1CCC([NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000192844506 1034697613 /nfs/dbraw/zinc/69/76/13/1034697613.db2.gz IPKMWQDLYIDDNQ-SFHVURJKSA-N 1 1 319.449 3.900 20 5 DHBDMO CCCCN1CCC([NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000192844506 1034697620 /nfs/dbraw/zinc/69/76/20/1034697620.db2.gz IPKMWQDLYIDDNQ-SFHVURJKSA-N 1 1 319.449 3.900 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000600189671 1034797853 /nfs/dbraw/zinc/79/78/53/1034797853.db2.gz LWLWAPRZANXMAK-SZWGIHMLSA-N 1 1 304.415 3.578 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](c2ccc(O)cc2)C1 ZINC000600214152 1034807672 /nfs/dbraw/zinc/80/76/72/1034807672.db2.gz LGDUQVKTYBYEDM-MRXNPFEDSA-N 1 1 312.369 3.598 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)cc1 ZINC000481677694 1034930081 /nfs/dbraw/zinc/93/00/81/1034930081.db2.gz PXJIDYRTUZZSTA-IBGZPJMESA-N 1 1 324.380 3.616 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H](C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000481976071 1035039908 /nfs/dbraw/zinc/03/99/08/1035039908.db2.gz XROYFRFTWWSINV-HOTGVXAUSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c([C@H](C)NC[C@H](C)[NH+]2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000481976594 1035040133 /nfs/dbraw/zinc/04/01/33/1035040133.db2.gz ZYVGDHXZXASOHM-HOCLYGCPSA-N 1 1 319.449 3.674 20 5 DHBDMO CCC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000159415501 1035048711 /nfs/dbraw/zinc/04/87/11/1035048711.db2.gz XBBVIKNCTJDYSX-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO CC(C)[N@@H+](CCc1nccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC000159888663 1035105864 /nfs/dbraw/zinc/10/58/64/1035105864.db2.gz FOIRJHHLZJGEPA-UHFFFAOYSA-N 1 1 305.403 3.504 20 5 DHBDMO C[N@H+]1CCc2ccc(Nc3ccc(/C=C/[N+](=O)[O-])cc3)cc2C1 ZINC001175905397 1035157254 /nfs/dbraw/zinc/15/72/54/1035157254.db2.gz NPPQJSQNUJZNSH-DHZHZOJOSA-N 1 1 309.369 3.666 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1CCN[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000482941706 1035203026 /nfs/dbraw/zinc/20/30/26/1035203026.db2.gz AKGVETSGRMDNTD-HOTGVXAUSA-N 1 1 319.449 3.818 20 5 DHBDMO CC[C@H]1CCCCN1CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000482941706 1035203032 /nfs/dbraw/zinc/20/30/32/1035203032.db2.gz AKGVETSGRMDNTD-HOTGVXAUSA-N 1 1 319.449 3.818 20 5 DHBDMO COCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC[C@@H](C)C1 ZINC000483422673 1035268781 /nfs/dbraw/zinc/26/87/81/1035268781.db2.gz YBFHSKZARULJME-NDOICKTLSA-N 1 1 318.417 3.745 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1F)c1cccc([N+](=O)[O-])c1 ZINC001177328414 1035363946 /nfs/dbraw/zinc/36/39/46/1035363946.db2.gz MWPSKUMFCYTNIR-SECBINFHSA-N 1 1 310.275 3.863 20 5 DHBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC[N@H+]1C ZINC000484640044 1035378912 /nfs/dbraw/zinc/37/89/12/1035378912.db2.gz PSFBRWVDQKPAAU-TZMCWYRMSA-N 1 1 321.421 3.667 20 5 DHBDMO CC[C@H](CSC)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000773707367 1035390711 /nfs/dbraw/zinc/39/07/11/1035390711.db2.gz NYNFYGCXMDFTRS-GFCCVEGCSA-N 1 1 302.827 3.822 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)nc1 ZINC001179028096 1035463239 /nfs/dbraw/zinc/46/32/39/1035463239.db2.gz KMKZXMCREXXOJT-UHFFFAOYSA-N 1 1 323.352 3.848 20 5 DHBDMO CCOc1cccc(F)c1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001179391060 1035477474 /nfs/dbraw/zinc/47/74/74/1035477474.db2.gz PRUIYCZGLFFNON-UHFFFAOYSA-N 1 1 318.348 3.731 20 5 DHBDMO CC[C@@H](C)[C@@H](C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)OC ZINC001179945667 1035540829 /nfs/dbraw/zinc/54/08/29/1035540829.db2.gz IXNVZORFTFACAG-IAQYHMDHSA-N 1 1 314.813 3.741 20 5 DHBDMO CC[C@@H](C)[C@@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)OC ZINC001179945667 1035540838 /nfs/dbraw/zinc/54/08/38/1035540838.db2.gz IXNVZORFTFACAG-IAQYHMDHSA-N 1 1 314.813 3.741 20 5 DHBDMO C[C@]1(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCCS1 ZINC001179909457 1035547491 /nfs/dbraw/zinc/54/74/91/1035547491.db2.gz MLAABHPTXBSQPI-MRXNPFEDSA-N 1 1 306.431 3.845 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1CN(C)CC[C@H]1CCCC[N@H+]1C ZINC001180098011 1035597366 /nfs/dbraw/zinc/59/73/66/1035597366.db2.gz JAGFLMJGWKYIBQ-MRXNPFEDSA-N 1 1 319.449 3.518 20 5 DHBDMO C[C@H](C1CCCCC1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001193808517 1035741952 /nfs/dbraw/zinc/74/19/52/1035741952.db2.gz VIHJZKQZRHQZRP-CQSZACIVSA-N 1 1 306.406 3.874 20 5 DHBDMO C[C@@H]1[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCC12CCOCC2 ZINC000494631808 1035748611 /nfs/dbraw/zinc/74/86/11/1035748611.db2.gz CGYYPZQCGLBZSZ-LBPRGKRZSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](OCC3CC3)C2)c(Cl)c1 ZINC000494703528 1035770121 /nfs/dbraw/zinc/77/01/21/1035770121.db2.gz PSAOWPRCGDZCEC-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](OCC3CC3)C2)c(Cl)c1 ZINC000494703528 1035770136 /nfs/dbraw/zinc/77/01/36/1035770136.db2.gz PSAOWPRCGDZCEC-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]1C ZINC000089904020 1035785887 /nfs/dbraw/zinc/78/58/87/1035785887.db2.gz IJNBQLTZYIPSSE-CHWSQXEVSA-N 1 1 315.373 3.870 20 5 DHBDMO Cc1ccc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000539849013 1035902559 /nfs/dbraw/zinc/90/25/59/1035902559.db2.gz HNQOABOSYNHDBL-ZBFHGGJFSA-N 1 1 306.431 3.763 20 5 DHBDMO COc1c(O)ccc(C[N@@H+](C)[C@@H](C)C2CCCCC2)c1[N+](=O)[O-] ZINC001181410193 1035915913 /nfs/dbraw/zinc/91/59/13/1035915913.db2.gz JORHLPCTHIAYEO-LBPRGKRZSA-N 1 1 322.405 3.710 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]2C2CCCC2)ccc1[N+](=O)[O-] ZINC000485787494 1035967742 /nfs/dbraw/zinc/96/77/42/1035967742.db2.gz CZKYTYQCTJODDQ-HNNXBMFYSA-N 1 1 304.390 3.758 20 5 DHBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC2(CCCC2)O1 ZINC000443344501 1036085123 /nfs/dbraw/zinc/08/51/23/1036085123.db2.gz LDMDUVBGZKCGQC-UHFFFAOYSA-N 1 1 318.417 3.561 20 5 DHBDMO CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CC(C)(C)C1 ZINC001195094602 1036134278 /nfs/dbraw/zinc/13/42/78/1036134278.db2.gz SUOWSBNTBNMSOC-UHFFFAOYSA-N 1 1 306.406 3.874 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(C)c(C)c1 ZINC001195146896 1036153111 /nfs/dbraw/zinc/15/31/11/1036153111.db2.gz HLRAEBAFGKCCSZ-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(C)c(C)c1 ZINC001195146896 1036153118 /nfs/dbraw/zinc/15/31/18/1036153118.db2.gz HLRAEBAFGKCCSZ-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO Cc1c(C[N@H+](C)C2CC(OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195267975 1036198770 /nfs/dbraw/zinc/19/87/70/1036198770.db2.gz BOWGOOZRBQDPHX-UHFFFAOYSA-N 1 1 306.406 3.681 20 5 DHBDMO Cc1nc(NCc2cc([N+](=O)[O-])ccc2Cl)c(C)c(C)[nH+]1 ZINC000761907047 1036397009 /nfs/dbraw/zinc/39/70/09/1036397009.db2.gz WPOYGKRXWOGNBW-UHFFFAOYSA-N 1 1 306.753 3.576 20 5 DHBDMO CC(C)n1cc([C@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000541644943 1036399244 /nfs/dbraw/zinc/39/92/44/1036399244.db2.gz LKLZREOOOURAKE-NSHDSACASA-N 1 1 322.796 3.876 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000464782363 1036455280 /nfs/dbraw/zinc/45/52/80/1036455280.db2.gz YLYJJKHJEXRBGA-GOEBONIOSA-N 1 1 324.446 3.580 20 5 DHBDMO COc1ccc(F)c(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC001182999084 1036499279 /nfs/dbraw/zinc/49/92/79/1036499279.db2.gz FVVLHJTZRDNPJE-UHFFFAOYSA-N 1 1 324.739 3.686 20 5 DHBDMO CC[N@@H+](CCNc1ccc([N+](=O)[O-])cc1C)CCC(F)(F)F ZINC000491822756 1036644872 /nfs/dbraw/zinc/64/48/72/1036644872.db2.gz XQXNUMOCWOCCSF-UHFFFAOYSA-N 1 1 319.327 3.589 20 5 DHBDMO CC(C)(C)[C@H]1CSCC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001197295088 1036742053 /nfs/dbraw/zinc/74/20/53/1036742053.db2.gz CYUZQCLEPYKAEY-CQSZACIVSA-N 1 1 312.410 3.697 20 5 DHBDMO CC(C)(C)[C@H]1CSCC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001197295088 1036742077 /nfs/dbraw/zinc/74/20/77/1036742077.db2.gz CYUZQCLEPYKAEY-CQSZACIVSA-N 1 1 312.410 3.697 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(CNc2[nH]c3ccccc3[nH+]2)c1 ZINC000762540892 1036817325 /nfs/dbraw/zinc/81/73/25/1036817325.db2.gz HOOJYASXRIHDJI-UHFFFAOYSA-N 1 1 302.721 3.737 20 5 DHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H]1CCC[C@H]1C ZINC000487967835 1036885338 /nfs/dbraw/zinc/88/53/38/1036885338.db2.gz CAWMKWPJMPMOCK-CJNGLKHVSA-N 1 1 306.406 3.540 20 5 DHBDMO CCOc1cc(C[N@@H+](C)[C@H](CC)CSC)ccc1[N+](=O)[O-] ZINC000492723877 1036988437 /nfs/dbraw/zinc/98/84/37/1036988437.db2.gz RHZOAZPNGFITFD-CYBMUJFWSA-N 1 1 312.435 3.567 20 5 DHBDMO COc1cc(C[NH2+][C@H](C)c2cccc(F)c2F)ccc1[N+](=O)[O-] ZINC000492878002 1037049221 /nfs/dbraw/zinc/04/92/21/1037049221.db2.gz OWLLIZUIVXZBAW-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO C[C@@H](CNc1cccc(C(F)(F)F)c1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC001185230303 1037073197 /nfs/dbraw/zinc/07/31/97/1037073197.db2.gz BRUPEIDDAKNEHV-VIFPVBQESA-N 1 1 317.311 3.508 20 5 DHBDMO CCC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774902336 1037192225 /nfs/dbraw/zinc/19/22/25/1037192225.db2.gz DYSUZZCMCMJIAU-LBPRGKRZSA-N 1 1 307.350 3.515 20 5 DHBDMO C[C@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000489066299 1037258824 /nfs/dbraw/zinc/25/88/24/1037258824.db2.gz CDPOQMHQZWEIIL-CYBMUJFWSA-N 1 1 302.349 3.797 20 5 DHBDMO COc1cccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000761509968 1037336369 /nfs/dbraw/zinc/33/63/69/1037336369.db2.gz FKULWHJAJPVKGH-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC12CCC2 ZINC000775054961 1037523977 /nfs/dbraw/zinc/52/39/77/1037523977.db2.gz DAQDDCLWOFZEKP-LBPRGKRZSA-N 1 1 319.361 3.515 20 5 DHBDMO CC[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1OC ZINC000775068477 1037535666 /nfs/dbraw/zinc/53/56/66/1037535666.db2.gz PHZWMZJMDKFPEU-HNNXBMFYSA-N 1 1 318.348 3.983 20 5 DHBDMO Cc1cnc(Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)c([N+](=O)[O-])c1 ZINC000089649008 1037709120 /nfs/dbraw/zinc/70/91/20/1037709120.db2.gz XSHQCQBFRJHFAL-UHFFFAOYSA-N 1 1 323.356 3.806 20 5 DHBDMO Cc1ccc(F)cc1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000491089023 1037907972 /nfs/dbraw/zinc/90/79/72/1037907972.db2.gz LZBHYGBOROESEM-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1ccc(F)cc1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000491089023 1037907976 /nfs/dbraw/zinc/90/79/76/1037907976.db2.gz LZBHYGBOROESEM-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO C[N@@H+](CCc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000491194047 1037936797 /nfs/dbraw/zinc/93/67/97/1037936797.db2.gz IQBPIISVFNAJKA-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cc(C)cc(C)c2)cc1[N+](=O)[O-] ZINC000609194222 1038070578 /nfs/dbraw/zinc/07/05/78/1038070578.db2.gz GBOVRZQVCJHPOR-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000917007015 1038114876 /nfs/dbraw/zinc/11/48/76/1038114876.db2.gz VXRVHQWERNRISC-QGZVFWFLSA-N 1 1 314.360 3.941 20 5 DHBDMO C[C@H](c1ccncc1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590757328 1038700117 /nfs/dbraw/zinc/70/01/17/1038700117.db2.gz PXFPTEAHWGEMIS-PBHICJAKSA-N 1 1 311.385 3.930 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000598676822 1038831021 /nfs/dbraw/zinc/83/10/21/1038831021.db2.gz LNULSZUGIWRANB-INIZCTEOSA-N 1 1 316.332 3.520 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H](c2ccccn2)C2CCC2)cs1 ZINC000598993783 1038985810 /nfs/dbraw/zinc/98/58/10/1038985810.db2.gz OQVUPRVSZFDTBB-HNNXBMFYSA-N 1 1 303.387 3.682 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccn2)C2CCC2)c(F)c1 ZINC000598992736 1038986254 /nfs/dbraw/zinc/98/62/54/1038986254.db2.gz CFKHPHPGVJWMPX-KRWDZBQOSA-N 1 1 315.348 3.760 20 5 DHBDMO COc1ccc(C(C)(C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1F ZINC000598997053 1038989695 /nfs/dbraw/zinc/98/96/95/1038989695.db2.gz UHNPIVVPQVXIPP-UHFFFAOYSA-N 1 1 324.377 3.829 20 5 DHBDMO C[C@H](c1cccs1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000046054719 1039061346 /nfs/dbraw/zinc/06/13/46/1039061346.db2.gz GGJNBBHWCVAYOC-GFCCVEGCSA-N 1 1 306.387 3.728 20 5 DHBDMO C[C@H](c1ccccc1F)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603855082 1039188244 /nfs/dbraw/zinc/18/82/44/1039188244.db2.gz AYOSFFFIIFWSHB-CYBMUJFWSA-N 1 1 318.348 3.806 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC(F)(F)CC1 ZINC000599551536 1039208724 /nfs/dbraw/zinc/20/87/24/1039208724.db2.gz PAUDMROFPOFPFS-UHFFFAOYSA-N 1 1 314.332 3.615 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC(F)(F)CC1 ZINC000599551536 1039208742 /nfs/dbraw/zinc/20/87/42/1039208742.db2.gz PAUDMROFPOFPFS-UHFFFAOYSA-N 1 1 314.332 3.615 20 5 DHBDMO COc1cc(C[N@H+]2CCCC3(CC3)CC2)c([N+](=O)[O-])cc1F ZINC000599673527 1039252925 /nfs/dbraw/zinc/25/29/25/1039252925.db2.gz SBSDMBMPGNBQMV-UHFFFAOYSA-N 1 1 308.353 3.509 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1C1CCCC1 ZINC000604012864 1039281853 /nfs/dbraw/zinc/28/18/53/1039281853.db2.gz BRCSISJUIHWVNS-HNNXBMFYSA-N 1 1 304.390 3.628 20 5 DHBDMO CCC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(C)C ZINC000604492909 1039485653 /nfs/dbraw/zinc/48/56/53/1039485653.db2.gz UJUDWJAJNFWZRU-UHFFFAOYSA-N 1 1 321.421 3.600 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc(OC3CC3)c2F)cc1 ZINC000594920889 1039927459 /nfs/dbraw/zinc/92/74/59/1039927459.db2.gz BLMLLYPNGXYLFL-UHFFFAOYSA-N 1 1 316.332 3.565 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594026273 1039950909 /nfs/dbraw/zinc/95/09/09/1039950909.db2.gz HYUUKDDALPPGGR-CXAGYDPISA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@@H](N[C@H]1CC[N@H+](C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595079014 1040073304 /nfs/dbraw/zinc/07/33/04/1040073304.db2.gz BZDKFUMWJVUDIR-ZBFHGGJFSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCN(C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595079014 1040073319 /nfs/dbraw/zinc/07/33/19/1040073319.db2.gz BZDKFUMWJVUDIR-ZBFHGGJFSA-N 1 1 317.433 3.652 20 5 DHBDMO Cn1cc[nH+]c1C[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000078559001 1040085696 /nfs/dbraw/zinc/08/56/96/1040085696.db2.gz PULQDKYYPWNMAY-KRWDZBQOSA-N 1 1 322.368 3.724 20 5 DHBDMO CCC[N@H+](Cc1onc(C)c1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000595290238 1040093547 /nfs/dbraw/zinc/09/35/47/1040093547.db2.gz XMQOBPQDMZADEY-UHFFFAOYSA-N 1 1 303.362 3.612 20 5 DHBDMO CCC[N@@H+](Cc1onc(C)c1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000595290238 1040093566 /nfs/dbraw/zinc/09/35/66/1040093566.db2.gz XMQOBPQDMZADEY-UHFFFAOYSA-N 1 1 303.362 3.612 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595326439 1040098154 /nfs/dbraw/zinc/09/81/54/1040098154.db2.gz KDNWGQLGICJBRS-YGRLFVJLSA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595326439 1040098174 /nfs/dbraw/zinc/09/81/74/1040098174.db2.gz KDNWGQLGICJBRS-YGRLFVJLSA-N 1 1 319.336 3.613 20 5 DHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595377399 1040127520 /nfs/dbraw/zinc/12/75/20/1040127520.db2.gz NHUBLGDQQIJJGT-LLVKDONJSA-N 1 1 300.399 3.697 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](C)c2cc3ccccc3s2)c1[N+](=O)[O-] ZINC000595427803 1040135512 /nfs/dbraw/zinc/13/55/12/1040135512.db2.gz DLXZTYULOXPHDE-VIFPVBQESA-N 1 1 317.370 3.957 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@H](c3ccc(C)cc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000595479629 1040149442 /nfs/dbraw/zinc/14/94/42/1040149442.db2.gz GAVFXZPOIFXNLC-SWLSCSKDSA-N 1 1 315.373 3.578 20 5 DHBDMO C[C@H]1C[C@H](Nc2ccc(C(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000596154974 1040331033 /nfs/dbraw/zinc/33/10/33/1040331033.db2.gz GLJORNOEWNIEHU-ONGXEEELSA-N 1 1 311.332 3.570 20 5 DHBDMO CC(C)(C)[N@H+]1CC[C@H]1CNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000596308264 1040378567 /nfs/dbraw/zinc/37/85/67/1040378567.db2.gz JBNWIACRTBAJEF-NSHDSACASA-N 1 1 313.348 3.817 20 5 DHBDMO O=[N+]([O-])c1ccc(NCCC[N@H+]2CCc3ccccc3C2)s1 ZINC000064029449 1040642916 /nfs/dbraw/zinc/64/29/16/1040642916.db2.gz QGVYFHYQCUZYSK-UHFFFAOYSA-N 1 1 317.414 3.517 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H]4C[C@@H]4C3)cs2)c1 ZINC000597223595 1040702319 /nfs/dbraw/zinc/70/23/19/1040702319.db2.gz QOGXIMOKEQPCPS-DGCLKSJQSA-N 1 1 315.398 3.560 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](c2cccnc2)C1 ZINC000602854946 1041263818 /nfs/dbraw/zinc/26/38/18/1041263818.db2.gz NWSRISKBGJBTEQ-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO CSC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000602920518 1041315895 /nfs/dbraw/zinc/31/58/95/1041315895.db2.gz OZVOABWTGANOFO-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO CCOc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000236944781 202086677 /nfs/dbraw/zinc/08/66/77/202086677.db2.gz IKJVVHFFLKIGGG-UHFFFAOYSA-N 1 1 320.776 3.937 20 5 DHBDMO CCOC1CC2(C1)CC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000285445858 535397961 /nfs/dbraw/zinc/39/79/61/535397961.db2.gz ILHGMOQKGVMKFU-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO CCOC1CC2(C1)CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000285445858 535397967 /nfs/dbraw/zinc/39/79/67/535397967.db2.gz ILHGMOQKGVMKFU-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000272409649 130027410 /nfs/dbraw/zinc/02/74/10/130027410.db2.gz FOQPBSMSGHVPKD-UONOGXRCSA-N 1 1 314.389 3.567 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1ncc[nH]1)C1CCCCC1 ZINC000285900209 131209422 /nfs/dbraw/zinc/20/94/22/131209422.db2.gz CRYBATLDRGWYHV-INIZCTEOSA-N 1 1 314.389 3.729 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2ccncc2)C1 ZINC000289288959 131371082 /nfs/dbraw/zinc/37/10/82/131371082.db2.gz HABAVYMTCUJVFY-WMLDXEAASA-N 1 1 311.385 3.930 20 5 DHBDMO Cc1ccc([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-] ZINC000131806120 332037195 /nfs/dbraw/zinc/03/71/95/332037195.db2.gz CGPQOUMAURDTBI-HZTRTUMWSA-N 1 1 317.433 3.569 20 5 DHBDMO Cc1ccc([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000131806120 332037196 /nfs/dbraw/zinc/03/71/96/332037196.db2.gz CGPQOUMAURDTBI-HZTRTUMWSA-N 1 1 317.433 3.569 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)cc1[N+](=O)[O-] ZINC000131806120 332037197 /nfs/dbraw/zinc/03/71/97/332037197.db2.gz CGPQOUMAURDTBI-HZTRTUMWSA-N 1 1 317.433 3.569 20 5 DHBDMO CC[N@@H+]1CCCC[C@H]1CNCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000518450519 332047399 /nfs/dbraw/zinc/04/73/99/332047399.db2.gz IWUNGZILDSNCHG-INIZCTEOSA-N 1 1 319.449 3.682 20 5 DHBDMO CC[N@H+]1CCCC[C@H]1CNCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000518450519 332047400 /nfs/dbraw/zinc/04/74/00/332047400.db2.gz IWUNGZILDSNCHG-INIZCTEOSA-N 1 1 319.449 3.682 20 5 DHBDMO Cc1cccc(CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000563060945 333226647 /nfs/dbraw/zinc/22/66/47/333226647.db2.gz RTENQGUIVALQMF-UHFFFAOYSA-N 1 1 313.401 3.751 20 5 DHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cnn(C2CCCC2)c1 ZINC000337496990 333450391 /nfs/dbraw/zinc/45/03/91/333450391.db2.gz YUSRESFZENOYCR-ZDUSSCGKSA-N 1 1 314.389 3.757 20 5 DHBDMO Cc1csc(C2([NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)CCC2)n1 ZINC000299640792 334256696 /nfs/dbraw/zinc/25/66/96/334256696.db2.gz SMYKZTPLIWUVHN-UHFFFAOYSA-N 1 1 317.414 3.837 20 5 DHBDMO C[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000388773374 334269772 /nfs/dbraw/zinc/26/97/72/334269772.db2.gz GFWUWAVVRHWXPO-ONGXEEELSA-N 1 1 317.311 3.508 20 5 DHBDMO CC[C@H]([NH2+][C@H]1COc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000344096563 335217735 /nfs/dbraw/zinc/21/77/35/335217735.db2.gz HGAJQAZQJMIKKM-HOTGVXAUSA-N 1 1 316.332 3.908 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2cccnc2)C2CC2)c(Cl)c1 ZINC000344325442 335245650 /nfs/dbraw/zinc/24/56/50/335245650.db2.gz MBQDLTHWLZXBFK-MRXNPFEDSA-N 1 1 317.776 3.884 20 5 DHBDMO CCSCC[C@@H](C)[N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351720541 336062247 /nfs/dbraw/zinc/06/22/47/336062247.db2.gz PWDGCEJFCWCKEJ-SNVBAGLBSA-N 1 1 318.389 3.837 20 5 DHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351720541 336062249 /nfs/dbraw/zinc/06/22/49/336062249.db2.gz PWDGCEJFCWCKEJ-SNVBAGLBSA-N 1 1 318.389 3.837 20 5 DHBDMO COCC[C@H]1CCCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000332240633 336164473 /nfs/dbraw/zinc/16/44/73/336164473.db2.gz AAZHNTKPERPDQL-OAHLLOKOSA-N 1 1 306.406 3.542 20 5 DHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C12CCC2 ZINC000352609046 336226760 /nfs/dbraw/zinc/22/67/60/336226760.db2.gz QNDMCYUZANMGQY-JKSUJKDBSA-N 1 1 322.380 3.513 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc(F)cc2[N+](=O)[O-])c1 ZINC000301079202 336288785 /nfs/dbraw/zinc/28/87/85/336288785.db2.gz CFYMESVGZGCEHM-UHFFFAOYSA-N 1 1 317.364 3.798 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2ccc(F)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000301823998 336332548 /nfs/dbraw/zinc/33/25/48/336332548.db2.gz CWJXOKGXMVIJPK-RDJZCZTQSA-N 1 1 315.348 3.591 20 5 DHBDMO C[C@@H](CNc1sccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000301976223 336340879 /nfs/dbraw/zinc/34/08/79/336340879.db2.gz CJYYOPIJJUPPKZ-LBPRGKRZSA-N 1 1 317.414 3.515 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2sccc2[N+](=O)[O-])C1 ZINC000302020521 336343555 /nfs/dbraw/zinc/34/35/55/336343555.db2.gz NQGUAAWUNZOUFO-KGLIPLIRSA-N 1 1 323.462 3.747 20 5 DHBDMO C[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302052745 336345675 /nfs/dbraw/zinc/34/56/75/336345675.db2.gz OYLSVPROBGKCFC-OLZOCXBDSA-N 1 1 321.396 3.799 20 5 DHBDMO Cc1[nH+]c(CNc2c(Cl)cccc2[N+](=O)[O-])c2n1CCCC2 ZINC000367938062 336832642 /nfs/dbraw/zinc/83/26/42/336832642.db2.gz XEQHEEXMIPYCET-UHFFFAOYSA-N 1 1 320.780 3.702 20 5 DHBDMO CC(C)c1[nH+]ccn1[C@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 ZINC000374007457 336978925 /nfs/dbraw/zinc/97/89/25/336978925.db2.gz HDVKAWVEJAJYJS-AWEZNQCLSA-N 1 1 314.389 3.756 20 5 DHBDMO Cc1c[nH+]cn1C1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000376741455 337040332 /nfs/dbraw/zinc/04/03/32/337040332.db2.gz HRPSXBGGQKBWAT-UHFFFAOYSA-N 1 1 320.780 3.595 20 5 DHBDMO Cc1cc(SCC[N@H+](C)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000193745479 337079313 /nfs/dbraw/zinc/07/93/13/337079313.db2.gz BWNOIGHFIKSTLD-UHFFFAOYSA-N 1 1 317.414 3.522 20 5 DHBDMO C[C@H]([NH2+][C@@H]1c2cccc(F)c2O[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000360061316 337084683 /nfs/dbraw/zinc/08/46/83/337084683.db2.gz SROLILPDGHIMQW-USBNGQNGSA-N 1 1 316.332 3.907 20 5 DHBDMO CO[C@H](C)C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000582573953 337107637 /nfs/dbraw/zinc/10/76/37/337107637.db2.gz XDTZATUMWBOXNZ-GFCCVEGCSA-N 1 1 320.414 3.790 20 5 DHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182339480 337187971 /nfs/dbraw/zinc/18/79/71/337187971.db2.gz NIXZRXPFDOWUHJ-SNVBAGLBSA-N 1 1 302.827 3.822 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000583173590 337253559 /nfs/dbraw/zinc/25/35/59/337253559.db2.gz GJZLDRGAMNEGHY-LSDHHAIUSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000583173590 337253560 /nfs/dbraw/zinc/25/35/60/337253560.db2.gz GJZLDRGAMNEGHY-LSDHHAIUSA-N 1 1 307.438 3.674 20 5 DHBDMO C[C@H]1CCSCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000191816893 337300396 /nfs/dbraw/zinc/30/03/96/337300396.db2.gz NKWYBIUJBJLNLQ-JTQLQIEISA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@H]1CCSCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000191816893 337300397 /nfs/dbraw/zinc/30/03/97/337300397.db2.gz NKWYBIUJBJLNLQ-JTQLQIEISA-N 1 1 300.811 3.576 20 5 DHBDMO Cc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc(C)n1 ZINC000421376184 337528710 /nfs/dbraw/zinc/52/87/10/337528710.db2.gz IYGWDBZYWSSSFP-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426456833 338032694 /nfs/dbraw/zinc/03/26/94/338032694.db2.gz FISJWOTWGLFNIG-CJNGLKHVSA-N 1 1 304.390 3.756 20 5 DHBDMO CSC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000429287645 338076567 /nfs/dbraw/zinc/07/65/67/338076567.db2.gz NKSWSHYXCIRMEE-NSHDSACASA-N 1 1 314.838 3.823 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430232220 338102293 /nfs/dbraw/zinc/10/22/93/338102293.db2.gz FWGQEWVMCGWENA-HIFRSBDPSA-N 1 1 324.446 3.709 20 5 DHBDMO Cc1c(C[N@H+](C)Cc2cccc(N(C)C)c2)cccc1[N+](=O)[O-] ZINC000432441055 338156510 /nfs/dbraw/zinc/15/65/10/338156510.db2.gz JILIEYCWSHWOFA-UHFFFAOYSA-N 1 1 313.401 3.601 20 5 DHBDMO CC[C@H](C)[N@@H+](C)CCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433173673 338184057 /nfs/dbraw/zinc/18/40/57/338184057.db2.gz HHFGUQJOBHWFIP-SUMWQHHRSA-N 1 1 319.449 3.637 20 5 DHBDMO CC[C@H](C)N(C)CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433173673 338184058 /nfs/dbraw/zinc/18/40/58/338184058.db2.gz HHFGUQJOBHWFIP-SUMWQHHRSA-N 1 1 319.449 3.637 20 5 DHBDMO C[C@@H](c1ccco1)[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000440906396 338399790 /nfs/dbraw/zinc/39/97/90/338399790.db2.gz HFLGDDBKICAUPJ-ZDUSSCGKSA-N 1 1 316.357 3.792 20 5 DHBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000463075104 339104385 /nfs/dbraw/zinc/10/43/85/339104385.db2.gz WWJBFRRUNCTWAB-CYBMUJFWSA-N 1 1 311.813 3.559 20 5 DHBDMO COc1cc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000464678515 339148409 /nfs/dbraw/zinc/14/84/09/339148409.db2.gz PMWBRAYMBBPFNP-TYNCELHUSA-N 1 1 322.380 3.896 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@H](CC(C)C)C2)c([N+](=O)[O-])cc1F ZINC000464678729 339148472 /nfs/dbraw/zinc/14/84/72/339148472.db2.gz GQZNBJDTYJCKIT-GFCCVEGCSA-N 1 1 310.369 3.611 20 5 DHBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467834820 339247340 /nfs/dbraw/zinc/24/73/40/339247340.db2.gz MSHSWVVQQGYMDC-QKPAOTATSA-N 1 1 319.449 3.612 20 5 DHBDMO C[C@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467834820 339247341 /nfs/dbraw/zinc/24/73/41/339247341.db2.gz MSHSWVVQQGYMDC-QKPAOTATSA-N 1 1 319.449 3.612 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1CCN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467867206 339248140 /nfs/dbraw/zinc/24/81/40/339248140.db2.gz KXEMBDQYWHGLSG-HOCLYGCPSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@H]1CCCCN1CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467867206 339248141 /nfs/dbraw/zinc/24/81/41/339248141.db2.gz KXEMBDQYWHGLSG-HOCLYGCPSA-N 1 1 305.422 3.510 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000469994356 339307252 /nfs/dbraw/zinc/30/72/52/339307252.db2.gz XCAZTFMHPWIXGD-LBPRGKRZSA-N 1 1 320.286 3.897 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000469994356 339307253 /nfs/dbraw/zinc/30/72/53/339307253.db2.gz XCAZTFMHPWIXGD-LBPRGKRZSA-N 1 1 320.286 3.897 20 5 DHBDMO CC[C@H]1C[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CCS1 ZINC000470183903 339313224 /nfs/dbraw/zinc/31/32/24/339313224.db2.gz SVOCJPFCNZDDLI-OVHOFWQVSA-N 1 1 306.431 3.826 20 5 DHBDMO Cc1c(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)cccc1[N+](=O)[O-] ZINC000470956269 339332793 /nfs/dbraw/zinc/33/27/93/339332793.db2.gz BJKKQINTAZCMGG-PWSUYJOCSA-N 1 1 302.296 3.676 20 5 DHBDMO CCOCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000500746503 340066303 /nfs/dbraw/zinc/06/63/03/340066303.db2.gz ISKZAZPXTUHEJU-UHFFFAOYSA-N 1 1 320.414 3.792 20 5 DHBDMO CCC[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501026543 340072529 /nfs/dbraw/zinc/07/25/29/340072529.db2.gz BWHYDNPCLMEVNI-CQSZACIVSA-N 1 1 319.405 3.578 20 5 DHBDMO Cc1cccc(C)c1OCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000501876153 340090159 /nfs/dbraw/zinc/09/01/59/340090159.db2.gz UCASNLVEBYAYNP-UHFFFAOYSA-N 1 1 314.385 3.722 20 5 DHBDMO COc1ccc(CCC[N@@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000502666877 340109925 /nfs/dbraw/zinc/10/99/25/340109925.db2.gz OKJDZPNRBXJMCC-UHFFFAOYSA-N 1 1 320.414 3.730 20 5 DHBDMO Cc1cc(F)cc2c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC000502874841 340115357 /nfs/dbraw/zinc/11/53/57/340115357.db2.gz ABFDLSONXFCZDC-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cc(F)cc2c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC000502874841 340115358 /nfs/dbraw/zinc/11/53/58/340115358.db2.gz ABFDLSONXFCZDC-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO CC(C)[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000507151185 340209552 /nfs/dbraw/zinc/20/95/52/340209552.db2.gz BGYXJWWTWOIVDK-CYBMUJFWSA-N 1 1 314.332 3.817 20 5 DHBDMO COCC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000508530137 340245823 /nfs/dbraw/zinc/24/58/23/340245823.db2.gz FSRBSZBLYFRVMJ-HNNXBMFYSA-N 1 1 314.385 3.804 20 5 DHBDMO COCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000508530137 340245824 /nfs/dbraw/zinc/24/58/24/340245824.db2.gz FSRBSZBLYFRVMJ-HNNXBMFYSA-N 1 1 314.385 3.804 20 5 DHBDMO CC[N@@H+](CCc1cccs1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000508707497 340251199 /nfs/dbraw/zinc/25/11/99/340251199.db2.gz TZEYNMXYRRDCMO-UHFFFAOYSA-N 1 1 320.414 3.730 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2cc(F)ccc2C1 ZINC000509433721 340269415 /nfs/dbraw/zinc/26/94/15/340269415.db2.gz BSPSVCGCMXVDST-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2cc(F)ccc2C1 ZINC000509433721 340269416 /nfs/dbraw/zinc/26/94/16/340269416.db2.gz BSPSVCGCMXVDST-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[N@H+](CCOc1ccccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000302802132 340282407 /nfs/dbraw/zinc/28/24/07/340282407.db2.gz BSPLOQHENLKFRE-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1ccccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000302802132 340282408 /nfs/dbraw/zinc/28/24/08/340282408.db2.gz BSPLOQHENLKFRE-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO COC[C@@H](C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000510434724 340299230 /nfs/dbraw/zinc/29/92/30/340299230.db2.gz GBCQNVBJIXBXJF-GFCCVEGCSA-N 1 1 320.414 3.790 20 5 DHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)CC(C)(C)C ZINC000510657044 340305392 /nfs/dbraw/zinc/30/53/92/340305392.db2.gz ITIUWJVFBUSRSS-UHFFFAOYSA-N 1 1 302.321 3.674 20 5 DHBDMO C[N@@H+](CCc1ccccc1Cl)CCc1ccccc1[N+](=O)[O-] ZINC000511107520 340320965 /nfs/dbraw/zinc/32/09/65/340320965.db2.gz NWIHUTPFRAQMAC-UHFFFAOYSA-N 1 1 318.804 3.965 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1CNc1[nH+]c2cc(F)ccc2n1C ZINC000184254880 340491464 /nfs/dbraw/zinc/49/14/64/340491464.db2.gz MNXYNLKMHVEASB-UHFFFAOYSA-N 1 1 314.320 3.541 20 5 DHBDMO COc1cccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)c1 ZINC000542699299 341017784 /nfs/dbraw/zinc/01/77/84/341017784.db2.gz GLASOUDRFNNLNW-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000544440537 341082237 /nfs/dbraw/zinc/08/22/37/341082237.db2.gz SNSRTRIXSNYNIN-RRQGHBQHSA-N 1 1 320.433 3.693 20 5 DHBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1 ZINC000547853026 341237793 /nfs/dbraw/zinc/23/77/93/341237793.db2.gz UYBCNMUDUWFVAX-UHFFFAOYSA-N 1 1 324.384 3.883 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000547979688 341241905 /nfs/dbraw/zinc/24/19/05/341241905.db2.gz WNGOPCIWKDELPW-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000550063120 341309270 /nfs/dbraw/zinc/30/92/70/341309270.db2.gz GGPUTEGRWGOJLK-QAPCUYQASA-N 1 1 320.433 3.695 20 5 DHBDMO C[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1C ZINC000245845838 341315948 /nfs/dbraw/zinc/31/59/48/341315948.db2.gz IJNBQLTZYIPSSE-OLZOCXBDSA-N 1 1 315.373 3.870 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@H]2COc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000552926027 341408937 /nfs/dbraw/zinc/40/89/37/341408937.db2.gz SNXQHVBCYJZCJT-NHYWBVRUSA-N 1 1 316.332 3.827 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cccc(C)n2)cc1[N+](=O)[O-] ZINC000153085312 341524257 /nfs/dbraw/zinc/52/42/57/341524257.db2.gz SZBMBQRKQGFJPX-CYBMUJFWSA-N 1 1 315.373 3.548 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000577529310 341916087 /nfs/dbraw/zinc/91/60/87/341916087.db2.gz QIUZCAFHSFUUFC-HNNXBMFYSA-N 1 1 316.332 3.520 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCCc2cccnc21 ZINC000364998084 521353771 /nfs/dbraw/zinc/35/37/71/521353771.db2.gz FDYUDOYBFHVTHS-QGZVFWFLSA-N 1 1 311.385 3.889 20 5 DHBDMO CC[C@@H]([NH2+][C@H](COC)c1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000156480174 522945070 /nfs/dbraw/zinc/94/50/70/522945070.db2.gz JQJYVTYONVMFLK-HZPDHXFCSA-N 1 1 318.373 3.925 20 5 DHBDMO Cc1nc(C)c(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000130914019 526715423 /nfs/dbraw/zinc/71/54/23/526715423.db2.gz PYHCZYKTWQSQNY-UHFFFAOYSA-N 1 1 317.414 3.833 20 5 DHBDMO Cc1nc(C)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000130914019 526715426 /nfs/dbraw/zinc/71/54/26/526715426.db2.gz PYHCZYKTWQSQNY-UHFFFAOYSA-N 1 1 317.414 3.833 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCC3(CCOCC3)C2)c1 ZINC000265985599 527354991 /nfs/dbraw/zinc/35/49/91/527354991.db2.gz CVRXCWDWRCDRDC-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO CC[C@@H](Nc1cc(CCOC)cc[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000287340767 535809614 /nfs/dbraw/zinc/80/96/14/535809614.db2.gz GJHAQFSEBDBXKD-MRXNPFEDSA-N 1 1 315.373 3.742 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000449735340 1017335032 /nfs/dbraw/zinc/33/50/32/1017335032.db2.gz TWACHGYBKASDFB-INIZCTEOSA-N 1 1 306.431 3.622 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000120900453 1013706978 /nfs/dbraw/zinc/70/69/78/1013706978.db2.gz BKJJNQJPSDYZGU-CYBMUJFWSA-N 1 1 314.389 3.757 20 5 DHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)C(C)C ZINC000118833249 1013707817 /nfs/dbraw/zinc/70/78/17/1013707817.db2.gz MXQAPOMDPXKKRM-AWEZNQCLSA-N 1 1 321.421 3.598 20 5 DHBDMO Cc1cccnc1[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000118839920 1013764935 /nfs/dbraw/zinc/76/49/35/1013764935.db2.gz GPTMWZUDEJBZOZ-INIZCTEOSA-N 1 1 317.364 3.924 20 5 DHBDMO Cc1c(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cccc1[N+](=O)[O-] ZINC000441434349 1013834241 /nfs/dbraw/zinc/83/42/41/1013834241.db2.gz JJFWNTXNORIKMJ-KRWDZBQOSA-N 1 1 318.417 3.827 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ncccc1F)CCCC2 ZINC000520547077 1014333781 /nfs/dbraw/zinc/33/37/81/1014333781.db2.gz PJYDGGZCCVDVIQ-INIZCTEOSA-N 1 1 315.348 3.686 20 5 DHBDMO CC[C@H](C)[C@H](C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000520592049 1014361442 /nfs/dbraw/zinc/36/14/42/1014361442.db2.gz QQVRYINRDAJNFL-KBPBESRZSA-N 1 1 306.406 3.873 20 5 DHBDMO Cc1ccnc([C@@H]2CC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000581556929 1014995300 /nfs/dbraw/zinc/99/53/00/1014995300.db2.gz VXPUUJRAXBPUJW-GOEBONIOSA-N 1 1 311.385 3.849 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccns1 ZINC000895454185 1015165104 /nfs/dbraw/zinc/16/51/04/1015165104.db2.gz WEEWPEZOOOIVHQ-WQLSENKSSA-N 1 1 303.387 3.587 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccns1 ZINC000895454185 1015165110 /nfs/dbraw/zinc/16/51/10/1015165110.db2.gz WEEWPEZOOOIVHQ-WQLSENKSSA-N 1 1 303.387 3.587 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]C3(c4ccccc4)CCC3)nc2c1 ZINC000610580781 1015628856 /nfs/dbraw/zinc/62/88/56/1015628856.db2.gz HNURPVZXIPIZLS-UHFFFAOYSA-N 1 1 323.352 3.905 20 5 DHBDMO C[C@@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000178532461 1016326704 /nfs/dbraw/zinc/32/67/04/1016326704.db2.gz OHRGGJJWTJOJLB-CZUORRHYSA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000178532461 1016326712 /nfs/dbraw/zinc/32/67/12/1016326712.db2.gz OHRGGJJWTJOJLB-CZUORRHYSA-N 1 1 307.438 3.612 20 5 DHBDMO Cc1ccc(CNc2ccsc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000611584041 1016545503 /nfs/dbraw/zinc/54/55/03/1016545503.db2.gz SRMJXCFLADXCOF-UHFFFAOYSA-N 1 1 318.402 3.572 20 5 DHBDMO C[C@H]([NH2+]Cc1ccccc1OC1CC1)c1ccccc1[N+](=O)[O-] ZINC000295090906 1032272359 /nfs/dbraw/zinc/27/23/59/1032272359.db2.gz ZFBCTPJPPUUZGN-ZDUSSCGKSA-N 1 1 312.369 3.987 20 5 DHBDMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089512412 1032345730 /nfs/dbraw/zinc/34/57/30/1032345730.db2.gz ZIJSHFZJBJAUEP-GFCCVEGCSA-N 1 1 316.405 3.706 20 5 DHBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000537629294 1032362848 /nfs/dbraw/zinc/36/28/48/1032362848.db2.gz QUOORJVXOJHVQK-LBPRGKRZSA-N 1 1 316.357 3.848 20 5 DHBDMO CC[C@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000233979308 1012317204 /nfs/dbraw/zinc/31/72/04/1012317204.db2.gz XQOYNOSYKJILDD-VIFPVBQESA-N 1 1 301.184 3.588 20 5 DHBDMO CC[C@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000233979308 1012317215 /nfs/dbraw/zinc/31/72/15/1012317215.db2.gz XQOYNOSYKJILDD-VIFPVBQESA-N 1 1 301.184 3.588 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccc(O)cc1 ZINC000514784947 1012439232 /nfs/dbraw/zinc/43/92/32/1012439232.db2.gz BENMHRUEBQMIJZ-UVTDQMKNSA-N 1 1 312.369 3.836 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000515379581 1012615593 /nfs/dbraw/zinc/61/55/93/1012615593.db2.gz HJQOIASGPZGEKD-DZGCQCFKSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000515550905 1012659780 /nfs/dbraw/zinc/65/97/80/1012659780.db2.gz WMZMCVFHXFDCTP-GASCZTMLSA-N 1 1 305.422 3.765 20 5 DHBDMO C[C@H](c1ccccc1F)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000515675385 1012694073 /nfs/dbraw/zinc/69/40/73/1012694073.db2.gz ZKRLGRQJUKRVHK-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO CCC[C@H]([NH2+][C@@H](C)CN(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000336852406 1012949611 /nfs/dbraw/zinc/94/96/11/1012949611.db2.gz QCNPHZLUTVJKBN-YOEHRIQHSA-N 1 1 307.438 3.756 20 5 DHBDMO CCC[C@@H]([NH2+][C@H](C)CN(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000336852404 1012951365 /nfs/dbraw/zinc/95/13/65/1012951365.db2.gz QCNPHZLUTVJKBN-RHSMWYFYSA-N 1 1 307.438 3.756 20 5 DHBDMO COc1cccc(NCCCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000475357721 1017168768 /nfs/dbraw/zinc/16/87/68/1017168768.db2.gz XFBVZIIOEFATLD-CQSZACIVSA-N 1 1 321.421 3.670 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cnccc1C ZINC000475555170 1017425350 /nfs/dbraw/zinc/42/53/50/1017425350.db2.gz LIOCZIPFUDZMBW-NTEUORMPSA-N 1 1 311.385 3.834 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2cccs2)CC1 ZINC000121481056 1017577295 /nfs/dbraw/zinc/57/72/95/1017577295.db2.gz QXXQUFAAMKZSBJ-ZDUSSCGKSA-N 1 1 317.414 3.540 20 5 DHBDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000444609443 1017587680 /nfs/dbraw/zinc/58/76/80/1017587680.db2.gz NCQPGHHXESBWSV-NWDGAFQWSA-N 1 1 316.405 3.870 20 5 DHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCC[C@@H]1C ZINC000444673656 1017623746 /nfs/dbraw/zinc/62/37/46/1017623746.db2.gz IITMKKQMGSHJPO-LRDDRELGSA-N 1 1 316.405 3.872 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCc2ccc(Cl)nc21)c1ccccc1[N+](=O)[O-] ZINC000857905949 1032713133 /nfs/dbraw/zinc/71/31/33/1032713133.db2.gz AGRHPFIZNPRGHS-GWCFXTLKSA-N 1 1 317.776 3.981 20 5 DHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001167622870 1017673445 /nfs/dbraw/zinc/67/34/45/1017673445.db2.gz ZVVKVNRYUCNTAF-CQSZACIVSA-N 1 1 312.369 3.593 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC12CCC2 ZINC000444775949 1017675020 /nfs/dbraw/zinc/67/50/20/1017675020.db2.gz BIQQDVPJCGWTLI-UHFFFAOYSA-N 1 1 304.390 3.901 20 5 DHBDMO CCC[C@@H](NC1CC[NH+](CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000268747282 1017709747 /nfs/dbraw/zinc/70/97/47/1017709747.db2.gz VOONZCWTJXYNGN-QGZVFWFLSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1nn(C[N@H+](C)C2CCC(C)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000764889949 1018412263 /nfs/dbraw/zinc/41/22/63/1018412263.db2.gz QTERMXKTGLNDPB-UHFFFAOYSA-N 1 1 316.405 3.721 20 5 DHBDMO Cc1nn(C[N@@H+](C2CC2)C2CCCC2)c2ccc([N+](=O)[O-])cc12 ZINC000764891062 1018414815 /nfs/dbraw/zinc/41/48/15/1018414815.db2.gz QBOJRKSFFIFISN-UHFFFAOYSA-N 1 1 314.389 3.617 20 5 DHBDMO Cc1nn(C[N@@H+]2CC[C@H](C)C3(CCCCC3)C2)c(C)c1[N+](=O)[O-] ZINC000764956292 1018436594 /nfs/dbraw/zinc/43/65/94/1018436594.db2.gz SCRSHJZSYUQVGZ-ZDUSSCGKSA-N 1 1 320.437 3.658 20 5 DHBDMO CC(C)[N@H+]1CC[C@@H](Oc2cc(Cl)c([N+](=O)[O-])cc2Cl)C1 ZINC001228150869 1018452977 /nfs/dbraw/zinc/45/29/77/1018452977.db2.gz BYMLCDUXFUCJQN-SECBINFHSA-N 1 1 319.188 3.763 20 5 DHBDMO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000042977588 1018508951 /nfs/dbraw/zinc/50/89/51/1018508951.db2.gz ASRLUAASKKMYOU-UHFFFAOYSA-N 1 1 322.311 3.828 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccc(F)cc21 ZINC000584125733 1018964595 /nfs/dbraw/zinc/96/45/95/1018964595.db2.gz YVFXODSLLMLNLD-SFHVURJKSA-N 1 1 314.360 3.896 20 5 DHBDMO Cc1ccc(C[N@@H+]2CCOc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000611262724 1019425394 /nfs/dbraw/zinc/42/53/94/1019425394.db2.gz HMZCHMLKUWSXJZ-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1ccc(C[N@H+]2CCOc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000611262724 1019425404 /nfs/dbraw/zinc/42/54/04/1019425404.db2.gz HMZCHMLKUWSXJZ-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000611350529 1019451118 /nfs/dbraw/zinc/45/11/18/1019451118.db2.gz PUROKMXYMLLHJT-PMPSAXMXSA-N 1 1 318.417 3.794 20 5 DHBDMO COc1ccc(-c2ccc(C[N@@H+]3CC=CCC3)o2)c([N+](=O)[O-])c1 ZINC000611521255 1019507896 /nfs/dbraw/zinc/50/78/96/1019507896.db2.gz YATKDKWCGXRXLA-UHFFFAOYSA-N 1 1 314.341 3.625 20 5 DHBDMO CCOc1cc(NC[C@H]2CCC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000092626548 1019523792 /nfs/dbraw/zinc/52/37/92/1019523792.db2.gz WFUZCEAYZJDULS-CQSZACIVSA-N 1 1 321.421 3.526 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCCC[C@H]1C1CCC1 ZINC001171752665 1032857833 /nfs/dbraw/zinc/85/78/33/1032857833.db2.gz VZAXOYPTLWYJSM-HNNXBMFYSA-N 1 1 304.390 3.628 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC[N@H+]1C ZINC000317376931 1019977449 /nfs/dbraw/zinc/97/74/49/1019977449.db2.gz HWZMPXVHGVFPLY-ZJUUUORDSA-N 1 1 317.311 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000730432216 1019987617 /nfs/dbraw/zinc/98/76/17/1019987617.db2.gz AEORMBHOQYQHEQ-LBPRGKRZSA-N 1 1 318.323 3.863 20 5 DHBDMO CCC[C@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000264175442 1032867168 /nfs/dbraw/zinc/86/71/68/1032867168.db2.gz ISOBVKMLQWXVEI-ZDUSSCGKSA-N 1 1 317.389 3.913 20 5 DHBDMO CC(C)[C@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000264185212 1032871683 /nfs/dbraw/zinc/87/16/83/1032871683.db2.gz LAKAAVYXIVIEPF-ZDUSSCGKSA-N 1 1 317.389 3.769 20 5 DHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000555099020 1020084579 /nfs/dbraw/zinc/08/45/79/1020084579.db2.gz JIDTYSHGHRFFDL-GQSKFBFOSA-N 1 1 318.417 3.888 20 5 DHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(C)(C)C ZINC000264196295 1032874157 /nfs/dbraw/zinc/87/41/57/1032874157.db2.gz OFLHMZUAJJCXRN-UHFFFAOYSA-N 1 1 317.389 3.770 20 5 DHBDMO Cc1ccc(C[N@H+](CCc2nccs2)C(C)C)cc1[N+](=O)[O-] ZINC000093764170 1020171913 /nfs/dbraw/zinc/17/19/13/1020171913.db2.gz DWYMUAYWPNQSPG-UHFFFAOYSA-N 1 1 319.430 3.813 20 5 DHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000155214368 1020200618 /nfs/dbraw/zinc/20/06/18/1020200618.db2.gz KDOVMHKWTCLOQE-MRXNPFEDSA-N 1 1 312.369 3.593 20 5 DHBDMO COc1ccc([C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1C ZINC000922672464 1020207700 /nfs/dbraw/zinc/20/77/00/1020207700.db2.gz UBVYEGNMMIXRGL-NSHDSACASA-N 1 1 306.387 3.824 20 5 DHBDMO CC(C)c1ccc(C[N@@H+]2CC[C@H](OC(F)F)C2)cc1[N+](=O)[O-] ZINC000555368050 1020232061 /nfs/dbraw/zinc/23/20/61/1020232061.db2.gz PUQORCLIOZWLNM-LBPRGKRZSA-N 1 1 314.332 3.532 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](OC(F)F)C2)cc1[N+](=O)[O-] ZINC000555368050 1020232069 /nfs/dbraw/zinc/23/20/69/1020232069.db2.gz PUQORCLIOZWLNM-LBPRGKRZSA-N 1 1 314.332 3.532 20 5 DHBDMO Cn1cccc1[C@@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000179704931 1020433860 /nfs/dbraw/zinc/43/38/60/1020433860.db2.gz NVVMAWOJTJQMLM-PYJQOMOHSA-N 1 1 311.385 3.784 20 5 DHBDMO Cc1c([C@H](C)NC[C@H](C)[N@@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000480619921 1020466391 /nfs/dbraw/zinc/46/63/91/1020466391.db2.gz BLHQOLWCUVTHIU-YCPHGPKFSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c([C@H](C)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000480619921 1020466396 /nfs/dbraw/zinc/46/63/96/1020466396.db2.gz BLHQOLWCUVTHIU-YCPHGPKFSA-N 1 1 319.449 3.674 20 5 DHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000179863528 1020530068 /nfs/dbraw/zinc/53/00/68/1020530068.db2.gz RSJSXNXUBUHEDP-LBPRGKRZSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000179863528 1020530073 /nfs/dbraw/zinc/53/00/73/1020530073.db2.gz RSJSXNXUBUHEDP-LBPRGKRZSA-N 1 1 318.398 3.544 20 5 DHBDMO Cc1ccc([C@@H](C)N[C@@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153722278 1020555686 /nfs/dbraw/zinc/55/56/86/1020555686.db2.gz RIKVHLGLHPLCEV-GDBMZVCRSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153722278 1020555693 /nfs/dbraw/zinc/55/56/93/1020555693.db2.gz RIKVHLGLHPLCEV-GDBMZVCRSA-N 1 1 317.433 3.571 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(C2CC2)n1 ZINC000282474435 1020574537 /nfs/dbraw/zinc/57/45/37/1020574537.db2.gz ODYVNBVDJJMJFJ-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(C2CC2)n1 ZINC000282474435 1020574544 /nfs/dbraw/zinc/57/45/44/1020574544.db2.gz ODYVNBVDJJMJFJ-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2cccc(F)c2C1 ZINC000612577373 1020629017 /nfs/dbraw/zinc/62/90/17/1020629017.db2.gz BJKSKIBESQBSCE-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2cccc(F)c2C1 ZINC000612577373 1020629023 /nfs/dbraw/zinc/62/90/23/1020629023.db2.gz BJKSKIBESQBSCE-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO CCCCC[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)C(C)C ZINC000734828981 1020666797 /nfs/dbraw/zinc/66/67/97/1020666797.db2.gz BJBMCAXWUVHJSW-UHFFFAOYSA-N 1 1 304.394 3.803 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000613180026 1020847137 /nfs/dbraw/zinc/84/71/37/1020847137.db2.gz FERIRVVAYBWUTC-HOCLYGCPSA-N 1 1 311.385 3.615 20 5 DHBDMO C[C@@H]1C[C@@H](C)[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000740860733 1020954877 /nfs/dbraw/zinc/95/48/77/1020954877.db2.gz RJSVNIHYZCMGAE-NXEZZACHSA-N 1 1 307.375 3.560 20 5 DHBDMO CCC[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776272185 1021214790 /nfs/dbraw/zinc/21/47/90/1021214790.db2.gz RFHNWKACIBSSGE-GOSISDBHSA-N 1 1 314.385 3.540 20 5 DHBDMO CCCC[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)[C@H](C)CC ZINC000917438488 1021259856 /nfs/dbraw/zinc/25/98/56/1021259856.db2.gz WDDRQUJWJARJSR-CYBMUJFWSA-N 1 1 304.394 3.803 20 5 DHBDMO CCC[C@]1(C)CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000743404569 1021287776 /nfs/dbraw/zinc/28/77/76/1021287776.db2.gz AGWDFIFGOMVMSS-QGZVFWFLSA-N 1 1 316.405 3.804 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1C[C@H](O)c2ccccc21 ZINC000850372249 1021494328 /nfs/dbraw/zinc/49/43/28/1021494328.db2.gz RUFHMZXANMFYBZ-ZBFHGGJFSA-N 1 1 318.760 3.516 20 5 DHBDMO CC[C@H]([NH2+]Cc1cc(C(C)C)no1)c1cccc([N+](=O)[O-])c1 ZINC000169264063 1021512233 /nfs/dbraw/zinc/51/22/33/1021512233.db2.gz WKVSLZVCZUIGAH-HNNXBMFYSA-N 1 1 303.362 3.947 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000556609948 1021793966 /nfs/dbraw/zinc/79/39/66/1021793966.db2.gz WGQUYCFRBSGNBI-ZBEVKASSSA-N 1 1 316.401 3.642 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2cccc(F)c2[N+](=O)[O-])C1 ZINC000919963794 1021986815 /nfs/dbraw/zinc/98/68/15/1021986815.db2.gz FVHFFUVSUWFOBS-OKILXGFUSA-N 1 1 323.412 3.904 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000337493408 1033028456 /nfs/dbraw/zinc/02/84/56/1033028456.db2.gz GSALAIFLUQASPJ-CYBMUJFWSA-N 1 1 300.333 3.723 20 5 DHBDMO CC[C@H](C)[C@H](C)[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776583135 1022094626 /nfs/dbraw/zinc/09/46/26/1022094626.db2.gz XQHNEDYDKVHNOY-DCGLDWPTSA-N 1 1 306.406 3.527 20 5 DHBDMO CC(C)(C)[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776584003 1022094888 /nfs/dbraw/zinc/09/48/88/1022094888.db2.gz ISTZGCKVMKWIDK-RDJZCZTQSA-N 1 1 320.433 3.776 20 5 DHBDMO CC(C)[C@@H]1CC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538303407 1033028906 /nfs/dbraw/zinc/02/89/06/1033028906.db2.gz JSRJPPVNTDVYGN-HNNXBMFYSA-N 1 1 317.414 3.949 20 5 DHBDMO CC(C)[C@@H]1CC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538303407 1033028917 /nfs/dbraw/zinc/02/89/17/1033028917.db2.gz JSRJPPVNTDVYGN-HNNXBMFYSA-N 1 1 317.414 3.949 20 5 DHBDMO CCC[C@@]1(C)CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776587440 1022105294 /nfs/dbraw/zinc/10/52/94/1022105294.db2.gz GNUAXSNRGSXLMB-IRXDYDNUSA-N 1 1 306.406 3.530 20 5 DHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586610 1022109991 /nfs/dbraw/zinc/10/99/91/1022109991.db2.gz OMHZFPPPJFRZLW-JQFCIGGWSA-N 1 1 306.406 3.529 20 5 DHBDMO CCOc1ccc([C@@H]2CCC[N@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169032930 1022220195 /nfs/dbraw/zinc/22/01/95/1022220195.db2.gz AAAJEVDIHUXJMO-ZVZYQTTQSA-N 1 1 318.417 3.668 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H](c3ccccc3Cl)C2)C1 ZINC001169034557 1022221911 /nfs/dbraw/zinc/22/19/11/1022221911.db2.gz HUURMWDZEYYJFA-HZSPNIEDSA-N 1 1 308.809 3.575 20 5 DHBDMO COc1cccc([C@@H]2CCCC[N@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)c1 ZINC001169036521 1022222939 /nfs/dbraw/zinc/22/29/39/1022222939.db2.gz PCJZZPGYDFJHLL-HFTRVMKXSA-N 1 1 318.417 3.668 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC[C@H]1CCCCO1)C1CC1 ZINC000347480635 1022272022 /nfs/dbraw/zinc/27/20/22/1022272022.db2.gz FPPIQYGTJNXENZ-MRXNPFEDSA-N 1 1 304.390 3.518 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000609800545 1022354549 /nfs/dbraw/zinc/35/45/49/1022354549.db2.gz MTIHKGXUQDOXCR-QGZVFWFLSA-N 1 1 314.410 3.885 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278826267 1022387255 /nfs/dbraw/zinc/38/72/55/1022387255.db2.gz QBENAVOSWZJHQO-QWRGUYRKSA-N 1 1 302.296 3.930 20 5 DHBDMO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000610133478 1022425118 /nfs/dbraw/zinc/42/51/18/1022425118.db2.gz RVOBAAVCRNJNHL-UAGQMJEPSA-N 1 1 318.417 3.620 20 5 DHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cn2)cc1 ZINC000080914802 1022534069 /nfs/dbraw/zinc/53/40/69/1022534069.db2.gz MYRODCKCMYPQCO-GFCCVEGCSA-N 1 1 323.356 3.657 20 5 DHBDMO CCn1ccc(C[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000616785524 1022769564 /nfs/dbraw/zinc/76/95/64/1022769564.db2.gz ZCCDIWYSZPCBLW-UHFFFAOYSA-N 1 1 307.781 3.702 20 5 DHBDMO CCn1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000616785524 1022769571 /nfs/dbraw/zinc/76/95/71/1022769571.db2.gz ZCCDIWYSZPCBLW-UHFFFAOYSA-N 1 1 307.781 3.702 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]2C2CCC2)c([N+](=O)[O-])cc1F ZINC000184198771 1022773182 /nfs/dbraw/zinc/77/31/82/1022773182.db2.gz GEULRWYRWUODCP-CQSZACIVSA-N 1 1 308.353 3.507 20 5 DHBDMO CCOc1cccc([C@@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000180684712 1022785786 /nfs/dbraw/zinc/78/57/86/1022785786.db2.gz WHDYMSUPUAQQLR-GFCCVEGCSA-N 1 1 318.348 3.983 20 5 DHBDMO Cc1ccc(C[NH2+][C@H]2CCc3ccc(Cl)nc32)cc1[N+](=O)[O-] ZINC000876500347 1033080348 /nfs/dbraw/zinc/08/03/48/1033080348.db2.gz QVJHWPYQWMTDAP-ZDUSSCGKSA-N 1 1 317.776 3.729 20 5 DHBDMO C[N@@H+](CC(=O)NC1CC1)Cc1c2ccccc2cc2ccccc21 ZINC000768204408 1022915514 /nfs/dbraw/zinc/91/55/14/1022915514.db2.gz XOGBAHNZUUUIRZ-UHFFFAOYSA-N 1 1 318.420 3.703 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(NCCC[N@@H+]2CCCC[C@@H]2C)c1F ZINC001167753090 1023044782 /nfs/dbraw/zinc/04/47/82/1023044782.db2.gz CFLVRCXPROSSKP-ZDUSSCGKSA-N 1 1 309.385 3.719 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCc2c1nccc2Cl)c1ccccc1[N+](=O)[O-] ZINC000925693105 1023180085 /nfs/dbraw/zinc/18/00/85/1023180085.db2.gz OKAAZPKOVZKDDT-IINYFYTJSA-N 1 1 317.776 3.981 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@H](C)[C@H]1C ZINC000112644970 1023815985 /nfs/dbraw/zinc/81/59/85/1023815985.db2.gz ZVHXSIIOIMZUHE-CHWSQXEVSA-N 1 1 324.446 3.708 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@H](C)[C@H]1C ZINC000112644970 1023815990 /nfs/dbraw/zinc/81/59/90/1023815990.db2.gz ZVHXSIIOIMZUHE-CHWSQXEVSA-N 1 1 324.446 3.708 20 5 DHBDMO CC[N@@H+](CCc1ccccc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788479671 1023892070 /nfs/dbraw/zinc/89/20/70/1023892070.db2.gz ZTEASBLDYXERJK-UHFFFAOYSA-N 1 1 302.349 3.799 20 5 DHBDMO CC[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1nc(C)cs1 ZINC000788485068 1023894007 /nfs/dbraw/zinc/89/40/07/1023894007.db2.gz HMFQISDOKULCQP-OAHLLOKOSA-N 1 1 323.393 3.914 20 5 DHBDMO COc1cc(F)cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000093899599 1023958487 /nfs/dbraw/zinc/95/84/87/1023958487.db2.gz OWKWMEVANLBLBS-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000051428230 1024048451 /nfs/dbraw/zinc/04/84/51/1024048451.db2.gz IZGQGWFVGWSXIQ-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO CC(C)OC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000531403067 1024143811 /nfs/dbraw/zinc/14/38/11/1024143811.db2.gz KSMHVBLYKOBMNF-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cc(O)ccc1Cl ZINC000883327381 1024379103 /nfs/dbraw/zinc/37/91/03/1024379103.db2.gz XNENODQDUDEOPT-HNNXBMFYSA-N 1 1 318.760 3.731 20 5 DHBDMO CCn1ccnc1[C@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000453362509 1024487666 /nfs/dbraw/zinc/48/76/66/1024487666.db2.gz RIIUKOXXNHEMIP-LRDDRELGSA-N 1 1 314.389 3.539 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)cc1[N+](=O)[O-] ZINC000585765529 1024602428 /nfs/dbraw/zinc/60/24/28/1024602428.db2.gz KRRSEBSVJOHBMF-CYBMUJFWSA-N 1 1 324.384 3.673 20 5 DHBDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000106878376 1024606461 /nfs/dbraw/zinc/60/64/61/1024606461.db2.gz RVZSRYBOGZCTPX-GFCCVEGCSA-N 1 1 319.430 3.904 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)cc1[N+](=O)[O-] ZINC000109781003 1024695932 /nfs/dbraw/zinc/69/59/32/1024695932.db2.gz ZZRFKLSIFPORIY-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO CO[C@H]1C[C@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C12CCC2 ZINC001170324903 1024743779 /nfs/dbraw/zinc/74/37/79/1024743779.db2.gz UTKKSOJIROFNEG-GJZGRUSLSA-N 1 1 324.808 3.638 20 5 DHBDMO CO[C@H]1C[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C12CCC2 ZINC001170324903 1024743783 /nfs/dbraw/zinc/74/37/83/1024743783.db2.gz UTKKSOJIROFNEG-GJZGRUSLSA-N 1 1 324.808 3.638 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)C[C@@H]2CC2(C)C)c([N+](=O)[O-])c1 ZINC001170352348 1024748258 /nfs/dbraw/zinc/74/82/58/1024748258.db2.gz MCYSSMPEVIBKEP-OCCSQVGLSA-N 1 1 306.406 3.512 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccsc2)c([N+](=O)[O-])c1 ZINC001170345209 1024757451 /nfs/dbraw/zinc/75/74/51/1024757451.db2.gz HYZUKHHTTRVDFH-GFCCVEGCSA-N 1 1 320.414 3.728 20 5 DHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000269694184 1024966124 /nfs/dbraw/zinc/96/61/24/1024966124.db2.gz WGJREWZSSFLUMJ-JKSUJKDBSA-N 1 1 318.398 3.527 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000353746088 1025226156 /nfs/dbraw/zinc/22/61/56/1025226156.db2.gz KVMWYXZBRBPAIX-BKSIFSGMSA-N 1 1 316.401 3.501 20 5 DHBDMO CCc1nc(NCc2cc([N+](=O)[O-])ccc2Cl)cc(C)[nH+]1 ZINC000804545464 1025355981 /nfs/dbraw/zinc/35/59/81/1025355981.db2.gz ZNRKXEZGURCJCQ-UHFFFAOYSA-N 1 1 306.753 3.521 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(O)cc2)CC2CC2)cc1 ZINC000354119679 1025362446 /nfs/dbraw/zinc/36/24/46/1025362446.db2.gz PCZSWQHWUUHBFA-UHFFFAOYSA-N 1 1 312.369 3.713 20 5 DHBDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886014615 1025438855 /nfs/dbraw/zinc/43/88/55/1025438855.db2.gz LPEMKDSBRRWEEY-SWLSCSKDSA-N 1 1 315.348 3.507 20 5 DHBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886021505 1025442949 /nfs/dbraw/zinc/44/29/49/1025442949.db2.gz XWTCUEALKGTQKS-MLGOLLRUSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886021505 1025442954 /nfs/dbraw/zinc/44/29/54/1025442954.db2.gz XWTCUEALKGTQKS-MLGOLLRUSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886021503 1025443718 /nfs/dbraw/zinc/44/37/18/1025443718.db2.gz XWTCUEALKGTQKS-BLLLJJGKSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886021503 1025443722 /nfs/dbraw/zinc/44/37/22/1025443722.db2.gz XWTCUEALKGTQKS-BLLLJJGKSA-N 1 1 315.348 3.712 20 5 DHBDMO Cc1cc(N2CCC(c3[nH]cc[nH+]3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000747211526 1025466869 /nfs/dbraw/zinc/46/68/69/1025466869.db2.gz DLFFJVOKCVARLC-UHFFFAOYSA-N 1 1 320.780 3.664 20 5 DHBDMO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(Cl)cc1[N+](=O)[O-] ZINC000747211280 1025467693 /nfs/dbraw/zinc/46/76/93/1025467693.db2.gz DCGCSNDHLRWRGM-NEPJUHHUSA-N 1 1 309.797 3.595 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc(Cl)nc1 ZINC000069219732 1025667204 /nfs/dbraw/zinc/66/72/04/1025667204.db2.gz BQWCEDFNPFTBGR-NSHDSACASA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000069219732 1025667220 /nfs/dbraw/zinc/66/72/20/1025667220.db2.gz BQWCEDFNPFTBGR-NSHDSACASA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000355785043 1025840111 /nfs/dbraw/zinc/84/01/11/1025840111.db2.gz PBUMXAZBQRHNES-PBHICJAKSA-N 1 1 304.390 3.548 20 5 DHBDMO C[C@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089883529 1026072169 /nfs/dbraw/zinc/07/21/69/1026072169.db2.gz PSXZGMONEDZKQM-LBPRGKRZSA-N 1 1 301.346 3.624 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000513496984 1026523888 /nfs/dbraw/zinc/52/38/88/1026523888.db2.gz OPYNLEDBQQUEJV-AWEZNQCLSA-N 1 1 300.333 3.723 20 5 DHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000280166774 1026604179 /nfs/dbraw/zinc/60/41/79/1026604179.db2.gz FSONCCVBZFSYNT-HNNXBMFYSA-N 1 1 312.797 3.639 20 5 DHBDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000237182969 1026945517 /nfs/dbraw/zinc/94/55/17/1026945517.db2.gz OUSFVCUJZXVUQK-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](O)CC23CCC3)cc1[N+](=O)[O-] ZINC000421366202 1026966452 /nfs/dbraw/zinc/96/64/52/1026966452.db2.gz BYHKTQXVJVPQMJ-HNNXBMFYSA-N 1 1 318.417 3.598 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](Cc3nccs3)C2)c1 ZINC000932207075 1027412671 /nfs/dbraw/zinc/41/26/71/1027412671.db2.gz QVFHZZHKGNTHNZ-CQSZACIVSA-N 1 1 317.414 3.506 20 5 DHBDMO C[C@@H](C[C@@H]1CCCCC[NH2+]1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423142608 1027435151 /nfs/dbraw/zinc/43/51/51/1027435151.db2.gz AUDFXRAEUMRQFX-DZKIICNBSA-N 1 1 305.422 3.556 20 5 DHBDMO C[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000932276678 1027441180 /nfs/dbraw/zinc/44/11/80/1027441180.db2.gz VLTFUPLVQLFSTL-YOEHRIQHSA-N 1 1 311.385 3.758 20 5 DHBDMO Cc1ccc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000562489001 1027455832 /nfs/dbraw/zinc/45/58/32/1027455832.db2.gz PGJKDFVAOXHDJY-LBPRGKRZSA-N 1 1 302.296 3.678 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC=C(c2cccnc2)C1 ZINC000295897943 1027481069 /nfs/dbraw/zinc/48/10/69/1027481069.db2.gz IDJBKOXVBYAELQ-AWEZNQCLSA-N 1 1 309.369 3.840 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(F)ccc1OC ZINC000932469756 1027507447 /nfs/dbraw/zinc/50/74/47/1027507447.db2.gz SIHMEFAEIUQBQO-HNNXBMFYSA-N 1 1 318.348 3.983 20 5 DHBDMO CCc1ccccc1[C@H](N)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000423499262 1027564989 /nfs/dbraw/zinc/56/49/89/1027564989.db2.gz JGIZQHMPOFXOJZ-FZKQIMNGSA-N 1 1 313.401 3.508 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(F)cc1F ZINC000576478730 1027622070 /nfs/dbraw/zinc/62/20/70/1027622070.db2.gz ADQRNENGVDAMFZ-HNNXBMFYSA-N 1 1 304.296 3.650 20 5 DHBDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000576805951 1027662262 /nfs/dbraw/zinc/66/22/62/1027662262.db2.gz WNFJIWBVGOZDFW-ZJUUUORDSA-N 1 1 302.296 3.844 20 5 DHBDMO CC[N@@H+](Cc1cccc(F)c1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485739365 1027922618 /nfs/dbraw/zinc/92/26/18/1027922618.db2.gz RPPRCFPJPHVHFV-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934335923 1027970324 /nfs/dbraw/zinc/97/03/24/1027970324.db2.gz IAHMTCQSNRWURC-CHWSQXEVSA-N 1 1 317.414 3.677 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934335926 1027970971 /nfs/dbraw/zinc/97/09/71/1027970971.db2.gz IAHMTCQSNRWURC-STQMWFEESA-N 1 1 317.414 3.677 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934335925 1027971673 /nfs/dbraw/zinc/97/16/73/1027971673.db2.gz IAHMTCQSNRWURC-QWHCGFSZSA-N 1 1 317.414 3.677 20 5 DHBDMO CSC[C@@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601168083 1028009197 /nfs/dbraw/zinc/00/91/97/1028009197.db2.gz OCELOIQQMVMWSS-GFCCVEGCSA-N 1 1 317.414 3.722 20 5 DHBDMO C[C@]12CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C[C@H]1C2(F)F ZINC000601167977 1028010297 /nfs/dbraw/zinc/01/02/97/1028010297.db2.gz KCZPLCAXZAOWQA-CABCVRRESA-N 1 1 319.311 3.625 20 5 DHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCCc2cccnc21 ZINC000367213777 1028146766 /nfs/dbraw/zinc/14/67/66/1028146766.db2.gz PUCHAEDWYZQIFD-MRXNPFEDSA-N 1 1 315.348 3.638 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCCc2cccnc21 ZINC000367213777 1028146777 /nfs/dbraw/zinc/14/67/77/1028146777.db2.gz PUCHAEDWYZQIFD-MRXNPFEDSA-N 1 1 315.348 3.638 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000563656649 1028149016 /nfs/dbraw/zinc/14/90/16/1028149016.db2.gz NTGFRWDHSIVWFG-UKRRQHHQSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000563656649 1028149029 /nfs/dbraw/zinc/14/90/29/1028149029.db2.gz NTGFRWDHSIVWFG-UKRRQHHQSA-N 1 1 307.438 3.674 20 5 DHBDMO Cc1[nH+]c(CNc2cc(Cl)ccc2[N+](=O)[O-])c2n1CCCC2 ZINC000367333245 1028169087 /nfs/dbraw/zinc/16/90/87/1028169087.db2.gz PSJINVKZLFQOLM-UHFFFAOYSA-N 1 1 320.780 3.702 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449096458 1028348195 /nfs/dbraw/zinc/34/81/95/1028348195.db2.gz HXPWMFUDWBWWGQ-CYBMUJFWSA-N 1 1 322.286 3.789 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000368612168 1028383110 /nfs/dbraw/zinc/38/31/10/1028383110.db2.gz IFNQOFQYZLIGGG-HOCLYGCPSA-N 1 1 311.385 3.615 20 5 DHBDMO CC[C@@H](CO)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449375672 1028585604 /nfs/dbraw/zinc/58/56/04/1028585604.db2.gz IITYVVAKVVGMPS-LBPRGKRZSA-N 1 1 320.414 3.526 20 5 DHBDMO CS[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449445035 1028647455 /nfs/dbraw/zinc/64/74/55/1028647455.db2.gz GNLYYZBKGLSYMK-CYBMUJFWSA-N 1 1 318.398 3.792 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449505736 1028728905 /nfs/dbraw/zinc/72/89/05/1028728905.db2.gz XMOWYJXYVGKVNA-QGZVFWFLSA-N 1 1 311.385 3.678 20 5 DHBDMO CCO[C@@H]1CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000449510315 1028737563 /nfs/dbraw/zinc/73/75/63/1028737563.db2.gz XCGNAKACWQWIKY-MHZPLBOYSA-N 1 1 318.417 3.745 20 5 DHBDMO Cc1cc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])cc(C)n1 ZINC000817410523 1029153488 /nfs/dbraw/zinc/15/34/88/1029153488.db2.gz MRJZJDNXHVXJGZ-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO Cc1c(C[N@H+]2CCSC3(CCC3)CC2)cccc1[N+](=O)[O-] ZINC000411870436 1029230520 /nfs/dbraw/zinc/23/05/20/1029230520.db2.gz ORQKYUDUXOGJET-UHFFFAOYSA-N 1 1 306.431 3.765 20 5 DHBDMO C[N@H+](CCCC(=O)c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000450227640 1029266932 /nfs/dbraw/zinc/26/69/32/1029266932.db2.gz RGANUTSHNRJIDT-UHFFFAOYSA-N 1 1 312.369 3.690 20 5 DHBDMO C[N@@H+](CCCC(=O)c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000450227640 1029266944 /nfs/dbraw/zinc/26/69/44/1029266944.db2.gz RGANUTSHNRJIDT-UHFFFAOYSA-N 1 1 312.369 3.690 20 5 DHBDMO Cc1cccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451548800 1029910723 /nfs/dbraw/zinc/91/07/23/1029910723.db2.gz OLHXVDVICNBMIW-MRXNPFEDSA-N 1 1 311.385 3.678 20 5 DHBDMO C[N@@H+](CC[C@@H]1CC1(Cl)Cl)Cc1ccccc1[N+](=O)[O-] ZINC000822570943 1030063338 /nfs/dbraw/zinc/06/33/38/1030063338.db2.gz SPZWHJBXPSKGJZ-LLVKDONJSA-N 1 1 303.189 3.611 20 5 DHBDMO C[N@H+]1CCCC[C@H](CNc2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865968180 1030096761 /nfs/dbraw/zinc/09/67/61/1030096761.db2.gz OKMVUKLEIUOFGI-LLVKDONJSA-N 1 1 313.348 3.676 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](CC[C@@H]1CC1(Cl)Cl)C2 ZINC000822780854 1030121772 /nfs/dbraw/zinc/12/17/72/1030121772.db2.gz WQKZPAPDPXOCHS-LLVKDONJSA-N 1 1 315.200 3.537 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CC[C@@H]1CC1(Cl)Cl)C2 ZINC000822780854 1030121777 /nfs/dbraw/zinc/12/17/77/1030121777.db2.gz WQKZPAPDPXOCHS-LLVKDONJSA-N 1 1 315.200 3.537 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCc2c1nccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC000924797646 1030190148 /nfs/dbraw/zinc/19/01/48/1030190148.db2.gz HQQKDNZWPNEFRB-BONVTDFDSA-N 1 1 317.776 3.981 20 5 DHBDMO CC(C)(C)n1cc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cn1 ZINC000291745233 1030627946 /nfs/dbraw/zinc/62/79/46/1030627946.db2.gz PMOWHUVSUIAOLN-UHFFFAOYSA-N 1 1 316.405 3.571 20 5 DHBDMO CCCC[C@H](C)[N@@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000558577429 1030658009 /nfs/dbraw/zinc/65/80/09/1030658009.db2.gz MEUHGRXPPDDAAS-LBPRGKRZSA-N 1 1 310.394 3.623 20 5 DHBDMO Cc1c(C[NH2+][C@H]2CCc3c2nccc3Cl)cccc1[N+](=O)[O-] ZINC000926271793 1030682794 /nfs/dbraw/zinc/68/27/94/1030682794.db2.gz SXQSXRDJDVKQJE-AWEZNQCLSA-N 1 1 317.776 3.729 20 5 DHBDMO CCCC[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000122987929 1030935586 /nfs/dbraw/zinc/93/55/86/1030935586.db2.gz OAOVWZQZXRHUDZ-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000611579724 1031108584 /nfs/dbraw/zinc/10/85/84/1031108584.db2.gz NRIXTWXRFQJGAR-YPMHNXCESA-N 1 1 314.332 3.668 20 5 DHBDMO CCC[C@@H](NC[C@@H](CC)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000360054403 1031258376 /nfs/dbraw/zinc/25/83/76/1031258376.db2.gz MRUBUMADUMXVDI-SJLPKXTDSA-N 1 1 319.449 3.900 20 5 DHBDMO COc1ccccc1/C=C\C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000536678002 1031390653 /nfs/dbraw/zinc/39/06/53/1031390653.db2.gz QNUVXNQNPMRMCC-XQRVVYSFSA-N 1 1 324.380 3.675 20 5 DHBDMO COc1ccccc1/C=C\C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000536678002 1031390666 /nfs/dbraw/zinc/39/06/66/1031390666.db2.gz QNUVXNQNPMRMCC-XQRVVYSFSA-N 1 1 324.380 3.675 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1cc(O)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000872026735 1031409519 /nfs/dbraw/zinc/40/95/19/1031409519.db2.gz FGXKZAIANCWDQN-QWRGUYRKSA-N 1 1 304.321 3.851 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(O)c1F ZINC000872026396 1031409560 /nfs/dbraw/zinc/40/95/60/1031409560.db2.gz AFBIEDWZXJOGIM-WDEREUQCSA-N 1 1 304.321 3.851 20 5 DHBDMO CC(C)[N@H+]1CCC[C@@H](CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872035585 1031419660 /nfs/dbraw/zinc/41/96/60/1031419660.db2.gz XIENAQMDRLSAAG-KGLIPLIRSA-N 1 1 323.412 3.505 20 5 DHBDMO Cc1cc(C)c(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cn1 ZINC000872077297 1031473816 /nfs/dbraw/zinc/47/38/16/1031473816.db2.gz FNCXOJRDWXGHNI-GFCCVEGCSA-N 1 1 303.337 3.597 20 5 DHBDMO Cc1cc(C)c(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cn1 ZINC000872077298 1031475078 /nfs/dbraw/zinc/47/50/78/1031475078.db2.gz FNCXOJRDWXGHNI-LBPRGKRZSA-N 1 1 303.337 3.597 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2cccc(O)c2F)cc1[N+](=O)[O-] ZINC000872092568 1031491158 /nfs/dbraw/zinc/49/11/58/1031491158.db2.gz PFVBEPLZEMNROK-NSHDSACASA-N 1 1 304.321 3.599 20 5 DHBDMO Cc1nn(C[N@@H+]2CCCC[C@@H]2CCC(C)C)c(C)c1[N+](=O)[O-] ZINC000760408440 1031706755 /nfs/dbraw/zinc/70/67/55/1031706755.db2.gz MZRWLYOIVPPTEI-OAHLLOKOSA-N 1 1 308.426 3.656 20 5 DHBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1C ZINC000361266078 1031825402 /nfs/dbraw/zinc/82/54/02/1031825402.db2.gz LYOMJYJLTSZRJW-UHFFFAOYSA-N 1 1 324.384 3.802 20 5 DHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1C ZINC000361266078 1031825417 /nfs/dbraw/zinc/82/54/17/1031825417.db2.gz LYOMJYJLTSZRJW-UHFFFAOYSA-N 1 1 324.384 3.802 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)cc1Cl ZINC000846104653 1031876291 /nfs/dbraw/zinc/87/62/91/1031876291.db2.gz JRQZLYAVSZRKGT-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)cc1Cl ZINC000846104653 1031876299 /nfs/dbraw/zinc/87/62/99/1031876299.db2.gz JRQZLYAVSZRKGT-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO CCC[C@H]([NH2+]Cc1cnccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000294480576 1032020226 /nfs/dbraw/zinc/02/02/26/1032020226.db2.gz XGXMRSNRQCPXPS-INIZCTEOSA-N 1 1 315.373 3.629 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(CNc3cc(C4CC4)cc[nH+]3)nc2c1 ZINC000877541476 1033345493 /nfs/dbraw/zinc/34/54/93/1033345493.db2.gz OOGVVUWUEUKFFQ-UHFFFAOYSA-N 1 1 310.313 3.621 20 5 DHBDMO Cc1c(C[N@H+]2CC3(CCOCC3)[C@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000877590567 1033373953 /nfs/dbraw/zinc/37/39/53/1033373953.db2.gz AZHAKWTVWROGNW-QGZVFWFLSA-N 1 1 318.417 3.540 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC13CCCC3)CC2 ZINC001172906180 1033436823 /nfs/dbraw/zinc/43/68/23/1033436823.db2.gz WNSBPFDKCFOKCG-MRXNPFEDSA-N 1 1 300.402 3.861 20 5 DHBDMO C[C@]1(CF)CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172906700 1033437931 /nfs/dbraw/zinc/43/79/31/1033437931.db2.gz YAYJPEFNKBWDMG-DOTOQJQBSA-N 1 1 306.381 3.524 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC3CCC1CC3)CC2 ZINC001172914146 1033464306 /nfs/dbraw/zinc/46/43/06/1033464306.db2.gz DAEPKXSVYWGXAO-QWFMPGPPSA-N 1 1 300.402 3.717 20 5 DHBDMO C[C@H]1CCCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909564 1033481998 /nfs/dbraw/zinc/48/19/98/1033481998.db2.gz SMKHLVPICAIIGW-YOEHRIQHSA-N 1 1 302.418 3.964 20 5 DHBDMO CCC[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1 ZINC000153493666 1033581952 /nfs/dbraw/zinc/58/19/52/1033581952.db2.gz ZHNBYDGIWPYXMO-UHFFFAOYSA-N 1 1 301.346 3.624 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@H](C)[C@H]2C)c1F ZINC001173190931 1033584146 /nfs/dbraw/zinc/58/41/46/1033584146.db2.gz XRAHTWCNTUHFJO-RWMBFGLXSA-N 1 1 324.396 3.794 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@H](C)C[C@@H]2C)c1F ZINC001173189890 1033584907 /nfs/dbraw/zinc/58/49/07/1033584907.db2.gz OICIJNPSJOJHKY-AVGNSLFASA-N 1 1 324.396 3.794 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)C[C@H]2CC2(C)C)c1F ZINC001173198387 1033589480 /nfs/dbraw/zinc/58/94/80/1033589480.db2.gz ZBTPQLBXHSNWLI-VXGBXAGGSA-N 1 1 324.396 3.651 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1ccncc1 ZINC001173228814 1033605343 /nfs/dbraw/zinc/60/53/43/1033605343.db2.gz ZACOQKQCJQDSLH-KDOFPFPSSA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cccc(F)c1 ZINC001173230721 1033606088 /nfs/dbraw/zinc/60/60/88/1033606088.db2.gz ZWJDWYLMENFSJM-ZDUSSCGKSA-N 1 1 302.349 3.797 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC001173228381 1033606173 /nfs/dbraw/zinc/60/61/73/1033606173.db2.gz VTXOBXIQDUQEOQ-WCQYABFASA-N 1 1 316.323 3.800 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])nc1Cl ZINC000878373798 1033682587 /nfs/dbraw/zinc/68/25/87/1033682587.db2.gz OTDSAIXPXCUYNV-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO CCN(CC)[C@H](C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000479479924 1033772504 /nfs/dbraw/zinc/77/25/04/1033772504.db2.gz MAELNNRNWGPQKZ-CXAGYDPISA-N 1 1 319.449 3.637 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](C)(C(F)(F)F)C1 ZINC000879998810 1034172590 /nfs/dbraw/zinc/17/25/90/1034172590.db2.gz ASFFLFUNFADKJX-ZWNOBZJWSA-N 1 1 302.296 3.930 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@@H](c3nccs3)C2)c1 ZINC000880317512 1034292245 /nfs/dbraw/zinc/29/22/45/1034292245.db2.gz OXRDTILVFRNLEC-SNVBAGLBSA-N 1 1 323.805 3.694 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3nccs3)C2)ccc1Cl ZINC000880320346 1034295379 /nfs/dbraw/zinc/29/53/79/1034295379.db2.gz SLICSUUMDSVLHF-LLVKDONJSA-N 1 1 323.805 3.694 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC3(CCCCO3)CC2)ccc1Cl ZINC000880456884 1034335030 /nfs/dbraw/zinc/33/50/30/1034335030.db2.gz XUGYYKOVVOQKOY-UHFFFAOYSA-N 1 1 324.808 3.783 20 5 DHBDMO Cc1c([C@H](C)NC[C@H](C)[N@@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000480619904 1034355850 /nfs/dbraw/zinc/35/58/50/1034355850.db2.gz BLHQOLWCUVTHIU-DZKIICNBSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c([C@H](C)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000480619904 1034355863 /nfs/dbraw/zinc/35/58/63/1034355863.db2.gz BLHQOLWCUVTHIU-DZKIICNBSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@H](C)c1nccs1 ZINC000183701269 1034414580 /nfs/dbraw/zinc/41/45/80/1034414580.db2.gz ZPXQWFDKMCCGLT-LBPRGKRZSA-N 1 1 305.403 3.595 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000480853345 1034475663 /nfs/dbraw/zinc/47/56/63/1034475663.db2.gz DVCHYYTVEYZPCS-GFCCVEGCSA-N 1 1 312.410 3.842 20 5 DHBDMO CC1(C)C[C@H]([NH2+]Cc2cccnc2F)c2cc([N+](=O)[O-])ccc21 ZINC000794827785 1034548754 /nfs/dbraw/zinc/54/87/54/1034548754.db2.gz JLTCDVIPPCVRKY-HNNXBMFYSA-N 1 1 315.348 3.641 20 5 DHBDMO O=[N+]([O-])c1ccc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c(C(F)F)c1 ZINC000865504436 1034680360 /nfs/dbraw/zinc/68/03/60/1034680360.db2.gz OENKQWRPOYDWAC-JTQLQIEISA-N 1 1 322.315 3.640 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2C[C@H]3[C@H](C[C@@H]3c3ccccc3)C2)c1 ZINC001175301236 1034895915 /nfs/dbraw/zinc/89/59/15/1034895915.db2.gz PPTNQDUVCMVGCY-QRQLOZEOSA-N 1 1 308.381 3.830 20 5 DHBDMO CC[C@@H](C)C[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159416436 1035049777 /nfs/dbraw/zinc/04/97/77/1035049777.db2.gz IXLSZTSRLQNIDL-SNVBAGLBSA-N 1 1 315.211 3.835 20 5 DHBDMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159418555 1035052466 /nfs/dbraw/zinc/05/24/66/1035052466.db2.gz RLIDAXAXUKVRMK-SNVBAGLBSA-N 1 1 315.211 3.978 20 5 DHBDMO Cc1[nH+]c2c(Nc3cc([N+](=O)[O-])ccc3F)cccn2c1C ZINC001175735417 1035096574 /nfs/dbraw/zinc/09/65/74/1035096574.db2.gz MLNNPRCTOIAZHW-UHFFFAOYSA-N 1 1 300.293 3.742 20 5 DHBDMO Cc1cccnc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC001176896743 1035338337 /nfs/dbraw/zinc/33/83/37/1035338337.db2.gz IENBMSLFFXHRSP-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC[C@]12CCCOC2 ZINC001177007639 1035343310 /nfs/dbraw/zinc/34/33/10/1035343310.db2.gz BRUQRFRYTOUQMH-MRXNPFEDSA-N 1 1 324.808 3.783 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCC[C@]12CCCOC2 ZINC001177007639 1035343313 /nfs/dbraw/zinc/34/33/13/1035343313.db2.gz BRUQRFRYTOUQMH-MRXNPFEDSA-N 1 1 324.808 3.783 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CC(Cc2ccccc2Cl)C1 ZINC000485303334 1035534055 /nfs/dbraw/zinc/53/40/55/1035534055.db2.gz NFNFTZWCPIZHIW-UHFFFAOYSA-N 1 1 316.788 3.923 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@H](C2CC2)C1 ZINC001180081953 1035586650 /nfs/dbraw/zinc/58/66/50/1035586650.db2.gz OTVAHIZVLFHVJX-NSHDSACASA-N 1 1 314.307 3.846 20 5 DHBDMO CC[N@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C1CCC1 ZINC001180140801 1035593538 /nfs/dbraw/zinc/59/35/38/1035593538.db2.gz ALPDYOBLOWZZRC-UHFFFAOYSA-N 1 1 319.224 3.793 20 5 DHBDMO CC[N@@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C1CCC1 ZINC001180140801 1035593545 /nfs/dbraw/zinc/59/35/45/1035593545.db2.gz ALPDYOBLOWZZRC-UHFFFAOYSA-N 1 1 319.224 3.793 20 5 DHBDMO C[C@@H]1CCCC[C@@H]1OCC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001193743597 1035713039 /nfs/dbraw/zinc/71/30/39/1035713039.db2.gz QTJMDDUZPJXWLK-QAPCUYQASA-N 1 1 320.433 3.664 20 5 DHBDMO CC[C@H](C)C[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089897265 1035769666 /nfs/dbraw/zinc/76/96/66/1035769666.db2.gz UTLCKQJMSNCRBJ-LBPRGKRZSA-N 1 1 303.362 3.728 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc3nc[nH]c3c2)cc1[N+](=O)[O-] ZINC000539530070 1035771464 /nfs/dbraw/zinc/77/14/64/1035771464.db2.gz AHROKPBRKHRIAT-LBPRGKRZSA-N 1 1 310.357 3.630 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000076069429 1035805221 /nfs/dbraw/zinc/80/52/21/1035805221.db2.gz XAZWUZFMBOSXKP-RYUDHWBXSA-N 1 1 312.410 3.840 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000076069429 1035805240 /nfs/dbraw/zinc/80/52/40/1035805240.db2.gz XAZWUZFMBOSXKP-RYUDHWBXSA-N 1 1 312.410 3.840 20 5 DHBDMO Cc1ccc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000539849012 1035900308 /nfs/dbraw/zinc/90/03/08/1035900308.db2.gz HNQOABOSYNHDBL-HOCLYGCPSA-N 1 1 306.431 3.763 20 5 DHBDMO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000539924829 1035934838 /nfs/dbraw/zinc/93/48/38/1035934838.db2.gz RJFWGEWMPLCECJ-MRXNPFEDSA-N 1 1 304.321 3.789 20 5 DHBDMO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000539924829 1035934850 /nfs/dbraw/zinc/93/48/50/1035934850.db2.gz RJFWGEWMPLCECJ-MRXNPFEDSA-N 1 1 304.321 3.789 20 5 DHBDMO C[C@]1(F)CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000539923790 1035935283 /nfs/dbraw/zinc/93/52/83/1035935283.db2.gz FHLYUYJFGGAKIO-INIZCTEOSA-N 1 1 304.321 3.789 20 5 DHBDMO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000539923790 1035935297 /nfs/dbraw/zinc/93/52/97/1035935297.db2.gz FHLYUYJFGGAKIO-INIZCTEOSA-N 1 1 304.321 3.789 20 5 DHBDMO COc1ccc(C[N@@H+](C)CCc2ccccc2C)cc1[N+](=O)[O-] ZINC001194633278 1035972966 /nfs/dbraw/zinc/97/29/66/1035972966.db2.gz PWNGWZAFGKLJEH-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@@H](C)CC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595482100 1036197342 /nfs/dbraw/zinc/19/73/42/1036197342.db2.gz HMOBUXUOCJMIAR-WFASDCNBSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1noc(C[N@H+]2C[C@@H](C)CC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595482100 1036197353 /nfs/dbraw/zinc/19/73/53/1036197353.db2.gz HMOBUXUOCJMIAR-WFASDCNBSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](OCCC(C)C)C1 ZINC000541772683 1036429144 /nfs/dbraw/zinc/42/91/44/1036429144.db2.gz HYSVMFGAKOQENN-KRWDZBQOSA-N 1 1 306.406 3.540 20 5 DHBDMO CC[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CCS1 ZINC000464794175 1036457339 /nfs/dbraw/zinc/45/73/39/1036457339.db2.gz WJMAGFLQOQHDMT-OAHLLOKOSA-N 1 1 324.446 3.709 20 5 DHBDMO CC[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CCS1 ZINC000464794175 1036457349 /nfs/dbraw/zinc/45/73/49/1036457349.db2.gz WJMAGFLQOQHDMT-OAHLLOKOSA-N 1 1 324.446 3.709 20 5 DHBDMO CCOc1c(Cl)cccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000486934043 1036467858 /nfs/dbraw/zinc/46/78/58/1036467858.db2.gz JKNIZRKNANCVBP-UHFFFAOYSA-N 1 1 320.776 3.937 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCOCc1ccccc1 ZINC000464852264 1036472408 /nfs/dbraw/zinc/47/24/08/1036472408.db2.gz QVHLQCYNNUAKLU-HNNXBMFYSA-N 1 1 314.385 3.804 20 5 DHBDMO Cc1cccc(CC2C[NH+](Cc3ccc([N+](=O)[O-])cc3F)C2)c1 ZINC001183025272 1036505604 /nfs/dbraw/zinc/50/56/04/1036505604.db2.gz QWRGCBPTHGQHQD-UHFFFAOYSA-N 1 1 314.360 3.717 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC001183371851 1036585063 /nfs/dbraw/zinc/58/50/63/1036585063.db2.gz UVFWYIRPVLUDSM-AKXCLDFRSA-N 1 1 318.442 3.683 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCOc1ccc(F)cc1 ZINC000487561913 1036676508 /nfs/dbraw/zinc/67/65/08/1036676508.db2.gz PLJVTPLZQSBTLB-ZDUSSCGKSA-N 1 1 318.348 3.806 20 5 DHBDMO CC(C)C[N@H+](Cc1ccccn1)Cc1ccc([N+](=O)[O-])cc1F ZINC001198000279 1036922065 /nfs/dbraw/zinc/92/20/65/1036922065.db2.gz GDJCGHFKXPQGEC-UHFFFAOYSA-N 1 1 317.364 3.787 20 5 DHBDMO CC(C)C[N@@H+](Cc1ccccn1)Cc1ccc([N+](=O)[O-])cc1F ZINC001198000279 1036922081 /nfs/dbraw/zinc/92/20/81/1036922081.db2.gz GDJCGHFKXPQGEC-UHFFFAOYSA-N 1 1 317.364 3.787 20 5 DHBDMO CCOc1cc(NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC001184839583 1036961255 /nfs/dbraw/zinc/96/12/55/1036961255.db2.gz MAXXGZVVCRLRAV-KGLIPLIRSA-N 1 1 321.421 3.526 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2ccc(C)s2)ccc1[N+](=O)[O-] ZINC000492795773 1037022312 /nfs/dbraw/zinc/02/23/12/1037022312.db2.gz ZGZBPIWPZWKNHX-UHFFFAOYSA-N 1 1 320.414 3.995 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000492829320 1037027101 /nfs/dbraw/zinc/02/71/01/1037027101.db2.gz KQNVNQMORGVHKH-HRCADAONSA-N 1 1 318.417 3.713 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC000488570739 1037077399 /nfs/dbraw/zinc/07/73/99/1037077399.db2.gz DXIPGJSQBWQIEB-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO COc1cc(C[N@@H+]2CC=C(C(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000492970101 1037078181 /nfs/dbraw/zinc/07/81/81/1037078181.db2.gz ACTCJAITIWRTGE-UHFFFAOYSA-N 1 1 304.390 3.782 20 5 DHBDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774902335 1037191626 /nfs/dbraw/zinc/19/16/26/1037191626.db2.gz DYSUZZCMCMJIAU-GFCCVEGCSA-N 1 1 307.350 3.515 20 5 DHBDMO C[C@H](Nc1ccsc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001186071115 1037301970 /nfs/dbraw/zinc/30/19/70/1037301970.db2.gz VMWJDWNEVSMWRH-RYUDHWBXSA-N 1 1 309.435 3.721 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCOc2ccccc2)C2CC2)c1 ZINC000490043027 1037592596 /nfs/dbraw/zinc/59/25/96/1037592596.db2.gz AYEIDLFJBQWKRV-UHFFFAOYSA-N 1 1 312.369 3.638 20 5 DHBDMO COc1cc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000490093173 1037613011 /nfs/dbraw/zinc/61/30/11/1037613011.db2.gz XMDHOOOMNOHTDF-VHDGCEQUSA-N 1 1 304.390 3.756 20 5 DHBDMO CC(C)[N@H+]1CC[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301124890 1037661284 /nfs/dbraw/zinc/66/12/84/1037661284.db2.gz PILWUYKQBZKHAO-LLVKDONJSA-N 1 1 317.311 3.508 20 5 DHBDMO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490398974 1037708232 /nfs/dbraw/zinc/70/82/32/1037708232.db2.gz HDDAHEZOUAYDPB-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490398974 1037708260 /nfs/dbraw/zinc/70/82/60/1037708260.db2.gz HDDAHEZOUAYDPB-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC000029484799 1037756781 /nfs/dbraw/zinc/75/67/81/1037756781.db2.gz DCLLTOAOYSJMPY-QGZVFWFLSA-N 1 1 312.369 3.723 20 5 DHBDMO CCC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC1CCCCC1 ZINC001190485735 1038317927 /nfs/dbraw/zinc/31/79/27/1038317927.db2.gz QECYSRHFDRGBRR-SFHVURJKSA-N 1 1 320.433 3.921 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[C@H](C2CC2)O1 ZINC001190528945 1038337240 /nfs/dbraw/zinc/33/72/40/1038337240.db2.gz OPQVZPHOLMXYSS-QZTJIDSGSA-N 1 1 318.417 3.763 20 5 DHBDMO CCC[N@@H+](CC)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001190605551 1038352778 /nfs/dbraw/zinc/35/27/78/1038352778.db2.gz OZPHVXSCLFJNSZ-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC001190975695 1038411895 /nfs/dbraw/zinc/41/18/95/1038411895.db2.gz GPMSBKCOSDWAJX-GOSISDBHSA-N 1 1 316.401 3.926 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc2[nH]ccc21 ZINC000589184933 1038444494 /nfs/dbraw/zinc/44/44/94/1038444494.db2.gz BVQQPIPFOHVKLB-UHFFFAOYSA-N 1 1 309.369 3.751 20 5 DHBDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000589187854 1038444894 /nfs/dbraw/zinc/44/48/94/1038444894.db2.gz ZYIXGJCOQUATNG-OJJSLQOQSA-N 1 1 318.417 3.624 20 5 DHBDMO C[N@H+](C/C=C/c1ccc(F)cc1)CCc1ccccc1[N+](=O)[O-] ZINC000572801975 1038503932 /nfs/dbraw/zinc/50/39/32/1038503932.db2.gz INQJPSKIJHBGGJ-SNAWJCMRSA-N 1 1 314.360 3.922 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1ccc3c(c1)CCC3)CC2 ZINC001191519748 1038513144 /nfs/dbraw/zinc/51/31/44/1038513144.db2.gz CDVOXAKDYYALLZ-UHFFFAOYSA-N 1 1 308.381 3.642 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1ccc3c(c1)CCC3)CC2 ZINC001191519748 1038513150 /nfs/dbraw/zinc/51/31/50/1038513150.db2.gz CDVOXAKDYYALLZ-UHFFFAOYSA-N 1 1 308.381 3.642 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000589609048 1038519097 /nfs/dbraw/zinc/51/90/97/1038519097.db2.gz XBPBEBXIVXPWLA-CYBMUJFWSA-N 1 1 309.410 3.526 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cs1 ZINC000589743975 1038535265 /nfs/dbraw/zinc/53/52/65/1038535265.db2.gz VKOWHAMJPSQMSM-RRFJBIMHSA-N 1 1 324.446 3.562 20 5 DHBDMO C[N@H+]1Cc2ccccc2[C@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000590082312 1038578124 /nfs/dbraw/zinc/57/81/24/1038578124.db2.gz DZEKYDXVBDMKNB-CQSZACIVSA-N 1 1 317.776 3.847 20 5 DHBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000590082312 1038578134 /nfs/dbraw/zinc/57/81/34/1038578134.db2.gz DZEKYDXVBDMKNB-CQSZACIVSA-N 1 1 317.776 3.847 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000590601793 1038675652 /nfs/dbraw/zinc/67/56/52/1038675652.db2.gz QMHUTOLJWFFCFN-CABCVRRESA-N 1 1 311.385 3.930 20 5 DHBDMO C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(Cl)c(F)c1 ZINC001192833010 1038705599 /nfs/dbraw/zinc/70/55/99/1038705599.db2.gz JEGPSPGUUDPJSM-SECBINFHSA-N 1 1 309.728 3.633 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)cc1[N+](=O)[O-] ZINC000593695215 1039082413 /nfs/dbraw/zinc/08/24/13/1039082413.db2.gz IKZPEBYIAPLIJI-OAHLLOKOSA-N 1 1 310.344 3.949 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccccc2C)CC1 ZINC000592139845 1039133147 /nfs/dbraw/zinc/13/31/47/1039133147.db2.gz KKLSGAQZPPTLBA-UHFFFAOYSA-N 1 1 312.369 3.691 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+]C1(c2ccccc2F)CCC1 ZINC000592146514 1039141139 /nfs/dbraw/zinc/14/11/39/1039141139.db2.gz RVBKWIIFSUVRKP-UHFFFAOYSA-N 1 1 300.333 3.903 20 5 DHBDMO COc1ccccc1C1([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000592395296 1039177357 /nfs/dbraw/zinc/17/73/57/1039177357.db2.gz VYACFKULKPBGHA-CYBMUJFWSA-N 1 1 312.369 3.943 20 5 DHBDMO C[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000603847238 1039183141 /nfs/dbraw/zinc/18/31/41/1039183141.db2.gz KRFHLEZWGCYHIN-OAGGEKHMSA-N 1 1 318.417 3.874 20 5 DHBDMO CC[C@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1cc(C)ccc1C ZINC000599642944 1039247212 /nfs/dbraw/zinc/24/72/12/1039247212.db2.gz DKNHEWJCEUGNTL-AWEZNQCLSA-N 1 1 303.362 3.749 20 5 DHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1F ZINC000604012071 1039279596 /nfs/dbraw/zinc/27/95/96/1039279596.db2.gz GRBZOWCWXCPHHC-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCCc1ccccc1 ZINC000058580847 1039292741 /nfs/dbraw/zinc/29/27/41/1039292741.db2.gz WILHOHWDNQJUIQ-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO CC1=C(c2ccco2)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000574465496 1039681989 /nfs/dbraw/zinc/68/19/89/1039681989.db2.gz IQAGGWWRTUJKMB-UHFFFAOYSA-N 1 1 312.369 3.910 20 5 DHBDMO CC[C@H](C)[N@H+](Cc1onc(C)c1[N+](=O)[O-])Cc1ccccc1 ZINC000595286500 1040095439 /nfs/dbraw/zinc/09/54/39/1040095439.db2.gz JMTRJIJAUAFSFZ-LBPRGKRZSA-N 1 1 303.362 3.692 20 5 DHBDMO CC[C@H](C)[N@@H+](Cc1onc(C)c1[N+](=O)[O-])Cc1ccccc1 ZINC000595286500 1040095456 /nfs/dbraw/zinc/09/54/56/1040095456.db2.gz JMTRJIJAUAFSFZ-LBPRGKRZSA-N 1 1 303.362 3.692 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2c2cccc(C)c2C)c1[N+](=O)[O-] ZINC000595327689 1040100281 /nfs/dbraw/zinc/10/02/81/1040100281.db2.gz QLAKABYTJFVNND-HNNXBMFYSA-N 1 1 315.373 3.845 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000595340863 1040102679 /nfs/dbraw/zinc/10/26/79/1040102679.db2.gz YGXZVPBYUGZFMZ-HIFRSBDPSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000595340863 1040102686 /nfs/dbraw/zinc/10/26/86/1040102686.db2.gz YGXZVPBYUGZFMZ-HIFRSBDPSA-N 1 1 310.394 3.594 20 5 DHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](CC)Cc1onc(C)c1[N+](=O)[O-] ZINC000595345178 1040105201 /nfs/dbraw/zinc/10/52/01/1040105201.db2.gz PVSNSAXXIFCIIQ-HNNXBMFYSA-N 1 1 317.389 3.734 20 5 DHBDMO CCC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000595367412 1040126846 /nfs/dbraw/zinc/12/68/46/1040126846.db2.gz QMSRWVKFZCUFGJ-HNNXBMFYSA-N 1 1 310.369 3.515 20 5 DHBDMO Cc1noc(C[NH2+][C@H](c2ccccc2)C(C)(C)C)c1[N+](=O)[O-] ZINC000595359729 1040127446 /nfs/dbraw/zinc/12/74/46/1040127446.db2.gz SVQPKIUEOKIDDE-OAHLLOKOSA-N 1 1 303.362 3.768 20 5 DHBDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595412940 1040130789 /nfs/dbraw/zinc/13/07/89/1040130789.db2.gz PLMPVVHDSDOJOI-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595407190 1040131252 /nfs/dbraw/zinc/13/12/52/1040131252.db2.gz COHNGGHGJYVDSI-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO Cc1noc(C[NH2+][C@H](CC2CC2)c2ccccc2)c1[N+](=O)[O-] ZINC000595416017 1040133712 /nfs/dbraw/zinc/13/37/12/1040133712.db2.gz FFLHNAWPNZWWOZ-CQSZACIVSA-N 1 1 301.346 3.522 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ccccn3)C2)c(F)c1 ZINC000595500709 1040156374 /nfs/dbraw/zinc/15/63/74/1040156374.db2.gz KGKNTAHHXWCDNL-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO COc1ccc(C[N@H+]2CC3CC2(c2ccccc2)C3)cc1[N+](=O)[O-] ZINC000595909797 1040273363 /nfs/dbraw/zinc/27/33/63/1040273363.db2.gz DMFLIIAWUGANRS-UHFFFAOYSA-N 1 1 324.380 3.725 20 5 DHBDMO Cc1[nH+]ccn1CCCCNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000596137795 1040314054 /nfs/dbraw/zinc/31/40/54/1040314054.db2.gz XBYNTPVEPHFAPI-UHFFFAOYSA-N 1 1 324.331 3.930 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)c1 ZINC000597159678 1040669872 /nfs/dbraw/zinc/66/98/72/1040669872.db2.gz QEUYOZPLUWSDAC-GWCFXTLKSA-N 1 1 312.316 3.571 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2C[C@@H]3CCCC[C@@H]32)c1 ZINC000597159678 1040669882 /nfs/dbraw/zinc/66/98/82/1040669882.db2.gz QEUYOZPLUWSDAC-GWCFXTLKSA-N 1 1 312.316 3.571 20 5 DHBDMO CC[C@@]1(C)CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000534107171 1040720248 /nfs/dbraw/zinc/72/02/48/1040720248.db2.gz MIZHCNYHHYSUGH-KRWDZBQOSA-N 1 1 315.373 3.872 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2cccnc2)C1 ZINC000602852129 1041260451 /nfs/dbraw/zinc/26/04/51/1041260451.db2.gz CPMDOLVEWLGXOS-ZBFHGGJFSA-N 1 1 311.385 3.930 20 5 DHBDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000093317018 193230211 /nfs/dbraw/zinc/23/02/11/193230211.db2.gz PZWYHAGZBCAPGU-INIZCTEOSA-N 1 1 306.406 3.684 20 5 DHBDMO COc1ccc(C[N@@H+](C)C2CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000286951546 131257354 /nfs/dbraw/zinc/25/73/54/131257354.db2.gz MQEWBRTWHMIGFI-UHFFFAOYSA-N 1 1 314.332 3.613 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1CCC(F)(F)CC1 ZINC000286957386 131257770 /nfs/dbraw/zinc/25/77/70/131257770.db2.gz MZRPWDPGQBCRDL-UHFFFAOYSA-N 1 1 314.332 3.613 20 5 DHBDMO CC(C)c1ccc(CNCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000518763443 333006958 /nfs/dbraw/zinc/00/69/58/333006958.db2.gz LJPDSAPKHZKGCG-HNNXBMFYSA-N 1 1 319.449 3.682 20 5 DHBDMO CC(C)c1ccc(CNCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000518763443 333006959 /nfs/dbraw/zinc/00/69/59/333006959.db2.gz LJPDSAPKHZKGCG-HNNXBMFYSA-N 1 1 319.449 3.682 20 5 DHBDMO Cc1cc(N[C@@H]2CC[N@@H+](CC3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000462933917 333132419 /nfs/dbraw/zinc/13/24/19/333132419.db2.gz YCEIEUOJMIBNMK-MRXNPFEDSA-N 1 1 303.406 3.580 20 5 DHBDMO CC[C@H]([NH2+]Cc1cn2cc(C)ccc2n1)c1cccc([N+](=O)[O-])c1 ZINC000178726444 333143108 /nfs/dbraw/zinc/14/31/08/333143108.db2.gz IKBTWLFUKYPCHB-KRWDZBQOSA-N 1 1 324.384 3.792 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000582035753 333177048 /nfs/dbraw/zinc/17/70/48/333177048.db2.gz UONCBIKJVLJSQE-CYBMUJFWSA-N 1 1 316.405 3.675 20 5 DHBDMO COc1ccc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000531378410 333347579 /nfs/dbraw/zinc/34/75/79/333347579.db2.gz ITQGUHQGJULZMN-SCLBCKFNSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1ccc(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000531378410 333347581 /nfs/dbraw/zinc/34/75/81/333347581.db2.gz ITQGUHQGJULZMN-SCLBCKFNSA-N 1 1 312.369 3.796 20 5 DHBDMO CC(C)c1ccc(C[NH2+]C[C@@H](N)c2ccccc2)cc1[N+](=O)[O-] ZINC000414830919 334110502 /nfs/dbraw/zinc/11/05/02/334110502.db2.gz MNIYYFLOEIYQRT-QGZVFWFLSA-N 1 1 313.401 3.508 20 5 DHBDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1(N)CCCCCC1 ZINC000414857414 334130437 /nfs/dbraw/zinc/13/04/37/334130437.db2.gz DDZDPVGMVAFWTJ-OAHLLOKOSA-N 1 1 319.449 3.557 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3ccc(O)cc3)CC2)cs1 ZINC000298755466 334251163 /nfs/dbraw/zinc/25/11/63/334251163.db2.gz PBNZWOQLWQJXIK-UHFFFAOYSA-N 1 1 318.398 3.742 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)[N@@H+]1CCC[C@H](C)C1 ZINC000531937944 334295751 /nfs/dbraw/zinc/29/57/51/334295751.db2.gz ZFLMOJVPHOXSIH-IMJJTQAJSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000531937944 334295752 /nfs/dbraw/zinc/29/57/52/334295752.db2.gz ZFLMOJVPHOXSIH-IMJJTQAJSA-N 1 1 319.449 3.674 20 5 DHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534841852 334339351 /nfs/dbraw/zinc/33/93/51/334339351.db2.gz GAINNTTUHMWVAK-IUODEOHRSA-N 1 1 315.373 3.870 20 5 DHBDMO CCCCCn1cc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c(C)n1 ZINC000348389721 335583204 /nfs/dbraw/zinc/58/32/04/335583204.db2.gz HWEHXQILHACBKT-UHFFFAOYSA-N 1 1 316.405 3.580 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)(C)C1 ZINC000332107744 336159195 /nfs/dbraw/zinc/15/91/95/336159195.db2.gz FOVDPPXKGKMWES-GFCCVEGCSA-N 1 1 315.373 3.870 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](c3nccs3)C2)c(F)c1 ZINC000332360535 336169639 /nfs/dbraw/zinc/16/96/39/336169639.db2.gz UXZYFUBOUPYXSK-LBPRGKRZSA-N 1 1 321.377 3.570 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nccs3)C2)c(F)c1 ZINC000332360535 336169641 /nfs/dbraw/zinc/16/96/41/336169641.db2.gz UXZYFUBOUPYXSK-LBPRGKRZSA-N 1 1 321.377 3.570 20 5 DHBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C2 ZINC000352447696 336219493 /nfs/dbraw/zinc/21/94/93/336219493.db2.gz NMYLHDMIJLMSFC-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1ccccc1[N+](=O)[O-])C2 ZINC000352447696 336219494 /nfs/dbraw/zinc/21/94/94/336219494.db2.gz NMYLHDMIJLMSFC-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000352546540 336223889 /nfs/dbraw/zinc/22/38/89/336223889.db2.gz WRBFQRBAVPKMGZ-MAUKXSAKSA-N 1 1 318.417 3.857 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000352609495 336226815 /nfs/dbraw/zinc/22/68/15/336226815.db2.gz UGVJMSDOWOHXDO-OCCSQVGLSA-N 1 1 312.410 3.840 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cscc1C(F)(F)F ZINC000352834117 336271205 /nfs/dbraw/zinc/27/12/05/336271205.db2.gz KQGJYYGRVRLQBV-UHFFFAOYSA-N 1 1 316.304 3.965 20 5 DHBDMO CCC[C@@H](NCCC[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000192925927 336284550 /nfs/dbraw/zinc/28/45/50/336284550.db2.gz JLAVSSWNVFNOPU-QGZVFWFLSA-N 1 1 305.422 3.512 20 5 DHBDMO CC[C@H](NC1CC(C)(C)[NH2+]C(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000193024328 336287193 /nfs/dbraw/zinc/28/71/93/336287193.db2.gz IJVCUMLBGMCEFJ-INIZCTEOSA-N 1 1 319.449 3.945 20 5 DHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])cc1F ZINC000301104097 336290269 /nfs/dbraw/zinc/29/02/69/336290269.db2.gz PFQQCCULEWGDFN-ZDUSSCGKSA-N 1 1 309.385 3.800 20 5 DHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC000301842162 336333640 /nfs/dbraw/zinc/33/36/40/336333640.db2.gz QBKOTKDIDHLHIL-SJORKVTESA-N 1 1 315.348 3.591 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000301879372 336335766 /nfs/dbraw/zinc/33/57/66/336335766.db2.gz ZIQZGYVUKFOQPI-RDJZCZTQSA-N 1 1 315.348 3.591 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 ZINC000301986409 336341470 /nfs/dbraw/zinc/34/14/70/336341470.db2.gz MHQRJUSWOJJNMQ-CVEARBPZSA-N 1 1 317.433 3.686 20 5 DHBDMO CSc1cccc(F)c1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000352914834 336380281 /nfs/dbraw/zinc/38/02/81/336380281.db2.gz MOLBNJGYVWDFBM-UHFFFAOYSA-N 1 1 306.362 3.746 20 5 DHBDMO C[C@@H]([NH2+]C[C@@]1(N(C)C)CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000320902645 336384309 /nfs/dbraw/zinc/38/43/09/336384309.db2.gz ZWJUVKCGXBSNIP-IIDMSEBBSA-N 1 1 319.449 3.756 20 5 DHBDMO CC(C)(C)OC1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000119128820 336880603 /nfs/dbraw/zinc/88/06/03/336880603.db2.gz UCWOHZZHTYRTHC-UHFFFAOYSA-N 1 1 310.369 3.513 20 5 DHBDMO C[C@@H]1[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCC12CCOCC2 ZINC000375240401 337006489 /nfs/dbraw/zinc/00/64/89/337006489.db2.gz XDMVVTICNBDFMQ-LBPRGKRZSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC4(CCCC4)C3)nc2c1 ZINC000177162983 337154574 /nfs/dbraw/zinc/15/45/74/337154574.db2.gz BNQRNNLHDCIWHE-UHFFFAOYSA-N 1 1 301.346 3.502 20 5 DHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cccnc1 ZINC000182032963 337185780 /nfs/dbraw/zinc/18/57/80/337185780.db2.gz HFUVBUGLVDBFLP-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cccnc1 ZINC000182032963 337185781 /nfs/dbraw/zinc/18/57/81/337185781.db2.gz HFUVBUGLVDBFLP-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccccc1N(C)C ZINC000515919211 338001171 /nfs/dbraw/zinc/00/11/71/338001171.db2.gz DRFGGRREDNIHFH-UHFFFAOYSA-N 1 1 313.401 3.601 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H]4CCC[C@H]43)co2)cc1 ZINC000426473123 338033320 /nfs/dbraw/zinc/03/33/20/338033320.db2.gz QNAQDRQHPIIIJQ-MLGOLLRUSA-N 1 1 313.357 3.624 20 5 DHBDMO CCOC1(C)CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000428726264 338059697 /nfs/dbraw/zinc/05/96/97/338059697.db2.gz UJTBVZFAGYBBEB-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429137308 338071559 /nfs/dbraw/zinc/07/15/59/338071559.db2.gz SANBMMFFUGSSTJ-KGLIPLIRSA-N 1 1 312.369 3.939 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429137308 338071560 /nfs/dbraw/zinc/07/15/60/338071560.db2.gz SANBMMFFUGSSTJ-KGLIPLIRSA-N 1 1 312.369 3.939 20 5 DHBDMO C[C@]12CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000430081239 338095140 /nfs/dbraw/zinc/09/51/40/338095140.db2.gz AIWQFXLRESIBJL-WBNAFJIESA-N 1 1 308.328 3.585 20 5 DHBDMO C[C@]12CC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000430081233 338095146 /nfs/dbraw/zinc/09/51/46/338095146.db2.gz AIWQFXLRESIBJL-VASHYATMSA-N 1 1 308.328 3.585 20 5 DHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430194301 338100636 /nfs/dbraw/zinc/10/06/36/338100636.db2.gz JANFDLOJAOSNNS-GFCCVEGCSA-N 1 1 312.435 3.567 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000430195636 338100827 /nfs/dbraw/zinc/10/08/27/338100827.db2.gz OTLASCBJXPDPHU-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000430195636 338100828 /nfs/dbraw/zinc/10/08/28/338100828.db2.gz OTLASCBJXPDPHU-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO Cc1csc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433168939 338183955 /nfs/dbraw/zinc/18/39/55/338183955.db2.gz OXOMDVHELBFTOI-CQSZACIVSA-N 1 1 317.414 3.872 20 5 DHBDMO CC[C@@H](C)[N@@H+](C)CCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433173668 338183968 /nfs/dbraw/zinc/18/39/68/338183968.db2.gz HHFGUQJOBHWFIP-DYVFJYSZSA-N 1 1 319.449 3.637 20 5 DHBDMO CC[C@@H](C)N(C)CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433173668 338183969 /nfs/dbraw/zinc/18/39/69/338183969.db2.gz HHFGUQJOBHWFIP-DYVFJYSZSA-N 1 1 319.449 3.637 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC000434674179 338222939 /nfs/dbraw/zinc/22/29/39/338222939.db2.gz HSBIQCKKYDZZHI-UHFFFAOYSA-N 1 1 314.838 3.966 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]2C2CCCC2)c([N+](=O)[O-])cc1F ZINC000463482210 339119346 /nfs/dbraw/zinc/11/93/46/339119346.db2.gz AOGWGQSOLRMXLY-OAHLLOKOSA-N 1 1 322.380 3.897 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000464499012 339143584 /nfs/dbraw/zinc/14/35/84/339143584.db2.gz LRNNUIQHHPLEFE-WHOFXGATSA-N 1 1 322.380 3.753 20 5 DHBDMO COc1cc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000464678514 339148449 /nfs/dbraw/zinc/14/84/49/339148449.db2.gz PMWBRAYMBBPFNP-LALPHHSUSA-N 1 1 322.380 3.896 20 5 DHBDMO COc1cc(C[N@H+]2CCC3(C2)CCCCC3)c([N+](=O)[O-])cc1F ZINC000464692538 339148995 /nfs/dbraw/zinc/14/89/95/339148995.db2.gz QHWOBBIPBVBGJR-UHFFFAOYSA-N 1 1 322.380 3.899 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464772983 339152306 /nfs/dbraw/zinc/15/23/06/339152306.db2.gz KBLWHFQBFBNGSD-HZPDHXFCSA-N 1 1 308.447 3.743 20 5 DHBDMO C[C@@H](NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467836859 339247260 /nfs/dbraw/zinc/24/72/60/339247260.db2.gz TUCXCLVKMDNFII-OWCLPIDISA-N 1 1 319.449 3.613 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1ccccc1F)C1CC1 ZINC000469900227 339304237 /nfs/dbraw/zinc/30/42/37/339304237.db2.gz VAZQHMZZPGDMKV-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCc1ccccn1 ZINC000470202921 339314242 /nfs/dbraw/zinc/31/42/42/339314242.db2.gz NFLSQUPQGNRTCU-NTCAYCPXSA-N 1 1 311.385 3.568 20 5 DHBDMO COC[C@H]1CCCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470209063 339314281 /nfs/dbraw/zinc/31/42/81/339314281.db2.gz XDWUXCRIXQEFPE-OBHPCNEJSA-N 1 1 318.417 3.747 20 5 DHBDMO Cc1c(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000470956267 339332801 /nfs/dbraw/zinc/33/28/01/339332801.db2.gz BJKKQINTAZCMGG-CMPLNLGQSA-N 1 1 302.296 3.676 20 5 DHBDMO C[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000471049525 339335830 /nfs/dbraw/zinc/33/58/30/339335830.db2.gz ZMAYKIHXMHJEGL-KDOFPFPSSA-N 1 1 312.369 3.667 20 5 DHBDMO CCCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)c1ccccc1 ZINC000472253907 339367783 /nfs/dbraw/zinc/36/77/83/339367783.db2.gz CSKKHBUJUXRKCM-HNNXBMFYSA-N 1 1 316.405 3.655 20 5 DHBDMO C[N@@H+](CCCOc1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000501804380 340089179 /nfs/dbraw/zinc/08/91/79/340089179.db2.gz KFKJVBYQYPBWSI-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO CCc1cccc(OCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000501834505 340089555 /nfs/dbraw/zinc/08/95/55/340089555.db2.gz XPYAGUNGVNYJOD-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO CCc1cccc(OCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000501834505 340089556 /nfs/dbraw/zinc/08/95/56/340089556.db2.gz XPYAGUNGVNYJOD-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCOc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000506163574 340187279 /nfs/dbraw/zinc/18/72/79/340187279.db2.gz LBKMWIMMIIZCLA-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO CC(C)C[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000506453552 340194893 /nfs/dbraw/zinc/19/48/93/340194893.db2.gz UILOCQOCNLVYDU-UHFFFAOYSA-N 1 1 305.403 3.806 20 5 DHBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000512317502 340356864 /nfs/dbraw/zinc/35/68/64/340356864.db2.gz CDDRTFYTLAQSPP-OAHLLOKOSA-N 1 1 314.360 3.723 20 5 DHBDMO COc1ccc(C[NH2+]Cc2ccc(Cl)cc2F)cc1[N+](=O)[O-] ZINC000189189021 340529128 /nfs/dbraw/zinc/52/91/28/340529128.db2.gz MXIXTFHFLOEBPV-UHFFFAOYSA-N 1 1 324.739 3.686 20 5 DHBDMO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC000542928689 341026563 /nfs/dbraw/zinc/02/65/63/341026563.db2.gz VCJLTDDZBNYUDY-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC000542928689 341026564 /nfs/dbraw/zinc/02/65/64/341026564.db2.gz VCJLTDDZBNYUDY-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO CCC[C@H](NC[C@@H](C)[N@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000130989117 341055730 /nfs/dbraw/zinc/05/57/30/341055730.db2.gz FQQSYOPEULHBMI-DYVFJYSZSA-N 1 1 305.422 3.508 20 5 DHBDMO CCC[C@H](NC[C@@H](C)[N@@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000130989117 341055731 /nfs/dbraw/zinc/05/57/31/341055731.db2.gz FQQSYOPEULHBMI-DYVFJYSZSA-N 1 1 305.422 3.508 20 5 DHBDMO CCC(CC)[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])C1CC1 ZINC000545918703 341146115 /nfs/dbraw/zinc/14/61/15/341146115.db2.gz MTLDFKAZXWZYFG-UHFFFAOYSA-N 1 1 310.369 3.896 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1COc2ccc(F)cc21 ZINC000546649188 341177162 /nfs/dbraw/zinc/17/71/62/341177162.db2.gz MLMNJYXIZHDAAR-BDJLRTHQSA-N 1 1 316.332 3.827 20 5 DHBDMO C[N@@H+](CCCOCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000546691957 341179084 /nfs/dbraw/zinc/17/90/84/341179084.db2.gz HLKOEXWLJJJGPH-UHFFFAOYSA-N 1 1 314.385 3.634 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000245516662 341298745 /nfs/dbraw/zinc/29/87/45/341298745.db2.gz FZQDLUUTFKHVGV-MPGHIAIKSA-N 1 1 318.417 3.591 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](c3ccccc3F)C2)cc1 ZINC000550211409 341312508 /nfs/dbraw/zinc/31/25/08/341312508.db2.gz INCOZMQOVLVTEG-HNNXBMFYSA-N 1 1 314.360 3.766 20 5 DHBDMO CCOC[C@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245530238 520171986 /nfs/dbraw/zinc/17/19/86/520171986.db2.gz SHLXBTAPFVQNBG-CABCVRRESA-N 1 1 306.406 3.713 20 5 DHBDMO CCOC1CC2(C1)CC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000367603813 521654427 /nfs/dbraw/zinc/65/44/27/521654427.db2.gz OOKPNDMOVRBMLU-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO CCOC1CC2(C1)CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000367603813 521654431 /nfs/dbraw/zinc/65/44/31/521654431.db2.gz OOKPNDMOVRBMLU-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO CCc1noc(C)c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000163124264 522835536 /nfs/dbraw/zinc/83/55/36/522835536.db2.gz VJKRFUVQXXCYDI-UHFFFAOYSA-N 1 1 317.389 3.864 20 5 DHBDMO CCc1noc(C)c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000163124264 522835543 /nfs/dbraw/zinc/83/55/43/522835543.db2.gz VJKRFUVQXXCYDI-UHFFFAOYSA-N 1 1 317.389 3.864 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCCC2 ZINC000130240038 525449975 /nfs/dbraw/zinc/44/99/75/525449975.db2.gz CURPVHLQCBVMIW-NSHDSACASA-N 1 1 317.414 3.781 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccncc1F ZINC000338018983 525640310 /nfs/dbraw/zinc/64/03/10/525640310.db2.gz GBUVXPXQIOKAGC-PIGZYNQJSA-N 1 1 315.348 3.857 20 5 DHBDMO Cc1csc([C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C2CC2)n1 ZINC000181590282 526416159 /nfs/dbraw/zinc/41/61/59/526416159.db2.gz IOUCNHCGFGTEJV-HNNXBMFYSA-N 1 1 317.414 3.909 20 5 DHBDMO Cc1ncc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000182662663 527251960 /nfs/dbraw/zinc/25/19/60/527251960.db2.gz BLYASDJPFJNTIX-NSHDSACASA-N 1 1 305.403 3.861 20 5 DHBDMO Cc1ncc(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000182662663 527251964 /nfs/dbraw/zinc/25/19/64/527251964.db2.gz BLYASDJPFJNTIX-NSHDSACASA-N 1 1 305.403 3.861 20 5 DHBDMO CCOC1CC2(C1)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000285362557 535398124 /nfs/dbraw/zinc/39/81/24/535398124.db2.gz BJWXJVBPQFVAKM-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO C[N@H+]1C[C@H]2C[C@@H](C1)N2C(=O)c1c2ccccc2cc2ccccc21 ZINC001270376672 1013112554 /nfs/dbraw/zinc/11/25/54/1013112554.db2.gz JAQDBTKGAUNDHD-CALCHBBNSA-N 1 1 316.404 3.522 20 5 DHBDMO C[N@@H+]1C[C@H]2C[C@@H](C1)N2C(=O)c1c2ccccc2cc2ccccc21 ZINC001270376672 1013112558 /nfs/dbraw/zinc/11/25/58/1013112558.db2.gz JAQDBTKGAUNDHD-CALCHBBNSA-N 1 1 316.404 3.522 20 5 DHBDMO CC[C@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000247044734 1013323319 /nfs/dbraw/zinc/32/33/19/1013323319.db2.gz LWCNOHFBPNOSBP-UXLLHSPISA-N 1 1 305.422 3.508 20 5 DHBDMO CSc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000894739513 1013474467 /nfs/dbraw/zinc/47/44/67/1013474467.db2.gz OMWULWOGUXWJQM-UHFFFAOYSA-N 1 1 306.387 3.584 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2nc3c(ccc4ccccc43)nc2Cl)C1 ZINC001167275582 1013492879 /nfs/dbraw/zinc/49/28/79/1013492879.db2.gz SWZXZXOFVQGTMO-LBPRGKRZSA-N 1 1 312.804 3.552 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000729481527 1013634505 /nfs/dbraw/zinc/63/45/05/1013634505.db2.gz TYCNWGLFUCHHHQ-CYBMUJFWSA-N 1 1 318.323 3.863 20 5 DHBDMO C[C@H]1c2ccc(F)cc2CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000610003972 1013843514 /nfs/dbraw/zinc/84/35/14/1013843514.db2.gz UZCQUBGDQMGCAO-ZDUSSCGKSA-N 1 1 314.360 3.896 20 5 DHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccc(F)cc21 ZINC000177684025 1013977782 /nfs/dbraw/zinc/97/77/82/1013977782.db2.gz NIGMKMADMISVOH-QGZVFWFLSA-N 1 1 300.333 3.853 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccc(F)cc21 ZINC000177684025 1013977784 /nfs/dbraw/zinc/97/77/84/1013977784.db2.gz NIGMKMADMISVOH-QGZVFWFLSA-N 1 1 300.333 3.853 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000580802738 1014356286 /nfs/dbraw/zinc/35/62/86/1014356286.db2.gz OYXZRLTZQHDGRC-XKQJLSEDSA-N 1 1 318.417 3.854 20 5 DHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000025942604 1014465978 /nfs/dbraw/zinc/46/59/78/1014465978.db2.gz NOOFFUZQHJEROU-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1C ZINC000059384424 1014581506 /nfs/dbraw/zinc/58/15/06/1014581506.db2.gz ISKDSFPNNZXBKD-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2c2ccsc2)cc1 ZINC000521477612 1014708134 /nfs/dbraw/zinc/70/81/34/1014708134.db2.gz QMGAZWGUDADLTN-INIZCTEOSA-N 1 1 318.398 3.872 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@H]3CCc4c3cccc4[N+](=O)[O-])nc2c1 ZINC000581380054 1014752940 /nfs/dbraw/zinc/75/29/40/1014752940.db2.gz GNZRMXWLIKCEFA-AWEZNQCLSA-N 1 1 322.368 3.557 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@H]3CCc4c3cccc4[N+](=O)[O-])[nH]c2c1 ZINC000581380054 1014752948 /nfs/dbraw/zinc/75/29/48/1014752948.db2.gz GNZRMXWLIKCEFA-AWEZNQCLSA-N 1 1 322.368 3.557 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cccc(Cl)c1 ZINC000522268277 1014992399 /nfs/dbraw/zinc/99/23/99/1014992399.db2.gz QUPNHKNEDFRNFD-UHFFFAOYSA-N 1 1 304.777 3.923 20 5 DHBDMO Cc1c(C[N@H+](C)[C@H](C)Cc2ccc(O)cc2)cccc1[N+](=O)[O-] ZINC000119406877 1015038521 /nfs/dbraw/zinc/03/85/21/1015038521.db2.gz QGFLHXKYXKUYOO-CYBMUJFWSA-N 1 1 314.385 3.672 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000076416452 1015150497 /nfs/dbraw/zinc/15/04/97/1015150497.db2.gz XIRVZHIVXIVFJR-ZDUSSCGKSA-N 1 1 322.405 3.710 20 5 DHBDMO CC(C)[N@H+]1CC[C@@H](Oc2cc(Cl)c(Cl)cc2[N+](=O)[O-])C1 ZINC001227125998 1015501746 /nfs/dbraw/zinc/50/17/46/1015501746.db2.gz OACUBOPXWVGMKE-SECBINFHSA-N 1 1 319.188 3.763 20 5 DHBDMO COc1cccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000051324166 1015576282 /nfs/dbraw/zinc/57/62/82/1015576282.db2.gz XZWJOLUOVUHHAR-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO CCOc1cc(C[N@H+](C)[C@H](C)c2ccccn2)ccc1[N+](=O)[O-] ZINC000276979563 1015790644 /nfs/dbraw/zinc/79/06/44/1015790644.db2.gz YEDJAUIRDCEXAG-CYBMUJFWSA-N 1 1 315.373 3.582 20 5 DHBDMO CCOc1cc(C[N@@H+](C)[C@H](C)c2ccccn2)ccc1[N+](=O)[O-] ZINC000276979563 1015790648 /nfs/dbraw/zinc/79/06/48/1015790648.db2.gz YEDJAUIRDCEXAG-CYBMUJFWSA-N 1 1 315.373 3.582 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCc2ccsc2C1 ZINC000127048735 1015802394 /nfs/dbraw/zinc/80/23/94/1015802394.db2.gz KDSAGPPIJYNMFT-HWKANZROSA-N 1 1 300.383 3.728 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCc2ccsc2C1 ZINC000127048735 1015802405 /nfs/dbraw/zinc/80/24/05/1015802405.db2.gz KDSAGPPIJYNMFT-HWKANZROSA-N 1 1 300.383 3.728 20 5 DHBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000119446588 1016073666 /nfs/dbraw/zinc/07/36/66/1016073666.db2.gz GVEGDLSVQJQWTB-GFCCVEGCSA-N 1 1 318.348 3.503 20 5 DHBDMO C[C@H]([NH2+]C[C@@]1(N(C)C)CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000320290610 1016077681 /nfs/dbraw/zinc/07/76/81/1016077681.db2.gz YOUKQHJLCQKCGT-RVKKMQEKSA-N 1 1 319.449 3.756 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2c2ccccc2)cc1 ZINC000065532641 1016201740 /nfs/dbraw/zinc/20/17/40/1016201740.db2.gz DCKWWVUVIUSLLL-GOSISDBHSA-N 1 1 312.369 3.811 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1ccccc1)C1CC1 ZINC000071950243 1016276047 /nfs/dbraw/zinc/27/60/47/1016276047.db2.gz WJZJRJVOEPTMNE-UHFFFAOYSA-N 1 1 312.369 3.638 20 5 DHBDMO O=[N+]([O-])c1ccc(CN2C[C@@H]3CCC[N@H+]3Cc3ccccc32)cc1 ZINC000342512310 1016640031 /nfs/dbraw/zinc/64/00/31/1016640031.db2.gz XZXHMQHWFJBSJM-SFHVURJKSA-N 1 1 323.396 3.579 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000897070736 1017031580 /nfs/dbraw/zinc/03/15/80/1017031580.db2.gz NLNZQNQOPFZMJW-CQSZACIVSA-N 1 1 317.776 3.810 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cs1 ZINC000537624090 1032327902 /nfs/dbraw/zinc/32/79/02/1032327902.db2.gz SXXMZCGAXDEHKN-ZDUSSCGKSA-N 1 1 320.389 3.860 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1ccc(C(=O)CC)cc1[N+](=O)[O-] ZINC000579783745 1012120625 /nfs/dbraw/zinc/12/06/25/1012120625.db2.gz ZZBYNYWPHHWEMC-CYBMUJFWSA-N 1 1 321.421 3.720 20 5 DHBDMO CC(C)n1cncc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000425328793 1012451889 /nfs/dbraw/zinc/45/18/89/1012451889.db2.gz RXTZMXSSLDYEEM-UHFFFAOYSA-N 1 1 316.405 3.783 20 5 DHBDMO CC(C)n1cncc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000425328793 1012451896 /nfs/dbraw/zinc/45/18/96/1012451896.db2.gz RXTZMXSSLDYEEM-UHFFFAOYSA-N 1 1 316.405 3.783 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)NC/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000515096548 1012556026 /nfs/dbraw/zinc/55/60/26/1012556026.db2.gz NSCWIVYEDKMSFP-RBFDBLARSA-N 1 1 319.449 3.708 20 5 DHBDMO CCCN(CC)C[C@@H](C)[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000515096548 1012556041 /nfs/dbraw/zinc/55/60/41/1012556041.db2.gz NSCWIVYEDKMSFP-RBFDBLARSA-N 1 1 319.449 3.708 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000515184686 1012570082 /nfs/dbraw/zinc/57/00/82/1012570082.db2.gz IJPCXCGUVFJWTL-GOEBONIOSA-N 1 1 318.417 3.713 20 5 DHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444651435 1017606207 /nfs/dbraw/zinc/60/62/07/1017606207.db2.gz VFZOYRLTQVVBCV-MLGOLLRUSA-N 1 1 316.405 3.872 20 5 DHBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444686853 1017614633 /nfs/dbraw/zinc/61/46/33/1017614633.db2.gz UHSZBRBWSILBPI-LRDDRELGSA-N 1 1 316.405 3.872 20 5 DHBDMO CC[C@@H](NC[C@H]1CCC[N@@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125910439 1032724478 /nfs/dbraw/zinc/72/44/78/1032724478.db2.gz QEVPBCUAWFOHBF-CRAIPNDOSA-N 1 1 319.449 3.756 20 5 DHBDMO CC[C@@H](NC[C@H]1CCC[N@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125910439 1032724486 /nfs/dbraw/zinc/72/44/86/1032724486.db2.gz QEVPBCUAWFOHBF-CRAIPNDOSA-N 1 1 319.449 3.756 20 5 DHBDMO Cc1cc(C)cc(C[N@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)c1 ZINC000766089895 1018230004 /nfs/dbraw/zinc/23/00/04/1018230004.db2.gz DMFIGKOEYXVUTK-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1cc(C)cc(C[N@@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)c1 ZINC000766089895 1018230018 /nfs/dbraw/zinc/23/00/18/1018230018.db2.gz DMFIGKOEYXVUTK-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCSc1ccccc1)CC2 ZINC000446737166 1018238326 /nfs/dbraw/zinc/23/83/26/1018238326.db2.gz UBPLGZUVANJRCZ-UHFFFAOYSA-N 1 1 314.410 3.745 20 5 DHBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000447389607 1018387596 /nfs/dbraw/zinc/38/75/96/1018387596.db2.gz ZPNWYZIVPIYAMI-QGZVFWFLSA-N 1 1 306.406 3.684 20 5 DHBDMO Cc1nn(C[N@@H+]2CC[C@@H](C)C3(CCCCC3)C2)c(C)c1[N+](=O)[O-] ZINC000764956260 1018435948 /nfs/dbraw/zinc/43/59/48/1018435948.db2.gz SCRSHJZSYUQVGZ-CYBMUJFWSA-N 1 1 320.437 3.658 20 5 DHBDMO CC[C@@H](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2 ZINC001168695075 1019098614 /nfs/dbraw/zinc/09/86/14/1019098614.db2.gz SSSQQGQWBSWMEX-CHWSQXEVSA-N 1 1 305.422 3.819 20 5 DHBDMO CC[C@@H](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2 ZINC001168695075 1019098626 /nfs/dbraw/zinc/09/86/26/1019098626.db2.gz SSSQQGQWBSWMEX-CHWSQXEVSA-N 1 1 305.422 3.819 20 5 DHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCOc2ccccc21 ZINC000611254773 1019422308 /nfs/dbraw/zinc/42/23/08/1019422308.db2.gz SBVWNGKVXOKNFK-CQSZACIVSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])s2)C1 ZINC000611509694 1019506391 /nfs/dbraw/zinc/50/63/91/1019506391.db2.gz FOHRZCDVJDHIDK-KBPBESRZSA-N 1 1 323.462 3.747 20 5 DHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccsc2[N+](=O)[O-])C1 ZINC000611509747 1019507251 /nfs/dbraw/zinc/50/72/51/1019507251.db2.gz ZQWUEZZHERODBW-UONOGXRCSA-N 1 1 323.462 3.747 20 5 DHBDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000611554732 1019514365 /nfs/dbraw/zinc/51/43/65/1019514365.db2.gz XEZLUECIXDSFET-CMPLNLGQSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000611554732 1019514376 /nfs/dbraw/zinc/51/43/76/1019514376.db2.gz XEZLUECIXDSFET-CMPLNLGQSA-N 1 1 302.296 3.758 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000370671222 1019712774 /nfs/dbraw/zinc/71/27/74/1019712774.db2.gz OPRITEJKMGTBPS-BQFCYCMXSA-N 1 1 317.433 3.652 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000370671222 1019712788 /nfs/dbraw/zinc/71/27/88/1019712788.db2.gz OPRITEJKMGTBPS-BQFCYCMXSA-N 1 1 317.433 3.652 20 5 DHBDMO CCc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000347597959 1019764113 /nfs/dbraw/zinc/76/41/13/1019764113.db2.gz XBPBJGSFKXTMLT-UHFFFAOYSA-N 1 1 311.385 3.717 20 5 DHBDMO CCc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000347597959 1019764129 /nfs/dbraw/zinc/76/41/29/1019764129.db2.gz XBPBJGSFKXTMLT-UHFFFAOYSA-N 1 1 311.385 3.717 20 5 DHBDMO CC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000315020243 1019778102 /nfs/dbraw/zinc/77/81/02/1019778102.db2.gz YMSMTZKYGVAJAN-NSHDSACASA-N 1 1 317.311 3.510 20 5 DHBDMO CC[C@@H](NCC[NH+]1CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000316041261 1019895476 /nfs/dbraw/zinc/89/54/76/1019895476.db2.gz GSEGMSRJTKBUMN-QGZVFWFLSA-N 1 1 305.422 3.512 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000316898510 1019945777 /nfs/dbraw/zinc/94/57/77/1019945777.db2.gz ZBNBRYCPECSUDZ-QRTARXTBSA-N 1 1 305.422 3.508 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000316898510 1019945782 /nfs/dbraw/zinc/94/57/82/1019945782.db2.gz ZBNBRYCPECSUDZ-QRTARXTBSA-N 1 1 305.422 3.508 20 5 DHBDMO C[N@@H+](CC[N+](=O)[O-])[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC001168765353 1020065197 /nfs/dbraw/zinc/06/51/97/1020065197.db2.gz INLOPDDTBCQJNY-KBPBESRZSA-N 1 1 316.323 3.550 20 5 DHBDMO CC(C)[N@H+]1CCCC[C@H]1CN[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000330668889 1020237046 /nfs/dbraw/zinc/23/70/46/1020237046.db2.gz ZLTKNTIWGCAWHQ-GJZGRUSLSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)N1CCCC[C@H]1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000330668889 1020237050 /nfs/dbraw/zinc/23/70/50/1020237050.db2.gz ZLTKNTIWGCAWHQ-GJZGRUSLSA-N 1 1 305.422 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(C(F)F)CC1 ZINC000766190602 1020302141 /nfs/dbraw/zinc/30/21/41/1020302141.db2.gz OWDVKFOYLUZNLC-UHFFFAOYSA-N 1 1 304.724 3.725 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000281047500 1020322797 /nfs/dbraw/zinc/32/27/97/1020322797.db2.gz QPMUBEDPWJTLDT-NXHRZFHOSA-N 1 1 318.417 3.500 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000922878954 1020325862 /nfs/dbraw/zinc/32/58/62/1020325862.db2.gz AXMNEHFTMGJUAD-CQSZACIVSA-N 1 1 317.776 3.810 20 5 DHBDMO COC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(C)o1 ZINC000156445202 1020350882 /nfs/dbraw/zinc/35/08/82/1020350882.db2.gz ZJSZFVQMVRCHLT-UKRRQHHQSA-N 1 1 318.373 3.843 20 5 DHBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000766212604 1020688182 /nfs/dbraw/zinc/68/81/82/1020688182.db2.gz RZWRRIVXDVREQP-GFCCVEGCSA-N 1 1 318.348 3.503 20 5 DHBDMO CCCCCC[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000735791069 1020768399 /nfs/dbraw/zinc/76/83/99/1020768399.db2.gz JESNQEMMDVMPBT-UHFFFAOYSA-N 1 1 318.377 3.657 20 5 DHBDMO C[C@H]1CCCCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000738227102 1020864134 /nfs/dbraw/zinc/86/41/34/1020864134.db2.gz RGTUWVFOXZIQOD-AWEZNQCLSA-N 1 1 314.389 3.680 20 5 DHBDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000581002594 1020869168 /nfs/dbraw/zinc/86/91/68/1020869168.db2.gz GWSBYVDYIPSKCE-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO CC1(C)CC[C@@H](C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)O1 ZINC000187308200 1021187308 /nfs/dbraw/zinc/18/73/08/1021187308.db2.gz KTYYKWMLGCNKML-HNNXBMFYSA-N 1 1 304.390 3.517 20 5 DHBDMO CC1(C)CC[C@@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)O1 ZINC000187308200 1021187313 /nfs/dbraw/zinc/18/73/13/1021187313.db2.gz KTYYKWMLGCNKML-HNNXBMFYSA-N 1 1 304.390 3.517 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc2c[nH]nc21)C1CC1 ZINC000154307765 1021206147 /nfs/dbraw/zinc/20/61/47/1021206147.db2.gz WWLQRDFBOAELSI-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]12 ZINC000776277478 1021209510 /nfs/dbraw/zinc/20/95/10/1021209510.db2.gz PYLGHFCCYMCCEU-ZSGPHXLJSA-N 1 1 318.417 3.529 20 5 DHBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000743380243 1021286801 /nfs/dbraw/zinc/28/68/01/1021286801.db2.gz XLGOCNYUECXYQB-CJNGLKHVSA-N 1 1 316.405 3.803 20 5 DHBDMO Cc1nc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000618565395 1021426371 /nfs/dbraw/zinc/42/63/71/1021426371.db2.gz WGFXBJBIMBMGJW-HNNXBMFYSA-N 1 1 303.387 3.527 20 5 DHBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000007661730 1021480536 /nfs/dbraw/zinc/48/05/36/1021480536.db2.gz LCSRIWFIPBMUMR-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])s2)[C@H]1c1ccccc1 ZINC000618679585 1021484637 /nfs/dbraw/zinc/48/46/37/1021484637.db2.gz VOFOSCJTMOMLFG-SWLSCSKDSA-N 1 1 303.387 3.514 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2C[C@@H](O)c3ccccc32)c1 ZINC000850369871 1021492260 /nfs/dbraw/zinc/49/22/60/1021492260.db2.gz CAJNNVARSUUBHD-JKSUJKDBSA-N 1 1 318.760 3.516 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2C[C@@H](O)c3ccccc32)c(Cl)c1 ZINC000850371959 1021494866 /nfs/dbraw/zinc/49/48/66/1021494866.db2.gz NRAUXWOTCKTMNV-HZPDHXFCSA-N 1 1 318.760 3.516 20 5 DHBDMO Cc1nc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cs1 ZINC000618982792 1021605461 /nfs/dbraw/zinc/60/54/61/1021605461.db2.gz UXVGYNINDDTPFP-OAHLLOKOSA-N 1 1 317.414 3.872 20 5 DHBDMO COc1cccc2c1CC[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000182673645 1021765157 /nfs/dbraw/zinc/76/51/57/1021765157.db2.gz CWRVTQCQYLSTPN-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc2c1CC[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000182673645 1021765175 /nfs/dbraw/zinc/76/51/75/1021765175.db2.gz CWRVTQCQYLSTPN-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000919721976 1021869339 /nfs/dbraw/zinc/86/93/39/1021869339.db2.gz ILGQYEGLICSOQI-GUTXKFCHSA-N 1 1 321.396 3.576 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCCCO2)C1 ZINC000365705312 1021884977 /nfs/dbraw/zinc/88/49/77/1021884977.db2.gz PMIGIWMMBSICOL-YOEHRIQHSA-N 1 1 304.390 3.691 20 5 DHBDMO C[N@@H+](CCCc1cccc(F)c1)CCc1cccc([N+](=O)[O-])c1 ZINC000619785210 1021892808 /nfs/dbraw/zinc/89/28/08/1021892808.db2.gz IHGMFHIHHFNYJC-UHFFFAOYSA-N 1 1 316.376 3.841 20 5 DHBDMO COc1cc(C[NH2+][C@@H](C)c2ccsc2)c([N+](=O)[O-])cc1F ZINC000619783586 1021895021 /nfs/dbraw/zinc/89/50/21/1021895021.db2.gz SFEAZHKPBGTVGY-VIFPVBQESA-N 1 1 310.350 3.655 20 5 DHBDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000102534870 1021953281 /nfs/dbraw/zinc/95/32/81/1021953281.db2.gz VMJRUSBDUHYBGX-ZDUSSCGKSA-N 1 1 300.358 3.763 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](Cc1cccnc1)C1CC1 ZINC000290383983 1021955306 /nfs/dbraw/zinc/95/53/06/1021955306.db2.gz IHFFDSYQIAAMEJ-QPJJXVBHSA-N 1 1 309.369 3.668 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(F)n1 ZINC000851735925 1021976287 /nfs/dbraw/zinc/97/62/87/1021976287.db2.gz KYLNTEKPMDUDHX-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(F)n1 ZINC000851735925 1021976296 /nfs/dbraw/zinc/97/62/96/1021976296.db2.gz KYLNTEKPMDUDHX-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO Cc1noc(C[NH2+][C@H](C)c2csc3ccccc23)c1[N+](=O)[O-] ZINC000851930919 1022044581 /nfs/dbraw/zinc/04/45/81/1022044581.db2.gz HAHJBASWATYNNF-SECBINFHSA-N 1 1 317.370 3.957 20 5 DHBDMO CCCCC[C@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587922 1022101994 /nfs/dbraw/zinc/10/19/94/1022101994.db2.gz ZMYPCGMBHYZMJH-RDJZCZTQSA-N 1 1 306.406 3.673 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC3CC2(c2ccccc2)C3)cc1F ZINC000852761277 1022174909 /nfs/dbraw/zinc/17/49/09/1022174909.db2.gz JGXVACVZJBLPPX-UHFFFAOYSA-N 1 1 312.344 3.855 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3CC2(c2ccccc2)C3)cc1F ZINC000852761277 1022174911 /nfs/dbraw/zinc/17/49/11/1022174911.db2.gz JGXVACVZJBLPPX-UHFFFAOYSA-N 1 1 312.344 3.855 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H]2c2cc(F)ccc2F)C1 ZINC001169038486 1022222863 /nfs/dbraw/zinc/22/28/63/1022222863.db2.gz ZDQDLMOLRKYMBW-FFSVYQOJSA-N 1 1 310.344 3.547 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H]2c2cccc(Cl)c2)C1 ZINC001169041158 1022223966 /nfs/dbraw/zinc/22/39/66/1022223966.db2.gz BCDHREXMOVGFAQ-WQVCFCJDSA-N 1 1 308.809 3.922 20 5 DHBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2c2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000853522626 1022286952 /nfs/dbraw/zinc/28/69/52/1022286952.db2.gz NUJRZZUMMVMMPI-OAHLLOKOSA-N 1 1 314.389 3.511 20 5 DHBDMO Cc1nn(C[N@H+]2CCC[C@@H]2c2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000853522626 1022286954 /nfs/dbraw/zinc/28/69/54/1022286954.db2.gz NUJRZZUMMVMMPI-OAHLLOKOSA-N 1 1 314.389 3.511 20 5 DHBDMO Cc1ccc([C@H](C)N[C@H](C)C[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000481169729 1022427982 /nfs/dbraw/zinc/42/79/82/1022427982.db2.gz FKCLYFVFWIARNR-BMFZPTHFSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([C@H](C)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000481169729 1022427991 /nfs/dbraw/zinc/42/79/91/1022427991.db2.gz FKCLYFVFWIARNR-BMFZPTHFSA-N 1 1 319.449 3.674 20 5 DHBDMO CCc1ncc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000417351213 1022694374 /nfs/dbraw/zinc/69/43/74/1022694374.db2.gz RJUPNXJPDJIWOT-INIZCTEOSA-N 1 1 315.373 3.703 20 5 DHBDMO Cc1c(C[NH2+]Cc2nc3c(s2)CCCC3)cccc1[N+](=O)[O-] ZINC000616483669 1022721896 /nfs/dbraw/zinc/72/18/96/1022721896.db2.gz ZDRHSCNIJIJTSK-UHFFFAOYSA-N 1 1 317.414 3.528 20 5 DHBDMO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCc1ccccn1 ZINC000769034451 1023073012 /nfs/dbraw/zinc/07/30/12/1023073012.db2.gz QEEBJMRXELRZEL-VQHVLOKHSA-N 1 1 311.385 3.568 20 5 DHBDMO C[C@@H]1CC[C@@H](C)[NH+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000770311423 1023296096 /nfs/dbraw/zinc/29/60/96/1023296096.db2.gz PCMWWKPTGAAWCL-NXEZZACHSA-N 1 1 313.195 3.730 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000876746506 1033135355 /nfs/dbraw/zinc/13/53/55/1033135355.db2.gz ZYCVTRIKFSMEIT-UHFFFAOYSA-N 1 1 318.417 3.604 20 5 DHBDMO C[C@H]1c2ccc(Cl)n2CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000787656098 1023808485 /nfs/dbraw/zinc/80/84/85/1023808485.db2.gz XVDHCRKQPYUWDR-LBPRGKRZSA-N 1 1 319.792 3.669 20 5 DHBDMO C[C@H]1c2ccc(Cl)n2CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000787656098 1023808489 /nfs/dbraw/zinc/80/84/89/1023808489.db2.gz XVDHCRKQPYUWDR-LBPRGKRZSA-N 1 1 319.792 3.669 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1C ZINC000788482204 1023891244 /nfs/dbraw/zinc/89/12/44/1023891244.db2.gz KADIFCYUXZIPGZ-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)c[nH]2)cc1[N+](=O)[O-] ZINC000883029458 1024216702 /nfs/dbraw/zinc/21/67/02/1024216702.db2.gz USEWKTXMRDNHRC-LBPRGKRZSA-N 1 1 302.378 3.601 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]C2CCN(C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000269060745 1024231173 /nfs/dbraw/zinc/23/11/73/1024231173.db2.gz XUAMHATXYOKKER-CQSZACIVSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c(C[NH2+][C@@H]2COc3c2cccc3Cl)cccc1[N+](=O)[O-] ZINC000790697210 1024356975 /nfs/dbraw/zinc/35/69/75/1024356975.db2.gz VWXIETMZNLEWHR-CQSZACIVSA-N 1 1 318.760 3.780 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000105503840 1024395931 /nfs/dbraw/zinc/39/59/31/1024395931.db2.gz YBYXZDFOIAICIL-ZDUSSCGKSA-N 1 1 305.403 3.909 20 5 DHBDMO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000883463693 1024439802 /nfs/dbraw/zinc/43/98/02/1024439802.db2.gz WDPFVJATGJDVSE-INIZCTEOSA-N 1 1 315.348 3.769 20 5 DHBDMO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453359683 1024480157 /nfs/dbraw/zinc/48/01/57/1024480157.db2.gz QEYKLAWEDQELLA-STQMWFEESA-N 1 1 302.378 3.531 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-] ZINC000271649555 1024556993 /nfs/dbraw/zinc/55/69/93/1024556993.db2.gz URDZWYPBPBVLOK-VXGBXAGGSA-N 1 1 315.329 3.915 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271693098 1024562571 /nfs/dbraw/zinc/56/25/71/1024562571.db2.gz FOOMSJZHCGBKDK-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)cc1[N+](=O)[O-] ZINC000585765531 1024603029 /nfs/dbraw/zinc/60/30/29/1024603029.db2.gz KRRSEBSVJOHBMF-ZDUSSCGKSA-N 1 1 324.384 3.673 20 5 DHBDMO CCCc1csc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])n1 ZINC000348675520 1024604963 /nfs/dbraw/zinc/60/49/63/1024604963.db2.gz QGPBEWYYBSCQTD-UHFFFAOYSA-N 1 1 319.430 3.678 20 5 DHBDMO CCCc1csc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])n1 ZINC000348675520 1024604970 /nfs/dbraw/zinc/60/49/70/1024604970.db2.gz QGPBEWYYBSCQTD-UHFFFAOYSA-N 1 1 319.430 3.678 20 5 DHBDMO COc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1F ZINC000182019938 1024609947 /nfs/dbraw/zinc/60/99/47/1024609947.db2.gz ZURGWIGACXOQGE-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO COC1(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)CCCC1 ZINC000792157348 1024636658 /nfs/dbraw/zinc/63/66/58/1024636658.db2.gz UVGCVCUEGCWRGZ-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cccc([N+](=O)[O-])c1)CCC2 ZINC000111310755 1024752340 /nfs/dbraw/zinc/75/23/40/1024752340.db2.gz GZNWEQZSGXLGFD-OAHLLOKOSA-N 1 1 317.414 3.869 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H]3CCC[C@H]32)c([N+](=O)[O-])c1 ZINC001170348014 1024756401 /nfs/dbraw/zinc/75/64/01/1024756401.db2.gz URYCOZBPIMDGBO-GRDNDAEWSA-N 1 1 318.417 3.799 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](C)[C@H]2C)c([N+](=O)[O-])c1 ZINC001170345737 1024757951 /nfs/dbraw/zinc/75/79/51/1024757951.db2.gz LIUYOTNIDBNINF-HZSPNIEDSA-N 1 1 306.406 3.655 20 5 DHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccn1 ZINC000350395715 1024808149 /nfs/dbraw/zinc/80/81/49/1024808149.db2.gz VGPUZYGPEMHTAP-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccn1 ZINC000350395715 1024808167 /nfs/dbraw/zinc/80/81/67/1024808167.db2.gz VGPUZYGPEMHTAP-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[C@]12CC[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]1C2(Cl)Cl ZINC000792901116 1024831369 /nfs/dbraw/zinc/83/13/69/1024831369.db2.gz KDZJWGVHEPEMCP-OLZOCXBDSA-N 1 1 315.200 3.611 20 5 DHBDMO C[C@]12CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]1C2(Cl)Cl ZINC000792901116 1024831390 /nfs/dbraw/zinc/83/13/90/1024831390.db2.gz KDZJWGVHEPEMCP-OLZOCXBDSA-N 1 1 315.200 3.611 20 5 DHBDMO CC(C)c1ccc(CN[C@@H](C)C[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000353089132 1024942634 /nfs/dbraw/zinc/94/26/34/1024942634.db2.gz DOKUFPJLCQGJDA-AWEZNQCLSA-N 1 1 307.438 3.537 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@@H](C)CN(C)C(C)C)cc1[N+](=O)[O-] ZINC000353089132 1024942641 /nfs/dbraw/zinc/94/26/41/1024942641.db2.gz DOKUFPJLCQGJDA-AWEZNQCLSA-N 1 1 307.438 3.537 20 5 DHBDMO C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1c(F)cncc1F ZINC000353148089 1024965062 /nfs/dbraw/zinc/96/50/62/1024965062.db2.gz ZJMXBPDCHSJCMQ-VLWUPBBWSA-N 1 1 319.311 3.632 20 5 DHBDMO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000353204337 1024982387 /nfs/dbraw/zinc/98/23/87/1024982387.db2.gz CAQUAFVIUCAAIH-MRXNPFEDSA-N 1 1 316.332 3.656 20 5 DHBDMO Cc1cc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c(C)s1 ZINC000353586583 1025141529 /nfs/dbraw/zinc/14/15/29/1025141529.db2.gz DTFMVYCSOKQHGN-UHFFFAOYSA-N 1 1 302.399 3.831 20 5 DHBDMO Cc1cc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c(C)s1 ZINC000353586583 1025141538 /nfs/dbraw/zinc/14/15/38/1025141538.db2.gz DTFMVYCSOKQHGN-UHFFFAOYSA-N 1 1 302.399 3.831 20 5 DHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CCCC1 ZINC000170906566 1025209638 /nfs/dbraw/zinc/20/96/38/1025209638.db2.gz QUTDUTOIJYOSCB-UHFFFAOYSA-N 1 1 315.373 3.667 20 5 DHBDMO CC[C@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000135649631 1025252204 /nfs/dbraw/zinc/25/22/04/1025252204.db2.gz CBBUSDCTEFJEFA-JTQLQIEISA-N 1 1 313.195 3.589 20 5 DHBDMO CC[C@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000135649631 1025252215 /nfs/dbraw/zinc/25/22/15/1025252215.db2.gz CBBUSDCTEFJEFA-JTQLQIEISA-N 1 1 313.195 3.589 20 5 DHBDMO C[N@H+](Cc1ccc[nH]1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000354044035 1025333871 /nfs/dbraw/zinc/33/38/71/1025333871.db2.gz DPWDQTKQNQRPLG-UHFFFAOYSA-N 1 1 311.341 3.815 20 5 DHBDMO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000354044035 1025333882 /nfs/dbraw/zinc/33/38/82/1025333882.db2.gz DPWDQTKQNQRPLG-UHFFFAOYSA-N 1 1 311.341 3.815 20 5 DHBDMO CCC[C@@H]1CCC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000354109247 1025355835 /nfs/dbraw/zinc/35/58/35/1025355835.db2.gz JNLIZMZOPZYIOG-CYBMUJFWSA-N 1 1 322.405 3.624 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](CC2CCC2)[C@@H](C)CO)cc1[N+](=O)[O-] ZINC000348355979 1025389559 /nfs/dbraw/zinc/38/95/59/1025389559.db2.gz NHCTUGLUTPHUCO-AWEZNQCLSA-N 1 1 320.433 3.701 20 5 DHBDMO CO[C@H](C)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C(C)C ZINC000354474037 1025441201 /nfs/dbraw/zinc/44/12/01/1025441201.db2.gz ZPZLVMOFNQYUGH-CQSZACIVSA-N 1 1 324.421 3.627 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000886020648 1025443946 /nfs/dbraw/zinc/44/39/46/1025443946.db2.gz FIIZWAPMVLHYGW-YOEHRIQHSA-N 1 1 311.385 3.615 20 5 DHBDMO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(Cl)cc1[N+](=O)[O-] ZINC000747211281 1025466932 /nfs/dbraw/zinc/46/69/32/1025466932.db2.gz DCGCSNDHLRWRGM-NWDGAFQWSA-N 1 1 309.797 3.595 20 5 DHBDMO CCC[N@H+](Cc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136809449 1025487790 /nfs/dbraw/zinc/48/77/90/1025487790.db2.gz CKDHVVRWQKBAMB-GOSISDBHSA-N 1 1 314.385 3.540 20 5 DHBDMO CC(C)C[C@@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000137072170 1025496590 /nfs/dbraw/zinc/49/65/90/1025496590.db2.gz ZMTLXCWCJZKRIS-RDJZCZTQSA-N 1 1 306.406 3.529 20 5 DHBDMO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1 ZINC000886106681 1025506672 /nfs/dbraw/zinc/50/66/72/1025506672.db2.gz AKSDXBNHDHHPNO-ZDUSSCGKSA-N 1 1 315.373 3.628 20 5 DHBDMO CC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC000886147384 1025531570 /nfs/dbraw/zinc/53/15/70/1025531570.db2.gz RIICUQCLRQTDNW-GFCCVEGCSA-N 1 1 305.403 3.504 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1C[C@H](c2ccccc2)C2(CCC2)C1 ZINC000886247574 1025570762 /nfs/dbraw/zinc/57/07/62/1025570762.db2.gz VFERHJQNJJICRG-QGZVFWFLSA-N 1 1 323.396 3.760 20 5 DHBDMO C[C@@H]([N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1(C)CC1 ZINC000355086914 1025601092 /nfs/dbraw/zinc/60/10/92/1025601092.db2.gz LYHLSFSZPMDZLS-SNVBAGLBSA-N 1 1 314.332 3.817 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2n1C ZINC000453228696 1025766366 /nfs/dbraw/zinc/76/63/66/1025766366.db2.gz BHTWMKYKXKQTJV-QWHCGFSZSA-N 1 1 324.384 3.893 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H]2CCC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000355580166 1025772982 /nfs/dbraw/zinc/77/29/82/1025772982.db2.gz HQLPJHVCVHYOLY-ZDUSSCGKSA-N 1 1 322.405 3.623 20 5 DHBDMO CC(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1 ZINC000355575262 1025773036 /nfs/dbraw/zinc/77/30/36/1025773036.db2.gz OXTCODZVALQSMJ-UHFFFAOYSA-N 1 1 324.384 3.882 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000355580165 1025773677 /nfs/dbraw/zinc/77/36/77/1025773677.db2.gz HQLPJHVCVHYOLY-CYBMUJFWSA-N 1 1 322.405 3.623 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccccc1 ZINC000355803070 1025846625 /nfs/dbraw/zinc/84/66/25/1025846625.db2.gz QLBLBNIJARTFAW-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccccc1 ZINC000355803070 1025846640 /nfs/dbraw/zinc/84/66/40/1025846640.db2.gz QLBLBNIJARTFAW-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO CSC1(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCC1 ZINC000356059758 1025933015 /nfs/dbraw/zinc/93/30/15/1025933015.db2.gz QYLPSGXDGIEYHO-UHFFFAOYSA-N 1 1 306.431 3.845 20 5 DHBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000453352217 1025970775 /nfs/dbraw/zinc/97/07/75/1025970775.db2.gz INXUUFMFFFKYGS-YOEHRIQHSA-N 1 1 320.458 3.745 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCOCC2(CCCC2)C1 ZINC000614253543 1025999988 /nfs/dbraw/zinc/99/99/88/1025999988.db2.gz IPZPGZLSDGNJCR-FNORWQNLSA-N 1 1 316.401 3.501 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cnc(C2CC2)o1)c1cccc([N+](=O)[O-])c1 ZINC000453355716 1026019788 /nfs/dbraw/zinc/01/97/88/1026019788.db2.gz MRCNSWJRGPCSQM-OAHLLOKOSA-N 1 1 301.346 3.701 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000289652347 1026112824 /nfs/dbraw/zinc/11/28/24/1026112824.db2.gz TWFCIOPFHZVQDF-COXVUDFISA-N 1 1 316.401 3.689 20 5 DHBDMO C[C@@H]1c2ccsc2CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000052070780 1026199100 /nfs/dbraw/zinc/19/91/00/1026199100.db2.gz MXLVXTOKUOYIHE-GFCCVEGCSA-N 1 1 302.399 3.818 20 5 DHBDMO C[C@@H]1[C@@H](C)[C@H](C)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000419367602 1026273110 /nfs/dbraw/zinc/27/31/10/1026273110.db2.gz DHIBKNAFUPOZDT-FRRDWIJNSA-N 1 1 315.373 3.726 20 5 DHBDMO CCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000513510021 1026527861 /nfs/dbraw/zinc/52/78/61/1026527861.db2.gz XRBOAEVSSLTYNM-KMDWOBIYSA-N 1 1 318.417 3.889 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cs1 ZINC000420954060 1026890210 /nfs/dbraw/zinc/89/02/10/1026890210.db2.gz UEDIOFQKOXDVFQ-SECBINFHSA-N 1 1 308.325 3.821 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cs1 ZINC000420954060 1026890220 /nfs/dbraw/zinc/89/02/20/1026890220.db2.gz UEDIOFQKOXDVFQ-SECBINFHSA-N 1 1 308.325 3.821 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](CC(F)(F)F)C2)cc1 ZINC000420953594 1026892041 /nfs/dbraw/zinc/89/20/41/1026892041.db2.gz TUHYWLCMWXERSN-CYBMUJFWSA-N 1 1 316.323 3.802 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000362384839 1027176663 /nfs/dbraw/zinc/17/66/63/1027176663.db2.gz MLUJRNNCQLBQDM-KGLIPLIRSA-N 1 1 324.446 3.580 20 5 DHBDMO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000572201421 1027183441 /nfs/dbraw/zinc/18/34/41/1027183441.db2.gz FWFZDCBRHDGSTO-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000572201421 1027183444 /nfs/dbraw/zinc/18/34/44/1027183444.db2.gz FWFZDCBRHDGSTO-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO Cc1noc(C[NH2+][C@@H]2CCc3cccc4cccc2c43)c1[N+](=O)[O-] ZINC000931808902 1027264535 /nfs/dbraw/zinc/26/45/35/1027264535.db2.gz MEEGSPDQVYQYLS-OAHLLOKOSA-N 1 1 323.352 3.822 20 5 DHBDMO CC(C)(C)OC[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000932166903 1027395192 /nfs/dbraw/zinc/39/51/92/1027395192.db2.gz DHZKNKJECKNJRF-CYBMUJFWSA-N 1 1 310.369 3.513 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000574676205 1027417602 /nfs/dbraw/zinc/41/76/02/1027417602.db2.gz VFCMWWZSFHJWGS-CABCVRRESA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000574676205 1027417607 /nfs/dbraw/zinc/41/76/07/1027417607.db2.gz VFCMWWZSFHJWGS-CABCVRRESA-N 1 1 307.438 3.674 20 5 DHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812848634 1027446122 /nfs/dbraw/zinc/44/61/22/1027446122.db2.gz LKJXPVPUZPHMHW-KBXCAEBGSA-N 1 1 314.385 3.539 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812850521 1027447043 /nfs/dbraw/zinc/44/70/43/1027447043.db2.gz UTBAIRUGXXAXPI-KBXCAEBGSA-N 1 1 314.385 3.539 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000932377659 1027469506 /nfs/dbraw/zinc/46/95/06/1027469506.db2.gz ISTXRPPVJDHRRH-INIZCTEOSA-N 1 1 317.776 3.884 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(F)ccc1OC ZINC000932469757 1027508453 /nfs/dbraw/zinc/50/84/53/1027508453.db2.gz SIHMEFAEIUQBQO-OAHLLOKOSA-N 1 1 318.348 3.983 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccccc1Br ZINC000048068926 1027794642 /nfs/dbraw/zinc/79/46/42/1027794642.db2.gz FWVZMRXUHAUOGK-UHFFFAOYSA-N 1 1 321.174 3.647 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934333890 1027967705 /nfs/dbraw/zinc/96/77/05/1027967705.db2.gz RIAQWTCLRDNOGV-STQMWFEESA-N 1 1 317.414 3.677 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc(C(F)F)nc1)c1ccccc1[N+](=O)[O-] ZINC000601113011 1027989756 /nfs/dbraw/zinc/98/97/56/1027989756.db2.gz JJIIEIADVKJBDN-JTQLQIEISA-N 1 1 307.300 3.778 20 5 DHBDMO COC1CCC(N(C)c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601116942 1027990685 /nfs/dbraw/zinc/99/06/85/1027990685.db2.gz SHHHAWPZCBCTIV-UHFFFAOYSA-N 1 1 315.373 3.537 20 5 DHBDMO C[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCC1(F)F ZINC000601166244 1028008923 /nfs/dbraw/zinc/00/89/23/1028008923.db2.gz MLBQMJLPTMQAHN-SNVBAGLBSA-N 1 1 307.300 3.625 20 5 DHBDMO Cc1cnc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)s1 ZINC000579667325 1028462524 /nfs/dbraw/zinc/46/25/24/1028462524.db2.gz DRALYXKOVJFXMS-CQSZACIVSA-N 1 1 317.414 3.872 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1 ZINC000449495942 1028705795 /nfs/dbraw/zinc/70/57/95/1028705795.db2.gz FNNYXNGERZJVSQ-INIZCTEOSA-N 1 1 311.385 3.678 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1 ZINC000449495944 1028707117 /nfs/dbraw/zinc/70/71/17/1028707117.db2.gz FNNYXNGERZJVSQ-MRXNPFEDSA-N 1 1 311.385 3.678 20 5 DHBDMO CS[C@@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000687927371 1028751579 /nfs/dbraw/zinc/75/15/79/1028751579.db2.gz WGAAMRLKFMISKX-CYBMUJFWSA-N 1 1 314.838 3.966 20 5 DHBDMO CC(C)[C@@H]1C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CCS1 ZINC000687935364 1028754746 /nfs/dbraw/zinc/75/47/46/1028754746.db2.gz PNEUXZMIFREDGL-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@@H]1C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CCS1 ZINC000687935364 1028754762 /nfs/dbraw/zinc/75/47/62/1028754762.db2.gz PNEUXZMIFREDGL-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CC(c2ccc(Cl)cc2)C1 ZINC000449557779 1028796095 /nfs/dbraw/zinc/79/60/95/1028796095.db2.gz TZBXGUDOAXLRGL-UHFFFAOYSA-N 1 1 302.761 3.848 20 5 DHBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@@H](C)[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000816646674 1028971561 /nfs/dbraw/zinc/97/15/61/1028971561.db2.gz HMJTWMZIHJDPJW-NEPJUHHUSA-N 1 1 316.357 3.704 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](O)c2ccccc2C1 ZINC000374806655 1029463254 /nfs/dbraw/zinc/46/32/54/1029463254.db2.gz MUFCOEFAANMEKX-FZKQIMNGSA-N 1 1 312.369 3.595 20 5 DHBDMO Cc1cnc([C@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451545910 1029909255 /nfs/dbraw/zinc/90/92/55/1029909255.db2.gz HVDKQKGEEXJSRT-DZGCQCFKSA-N 1 1 315.373 3.832 20 5 DHBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549108 1029913091 /nfs/dbraw/zinc/91/30/91/1029913091.db2.gz OXZAIMXXGIYAOE-ZBFHGGJFSA-N 1 1 311.385 3.930 20 5 DHBDMO CC(C)OCCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451551336 1029914115 /nfs/dbraw/zinc/91/41/15/1029914115.db2.gz UIWNGYUHVXMAIL-MRXNPFEDSA-N 1 1 306.406 3.589 20 5 DHBDMO C[C@@H](NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467839112 1029974046 /nfs/dbraw/zinc/97/40/46/1029974046.db2.gz MXKNJYRWWLRGKE-HUUCEWRRSA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@@H]([NH2+]CC(C)(C)N1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467839112 1029974056 /nfs/dbraw/zinc/97/40/56/1029974056.db2.gz MXKNJYRWWLRGKE-HUUCEWRRSA-N 1 1 319.449 3.756 20 5 DHBDMO COc1ccc(C[NH2+]Cc2ccc(C(C)(C)C)o2)cc1[N+](=O)[O-] ZINC000865815315 1030037069 /nfs/dbraw/zinc/03/70/69/1030037069.db2.gz YORSFANKMHOHHI-UHFFFAOYSA-N 1 1 318.373 3.784 20 5 DHBDMO C[C@@H](c1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451963685 1030067024 /nfs/dbraw/zinc/06/70/24/1030067024.db2.gz HXZXBFZVKDLTAO-BBRMVZONSA-N 1 1 306.431 3.875 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC[C@@H]1CC1(Cl)Cl ZINC000823116114 1030213111 /nfs/dbraw/zinc/21/31/11/1030213111.db2.gz QLZMZOAJTYIZFT-GFCCVEGCSA-N 1 1 317.216 3.653 20 5 DHBDMO COc1ccc(C[NH2+][C@H]2CSc3ccccc32)cc1[N+](=O)[O-] ZINC000358022560 1030283723 /nfs/dbraw/zinc/28/37/23/1030283723.db2.gz OVTFSINJWHZKDO-ZDUSSCGKSA-N 1 1 316.382 3.540 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cnn(C2CCC2)c1 ZINC000925696312 1030455231 /nfs/dbraw/zinc/45/52/31/1030455231.db2.gz ZEQABVMEQXHQHR-STQMWFEESA-N 1 1 314.389 3.928 20 5 DHBDMO CCC[C@@H]([NH2+]C[C@@H](C)N(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000359021266 1030735428 /nfs/dbraw/zinc/73/54/28/1030735428.db2.gz UHGOFXXCZHIOIG-RHSMWYFYSA-N 1 1 307.438 3.756 20 5 DHBDMO CC1(C)[C@@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@@H]21 ZINC000559105821 1031127496 /nfs/dbraw/zinc/12/74/96/1031127496.db2.gz HOQQHIXOEILIMV-BETUJISGSA-N 1 1 314.307 3.701 20 5 DHBDMO C[C@@H]1SCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)[C@H]1C ZINC000360018562 1031241333 /nfs/dbraw/zinc/24/13/33/1031241333.db2.gz UTQPKRIXQDBESG-UWVGGRQHSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@@H]1SCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)[C@H]1C ZINC000360018562 1031241343 /nfs/dbraw/zinc/24/13/43/1031241343.db2.gz UTQPKRIXQDBESG-UWVGGRQHSA-N 1 1 300.811 3.574 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(CCCOC3)C2)c(Cl)c1 ZINC000360028657 1031247161 /nfs/dbraw/zinc/24/71/61/1031247161.db2.gz WCXAGYTVEVWXKQ-MRXNPFEDSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1ccccc1NCCNc1cc[nH+]c2ccsc21 ZINC000360219130 1031329471 /nfs/dbraw/zinc/32/94/71/1031329471.db2.gz SKLPUHLRCCPAFH-UHFFFAOYSA-N 1 1 314.370 3.729 20 5 DHBDMO COCc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872020661 1031404078 /nfs/dbraw/zinc/40/40/78/1031404078.db2.gz JZWJITOSQSOWTF-LBPRGKRZSA-N 1 1 318.348 3.731 20 5 DHBDMO COCc1cccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872022232 1031405973 /nfs/dbraw/zinc/40/59/73/1031405973.db2.gz ICPBKNHAVFDEBP-GFCCVEGCSA-N 1 1 318.348 3.731 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](OC3CCC3)CC2)cc1 ZINC000872278251 1031572436 /nfs/dbraw/zinc/57/24/36/1031572436.db2.gz KWVWYPRORRVQTL-GOSISDBHSA-N 1 1 318.417 3.561 20 5 DHBDMO CC[C@@H](CSC)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000124327833 1031684646 /nfs/dbraw/zinc/68/46/46/1031684646.db2.gz WCCGJGJBUJUTGZ-NSHDSACASA-N 1 1 302.827 3.822 20 5 DHBDMO Cc1c(C[NH2+]Cc2nc(C(C)C)cs2)cccc1[N+](=O)[O-] ZINC000873081199 1031704272 /nfs/dbraw/zinc/70/42/72/1031704272.db2.gz WYWPCLHXDGDDFK-UHFFFAOYSA-N 1 1 305.403 3.773 20 5 DHBDMO COc1ccc(C)cc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000873184171 1031746382 /nfs/dbraw/zinc/74/63/82/1031746382.db2.gz DTQWLHQCDNSXTL-CYBMUJFWSA-N 1 1 300.358 3.763 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846109766 1031859176 /nfs/dbraw/zinc/85/91/76/1031859176.db2.gz VNDUYDDLZYKSEL-OMVNSRBRSA-N 1 1 308.328 3.729 20 5 DHBDMO CC[C@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777954174 1032028041 /nfs/dbraw/zinc/02/80/41/1032028041.db2.gz CYZSGLFXTCWFBE-AWEZNQCLSA-N 1 1 314.389 3.538 20 5 DHBDMO COCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1CC[C@@H](C)C1 ZINC000361641557 1032031323 /nfs/dbraw/zinc/03/13/23/1032031323.db2.gz CKEKVIRUEXFJLQ-CZUORRHYSA-N 1 1 306.406 3.540 20 5 DHBDMO CC1(C)CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777955719 1032035991 /nfs/dbraw/zinc/03/59/91/1032035991.db2.gz QZSQTWLBSCQSRI-UHFFFAOYSA-N 1 1 314.389 3.538 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@H](C(F)F)C1)CC2 ZINC001172916099 1033464674 /nfs/dbraw/zinc/46/46/74/1033464674.db2.gz QQGCRXDVSDRBPB-GJZGRUSLSA-N 1 1 324.371 3.819 20 5 DHBDMO C[C@@H]1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H](C)C1 ZINC001172914829 1033464903 /nfs/dbraw/zinc/46/49/03/1033464903.db2.gz JOCQUUTUIOCQJG-JKIFEVAISA-N 1 1 302.418 3.963 20 5 DHBDMO C[C@@H]1CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H]1C ZINC001172917847 1033465122 /nfs/dbraw/zinc/46/51/22/1033465122.db2.gz XMKXZPZYBPNMLB-CKEIUWERSA-N 1 1 302.418 3.963 20 5 DHBDMO C[C@@H]1CCCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909557 1033483085 /nfs/dbraw/zinc/48/30/85/1033483085.db2.gz SMKHLVPICAIIGW-PBHICJAKSA-N 1 1 302.418 3.964 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000552922938 1033554952 /nfs/dbraw/zinc/55/49/52/1033554952.db2.gz ATUICLHXZSJWAV-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@H](C)CC2)c1F ZINC001173182803 1033583365 /nfs/dbraw/zinc/58/33/65/1033583365.db2.gz UHSVQBQCRJNRLR-STQMWFEESA-N 1 1 324.396 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC23CCCC3)c1F ZINC001173183010 1033583686 /nfs/dbraw/zinc/58/36/86/1033583686.db2.gz VPSYYGLQDONURR-GFCCVEGCSA-N 1 1 322.380 3.692 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1F ZINC001173187080 1033584129 /nfs/dbraw/zinc/58/41/29/1033584129.db2.gz WMFSSOCOHGGEHH-NWDGAFQWSA-N 1 1 310.369 3.548 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CC3(C2)CCCC3)c1F ZINC001173182774 1033585152 /nfs/dbraw/zinc/58/51/52/1033585152.db2.gz TYNODPOLNPVWTI-GFCCVEGCSA-N 1 1 322.380 3.550 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@H]2C(C)C)c1F ZINC001173193145 1033588144 /nfs/dbraw/zinc/58/81/44/1033588144.db2.gz QRSPXWGLZCHHAT-TZMCWYRMSA-N 1 1 324.396 3.794 20 5 DHBDMO CC[C@H]1CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173197567 1033588956 /nfs/dbraw/zinc/58/89/56/1033588956.db2.gz UNLUWAYDNLZKMY-STQMWFEESA-N 1 1 324.396 3.796 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001173221457 1033603905 /nfs/dbraw/zinc/60/39/05/1033603905.db2.gz IPYVWLRVNVHDRA-FZMZJTMJSA-N 1 1 316.323 3.595 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001173221457 1033603912 /nfs/dbraw/zinc/60/39/12/1033603912.db2.gz IPYVWLRVNVHDRA-FZMZJTMJSA-N 1 1 316.323 3.595 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1Cc2cccc(F)c2C1 ZINC001173234866 1033608387 /nfs/dbraw/zinc/60/83/87/1033608387.db2.gz UKKRWVOCUVFTBB-LBPRGKRZSA-N 1 1 300.333 3.681 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1Cc2cccc(F)c2C1 ZINC001173234866 1033608393 /nfs/dbraw/zinc/60/83/93/1033608393.db2.gz UKKRWVOCUVFTBB-LBPRGKRZSA-N 1 1 300.333 3.681 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001173232468 1033609537 /nfs/dbraw/zinc/60/95/37/1033609537.db2.gz GXJHIMXWLGPXRX-LBPRGKRZSA-N 1 1 319.792 3.706 20 5 DHBDMO CCCC[C@H](C)[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878632721 1033778697 /nfs/dbraw/zinc/77/86/97/1033778697.db2.gz MJNWWRLAPITFQN-LBPRGKRZSA-N 1 1 318.377 3.655 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H](c3ccccn3)C2)cc1[N+](=O)[O-] ZINC000878647879 1033782171 /nfs/dbraw/zinc/78/21/71/1033782171.db2.gz JVSAIZWHXUXVSQ-INIZCTEOSA-N 1 1 311.385 3.678 20 5 DHBDMO CCc1onc(C)c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000927137668 1034121860 /nfs/dbraw/zinc/12/18/60/1034121860.db2.gz AJEXYKSOSOEIHV-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000880003495 1034178232 /nfs/dbraw/zinc/17/82/32/1034178232.db2.gz HYELYMOJNWWAIG-GFCCVEGCSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000880003495 1034178235 /nfs/dbraw/zinc/17/82/35/1034178235.db2.gz HYELYMOJNWWAIG-GFCCVEGCSA-N 1 1 306.259 3.508 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880319656 1034297299 /nfs/dbraw/zinc/29/72/99/1034297299.db2.gz IFYUWWKOHPKTSL-CHWSQXEVSA-N 1 1 317.414 3.910 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC3(CCCCO3)CC2)c1 ZINC000880454607 1034336125 /nfs/dbraw/zinc/33/61/25/1034336125.db2.gz GLKUXIMVCWHHMK-UHFFFAOYSA-N 1 1 324.808 3.783 20 5 DHBDMO C[C@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H]1C ZINC000480642923 1034362607 /nfs/dbraw/zinc/36/26/07/1034362607.db2.gz NVZDPDMTENYCOE-ZNMIVQPWSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1C ZINC000480642923 1034362615 /nfs/dbraw/zinc/36/26/15/1034362615.db2.gz NVZDPDMTENYCOE-ZNMIVQPWSA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1csc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2C)n1 ZINC000183477959 1034389975 /nfs/dbraw/zinc/38/99/75/1034389975.db2.gz OKQBJAIVMCKABF-UHFFFAOYSA-N 1 1 305.403 3.693 20 5 DHBDMO CCc1ccc([C@@H](COC)[NH2+]Cc2ccc([N+](=O)[O-])cc2C)o1 ZINC000183479218 1034391542 /nfs/dbraw/zinc/39/15/42/1034391542.db2.gz NCRYNEFCTZVUJR-MRXNPFEDSA-N 1 1 318.373 3.536 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(F)c(F)cc1F ZINC000555340204 1034628867 /nfs/dbraw/zinc/62/88/67/1034628867.db2.gz SOSJSVIJTFWAGO-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(F)c(F)cc1F ZINC000555340204 1034628875 /nfs/dbraw/zinc/62/88/75/1034628875.db2.gz SOSJSVIJTFWAGO-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](C3CC3)C2)c1 ZINC000555417917 1034695213 /nfs/dbraw/zinc/69/52/13/1034695213.db2.gz VMLZDILGZXBVKP-NSHDSACASA-N 1 1 314.307 3.846 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@@H]4C3)s2)cc1 ZINC000600190066 1034795116 /nfs/dbraw/zinc/79/51/16/1034795116.db2.gz GHOHHACPDHTQFM-BETUJISGSA-N 1 1 300.383 3.775 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC[C@@]12CCCOC2 ZINC001177007638 1035342402 /nfs/dbraw/zinc/34/24/02/1035342402.db2.gz BRUQRFRYTOUQMH-INIZCTEOSA-N 1 1 324.808 3.783 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCC[C@@]12CCCOC2 ZINC001177007638 1035342406 /nfs/dbraw/zinc/34/24/06/1035342406.db2.gz BRUQRFRYTOUQMH-INIZCTEOSA-N 1 1 324.808 3.783 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc(F)c(F)c1F)c1cccc([N+](=O)[O-])c1 ZINC001177328415 1035363549 /nfs/dbraw/zinc/36/35/49/1035363549.db2.gz MWPSKUMFCYTNIR-VIFPVBQESA-N 1 1 310.275 3.863 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)Cc1ccc(Cl)nc1 ZINC001180540961 1035715264 /nfs/dbraw/zinc/71/52/64/1035715264.db2.gz XJGHCLPFKYHFBV-UHFFFAOYSA-N 1 1 319.792 3.892 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001180540961 1035715279 /nfs/dbraw/zinc/71/52/79/1035715279.db2.gz XJGHCLPFKYHFBV-UHFFFAOYSA-N 1 1 319.792 3.892 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494669020 1035766413 /nfs/dbraw/zinc/76/64/13/1035766413.db2.gz SQVKTQFGYGJUGL-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494669020 1035766423 /nfs/dbraw/zinc/76/64/23/1035766423.db2.gz SQVKTQFGYGJUGL-OAHLLOKOSA-N 1 1 324.808 3.639 20 5 DHBDMO CNc1ccc(C)cc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001181153491 1035854730 /nfs/dbraw/zinc/85/47/30/1035854730.db2.gz DASHZDUXQRDHPR-UHFFFAOYSA-N 1 1 313.401 3.619 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H]1C[C@H]1c1ccccc1)C2 ZINC000539829624 1035887219 /nfs/dbraw/zinc/88/72/19/1035887219.db2.gz PUWYCCHLTAAPSH-AEFFLSMTSA-N 1 1 308.381 3.757 20 5 DHBDMO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000539923791 1035936252 /nfs/dbraw/zinc/93/62/52/1035936252.db2.gz FHLYUYJFGGAKIO-MRXNPFEDSA-N 1 1 304.321 3.789 20 5 DHBDMO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000539923791 1035936262 /nfs/dbraw/zinc/93/62/62/1035936262.db2.gz FHLYUYJFGGAKIO-MRXNPFEDSA-N 1 1 304.321 3.789 20 5 DHBDMO C[N@H+](C/C=C/c1cccc(F)c1)CCc1ccccc1[N+](=O)[O-] ZINC001181697939 1035975906 /nfs/dbraw/zinc/97/59/06/1035975906.db2.gz PKUGHBKKISDCDV-FNORWQNLSA-N 1 1 314.360 3.922 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000152936203 1036116700 /nfs/dbraw/zinc/11/67/00/1036116700.db2.gz MOHUERKCJAGWAW-MRXNPFEDSA-N 1 1 304.390 3.518 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC001182327976 1036229441 /nfs/dbraw/zinc/22/94/41/1036229441.db2.gz XDPMTGNXKLYVBW-KRWDZBQOSA-N 1 1 320.458 3.931 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](C2CCC2)C1 ZINC001196254880 1036482017 /nfs/dbraw/zinc/48/20/17/1036482017.db2.gz PIYQUJVLVDQSDD-AWEZNQCLSA-N 1 1 304.390 3.616 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@@H](OC(C)C)C1 ZINC001206545494 1036483705 /nfs/dbraw/zinc/48/37/05/1036483705.db2.gz WKPSEMKPLAVHAM-OAHLLOKOSA-N 1 1 306.406 3.601 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cccc(C)n2)cc1[N+](=O)[O-] ZINC000153085421 1036546347 /nfs/dbraw/zinc/54/63/47/1036546347.db2.gz SZBMBQRKQGFJPX-ZDUSSCGKSA-N 1 1 315.373 3.548 20 5 DHBDMO CC(C)[C@@H](C)[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636496 1036602028 /nfs/dbraw/zinc/60/20/28/1036602028.db2.gz UYPTWFAKTAULMQ-SNVBAGLBSA-N 1 1 310.785 3.532 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1C[C@@H]2C[C@]2(c2ccccc2)C1 ZINC001197719764 1036856057 /nfs/dbraw/zinc/85/60/57/1036856057.db2.gz LXDKBSSFOWBKSG-MAUKXSAKSA-N 1 1 312.344 3.507 20 5 DHBDMO CCOc1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000492650216 1036958509 /nfs/dbraw/zinc/95/85/09/1036958509.db2.gz IVZDPRIFBWPRJL-MRXNPFEDSA-N 1 1 312.369 3.941 20 5 DHBDMO CCOc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000492650216 1036958520 /nfs/dbraw/zinc/95/85/20/1036958520.db2.gz IVZDPRIFBWPRJL-MRXNPFEDSA-N 1 1 312.369 3.941 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2c(F)cccc2[N+](=O)[O-])C1 ZINC001184865853 1036966203 /nfs/dbraw/zinc/96/62/03/1036966203.db2.gz YNJPBTMCAAJHAH-BETUJISGSA-N 1 1 309.385 3.514 20 5 DHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000488409010 1036995194 /nfs/dbraw/zinc/99/51/94/1036995194.db2.gz DBTWLIQETLEBDZ-CQSZACIVSA-N 1 1 306.406 3.874 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCSC[C@H](C)C1 ZINC000488403962 1036999741 /nfs/dbraw/zinc/99/97/41/1036999741.db2.gz ZEGFELISTUATOL-MAUPQMMJSA-N 1 1 306.431 3.683 20 5 DHBDMO C[C@H](CNc1c(Cl)c(Cl)ccc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC001185231469 1037075596 /nfs/dbraw/zinc/07/55/96/1037075596.db2.gz YZGGVILGLSVSBP-MRVPVSSYSA-N 1 1 318.204 3.796 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000774854539 1037104871 /nfs/dbraw/zinc/10/48/71/1037104871.db2.gz WQKZNRWRWWJOFW-HNNXBMFYSA-N 1 1 319.361 3.658 20 5 DHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774905225 1037196393 /nfs/dbraw/zinc/19/63/93/1037196393.db2.gz LPSJDPJUFFGTQN-CYBMUJFWSA-N 1 1 307.350 3.658 20 5 DHBDMO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000489066300 1037258171 /nfs/dbraw/zinc/25/81/71/1037258171.db2.gz CDPOQMHQZWEIIL-ZDUSSCGKSA-N 1 1 302.349 3.797 20 5 DHBDMO CC(C)CCOC1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000194240877 1037416142 /nfs/dbraw/zinc/41/61/42/1037416142.db2.gz SYQXHRJEUWVXDD-UHFFFAOYSA-N 1 1 312.435 3.683 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c1 ZINC000609234553 1037461639 /nfs/dbraw/zinc/46/16/39/1037461639.db2.gz UWFWGVCJHPHJSU-GOSISDBHSA-N 1 1 312.369 3.558 20 5 DHBDMO C[C@@H]1CC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000494145490 1037651762 /nfs/dbraw/zinc/65/17/62/1037651762.db2.gz OBICAZZNLKEHJO-SNVBAGLBSA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000494145490 1037651779 /nfs/dbraw/zinc/65/17/79/1037651779.db2.gz OBICAZZNLKEHJO-SNVBAGLBSA-N 1 1 300.811 3.576 20 5 DHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609195443 1038073153 /nfs/dbraw/zinc/07/31/53/1038073153.db2.gz VRYGITVMAFQRJG-INIZCTEOSA-N 1 1 306.406 3.874 20 5 DHBDMO CC[C@H](C)[C@H](C)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001190911985 1038406387 /nfs/dbraw/zinc/40/63/87/1038406387.db2.gz AFPQGVUBKJXXKZ-KBPBESRZSA-N 1 1 306.406 3.873 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000588960899 1038413124 /nfs/dbraw/zinc/41/31/24/1038413124.db2.gz NTGFRWDHSIVWFG-ZFWWWQNUSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000588960899 1038413130 /nfs/dbraw/zinc/41/31/30/1038413130.db2.gz NTGFRWDHSIVWFG-ZFWWWQNUSA-N 1 1 307.438 3.674 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000589200244 1038449953 /nfs/dbraw/zinc/44/99/53/1038449953.db2.gz YAOKVPOMRWAKTB-HOTGVXAUSA-N 1 1 318.417 3.542 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000590601795 1038674332 /nfs/dbraw/zinc/67/43/32/1038674332.db2.gz QMHUTOLJWFFCFN-HUUCEWRRSA-N 1 1 311.385 3.930 20 5 DHBDMO Cc1cccc(CC2C[NH+](Cc3csc([N+](=O)[O-])c3)C2)c1 ZINC000590967168 1038732818 /nfs/dbraw/zinc/73/28/18/1038732818.db2.gz AWQVUFYHSARUIO-UHFFFAOYSA-N 1 1 302.399 3.639 20 5 DHBDMO Cc1ccc(C[NH2+]C[C@]2(N(C)C)CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000058066253 1038903361 /nfs/dbraw/zinc/90/33/61/1038903361.db2.gz GGPARFCSNRZUKO-KSSFIOAISA-N 1 1 319.449 3.503 20 5 DHBDMO Cc1c([C@@H](C)NC[C@@H]2CC[N@@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000599074723 1039028630 /nfs/dbraw/zinc/02/86/30/1039028630.db2.gz VULMAWYWUKUFDO-ZBFHGGJFSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c([C@@H](C)NC[C@@H]2CC[N@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000599074723 1039028648 /nfs/dbraw/zinc/02/86/48/1039028648.db2.gz VULMAWYWUKUFDO-ZBFHGGJFSA-N 1 1 317.433 3.571 20 5 DHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC000603844718 1039181695 /nfs/dbraw/zinc/18/16/95/1039181695.db2.gz QJYDAHYCVKRQNF-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cc2n(n1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000592386861 1039184519 /nfs/dbraw/zinc/18/45/19/1039184519.db2.gz KXUAUQIEOHLSQT-OLZOCXBDSA-N 1 1 314.389 3.539 20 5 DHBDMO C[C@H](c1ccccc1F)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603855201 1039188487 /nfs/dbraw/zinc/18/84/87/1039188487.db2.gz OEBFTXZKDVEMIK-CYBMUJFWSA-N 1 1 318.348 3.806 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc(F)cc1[N+](=O)[O-] ZINC000603859504 1039194837 /nfs/dbraw/zinc/19/48/37/1039194837.db2.gz FLWQNMCBKFHQSI-CYBMUJFWSA-N 1 1 309.385 3.800 20 5 DHBDMO CC(C)O[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000593055769 1039383377 /nfs/dbraw/zinc/38/33/77/1039383377.db2.gz ORCHKQWEIPVMRB-CQSZACIVSA-N 1 1 312.797 3.638 20 5 DHBDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000593055769 1039383388 /nfs/dbraw/zinc/38/33/88/1039383388.db2.gz ORCHKQWEIPVMRB-CQSZACIVSA-N 1 1 312.797 3.638 20 5 DHBDMO C[C@H]([NH2+][C@H](CCO)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000592402903 1039462841 /nfs/dbraw/zinc/46/28/41/1039462841.db2.gz LNCQNVKYFFKMGD-YVEFUNNKSA-N 1 1 318.348 3.508 20 5 DHBDMO C[C@H]([NH2+][C@@H](CCO)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000592402900 1039463508 /nfs/dbraw/zinc/46/35/08/1039463508.db2.gz LNCQNVKYFFKMGD-SJCJKPOMSA-N 1 1 318.348 3.508 20 5 DHBDMO COc1ccc(C[N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])cc1C ZINC000171391221 1039470546 /nfs/dbraw/zinc/47/05/46/1039470546.db2.gz HJSVGSIJTBZQDW-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])cc1C ZINC000171391221 1039470548 /nfs/dbraw/zinc/47/05/48/1039470548.db2.gz HJSVGSIJTBZQDW-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO C[C@@H](CNc1ccsc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000604432634 1039475018 /nfs/dbraw/zinc/47/50/18/1039475018.db2.gz GZDXGCVQRRJVOL-JTQLQIEISA-N 1 1 323.443 3.577 20 5 DHBDMO C[C@@H](CNc1ccsc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000604432634 1039475023 /nfs/dbraw/zinc/47/50/23/1039475023.db2.gz GZDXGCVQRRJVOL-JTQLQIEISA-N 1 1 323.443 3.577 20 5 DHBDMO COc1ccccc1C1([NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000594506880 1039807005 /nfs/dbraw/zinc/80/70/05/1039807005.db2.gz GRQGELMDFFILMX-INIZCTEOSA-N 1 1 324.380 3.870 20 5 DHBDMO C[C@@H](N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595079011 1040072528 /nfs/dbraw/zinc/07/25/28/1040072528.db2.gz BZDKFUMWJVUDIR-GDBMZVCRSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCN(C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595079011 1040072543 /nfs/dbraw/zinc/07/25/43/1040072543.db2.gz BZDKFUMWJVUDIR-GDBMZVCRSA-N 1 1 317.433 3.652 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@H]2c2cccc(C)c2)c1[N+](=O)[O-] ZINC000595292903 1040092236 /nfs/dbraw/zinc/09/22/36/1040092236.db2.gz DVTYRFNEWNXMDQ-AWEZNQCLSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2c2cccc(C)c2)c1[N+](=O)[O-] ZINC000595292903 1040092252 /nfs/dbraw/zinc/09/22/52/1040092252.db2.gz DVTYRFNEWNXMDQ-AWEZNQCLSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595326430 1040099042 /nfs/dbraw/zinc/09/90/42/1040099042.db2.gz KDNWGQLGICJBRS-IINYFYTJSA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595326430 1040099058 /nfs/dbraw/zinc/09/90/58/1040099058.db2.gz KDNWGQLGICJBRS-IINYFYTJSA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@@H+](C)[C@H](c2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000595316870 1040107711 /nfs/dbraw/zinc/10/77/11/1040107711.db2.gz AAHKKVPQMAXEIE-HNNXBMFYSA-N 1 1 303.362 3.720 20 5 DHBDMO Cc1noc(C[N@H+](C)[C@H](c2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000595316870 1040107717 /nfs/dbraw/zinc/10/77/17/1040107717.db2.gz AAHKKVPQMAXEIE-HNNXBMFYSA-N 1 1 303.362 3.720 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2CCC2CCCC2)c1[N+](=O)[O-] ZINC000595352814 1040125151 /nfs/dbraw/zinc/12/51/51/1040125151.db2.gz OLJDIXLKNRHEOB-CQSZACIVSA-N 1 1 307.394 3.826 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C3CC3)no2)cc1[N+](=O)[O-] ZINC000595421147 1040133832 /nfs/dbraw/zinc/13/38/32/1040133832.db2.gz SHFNYNZVQLEENV-LLVKDONJSA-N 1 1 301.346 3.619 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000595432534 1040135790 /nfs/dbraw/zinc/13/57/90/1040135790.db2.gz WMCHXWVUXWZGRN-KVPUOBJLSA-N 1 1 313.357 3.569 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000595432534 1040135795 /nfs/dbraw/zinc/13/57/95/1040135795.db2.gz WMCHXWVUXWZGRN-KVPUOBJLSA-N 1 1 313.357 3.569 20 5 DHBDMO Cc1noc(C[N@H+]2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000595507085 1040155899 /nfs/dbraw/zinc/15/58/99/1040155899.db2.gz JVWOEXZJMKVCGG-KYOSRNDESA-N 1 1 315.373 3.658 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)c(F)c1 ZINC000595500710 1040156286 /nfs/dbraw/zinc/15/62/86/1040156286.db2.gz KGKNTAHHXWCDNL-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO O=[N+]([O-])c1sccc1N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000063258393 1040163699 /nfs/dbraw/zinc/16/36/99/1040163699.db2.gz JMLHXTYHTBZEFX-AWEZNQCLSA-N 1 1 317.414 3.733 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H]2c2ccc(F)cc2)cc1 ZINC000595701811 1040223941 /nfs/dbraw/zinc/22/39/41/1040223941.db2.gz FXONHDHRJKYXQU-KRWDZBQOSA-N 1 1 300.333 3.723 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC000595822385 1040249254 /nfs/dbraw/zinc/24/92/54/1040249254.db2.gz SJSNPSYZIHMFFV-ZDUSSCGKSA-N 1 1 316.401 3.547 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC000595822385 1040249265 /nfs/dbraw/zinc/24/92/65/1040249265.db2.gz SJSNPSYZIHMFFV-ZDUSSCGKSA-N 1 1 316.401 3.547 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccon3)CC2)c(Cl)c1 ZINC000595827563 1040265159 /nfs/dbraw/zinc/26/51/59/1040265159.db2.gz DIVRQLFOJFNYJN-UHFFFAOYSA-N 1 1 321.764 3.616 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491206188 1040637222 /nfs/dbraw/zinc/63/72/22/1040637222.db2.gz CVQJHEMCCKFEPH-CQSZACIVSA-N 1 1 304.390 3.614 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H]3CCCc4ccccc43)nc2c1 ZINC000602504288 1041070821 /nfs/dbraw/zinc/07/08/21/1041070821.db2.gz OQEPBOHDFXLJMM-OAHLLOKOSA-N 1 1 323.352 3.903 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2cccnc2)C1 ZINC000602857965 1041267066 /nfs/dbraw/zinc/26/70/66/1041267066.db2.gz ZNAXGOMQBLNQQG-RHSMWYFYSA-N 1 1 311.385 3.930 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@H]2CCC[C@H](C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761280100 1041273134 /nfs/dbraw/zinc/27/31/34/1041273134.db2.gz LTTZCOYXJQZQJK-JSGCOSHPSA-N 1 1 316.405 3.721 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CCOCC3)C2)c(Cl)c1 ZINC000272835461 130067854 /nfs/dbraw/zinc/06/78/54/130067854.db2.gz RSRCHEWXFKMHNC-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)N[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353480647 131109353 /nfs/dbraw/zinc/10/93/53/131109353.db2.gz CGWRCWGYHYDUQA-PBHICJAKSA-N 1 1 307.438 3.756 20 5 DHBDMO CCCN(CC)C[C@@H](C)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353480647 131109354 /nfs/dbraw/zinc/10/93/54/131109354.db2.gz CGWRCWGYHYDUQA-PBHICJAKSA-N 1 1 307.438 3.756 20 5 DHBDMO COC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000288742013 131337961 /nfs/dbraw/zinc/33/79/61/131337961.db2.gz HKRVRJNBILYTHN-OAHLLOKOSA-N 1 1 320.776 3.726 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cn2c(cccc2C)n1 ZINC000160316865 332783578 /nfs/dbraw/zinc/78/35/78/332783578.db2.gz RXXIUGQBGKOECI-AWEZNQCLSA-N 1 1 324.384 3.710 20 5 DHBDMO CCC(CC)C[N@@H+](CC)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000409857232 332061078 /nfs/dbraw/zinc/06/10/78/332061078.db2.gz SOHDCUMVHZESEY-UHFFFAOYSA-N 1 1 321.421 3.682 20 5 DHBDMO C[C@H]1COCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000091800904 332112427 /nfs/dbraw/zinc/11/24/27/332112427.db2.gz KLLAZRHCEXGCQA-LBPRGKRZSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@H]1COCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000091800904 332112428 /nfs/dbraw/zinc/11/24/28/332112428.db2.gz KLLAZRHCEXGCQA-LBPRGKRZSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000408201455 332241141 /nfs/dbraw/zinc/24/11/41/332241141.db2.gz FMSRIMIXJGXCSK-KBPBESRZSA-N 1 1 304.390 3.547 20 5 DHBDMO CCOc1ncccc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000151196172 332556897 /nfs/dbraw/zinc/55/68/97/332556897.db2.gz QJVSGFSFPYAFJW-CYBMUJFWSA-N 1 1 315.373 3.548 20 5 DHBDMO COc1ccc(Cl)cc1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000051634397 332655840 /nfs/dbraw/zinc/65/58/40/332655840.db2.gz MLCLQADKMKGFCD-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO CCC(CC)[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000314114294 333087596 /nfs/dbraw/zinc/08/75/96/333087596.db2.gz NYOZKBZHQZXBNZ-CXAGYDPISA-N 1 1 307.438 3.612 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccn(C(C)C)n2)cc1[N+](=O)[O-] ZINC000178509934 333140067 /nfs/dbraw/zinc/14/00/67/333140067.db2.gz BONYBTWNSFUWGI-ZDUSSCGKSA-N 1 1 302.378 3.531 20 5 DHBDMO C[C@H](C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000183989442 333190787 /nfs/dbraw/zinc/19/07/87/333190787.db2.gz BDWOMHGPKLWEFU-NEPJUHHUSA-N 1 1 305.403 3.848 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)N[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000344133040 335220477 /nfs/dbraw/zinc/22/04/77/335220477.db2.gz YADMWVFXOLYFSB-YOEHRIQHSA-N 1 1 307.438 3.756 20 5 DHBDMO CCCCN(C)C[C@H](C)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000344133040 335220478 /nfs/dbraw/zinc/22/04/78/335220478.db2.gz YADMWVFXOLYFSB-YOEHRIQHSA-N 1 1 307.438 3.756 20 5 DHBDMO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000350261129 335740693 /nfs/dbraw/zinc/74/06/93/335740693.db2.gz ZSHVECSOKAWTKT-NSHDSACASA-N 1 1 303.337 3.542 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000332317059 336167943 /nfs/dbraw/zinc/16/79/43/336167943.db2.gz MWTWDSWNRDVVPW-QWHCGFSZSA-N 1 1 317.414 3.992 20 5 DHBDMO COc1cc(C[N@@H+](Cc2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000351982583 336185683 /nfs/dbraw/zinc/18/56/83/336185683.db2.gz DXALIVNONZBVTH-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@@H+]2C/C=C\c2ccccc2[N+](=O)[O-])on1 ZINC000352087511 336194030 /nfs/dbraw/zinc/19/40/30/336194030.db2.gz OGDOVMOANWKYBY-OUOZUETKSA-N 1 1 313.357 3.742 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@H+]2C/C=C\c2ccccc2[N+](=O)[O-])on1 ZINC000352087511 336194032 /nfs/dbraw/zinc/19/40/32/336194032.db2.gz OGDOVMOANWKYBY-OUOZUETKSA-N 1 1 313.357 3.742 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352540042 336223333 /nfs/dbraw/zinc/22/33/33/336223333.db2.gz GMMBQHHVSVAOKB-ZIAGYGMSSA-N 1 1 324.446 3.709 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000352546542 336223864 /nfs/dbraw/zinc/22/38/64/336223864.db2.gz WRBFQRBAVPKMGZ-YJBOKZPZSA-N 1 1 318.417 3.857 20 5 DHBDMO Cc1n[nH]cc1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000352844099 336275959 /nfs/dbraw/zinc/27/59/59/336275959.db2.gz AXLYYQMQMXQRMN-SFHVURJKSA-N 1 1 322.368 3.506 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2cc(C)ccc2[N+](=O)[O-])c1 ZINC000301558313 336314751 /nfs/dbraw/zinc/31/47/51/336314751.db2.gz JHTGMWFLWWRHST-UHFFFAOYSA-N 1 1 313.401 3.967 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1 ZINC000301820323 336332284 /nfs/dbraw/zinc/33/22/84/336332284.db2.gz AZOGLEDBFXYNEN-QAPCUYQASA-N 1 1 311.385 3.761 20 5 DHBDMO C[N@H+]1CC[C@@H](Nc2ccc(F)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000301823999 336332440 /nfs/dbraw/zinc/33/24/40/336332440.db2.gz CWJXOKGXMVIJPK-WBVHZDCISA-N 1 1 315.348 3.591 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 ZINC000301986411 336341476 /nfs/dbraw/zinc/34/14/76/336341476.db2.gz MHQRJUSWOJJNMQ-HZPDHXFCSA-N 1 1 317.433 3.686 20 5 DHBDMO C[C@@H](CNc1sccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000301995910 336342013 /nfs/dbraw/zinc/34/20/13/336342013.db2.gz PQQOZVCGOLCLMP-JTQLQIEISA-N 1 1 323.443 3.577 20 5 DHBDMO C[C@@H](CNc1sccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000301995910 336342014 /nfs/dbraw/zinc/34/20/14/336342014.db2.gz PQQOZVCGOLCLMP-JTQLQIEISA-N 1 1 323.443 3.577 20 5 DHBDMO C[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302052744 336345691 /nfs/dbraw/zinc/34/56/91/336345691.db2.gz OYLSVPROBGKCFC-CHWSQXEVSA-N 1 1 321.396 3.799 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2cccc(C)c2[N+](=O)[O-])c1 ZINC000302471384 336359427 /nfs/dbraw/zinc/35/94/27/336359427.db2.gz CXBQCJOZDVBZMX-UHFFFAOYSA-N 1 1 313.401 3.967 20 5 DHBDMO C[C@H]1[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCC12CCOCC2 ZINC000375240397 337006401 /nfs/dbraw/zinc/00/64/01/337006401.db2.gz XDMVVTICNBDFMQ-GFCCVEGCSA-N 1 1 324.808 3.639 20 5 DHBDMO COc1cccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000122817537 337026645 /nfs/dbraw/zinc/02/66/45/337026645.db2.gz JJSHDODWGRSCDM-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO COc1cccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000122817537 337026646 /nfs/dbraw/zinc/02/66/46/337026646.db2.gz JJSHDODWGRSCDM-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000376558922 337036824 /nfs/dbraw/zinc/03/68/24/337036824.db2.gz RDGBGHDTSGKXCR-SJKOYZFVSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000376558922 337036825 /nfs/dbraw/zinc/03/68/25/337036825.db2.gz RDGBGHDTSGKXCR-SJKOYZFVSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]([NH2+][C@H]1c2cccc(F)c2O[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000360061317 337084654 /nfs/dbraw/zinc/08/46/54/337084654.db2.gz SROLILPDGHIMQW-XMZIXOGTSA-N 1 1 316.332 3.907 20 5 DHBDMO C[C@H]([NH2+][C@@H]1c2cccc(F)c2O[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000360061315 337084784 /nfs/dbraw/zinc/08/47/84/337084784.db2.gz SROLILPDGHIMQW-MMPTUQATSA-N 1 1 316.332 3.907 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2nc3ccccc3n2C2CC2)cc1 ZINC000184784658 337201056 /nfs/dbraw/zinc/20/10/56/337201056.db2.gz WBMBPZBNBQVZEH-UHFFFAOYSA-N 1 1 322.368 3.569 20 5 DHBDMO Cc1cnccc1CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000583082012 337237225 /nfs/dbraw/zinc/23/72/25/337237225.db2.gz ZYANVPZEVLNLKU-UHFFFAOYSA-N 1 1 311.385 3.505 20 5 DHBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)n1 ZINC000187379125 337265275 /nfs/dbraw/zinc/26/52/75/337265275.db2.gz VMZZCNCWJHNATH-UHFFFAOYSA-N 1 1 311.385 3.771 20 5 DHBDMO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)n1 ZINC000187379125 337265276 /nfs/dbraw/zinc/26/52/76/337265276.db2.gz VMZZCNCWJHNATH-UHFFFAOYSA-N 1 1 311.385 3.771 20 5 DHBDMO Cc1[nH+]ccn1CCCCNc1c(Cl)cccc1[N+](=O)[O-] ZINC000432333079 337559185 /nfs/dbraw/zinc/55/91/85/337559185.db2.gz AEBHYQFYXMUEBH-UHFFFAOYSA-N 1 1 308.769 3.645 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1ccc2c(c1)[nH+]cn2C ZINC000537538074 337941601 /nfs/dbraw/zinc/94/16/01/337941601.db2.gz XGGQPFIVONYHTM-LBPRGKRZSA-N 1 1 310.357 3.963 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@@H]3CCC[C@H]32)c1 ZINC000428452090 338052423 /nfs/dbraw/zinc/05/24/23/338052423.db2.gz JDEOBPAFFYHDKW-GXFFZTMASA-N 1 1 312.316 3.571 20 5 DHBDMO CCOC1(C)CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000428741713 338060201 /nfs/dbraw/zinc/06/02/01/338060201.db2.gz FKDASQSNWBIJCQ-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2cc(C)ccc2C)ccc1[N+](=O)[O-] ZINC000429304487 338077264 /nfs/dbraw/zinc/07/72/64/338077264.db2.gz YLZOPQDNIBXLPH-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO Cc1ccc(C[N@@H+]2Cc3ccccc3O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000430135955 338098550 /nfs/dbraw/zinc/09/85/50/338098550.db2.gz HNCRETZVEAVDBH-CQSZACIVSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1ccc(C[N@H+]2Cc3ccccc3O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000430135955 338098551 /nfs/dbraw/zinc/09/85/51/338098551.db2.gz HNCRETZVEAVDBH-CQSZACIVSA-N 1 1 312.369 3.686 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1cc(C)oc1C ZINC000430230318 338102296 /nfs/dbraw/zinc/10/22/96/338102296.db2.gz XXJLYHCYFCQESQ-NSHDSACASA-N 1 1 304.346 3.664 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCC2)C[C@H]1C ZINC000432797272 338168300 /nfs/dbraw/zinc/16/83/00/338168300.db2.gz LCCGUARSYADVLA-CYBMUJFWSA-N 1 1 304.390 3.758 20 5 DHBDMO CC1(C)C[C@H]([NH2+]Cc2ccc(F)cn2)c2cc([N+](=O)[O-])ccc21 ZINC000433297299 338189925 /nfs/dbraw/zinc/18/99/25/338189925.db2.gz VUIJWWSHZTTYGI-INIZCTEOSA-N 1 1 315.348 3.641 20 5 DHBDMO CSCc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000438355572 338341075 /nfs/dbraw/zinc/34/10/75/338341075.db2.gz GOVOBXOZGMLCDY-UHFFFAOYSA-N 1 1 320.389 3.887 20 5 DHBDMO CC(C)c1ncc(C[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000440475877 338388111 /nfs/dbraw/zinc/38/81/11/338388111.db2.gz FJEVIVYRZVVXRJ-CYBMUJFWSA-N 1 1 314.389 3.701 20 5 DHBDMO CC(C)c1ncc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000440475877 338388112 /nfs/dbraw/zinc/38/81/12/338388112.db2.gz FJEVIVYRZVVXRJ-CYBMUJFWSA-N 1 1 314.389 3.701 20 5 DHBDMO COc1cc(C[N@H+](C)Cc2cccc(C)c2)c([N+](=O)[O-])cc1F ZINC000463494940 339119537 /nfs/dbraw/zinc/11/95/37/339119537.db2.gz YBIBKPYGNKHROP-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2cccc(C)c2)c([N+](=O)[O-])cc1F ZINC000463494940 339119538 /nfs/dbraw/zinc/11/95/38/339119538.db2.gz YBIBKPYGNKHROP-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]2C(C)(C)C)c([N+](=O)[O-])cc1F ZINC000464104192 339134560 /nfs/dbraw/zinc/13/45/60/339134560.db2.gz KOWTZWJYLFVMJO-HNNXBMFYSA-N 1 1 310.369 3.753 20 5 DHBDMO CCC1(CC)C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)CCS1 ZINC000464577063 339146007 /nfs/dbraw/zinc/14/60/07/339146007.db2.gz RPKMKQNSDPVQAX-UHFFFAOYSA-N 1 1 324.446 3.711 20 5 DHBDMO C[C@H]([NH2+]C[C@H](C1CCCCC1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000467834143 339247167 /nfs/dbraw/zinc/24/71/67/339247167.db2.gz PGCJUHZDJJUHQC-KBXCAEBGSA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467834819 339247345 /nfs/dbraw/zinc/24/73/45/339247345.db2.gz MSHSWVVQQGYMDC-FZKCQIBNSA-N 1 1 319.449 3.612 20 5 DHBDMO C[C@@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467834819 339247346 /nfs/dbraw/zinc/24/73/46/339247346.db2.gz MSHSWVVQQGYMDC-FZKCQIBNSA-N 1 1 319.449 3.612 20 5 DHBDMO CO[C@H](C)C[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C(C)C ZINC000470179365 339313113 /nfs/dbraw/zinc/31/31/13/339313113.db2.gz WWGZSBIICQKIMR-KQGZCTBQSA-N 1 1 306.406 3.743 20 5 DHBDMO Cc1c(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)cccc1[N+](=O)[O-] ZINC000470956270 339332876 /nfs/dbraw/zinc/33/28/76/339332876.db2.gz BJKKQINTAZCMGG-ZYHUDNBSSA-N 1 1 302.296 3.676 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000471029992 339335075 /nfs/dbraw/zinc/33/50/75/339335075.db2.gz JBYLSIUDVLGBTB-FZKQIMNGSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000471029992 339335076 /nfs/dbraw/zinc/33/50/76/339335076.db2.gz JBYLSIUDVLGBTB-FZKQIMNGSA-N 1 1 312.369 3.796 20 5 DHBDMO CCc1cc(OC)ccc1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000503892390 340135994 /nfs/dbraw/zinc/13/59/94/340135994.db2.gz MKUGZEUOUXDBGH-UHFFFAOYSA-N 1 1 314.385 3.798 20 5 DHBDMO CCc1cc(OC)ccc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000503892390 340135995 /nfs/dbraw/zinc/13/59/95/340135995.db2.gz MKUGZEUOUXDBGH-UHFFFAOYSA-N 1 1 314.385 3.798 20 5 DHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1F ZINC000505605347 340172651 /nfs/dbraw/zinc/17/26/51/340172651.db2.gz GGNRVSJJWBFVCC-TWGQIWQCSA-N 1 1 300.333 3.879 20 5 DHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1F ZINC000505605347 340172652 /nfs/dbraw/zinc/17/26/52/340172652.db2.gz GGNRVSJJWBFVCC-TWGQIWQCSA-N 1 1 300.333 3.879 20 5 DHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000505636360 340173798 /nfs/dbraw/zinc/17/37/98/340173798.db2.gz QHMGAULMDNFCHT-VMPITWQZSA-N 1 1 300.333 3.879 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1N(C)C ZINC000506727331 340200120 /nfs/dbraw/zinc/20/01/20/340200120.db2.gz BBXGEYULVYPTES-CQSZACIVSA-N 1 1 313.401 3.854 20 5 DHBDMO CC[N@H+](Cc1cccc(F)c1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000508947880 340256138 /nfs/dbraw/zinc/25/61/38/340256138.db2.gz FRXIAFHSTJFCIZ-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CC[N@@H+](Cc1cccc(F)c1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000508947880 340256139 /nfs/dbraw/zinc/25/61/39/340256139.db2.gz FRXIAFHSTJFCIZ-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[NH2+]C1(C(F)F)CCCCC1 ZINC000510142302 340290384 /nfs/dbraw/zinc/29/03/84/340290384.db2.gz FNFUHIQKWYEVQZ-UHFFFAOYSA-N 1 1 314.332 3.531 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC000511061673 340319722 /nfs/dbraw/zinc/31/97/22/340319722.db2.gz YPMAJVZGMBYRLU-UHFFFAOYSA-N 1 1 304.777 3.923 20 5 DHBDMO C[C@@H](c1cccc(F)c1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511061762 340319828 /nfs/dbraw/zinc/31/98/28/340319828.db2.gz BGZXRBRKWOPGAF-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccc(F)cc21 ZINC000511103683 340320738 /nfs/dbraw/zinc/32/07/38/340320738.db2.gz DMGUORPUCFPSJO-GOSISDBHSA-N 1 1 314.360 3.896 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccc(F)cc21 ZINC000511103686 340320765 /nfs/dbraw/zinc/32/07/65/340320765.db2.gz DMGUORPUCFPSJO-SFHVURJKSA-N 1 1 314.360 3.896 20 5 DHBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1F ZINC000511724288 340336314 /nfs/dbraw/zinc/33/63/14/340336314.db2.gz VDOYGVMHOUQJNL-XQQFMLRXSA-N 1 1 309.385 3.512 20 5 DHBDMO COCCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000512259741 340354448 /nfs/dbraw/zinc/35/44/48/340354448.db2.gz KWEQBGGYOZRFQR-UHFFFAOYSA-N 1 1 320.414 3.792 20 5 DHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC000512697630 340373518 /nfs/dbraw/zinc/37/35/18/340373518.db2.gz CYSJWHUVBJRSJZ-ZBFHGGJFSA-N 1 1 311.385 3.842 20 5 DHBDMO CCOc1ccccc1C[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000512744381 340375477 /nfs/dbraw/zinc/37/54/77/340375477.db2.gz LOKUOTFLNQXUFV-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO Cc1ccc([C@@H](C)Nc2ccc3c(c2)[nH+]cn3C)cc1[N+](=O)[O-] ZINC000539741395 340898524 /nfs/dbraw/zinc/89/85/24/340898524.db2.gz QYJOITNMRHSSIN-GFCCVEGCSA-N 1 1 310.357 3.963 20 5 DHBDMO COc1cccc2c1CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000543105621 341032132 /nfs/dbraw/zinc/03/21/32/341032132.db2.gz KQDPDOVDXAIIRO-YVMONPNESA-N 1 1 324.380 3.675 20 5 DHBDMO COc1cccc2c1CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000543105621 341032133 /nfs/dbraw/zinc/03/21/33/341032133.db2.gz KQDPDOVDXAIIRO-YVMONPNESA-N 1 1 324.380 3.675 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCc1ccccc1O ZINC000543249357 341038334 /nfs/dbraw/zinc/03/83/34/341038334.db2.gz QQRZWKPHMKPXQB-AWEZNQCLSA-N 1 1 314.385 3.844 20 5 DHBDMO CCC[C@H](NC[C@H](C)[N@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000130989548 341055725 /nfs/dbraw/zinc/05/57/25/341055725.db2.gz FQQSYOPEULHBMI-GUYCJALGSA-N 1 1 305.422 3.508 20 5 DHBDMO CCC[C@H](NC[C@H](C)[N@@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000130989548 341055726 /nfs/dbraw/zinc/05/57/26/341055726.db2.gz FQQSYOPEULHBMI-GUYCJALGSA-N 1 1 305.422 3.508 20 5 DHBDMO COc1ccc(CCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000072014238 341056929 /nfs/dbraw/zinc/05/69/29/341056929.db2.gz VNXBROSDXVSZBK-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000544611517 341088966 /nfs/dbraw/zinc/08/89/66/341088966.db2.gz FUYPFYBOVJYNKS-JKSUJKDBSA-N 1 1 306.431 3.763 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCOC1 ZINC000132093387 341116203 /nfs/dbraw/zinc/11/62/03/341116203.db2.gz MMKGZXPGKDGBNU-LBPRGKRZSA-N 1 1 318.398 3.544 20 5 DHBDMO CC(C)OC1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000548623414 341267530 /nfs/dbraw/zinc/26/75/30/341267530.db2.gz KAPNFEQAODCJMN-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO CCOc1cccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549810204 341303779 /nfs/dbraw/zinc/30/37/79/341303779.db2.gz OJYOORUJEAAWKQ-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO CCCO[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000266721540 520287460 /nfs/dbraw/zinc/28/74/60/520287460.db2.gz HOPOAESAKZLUNN-GJZGRUSLSA-N 1 1 306.406 3.937 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1O ZINC000156877643 522359294 /nfs/dbraw/zinc/35/92/94/522359294.db2.gz BJYAEJBTQMADEJ-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO COC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000156427744 522377166 /nfs/dbraw/zinc/37/71/66/522377166.db2.gz YLPSCAHZKKCAJP-UKRRQHHQSA-N 1 1 318.373 3.843 20 5 DHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000366002072 524833834 /nfs/dbraw/zinc/83/38/34/524833834.db2.gz UJOYAVZFCFDDPN-SJCJKPOMSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000366002072 524833846 /nfs/dbraw/zinc/83/38/46/524833846.db2.gz UJOYAVZFCFDDPN-SJCJKPOMSA-N 1 1 315.348 3.712 20 5 DHBDMO Cc1c([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cccc1[N+](=O)[O-] ZINC000126608601 525916174 /nfs/dbraw/zinc/91/61/74/525916174.db2.gz LWIFSGGVGPZRNY-HNSVSWJLSA-N 1 1 317.433 3.569 20 5 DHBDMO Cc1c([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cccc1[N+](=O)[O-] ZINC000126608601 525916182 /nfs/dbraw/zinc/91/61/82/525916182.db2.gz LWIFSGGVGPZRNY-HNSVSWJLSA-N 1 1 317.433 3.569 20 5 DHBDMO C[C@H](c1ccccn1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000129455846 526122862 /nfs/dbraw/zinc/12/28/62/526122862.db2.gz LDDWXIYMRMSBAH-LLVKDONJSA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000129455846 526122875 /nfs/dbraw/zinc/12/28/75/526122875.db2.gz LDDWXIYMRMSBAH-LLVKDONJSA-N 1 1 305.765 3.836 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)c(Cl)c1 ZINC000517736056 1013054694 /nfs/dbraw/zinc/05/46/94/1013054694.db2.gz FPRJVBYVXZNZBD-CZUORRHYSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000441487047 1014243067 /nfs/dbraw/zinc/24/30/67/1014243067.db2.gz OFCCKKHOHMFSIF-QLFBSQMISA-N 1 1 304.390 3.627 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CCOC(C)(C)C1 ZINC000580743293 1014326758 /nfs/dbraw/zinc/32/67/58/1014326758.db2.gz NQNADHZHEJFZGB-OAHLLOKOSA-N 1 1 306.406 3.683 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3C3CCC3)nc2c1 ZINC000610581333 1014861439 /nfs/dbraw/zinc/86/14/39/1014861439.db2.gz AOAOEWZVJDKQPT-AWEZNQCLSA-N 1 1 301.346 3.501 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895585930 1015213436 /nfs/dbraw/zinc/21/34/36/1015213436.db2.gz ZVWWJOBIELDJAY-ZDUSSCGKSA-N 1 1 317.414 3.658 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000051212248 1015304101 /nfs/dbraw/zinc/30/41/01/1015304101.db2.gz DOJKUMJZRCABGX-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1cccs1 ZINC000051231146 1015345459 /nfs/dbraw/zinc/34/54/59/1015345459.db2.gz BZGUSRRYMRKXDN-AWEZNQCLSA-N 1 1 318.398 3.872 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]CC2(N(C)C)CCCCC2)cc1[N+](=O)[O-] ZINC000320205043 1015391505 /nfs/dbraw/zinc/39/15/05/1015391505.db2.gz SCOHWESBDNQTAX-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO CC[C@H](CN[C@@H](CC)c1cccc([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000151692086 1015404049 /nfs/dbraw/zinc/40/40/49/1015404049.db2.gz FIDCHDICGOCJJP-WBVHZDCISA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)C1CCCCC1)C1CC1 ZINC000474969259 1015733933 /nfs/dbraw/zinc/73/39/33/1015733933.db2.gz BKHWICXEQBRWEC-SFHVURJKSA-N 1 1 318.417 3.500 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc3[nH]cnc3c2)C2CC2)c1 ZINC000535785933 1015823981 /nfs/dbraw/zinc/82/39/81/1015823981.db2.gz YYWYSMWGYYOASU-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc3nc[nH]c3c2)C2CC2)c1 ZINC000535785933 1015823986 /nfs/dbraw/zinc/82/39/86/1015823986.db2.gz YYWYSMWGYYOASU-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc3nc[nH]c3c2)C2CC2)c1 ZINC000535785933 1015823992 /nfs/dbraw/zinc/82/39/92/1015823992.db2.gz YYWYSMWGYYOASU-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccco1)C(C)C ZINC000346340197 1015834980 /nfs/dbraw/zinc/83/49/80/1015834980.db2.gz BOIKVKBQSXXPML-UHFFFAOYSA-N 1 1 304.346 3.607 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccco1)C(C)C ZINC000346340197 1015834986 /nfs/dbraw/zinc/83/49/86/1015834986.db2.gz BOIKVKBQSXXPML-UHFFFAOYSA-N 1 1 304.346 3.607 20 5 DHBDMO Cc1c([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000089512020 1032144900 /nfs/dbraw/zinc/14/49/00/1032144900.db2.gz UEFQWNHVHIJCHK-LBPRGKRZSA-N 1 1 315.329 3.662 20 5 DHBDMO C[C@H](Nc1sccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000611583556 1016511812 /nfs/dbraw/zinc/51/18/12/1016511812.db2.gz NYBOUXLFJQEEIB-NWDGAFQWSA-N 1 1 309.435 3.721 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000349707079 1016582065 /nfs/dbraw/zinc/58/20/65/1016582065.db2.gz MZEVJNLNXCGNIX-TZMCWYRMSA-N 1 1 322.405 3.623 20 5 DHBDMO CCOC1(C)CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601167756 1016705814 /nfs/dbraw/zinc/70/58/14/1016705814.db2.gz DFGDNHDOIQGBRY-UHFFFAOYSA-N 1 1 315.373 3.538 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000248632031 1016740791 /nfs/dbraw/zinc/74/07/91/1016740791.db2.gz RKPQQCPDRJNGHC-BXUZGUMPSA-N 1 1 308.353 3.507 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@H](O)C2CCCCC2)C2CC2)c1 ZINC000475054968 1016761090 /nfs/dbraw/zinc/76/10/90/1016761090.db2.gz QHPGIKPLCHFGKO-SFHVURJKSA-N 1 1 318.417 3.500 20 5 DHBDMO Cc1cc(Cl)nc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)c1 ZINC000281906486 1016792363 /nfs/dbraw/zinc/79/23/63/1016792363.db2.gz FYERQXQXNYAYAL-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1CCC1 ZINC000127775105 1016862885 /nfs/dbraw/zinc/86/28/85/1016862885.db2.gz UQGKGKAFKLKRCS-UHFFFAOYSA-N 1 1 317.414 3.950 20 5 DHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2ccccc2n1 ZINC000089512112 1032157552 /nfs/dbraw/zinc/15/75/52/1032157552.db2.gz WUBWJNIGDHVGRB-ZDUSSCGKSA-N 1 1 307.353 3.994 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)ccc1Cl ZINC000847037533 1032190801 /nfs/dbraw/zinc/19/08/01/1032190801.db2.gz OPERICXBRPUUGV-CQSZACIVSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](OC3CCC3)C2)ccc1Cl ZINC000847037533 1032190808 /nfs/dbraw/zinc/19/08/08/1032190808.db2.gz OPERICXBRPUUGV-CQSZACIVSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H]1CC[C@H](C2CC2)O1)C1CC1 ZINC001168317349 1032229249 /nfs/dbraw/zinc/22/92/49/1032229249.db2.gz MYQKTLKZCWNHFW-FUHWJXTLSA-N 1 1 316.401 3.517 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H]1CC[C@H](C2CC2)O1)C1CC1 ZINC001168317349 1032229258 /nfs/dbraw/zinc/22/92/58/1032229258.db2.gz MYQKTLKZCWNHFW-FUHWJXTLSA-N 1 1 316.401 3.517 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(C3CC3)ccc2F)cc1 ZINC000295112551 1032279583 /nfs/dbraw/zinc/27/95/83/1032279583.db2.gz LWTOFZRKFOTESK-UHFFFAOYSA-N 1 1 300.333 3.901 20 5 DHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000064029479 1012260250 /nfs/dbraw/zinc/26/02/50/1012260250.db2.gz WCRZVACMSXYQJK-AWEZNQCLSA-N 1 1 317.414 3.733 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(C)cc1 ZINC000430200118 1012321917 /nfs/dbraw/zinc/32/19/17/1012321917.db2.gz FPHLWBDUSPOKJS-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(C)cc1 ZINC000430200118 1012321935 /nfs/dbraw/zinc/32/19/35/1012321935.db2.gz FPHLWBDUSPOKJS-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1cccs1 ZINC000430200975 1012328051 /nfs/dbraw/zinc/32/80/51/1012328051.db2.gz IPBYUJKRIJPWCA-LLVKDONJSA-N 1 1 306.387 3.858 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)c1cccs1 ZINC000430200975 1012328071 /nfs/dbraw/zinc/32/80/71/1012328071.db2.gz IPBYUJKRIJPWCA-LLVKDONJSA-N 1 1 306.387 3.858 20 5 DHBDMO COc1ccc(Cl)cc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000015107272 1012580031 /nfs/dbraw/zinc/58/00/31/1012580031.db2.gz SFDYPQYUESCFJS-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000015107272 1012580042 /nfs/dbraw/zinc/58/00/42/1012580042.db2.gz SFDYPQYUESCFJS-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)Nc1ccc(C(=O)CC)cc1[N+](=O)[O-] ZINC000516992008 1012881741 /nfs/dbraw/zinc/88/17/41/1012881741.db2.gz FGTOGCGEOYSIGQ-ZDUSSCGKSA-N 1 1 321.421 3.720 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](C3CC3)C3CCCC3)nc2c1 ZINC000083168391 1017607085 /nfs/dbraw/zinc/60/70/85/1017607085.db2.gz JTDSBYDSIWQTGK-UHFFFAOYSA-N 1 1 301.346 3.643 20 5 DHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444651430 1017607766 /nfs/dbraw/zinc/60/77/66/1017607766.db2.gz VFZOYRLTQVVBCV-BLLLJJGKSA-N 1 1 316.405 3.872 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1F ZINC000444659756 1017610708 /nfs/dbraw/zinc/61/07/08/1017610708.db2.gz DZJNWBHZEZGSAZ-RISCZKNCSA-N 1 1 310.369 3.753 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC1(c2ccccc2)CC1 ZINC000444683136 1017628705 /nfs/dbraw/zinc/62/87/05/1017628705.db2.gz DDCYEHRDXCZXHB-UHFFFAOYSA-N 1 1 310.397 3.801 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000524425723 1017992687 /nfs/dbraw/zinc/99/26/87/1017992687.db2.gz BVBHQURVZXBBKX-LJQANCHMSA-N 1 1 310.397 3.844 20 5 DHBDMO O=[N+]([O-])c1cccc(CNc2cc[nH+]c3ccc(Cl)cc23)c1 ZINC000524461836 1018003265 /nfs/dbraw/zinc/00/32/65/1018003265.db2.gz JMEOLFOZHMLVNA-UHFFFAOYSA-N 1 1 313.744 3.830 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H]2CC2(Cl)Cl)C2CC2)cc1 ZINC000764493179 1018293187 /nfs/dbraw/zinc/29/31/87/1018293187.db2.gz PEDQLZJLDXRPSS-NSHDSACASA-N 1 1 315.200 3.753 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CC2(Cl)Cl)C2CC2)cc1 ZINC000764493179 1018293194 /nfs/dbraw/zinc/29/31/94/1018293194.db2.gz PEDQLZJLDXRPSS-NSHDSACASA-N 1 1 315.200 3.753 20 5 DHBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000248330576 1018354185 /nfs/dbraw/zinc/35/41/85/1018354185.db2.gz DOTXXPSPLSLDJE-OLZOCXBDSA-N 1 1 315.373 3.523 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000584111192 1018962098 /nfs/dbraw/zinc/96/20/98/1018962098.db2.gz QDGZNRBFIAXHBT-CYBMUJFWSA-N 1 1 317.776 3.633 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cc(F)c(F)c(F)c1 ZINC000540829739 1019379302 /nfs/dbraw/zinc/37/93/02/1019379302.db2.gz RGVKRPCKAVOWFC-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cccc(C)c2C)cc1[N+](=O)[O-] ZINC000611268105 1019428585 /nfs/dbraw/zinc/42/85/85/1019428585.db2.gz LQGCKBMXWMBEJP-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO C[N@@H+](CCCNc1sccc1[N+](=O)[O-])Cc1ccccc1 ZINC000611411409 1019474120 /nfs/dbraw/zinc/47/41/20/1019474120.db2.gz TYIGNQUGOZVPHW-UHFFFAOYSA-N 1 1 305.403 3.590 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2sccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000611413472 1019476905 /nfs/dbraw/zinc/47/69/05/1019476905.db2.gz WHVYFBGQGJMMNY-TZMCWYRMSA-N 1 1 317.414 3.731 20 5 DHBDMO COc1cc(C[N@@H+]2CCCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000611515783 1019508310 /nfs/dbraw/zinc/50/83/10/1019508310.db2.gz XQILVSUXIJLMGQ-UHFFFAOYSA-N 1 1 318.398 3.613 20 5 DHBDMO COc1cc(C[N@H+]2CCCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000611515783 1019508315 /nfs/dbraw/zinc/50/83/15/1019508315.db2.gz XQILVSUXIJLMGQ-UHFFFAOYSA-N 1 1 318.398 3.613 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000255831119 1019605896 /nfs/dbraw/zinc/60/58/96/1019605896.db2.gz NLWRKZBQAGOLPL-POZKEBTKSA-N 1 1 323.396 3.794 20 5 DHBDMO CCc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000347602168 1019762046 /nfs/dbraw/zinc/76/20/46/1019762046.db2.gz CEXQCCVOYQNZCU-UHFFFAOYSA-N 1 1 313.401 3.963 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCCC[C@@H]1C1CCC1 ZINC001171752668 1032857524 /nfs/dbraw/zinc/85/75/24/1032857524.db2.gz VZAXOYPTLWYJSM-OAHLLOKOSA-N 1 1 304.390 3.628 20 5 DHBDMO CSCC[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093509502 1020156857 /nfs/dbraw/zinc/15/68/57/1020156857.db2.gz PMZWQRPLEWXVEJ-UHFFFAOYSA-N 1 1 306.387 3.650 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc(F)c2)C2CC2)c1 ZINC000603859213 1020204812 /nfs/dbraw/zinc/20/48/12/1020204812.db2.gz TTZYNCNMSOSXQD-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO CC(C)n1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000179317753 1020251179 /nfs/dbraw/zinc/25/11/79/1020251179.db2.gz SOKZXAFUODOLFM-UHFFFAOYSA-N 1 1 314.389 3.537 20 5 DHBDMO CC(C)n1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000179317753 1020251187 /nfs/dbraw/zinc/25/11/87/1020251187.db2.gz SOKZXAFUODOLFM-UHFFFAOYSA-N 1 1 314.389 3.537 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCc3cccnc32)c(Cl)c1 ZINC000922880500 1020326417 /nfs/dbraw/zinc/32/64/17/1020326417.db2.gz DAOKJCCWRBJICP-HNNXBMFYSA-N 1 1 317.776 3.810 20 5 DHBDMO CC[C@@H](C)[N@@H+](CC)Cc1cc([N+](=O)[O-])ccc1Br ZINC001171917545 1032920291 /nfs/dbraw/zinc/92/02/91/1032920291.db2.gz ZIMFDBLSFOZJEY-SNVBAGLBSA-N 1 1 315.211 3.978 20 5 DHBDMO O=[N+]([O-])c1ccc(N2CCC[N@H+](C3CCCC3)CC2)c(Cl)c1 ZINC000737416381 1020844254 /nfs/dbraw/zinc/84/42/54/1020844254.db2.gz BMZASPXGBZSPTB-UHFFFAOYSA-N 1 1 323.824 3.703 20 5 DHBDMO CCC[C@@]1(C)CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000743404196 1021284659 /nfs/dbraw/zinc/28/46/59/1021284659.db2.gz MLSNGQQZZCSZPM-KRWDZBQOSA-N 1 1 316.405 3.804 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccccc1F ZINC000743848746 1021375880 /nfs/dbraw/zinc/37/58/80/1021375880.db2.gz CIUCYYUPJOJGJB-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000744201251 1021468530 /nfs/dbraw/zinc/46/85/30/1021468530.db2.gz VUARFPCIIRCQKH-MRXNPFEDSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000744201251 1021468537 /nfs/dbraw/zinc/46/85/37/1021468537.db2.gz VUARFPCIIRCQKH-MRXNPFEDSA-N 1 1 316.332 3.777 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1c(C)cccc1F ZINC000850440046 1021535869 /nfs/dbraw/zinc/53/58/69/1021535869.db2.gz VMXAONHSRLEHNG-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000744442059 1021546258 /nfs/dbraw/zinc/54/62/58/1021546258.db2.gz WBZHVTXCGMOFEK-GHMZBOCLSA-N 1 1 321.402 3.950 20 5 DHBDMO CC[C@H](CSC)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541119764 1021664805 /nfs/dbraw/zinc/66/48/05/1021664805.db2.gz GVUARSCNRJHOOM-LLVKDONJSA-N 1 1 302.827 3.822 20 5 DHBDMO CC(C)C[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000746055742 1021837600 /nfs/dbraw/zinc/83/76/00/1021837600.db2.gz CVSCQQLQYWNOMH-UHFFFAOYSA-N 1 1 316.405 3.803 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCCCC1 ZINC000619739252 1021854442 /nfs/dbraw/zinc/85/44/42/1021854442.db2.gz OMTSSKABQLZZSZ-UHFFFAOYSA-N 1 1 302.378 3.626 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]2CF)o1 ZINC000556950131 1021965872 /nfs/dbraw/zinc/96/58/72/1021965872.db2.gz NMHQJZXDWFUGPJ-LBPRGKRZSA-N 1 1 304.321 3.789 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]2CF)o1 ZINC000556950131 1021965883 /nfs/dbraw/zinc/96/58/83/1021965883.db2.gz NMHQJZXDWFUGPJ-LBPRGKRZSA-N 1 1 304.321 3.789 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H](c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000851749459 1021991475 /nfs/dbraw/zinc/99/14/75/1021991475.db2.gz ZFMSYSHKYXQXNF-OAHLLOKOSA-N 1 1 315.373 3.661 20 5 DHBDMO CC[C@H](C)[C@@H](C)[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776583137 1022095655 /nfs/dbraw/zinc/09/56/55/1022095655.db2.gz XQHNEDYDKVHNOY-OGHNNQOOSA-N 1 1 306.406 3.527 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000183311810 1022101111 /nfs/dbraw/zinc/10/11/11/1022101111.db2.gz KDZPYNXWLFMOFS-QGZVFWFLSA-N 1 1 311.385 3.590 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000183338243 1022102584 /nfs/dbraw/zinc/10/25/84/1022102584.db2.gz JNHBDGLUJFVMBX-ZDUSSCGKSA-N 1 1 300.358 3.802 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)Cc1ccc(O)cc1 ZINC000183339365 1022102624 /nfs/dbraw/zinc/10/26/24/1022102624.db2.gz LGLAUDVMJGILIK-CQSZACIVSA-N 1 1 314.385 3.672 20 5 DHBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CCC(C)(C)CC1 ZINC000776588842 1022115557 /nfs/dbraw/zinc/11/55/57/1022115557.db2.gz CJFUJVZRGWWUEB-MRXNPFEDSA-N 1 1 306.406 3.529 20 5 DHBDMO CO[C@H](C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)C1CCCC1 ZINC001168849169 1022161165 /nfs/dbraw/zinc/16/11/65/1022161165.db2.gz WHDANYYHAHIFJP-GOSISDBHSA-N 1 1 318.417 3.764 20 5 DHBDMO CC(C)CC[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000921050971 1022210304 /nfs/dbraw/zinc/21/03/04/1022210304.db2.gz ZVZFOPMSXAIKEY-UHFFFAOYSA-N 1 1 309.391 3.807 20 5 DHBDMO CC[C@@H]1CO[C@](C)(CCC(C)C)[N@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169038912 1022221953 /nfs/dbraw/zinc/22/19/53/1022221953.db2.gz LGCIPCDGLCNJGR-WCXIOVBPSA-N 1 1 312.454 3.695 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000853261337 1022247004 /nfs/dbraw/zinc/24/70/04/1022247004.db2.gz UYJYRTMHQFXKIG-LLVKDONJSA-N 1 1 322.315 3.640 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1cccc([N+](=O)[O-])c1 ZINC000182112916 1022265287 /nfs/dbraw/zinc/26/52/87/1022265287.db2.gz COJSCZHQTCCVLC-OAHLLOKOSA-N 1 1 305.765 3.884 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000609705137 1022336887 /nfs/dbraw/zinc/33/68/87/1022336887.db2.gz SZUQTMUUNFZTJQ-LBPRGKRZSA-N 1 1 306.749 3.831 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278826259 1022388483 /nfs/dbraw/zinc/38/84/83/1022388483.db2.gz QBENAVOSWZJHQO-GHMZBOCLSA-N 1 1 302.296 3.930 20 5 DHBDMO C[N@H+](CCC1CC1)Cc1cccc([N+](=O)[O-])c1Br ZINC000310950598 1022923676 /nfs/dbraw/zinc/92/36/76/1022923676.db2.gz LZUUDQALKMHHQU-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO C[N@@H+](CCC1CC1)Cc1cccc([N+](=O)[O-])c1Br ZINC000310950598 1022923685 /nfs/dbraw/zinc/92/36/85/1022923685.db2.gz LZUUDQALKMHHQU-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO CC[N@@H+](CC(=O)NC)Cc1c2ccccc2cc2ccccc21 ZINC000768301651 1022942870 /nfs/dbraw/zinc/94/28/70/1022942870.db2.gz GDTAQLYVOQAHFX-UHFFFAOYSA-N 1 1 306.409 3.561 20 5 DHBDMO Cc1csc(C2([NH2+]Cc3cccc([N+](=O)[O-])c3)CCCC2)n1 ZINC000171842449 1022976567 /nfs/dbraw/zinc/97/65/67/1022976567.db2.gz ODKKSOLPWPGIHG-UHFFFAOYSA-N 1 1 317.414 3.919 20 5 DHBDMO C[N@H+](Cc1cccc(O)c1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768553199 1022989145 /nfs/dbraw/zinc/98/91/45/1022989145.db2.gz BNMLDGQEFCMVDR-UHFFFAOYSA-N 1 1 306.749 3.586 20 5 DHBDMO C[N@@H+](Cc1cccc(O)c1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768553199 1022989151 /nfs/dbraw/zinc/98/91/51/1022989151.db2.gz BNMLDGQEFCMVDR-UHFFFAOYSA-N 1 1 306.749 3.586 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@@H]2CC2(Cl)Cl)C2CC2)c1 ZINC000768544974 1022993824 /nfs/dbraw/zinc/99/38/24/1022993824.db2.gz WQGUXRXWNSRLKG-NSHDSACASA-N 1 1 315.200 3.753 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H]2CC2(Cl)Cl)C2CC2)c1 ZINC000768544974 1022993830 /nfs/dbraw/zinc/99/38/30/1022993830.db2.gz WQGUXRXWNSRLKG-NSHDSACASA-N 1 1 315.200 3.753 20 5 DHBDMO CCNC(=O)C[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000768916101 1023054856 /nfs/dbraw/zinc/05/48/56/1023054856.db2.gz SGIVQSFGZULLKL-UHFFFAOYSA-N 1 1 306.409 3.561 20 5 DHBDMO CC[C@@H]1CCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769009412 1023079114 /nfs/dbraw/zinc/07/91/14/1023079114.db2.gz QWZWTVNFSCOQAN-SNVBAGLBSA-N 1 1 313.195 3.732 20 5 DHBDMO C[C@H]1C[C@H](C)[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769471231 1023160954 /nfs/dbraw/zinc/16/09/54/1023160954.db2.gz RNMAZLFRYQOEAJ-UWVGGRQHSA-N 1 1 313.195 3.588 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccccc2F)C2CC2)cc1 ZINC000108086766 1023524767 /nfs/dbraw/zinc/52/47/67/1023524767.db2.gz UZBMTUGGSYKRDL-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO C[N@@H+](CCC1CC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000746636337 1023759823 /nfs/dbraw/zinc/75/98/23/1023759823.db2.gz DCZZTGWABJJROE-UHFFFAOYSA-N 1 1 307.375 3.561 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788467844 1023889465 /nfs/dbraw/zinc/88/94/65/1023889465.db2.gz ALQPCVWHVLMUDB-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccccc1Cl ZINC000058562957 1024059132 /nfs/dbraw/zinc/05/91/32/1024059132.db2.gz YWWKBXYLMQZQKK-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccccc1Cl ZINC000058562957 1024059150 /nfs/dbraw/zinc/05/91/50/1024059150.db2.gz YWWKBXYLMQZQKK-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)nc1 ZINC000789590622 1024121686 /nfs/dbraw/zinc/12/16/86/1024121686.db2.gz WGWPWUILGXTVHI-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)nc1 ZINC000789590622 1024121694 /nfs/dbraw/zinc/12/16/94/1024121694.db2.gz WGWPWUILGXTVHI-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO C[C@@H]1C[C@@H](C)[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000162910285 1024177588 /nfs/dbraw/zinc/17/75/88/1024177588.db2.gz LXJHLRQBKGHXPJ-NXEZZACHSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000162910285 1024177601 /nfs/dbraw/zinc/17/76/01/1024177601.db2.gz LXJHLRQBKGHXPJ-NXEZZACHSA-N 1 1 313.195 3.588 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]C2CCN(C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000269060744 1024233077 /nfs/dbraw/zinc/23/30/77/1024233077.db2.gz XUAMHATXYOKKER-AWEZNQCLSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c(C[NH2+][C@@H](C)c2cccnc2Cl)cccc1[N+](=O)[O-] ZINC000790695300 1024357894 /nfs/dbraw/zinc/35/78/94/1024357894.db2.gz MTJVRZCKJAQQIQ-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)cc1[N+](=O)[O-] ZINC000105498641 1024389134 /nfs/dbraw/zinc/38/91/34/1024389134.db2.gz CQOHPOAQYWLTIC-UHFFFAOYSA-N 1 1 319.430 3.947 20 5 DHBDMO CCC[C@@H](C)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000270651428 1024414486 /nfs/dbraw/zinc/41/44/86/1024414486.db2.gz UDKLJVIHNZMUQH-GFCCVEGCSA-N 1 1 303.362 3.870 20 5 DHBDMO CCCC[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877900982 1033503145 /nfs/dbraw/zinc/50/31/45/1033503145.db2.gz PEKXZXLIOUSYFI-UHFFFAOYSA-N 1 1 324.768 3.530 20 5 DHBDMO CCC[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000453361326 1024486296 /nfs/dbraw/zinc/48/62/96/1024486296.db2.gz QWJOWNWPZODOHQ-KCXAZCMYSA-N 1 1 314.389 3.928 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCC(C)(C)[NH+]1CCCCC1 ZINC000532188539 1024572907 /nfs/dbraw/zinc/57/29/07/1024572907.db2.gz LYONNYNYIDKFHY-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO COc1cc(C[N@@H+](C)C(C)(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000585754357 1024595187 /nfs/dbraw/zinc/59/51/87/1024595187.db2.gz JRGNHMLEWBAVOJ-UHFFFAOYSA-N 1 1 314.385 3.971 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000585767908 1024604486 /nfs/dbraw/zinc/60/44/86/1024604486.db2.gz FCFGQEXIBVHJRI-BXBOZWQASA-N 1 1 316.401 3.501 20 5 DHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000747077743 1024676693 /nfs/dbraw/zinc/67/66/93/1024676693.db2.gz YDHIOGGSAROMEC-HNNXBMFYSA-N 1 1 316.405 3.803 20 5 DHBDMO CC(C)[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1cccnc1 ZINC000349287020 1024695759 /nfs/dbraw/zinc/69/57/59/1024695759.db2.gz UAXPXBUCIFDFOQ-TWGQIWQCSA-N 1 1 311.385 3.914 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001170328306 1024743251 /nfs/dbraw/zinc/74/32/51/1024743251.db2.gz JBTHJSTVNGXQSQ-ZIAGYGMSSA-N 1 1 306.406 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H](C)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170347992 1024756637 /nfs/dbraw/zinc/75/66/37/1024756637.db2.gz UNJRKOODBWBGKX-IHRRRGAJSA-N 1 1 306.406 3.655 20 5 DHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1ccccn1 ZINC000350454170 1024815641 /nfs/dbraw/zinc/81/56/41/1024815641.db2.gz DYTVGMUVWZMHKJ-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1ccccn1 ZINC000350454170 1024815658 /nfs/dbraw/zinc/81/56/58/1024815658.db2.gz DYTVGMUVWZMHKJ-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879191 1024818989 /nfs/dbraw/zinc/81/89/89/1024818989.db2.gz FRBFCSVDLXBYHH-RISCZKNCSA-N 1 1 307.350 3.514 20 5 DHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879189 1024821193 /nfs/dbraw/zinc/82/11/93/1024821193.db2.gz FRBFCSVDLXBYHH-BXUZGUMPSA-N 1 1 307.350 3.514 20 5 DHBDMO CC(C)[C@H]1CCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899548 1024835784 /nfs/dbraw/zinc/83/57/84/1024835784.db2.gz WQDSYCMAGLFOBR-QGZVFWFLSA-N 1 1 314.389 3.536 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1coc3ccccc13)CC2 ZINC000353608357 1025148866 /nfs/dbraw/zinc/14/88/66/1025148866.db2.gz GJYLYPTXMQPXMA-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1coc3ccccc13)CC2 ZINC000353608357 1025148883 /nfs/dbraw/zinc/14/88/83/1025148883.db2.gz GJYLYPTXMQPXMA-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000804476415 1025307453 /nfs/dbraw/zinc/30/74/53/1025307453.db2.gz WYZGSJIDXNNUHX-UHFFFAOYSA-N 1 1 323.824 3.703 20 5 DHBDMO C[N@H+](Cc1ccc[nH]1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000354025733 1025326298 /nfs/dbraw/zinc/32/62/98/1025326298.db2.gz IRCJCTLNZJZQAV-UHFFFAOYSA-N 1 1 311.341 3.815 20 5 DHBDMO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000354025733 1025326309 /nfs/dbraw/zinc/32/63/09/1025326309.db2.gz IRCJCTLNZJZQAV-UHFFFAOYSA-N 1 1 311.341 3.815 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000886052461 1025454024 /nfs/dbraw/zinc/45/40/24/1025454024.db2.gz QZTLKCWIIOBSML-KRWDZBQOSA-N 1 1 309.369 3.642 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000886052461 1025454034 /nfs/dbraw/zinc/45/40/34/1025454034.db2.gz QZTLKCWIIOBSML-KRWDZBQOSA-N 1 1 309.369 3.642 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](CCc1ccccc1)C1CC1 ZINC000728917466 1025456960 /nfs/dbraw/zinc/45/69/60/1025456960.db2.gz GIXLFQVTNCRDNG-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](CCc1ccccc1)C1CC1 ZINC000728917466 1025456967 /nfs/dbraw/zinc/45/69/67/1025456967.db2.gz GIXLFQVTNCRDNG-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO CCOc1ccccc1[C@H](CC)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886107732 1025508336 /nfs/dbraw/zinc/50/83/36/1025508336.db2.gz YQHOQNQTETXANF-HNNXBMFYSA-N 1 1 315.373 3.629 20 5 DHBDMO CCCC[N@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H](C)c1ccccc1 ZINC000355343214 1025685814 /nfs/dbraw/zinc/68/58/14/1025685814.db2.gz ZKAMVALDGWFCKW-CQSZACIVSA-N 1 1 316.405 3.692 20 5 DHBDMO CCCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H](C)c1ccccc1 ZINC000355343214 1025685819 /nfs/dbraw/zinc/68/58/19/1025685819.db2.gz ZKAMVALDGWFCKW-CQSZACIVSA-N 1 1 316.405 3.692 20 5 DHBDMO CC(C)([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000886896903 1025973490 /nfs/dbraw/zinc/97/34/90/1025973490.db2.gz YESYRQSIKPPCBN-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO CSCC[N@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000093509392 1026088486 /nfs/dbraw/zinc/08/84/86/1026088486.db2.gz MQKAYQZWTDEPCS-UHFFFAOYSA-N 1 1 323.443 3.513 20 5 DHBDMO CSCC[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000093509392 1026088504 /nfs/dbraw/zinc/08/85/04/1026088504.db2.gz MQKAYQZWTDEPCS-UHFFFAOYSA-N 1 1 323.443 3.513 20 5 DHBDMO C[C@H]1[C@@H](C)[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000419367604 1026274129 /nfs/dbraw/zinc/27/41/29/1026274129.db2.gz DHIBKNAFUPOZDT-JHJVBQTASA-N 1 1 315.373 3.726 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)cc1 ZINC000120620245 1026338158 /nfs/dbraw/zinc/33/81/58/1026338158.db2.gz GIPUFIHHQBFVCI-UHFFFAOYSA-N 1 1 312.369 3.713 20 5 DHBDMO CO[C@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000280133348 1026596505 /nfs/dbraw/zinc/59/65/05/1026596505.db2.gz CNZRBMURTDJRMD-OAHLLOKOSA-N 1 1 312.797 3.639 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)cn2c1 ZINC000571338259 1027122206 /nfs/dbraw/zinc/12/22/06/1027122206.db2.gz CEHCDOGWQWKCGT-CQSZACIVSA-N 1 1 324.384 3.710 20 5 DHBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000156700727 1027146704 /nfs/dbraw/zinc/14/67/04/1027146704.db2.gz KQZKZDSBBYXDBP-HOTGVXAUSA-N 1 1 306.406 3.529 20 5 DHBDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]c1ccc2c(c1)CCN2 ZINC000423220261 1027461896 /nfs/dbraw/zinc/46/18/96/1027461896.db2.gz VFPYJPVTBFVCIB-ZDUSSCGKSA-N 1 1 311.385 3.996 20 5 DHBDMO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000575929987 1027528695 /nfs/dbraw/zinc/52/86/95/1027528695.db2.gz YMEFHKYIYGIGSG-GUYCJALGSA-N 1 1 314.385 3.986 20 5 DHBDMO C[C@@]1([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])CCOc2ccccc21 ZINC000933368435 1027725560 /nfs/dbraw/zinc/72/55/60/1027725560.db2.gz DNZMMWKGNGYDCL-QGZVFWFLSA-N 1 1 316.332 3.521 20 5 DHBDMO CCC[C@](C)([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1ccccc1 ZINC000934180423 1027918191 /nfs/dbraw/zinc/91/81/91/1027918191.db2.gz QXBOQRQGCCOPGD-INIZCTEOSA-N 1 1 303.362 3.696 20 5 DHBDMO C[C@@H]1CC(F)(F)CCN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000601204082 1028023614 /nfs/dbraw/zinc/02/36/14/1028023614.db2.gz ZGAAPLDFDLREPM-SNVBAGLBSA-N 1 1 307.300 3.767 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cccc(F)c1F ZINC000601302084 1028066266 /nfs/dbraw/zinc/06/62/66/1028066266.db2.gz FSCXFOZPHDLAAR-CQSZACIVSA-N 1 1 304.296 3.650 20 5 DHBDMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000217198328 1028218400 /nfs/dbraw/zinc/21/84/00/1028218400.db2.gz YRWPFXZXMIAHDB-QGZVFWFLSA-N 1 1 314.360 3.723 20 5 DHBDMO C[C@H]1[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CCC12CCOCC2 ZINC000368832566 1028415211 /nfs/dbraw/zinc/41/52/11/1028415211.db2.gz FQCIBVOVQQVLDG-GFCCVEGCSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC(C)(C)C1 ZINC000565425265 1028586665 /nfs/dbraw/zinc/58/66/65/1028586665.db2.gz DDINIMYSXUCEIS-LLVKDONJSA-N 1 1 303.362 3.604 20 5 DHBDMO C[C@H]([NH2+][C@H]1c2cccc(F)c2O[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000370573374 1028620803 /nfs/dbraw/zinc/62/08/03/1028620803.db2.gz DHBGNHOVFFVBQM-XMZIXOGTSA-N 1 1 316.332 3.907 20 5 DHBDMO Cc1ccc(C[N@H+](C)[C@@H]2CCCc3cccnc32)cc1[N+](=O)[O-] ZINC000372769264 1028895132 /nfs/dbraw/zinc/89/51/32/1028895132.db2.gz UGKMATDVRKCGOE-MRXNPFEDSA-N 1 1 311.385 3.808 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000449687604 1028926085 /nfs/dbraw/zinc/92/60/85/1028926085.db2.gz QFHNHABNWFNPIM-GOSISDBHSA-N 1 1 318.417 3.721 20 5 DHBDMO COC[C@@H]1CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000449774919 1028987549 /nfs/dbraw/zinc/98/75/49/1028987549.db2.gz LMQAVODKMAROPG-RBFDBLARSA-N 1 1 318.417 3.747 20 5 DHBDMO CCCc1nc(C)c(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])o1 ZINC000568532351 1029087300 /nfs/dbraw/zinc/08/73/00/1029087300.db2.gz DYDNSARSBBLMQQ-AWEZNQCLSA-N 1 1 315.373 3.621 20 5 DHBDMO Cc1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc(C)n1 ZINC000817411939 1029152324 /nfs/dbraw/zinc/15/23/24/1029152324.db2.gz ZRLOAZKMFCOOBV-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCCCC(F)(F)F)CC2 ZINC000155446233 1029234127 /nfs/dbraw/zinc/23/41/27/1029234127.db2.gz YHUPOSPVNLIAJE-UHFFFAOYSA-N 1 1 302.296 3.686 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCCCC(F)(F)F)CC2 ZINC000155446233 1029234136 /nfs/dbraw/zinc/23/41/36/1029234136.db2.gz YHUPOSPVNLIAJE-UHFFFAOYSA-N 1 1 302.296 3.686 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)cc1F ZINC000374924240 1029500176 /nfs/dbraw/zinc/50/01/76/1029500176.db2.gz CMWZYZHATSIWLU-INIZCTEOSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1F ZINC000374924240 1029500180 /nfs/dbraw/zinc/50/01/80/1029500180.db2.gz CMWZYZHATSIWLU-INIZCTEOSA-N 1 1 316.332 3.777 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2ccncc2)C1 ZINC000451000647 1029762200 /nfs/dbraw/zinc/76/22/00/1029762200.db2.gz GGZPZANJVSZHBU-GOEBONIOSA-N 1 1 311.385 3.930 20 5 DHBDMO Cc1cnc([C@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451545913 1029908544 /nfs/dbraw/zinc/90/85/44/1029908544.db2.gz HVDKQKGEEXJSRT-ZFWWWQNUSA-N 1 1 315.373 3.832 20 5 DHBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549102 1029913142 /nfs/dbraw/zinc/91/31/42/1029913142.db2.gz OXZAIMXXGIYAOE-GDBMZVCRSA-N 1 1 311.385 3.930 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](Cc3ccccc3)C3CC3)nc2c1 ZINC000357210891 1029951021 /nfs/dbraw/zinc/95/10/21/1029951021.db2.gz RMSNKJJGTJROTJ-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](Cc3ccccc3)C3CC3)nc2c1 ZINC000357210891 1029951042 /nfs/dbraw/zinc/95/10/42/1029951042.db2.gz RMSNKJJGTJROTJ-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO C[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC[C@@H]1C ZINC000467839487 1029974773 /nfs/dbraw/zinc/97/47/73/1029974773.db2.gz MXOKHFPCAXTRHV-ZNMIVQPWSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1C ZINC000467839487 1029974786 /nfs/dbraw/zinc/97/47/86/1029974786.db2.gz MXOKHFPCAXTRHV-ZNMIVQPWSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](c1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451963687 1030069722 /nfs/dbraw/zinc/06/97/22/1030069722.db2.gz HXZXBFZVKDLTAO-CJNGLKHVSA-N 1 1 306.431 3.875 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@]4(CC4(F)F)C3)c2c1 ZINC000865911981 1030082579 /nfs/dbraw/zinc/08/25/79/1030082579.db2.gz XTPHNUOKSUIQKX-HNNXBMFYSA-N 1 1 319.311 3.769 20 5 DHBDMO C[C@H]1C[C@H](Nc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000557589814 1030204559 /nfs/dbraw/zinc/20/45/59/1030204559.db2.gz ZHLJVTIAUDQWAM-WCBMZHEXSA-N 1 1 318.204 3.796 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCN(C)c2ccccc2C1 ZINC000533413959 1030339776 /nfs/dbraw/zinc/33/97/76/1030339776.db2.gz DWXORUGTHQHMKV-CQSZACIVSA-N 1 1 311.385 3.608 20 5 DHBDMO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805839045 1030396937 /nfs/dbraw/zinc/39/69/37/1030396937.db2.gz NGTCJWRPZMQRKN-KMFMINBZSA-N 1 1 320.433 3.775 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccnc(Cl)c2F)cc1[N+](=O)[O-] ZINC000823961093 1030434343 /nfs/dbraw/zinc/43/43/43/1030434343.db2.gz KWCBTMGWAHBZRB-SNVBAGLBSA-N 1 1 323.755 3.942 20 5 DHBDMO CC[C@H]([NH2+]Cc1nc(C)sc1C)c1cccc([N+](=O)[O-])c1 ZINC000358358340 1030454331 /nfs/dbraw/zinc/45/43/31/1030454331.db2.gz RTJRHKDUEDWRFC-AWEZNQCLSA-N 1 1 305.403 3.909 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc2c1OCO2)c1ccccc1[N+](=O)[O-] ZINC000925696275 1030455061 /nfs/dbraw/zinc/45/50/61/1030455061.db2.gz YXYMRHARWZQTCY-NEPJUHHUSA-N 1 1 314.341 3.735 20 5 DHBDMO COc1ccsc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291662123 1030586549 /nfs/dbraw/zinc/58/65/49/1030586549.db2.gz FFJGAEVIOWFECQ-UHFFFAOYSA-N 1 1 306.387 3.690 20 5 DHBDMO CC[C@H](NCC(C)(C)[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000359369840 1030932053 /nfs/dbraw/zinc/93/20/53/1030932053.db2.gz LHAFVNKUROZSCK-KRWDZBQOSA-N 1 1 319.449 3.900 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844440169 1031142823 /nfs/dbraw/zinc/14/28/23/1031142823.db2.gz QXTGTXOJVWDMJH-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844440169 1031142830 /nfs/dbraw/zinc/14/28/30/1031142830.db2.gz QXTGTXOJVWDMJH-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO CCC[C@H](NC[C@H](CC)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000360054405 1031259261 /nfs/dbraw/zinc/25/92/61/1031259261.db2.gz MRUBUMADUMXVDI-WMZOPIPTSA-N 1 1 319.449 3.900 20 5 DHBDMO CCc1ccc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)s1 ZINC000536672440 1031384525 /nfs/dbraw/zinc/38/45/25/1031384525.db2.gz LNJPGPKAQUWMSQ-UHFFFAOYSA-N 1 1 302.399 3.777 20 5 DHBDMO CCc1ccc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)s1 ZINC000536672440 1031384538 /nfs/dbraw/zinc/38/45/38/1031384538.db2.gz LNJPGPKAQUWMSQ-UHFFFAOYSA-N 1 1 302.399 3.777 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H]1C[C@H]1c1ccccc1)CC2 ZINC000536677281 1031386587 /nfs/dbraw/zinc/38/65/87/1031386587.db2.gz IKIBCHOMUBJWHX-MJGOQNOKSA-N 1 1 308.381 3.757 20 5 DHBDMO COc1ccccc1/C=C/C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000536678001 1031389551 /nfs/dbraw/zinc/38/95/51/1031389551.db2.gz QNUVXNQNPMRMCC-GQCTYLIASA-N 1 1 324.380 3.675 20 5 DHBDMO COc1ccccc1/C=C/C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000536678001 1031389561 /nfs/dbraw/zinc/38/95/61/1031389561.db2.gz QNUVXNQNPMRMCC-GQCTYLIASA-N 1 1 324.380 3.675 20 5 DHBDMO CCC[NH+]1CCC(CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872033178 1031416127 /nfs/dbraw/zinc/41/61/27/1031416127.db2.gz GFRJEJGRGXNTLM-ZDUSSCGKSA-N 1 1 323.412 3.507 20 5 DHBDMO Cc1cc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc(C)n1 ZINC000872079590 1031476728 /nfs/dbraw/zinc/47/67/28/1031476728.db2.gz JHWDVFODVRMTBG-LBPRGKRZSA-N 1 1 303.337 3.597 20 5 DHBDMO CCC[C@H]([NH2+][C@@H](C)c1nccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000872132579 1031526183 /nfs/dbraw/zinc/52/61/83/1031526183.db2.gz GPXPPERJVKVOPD-BBRMVZONSA-N 1 1 314.389 3.885 20 5 DHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCSC1 ZINC000293690085 1031571729 /nfs/dbraw/zinc/57/17/29/1031571729.db2.gz BTKQPRHHFLFSGN-NSHDSACASA-N 1 1 320.336 3.551 20 5 DHBDMO COc1ccccc1-c1ccc([C@H](C)[N@H+](C)CC[N+](=O)[O-])cc1 ZINC000929710305 1031584611 /nfs/dbraw/zinc/58/46/11/1031584611.db2.gz NQLYLDFBLFROSL-AWEZNQCLSA-N 1 1 314.385 3.632 20 5 DHBDMO COc1ccccc1-c1ccc([C@H](C)[N@@H+](C)CC[N+](=O)[O-])cc1 ZINC000929710305 1031584620 /nfs/dbraw/zinc/58/46/20/1031584620.db2.gz NQLYLDFBLFROSL-AWEZNQCLSA-N 1 1 314.385 3.632 20 5 DHBDMO CCC[C@@H](NCC[N@@H+](CC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000360922293 1031624602 /nfs/dbraw/zinc/62/46/02/1031624602.db2.gz NOAZJFWGTNFNOG-QGZVFWFLSA-N 1 1 307.438 3.756 20 5 DHBDMO CCC[C@@H]([NH2+]CCN(CC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000360922293 1031624605 /nfs/dbraw/zinc/62/46/05/1031624605.db2.gz NOAZJFWGTNFNOG-QGZVFWFLSA-N 1 1 307.438 3.756 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc(Cl)cn1 ZINC000873100871 1031710721 /nfs/dbraw/zinc/71/07/21/1031710721.db2.gz HJOFBNNOOQNUQI-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cc(F)cnc1Cl ZINC000873129335 1031721052 /nfs/dbraw/zinc/72/10/52/1031721052.db2.gz NCIRQXPOTJBASE-UHFFFAOYSA-N 1 1 323.755 3.689 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000476231303 1031773417 /nfs/dbraw/zinc/77/34/17/1031773417.db2.gz LJYKFCANXPXFEL-HNNXBMFYSA-N 1 1 312.369 3.593 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(CNc3ccc(C4CC4)c[nH+]3)nc2c1 ZINC000897715098 1031809710 /nfs/dbraw/zinc/80/97/10/1031809710.db2.gz FWDJEZOQUGNZJQ-UHFFFAOYSA-N 1 1 310.313 3.621 20 5 DHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777957507 1032041953 /nfs/dbraw/zinc/04/19/53/1032041953.db2.gz RITQDLCOJHQUAV-XJKSGUPXSA-N 1 1 314.389 3.536 20 5 DHBDMO C[C@H]([N@@H+](C)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1(C)CC1 ZINC000777962353 1032045228 /nfs/dbraw/zinc/04/52/28/1032045228.db2.gz AOHPFRHQPHXBJP-ZDUSSCGKSA-N 1 1 314.389 3.536 20 5 DHBDMO CSC1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000877663741 1033403158 /nfs/dbraw/zinc/40/31/58/1033403158.db2.gz XYPSQKZTESDAIB-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+](CC1CC1)C1CC1)CC2 ZINC001172913944 1033461822 /nfs/dbraw/zinc/46/18/22/1033461822.db2.gz WIUJJGBDNZILAJ-INIZCTEOSA-N 1 1 300.402 3.717 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@H](CF)C1)CC2 ZINC001172916527 1033464288 /nfs/dbraw/zinc/46/42/88/1033464288.db2.gz TXCOHBFKUBVYKL-CJNGLKHVSA-N 1 1 306.381 3.524 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@]3(CC3(F)F)C1)CC2 ZINC001172917694 1033465021 /nfs/dbraw/zinc/46/50/21/1033465021.db2.gz WLAVDUHSEFJPKS-ZBFHGGJFSA-N 1 1 322.355 3.573 20 5 DHBDMO C[N@@H+](C[C@H]1CC1(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172919226 1033466027 /nfs/dbraw/zinc/46/60/27/1033466027.db2.gz FJXYRRBBRXOCFG-CVEARBPZSA-N 1 1 302.418 3.820 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC3(CCC3)C1)CC2 ZINC001172912671 1033484566 /nfs/dbraw/zinc/48/45/66/1033484566.db2.gz CDCRPUYGOQSSDT-MRXNPFEDSA-N 1 1 300.402 3.718 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@H](C)[C@@H]2C)c1F ZINC001173190928 1033584025 /nfs/dbraw/zinc/58/40/25/1033584025.db2.gz XRAHTWCNTUHFJO-AGIUHOORSA-N 1 1 324.396 3.794 20 5 DHBDMO CCCC[N@@H+](CC)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173186340 1033585046 /nfs/dbraw/zinc/58/50/46/1033585046.db2.gz REKJVGAIPGPVDC-GFCCVEGCSA-N 1 1 312.385 3.796 20 5 DHBDMO COc1ccccc1C[N@@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173226003 1033603487 /nfs/dbraw/zinc/60/34/87/1033603487.db2.gz GYLPQSNMOUOKTK-AWEZNQCLSA-N 1 1 314.385 3.666 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](F)C(F)(F)CC1 ZINC001173224245 1033603542 /nfs/dbraw/zinc/60/35/42/1033603542.db2.gz DDMOHYXSQJCQOK-BXUZGUMPSA-N 1 1 316.323 3.595 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2CC(F)(F)C[C@@H]2C1 ZINC001173222000 1033603576 /nfs/dbraw/zinc/60/35/76/1033603576.db2.gz OFBUBUIRBKPDLN-BNOWGMLFSA-N 1 1 310.344 3.503 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCOc1ccccc1 ZINC001173228256 1033604780 /nfs/dbraw/zinc/60/47/80/1033604780.db2.gz UVGHAHQYFBWDNZ-HNNXBMFYSA-N 1 1 314.385 3.537 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1ccncc1 ZINC001173228818 1033606254 /nfs/dbraw/zinc/60/62/54/1033606254.db2.gz ZACOQKQCJQDSLH-RDTXWAMCSA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1Cc2cccc(F)c2C1 ZINC001173234862 1033608226 /nfs/dbraw/zinc/60/82/26/1033608226.db2.gz UKKRWVOCUVFTBB-GFCCVEGCSA-N 1 1 300.333 3.681 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1Cc2cccc(F)c2C1 ZINC001173234862 1033608228 /nfs/dbraw/zinc/60/82/28/1033608228.db2.gz UKKRWVOCUVFTBB-GFCCVEGCSA-N 1 1 300.333 3.681 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1cccc(F)c1 ZINC001173233400 1033608666 /nfs/dbraw/zinc/60/86/66/1033608666.db2.gz WGMXRPSUNYBXOR-CQSZACIVSA-N 1 1 316.376 3.839 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2scnc2Cl)cc1[N+](=O)[O-] ZINC000878371476 1033679128 /nfs/dbraw/zinc/67/91/28/1033679128.db2.gz LXGJZKYPEXOCBX-SECBINFHSA-N 1 1 311.794 3.864 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC=C(c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000878617040 1033770304 /nfs/dbraw/zinc/77/03/04/1033770304.db2.gz HWCYNZDADDREMZ-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO CC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)CC(C)(C)C ZINC000878636710 1033778509 /nfs/dbraw/zinc/77/85/09/1033778509.db2.gz MMWBPVWFNGVAMO-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO Cc1cncc([C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000879747200 1034110545 /nfs/dbraw/zinc/11/05/45/1034110545.db2.gz KHAHCUUPDMBBCW-GOSISDBHSA-N 1 1 311.385 3.678 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3nccs3)C2)ccc1Cl ZINC000880320347 1034297414 /nfs/dbraw/zinc/29/74/14/1034297414.db2.gz SLICSUUMDSVLHF-NSHDSACASA-N 1 1 323.805 3.694 20 5 DHBDMO CC(C)n1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000179320450 1034301644 /nfs/dbraw/zinc/30/16/44/1034301644.db2.gz LLMQDKBXLLKGBU-UHFFFAOYSA-N 1 1 316.405 3.783 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2C[C@@H]3CC[C@H]2c2ccccc23)cc1 ZINC000880535452 1034351959 /nfs/dbraw/zinc/35/19/59/1034351959.db2.gz CPZVCYHZKFPPBF-ZOCIIQOWSA-N 1 1 324.380 3.563 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000480658306 1034378531 /nfs/dbraw/zinc/37/85/31/1034378531.db2.gz AWQRZOPEQBDETG-CVEARBPZSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1c([C@@H](C)[NH2+][C@H](C)CN2CCCCCC2)cccc1[N+](=O)[O-] ZINC000480700321 1034411622 /nfs/dbraw/zinc/41/16/22/1034411622.db2.gz QPTSYBMXRUUJET-GDBMZVCRSA-N 1 1 319.449 3.818 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC(C)(C)[C@H]2CCC[C@H]21 ZINC000555720959 1034874818 /nfs/dbraw/zinc/87/48/18/1034874818.db2.gz BLMYKAZIUQMOAA-LSDHHAIUSA-N 1 1 304.390 3.614 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)cc1 ZINC000481677696 1034930998 /nfs/dbraw/zinc/93/09/98/1034930998.db2.gz PXJIDYRTUZZSTA-LJQANCHMSA-N 1 1 324.380 3.616 20 5 DHBDMO Cc1c([C@@H](C)NC[C@H](C)[NH+]2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000481976592 1035039508 /nfs/dbraw/zinc/03/95/08/1035039508.db2.gz ZYVGDHXZXASOHM-GOEBONIOSA-N 1 1 319.449 3.674 20 5 DHBDMO CC(C)[N@@H+](CCc1nccs1)Cc1cccc([N+](=O)[O-])c1 ZINC000159783039 1035088627 /nfs/dbraw/zinc/08/86/27/1035088627.db2.gz VYHUDMLKBZYJCU-UHFFFAOYSA-N 1 1 305.403 3.504 20 5 DHBDMO Cc1[nH+]ccn1-c1ccc(Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC001175736634 1035098387 /nfs/dbraw/zinc/09/83/87/1035098387.db2.gz FFZAQPKNGQRIBJ-UHFFFAOYSA-N 1 1 312.304 3.972 20 5 DHBDMO C[C@]1(c2ccc(F)cc2)CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000482560054 1035135137 /nfs/dbraw/zinc/13/51/37/1035135137.db2.gz SVIQJHLVCRXFRE-INIZCTEOSA-N 1 1 320.389 3.959 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1CCN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000482954620 1035205195 /nfs/dbraw/zinc/20/51/95/1035205195.db2.gz FDRVNKQHJLKRDX-GOEBONIOSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@@H]1CCCCN1CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000482954620 1035205201 /nfs/dbraw/zinc/20/52/01/1035205201.db2.gz FDRVNKQHJLKRDX-GOEBONIOSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)nc2c1 ZINC000483853146 1035307306 /nfs/dbraw/zinc/30/73/06/1035307306.db2.gz FPIODMWIGJNJJF-CYBMUJFWSA-N 1 1 324.384 3.939 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)[nH]c2c1 ZINC000483853146 1035307309 /nfs/dbraw/zinc/30/73/09/1035307309.db2.gz FPIODMWIGJNJJF-CYBMUJFWSA-N 1 1 324.384 3.939 20 5 DHBDMO Cc1noc(C[N@H+]2CCCCC23CCCCCC3)c1[N+](=O)[O-] ZINC001176958877 1035340515 /nfs/dbraw/zinc/34/05/15/1035340515.db2.gz JOIUJWDXYLDHJG-UHFFFAOYSA-N 1 1 307.394 3.970 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CC(Cc3ccccc3Cl)C2)cc1 ZINC000485289671 1035520031 /nfs/dbraw/zinc/52/00/31/1035520031.db2.gz IHKFQIGDGRRNSW-UHFFFAOYSA-N 1 1 316.788 3.923 20 5 DHBDMO C[C@@]1(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCCS1 ZINC001179909456 1035549076 /nfs/dbraw/zinc/54/90/76/1035549076.db2.gz MLAABHPTXBSQPI-INIZCTEOSA-N 1 1 306.431 3.845 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCOc2ccccc2C1 ZINC001180039153 1035573466 /nfs/dbraw/zinc/57/34/66/1035573466.db2.gz MZVLVBOUXKXXIP-UHFFFAOYSA-N 1 1 312.369 3.606 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCOc2ccccc2C1 ZINC001180039153 1035573463 /nfs/dbraw/zinc/57/34/63/1035573463.db2.gz MZVLVBOUXKXXIP-UHFFFAOYSA-N 1 1 312.369 3.606 20 5 DHBDMO COc1cc(C[N@@H+]2CC[C@@H](C)C(C)(C)C2)c([N+](=O)[O-])cc1F ZINC001193208172 1035586525 /nfs/dbraw/zinc/58/65/25/1035586525.db2.gz BRPVSRHYROUHIA-LLVKDONJSA-N 1 1 310.369 3.611 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@H](C)C(C)(C)C2)c([N+](=O)[O-])cc1F ZINC001193208172 1035586536 /nfs/dbraw/zinc/58/65/36/1035586536.db2.gz BRPVSRHYROUHIA-LLVKDONJSA-N 1 1 310.369 3.611 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC001180081952 1035588720 /nfs/dbraw/zinc/58/87/20/1035588720.db2.gz OTVAHIZVLFHVJX-LLVKDONJSA-N 1 1 314.307 3.846 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)Cc1cccc(F)c1 ZINC001180497197 1035704251 /nfs/dbraw/zinc/70/42/51/1035704251.db2.gz DTIUEWQCGGFTRD-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089907260 1035784318 /nfs/dbraw/zinc/78/43/18/1035784318.db2.gz WKVKEDDWHOLWGN-QWHCGFSZSA-N 1 1 315.373 3.870 20 5 DHBDMO CCn1cc(C[N@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cn1 ZINC000539826882 1035887780 /nfs/dbraw/zinc/88/77/80/1035887780.db2.gz FCJDBSQWUGXKBS-UHFFFAOYSA-N 1 1 316.405 3.567 20 5 DHBDMO CCn1cc(C[N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cn1 ZINC000539826882 1035887798 /nfs/dbraw/zinc/88/77/98/1035887798.db2.gz FCJDBSQWUGXKBS-UHFFFAOYSA-N 1 1 316.405 3.567 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1cccs1)C1CC1 ZINC000027107827 1036134310 /nfs/dbraw/zinc/13/43/10/1036134310.db2.gz HEYVBBFMUAMVGW-UHFFFAOYSA-N 1 1 318.398 3.830 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1cccs1)C1CC1 ZINC000027107827 1036134319 /nfs/dbraw/zinc/13/43/19/1036134319.db2.gz HEYVBBFMUAMVGW-UHFFFAOYSA-N 1 1 318.398 3.830 20 5 DHBDMO Cc1noc(C[N@@H+]2CC[C@@H](C)C3(CCCCC3)C2)c1[N+](=O)[O-] ZINC000595438910 1036159210 /nfs/dbraw/zinc/15/92/10/1036159210.db2.gz JYTYDWCWDOIFNO-GFCCVEGCSA-N 1 1 307.394 3.684 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@@H]([C@@H]3CCCC3(C)C)C2)c1[N+](=O)[O-] ZINC000595558958 1036235050 /nfs/dbraw/zinc/23/50/50/1036235050.db2.gz RMDKHNONOLJFMC-OLZOCXBDSA-N 1 1 307.394 3.539 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000541772462 1036427771 /nfs/dbraw/zinc/42/77/71/1036427771.db2.gz AIOMIDPWBQWKBL-GOSISDBHSA-N 1 1 318.417 3.827 20 5 DHBDMO Cc1ccc(C)c(C[N@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)c1 ZINC000762049402 1036477261 /nfs/dbraw/zinc/47/72/61/1036477261.db2.gz BTNLXIVTCCQXTE-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1ccc(C)c(C[N@@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)c1 ZINC000762049402 1036477272 /nfs/dbraw/zinc/47/72/72/1036477272.db2.gz BTNLXIVTCCQXTE-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO COc1ccc2c(c1)C[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000491430561 1036571911 /nfs/dbraw/zinc/57/19/11/1036571911.db2.gz JFHKJZWLHMPFTB-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc2c(c1)C[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000491430561 1036571927 /nfs/dbraw/zinc/57/19/27/1036571927.db2.gz JFHKJZWLHMPFTB-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO CC(C)[C@H](C)[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636490 1036601211 /nfs/dbraw/zinc/60/12/11/1036601211.db2.gz UYPTWFAKTAULMQ-JTQLQIEISA-N 1 1 310.785 3.532 20 5 DHBDMO CC(C)[C@H](C)[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000915207963 1036705267 /nfs/dbraw/zinc/70/52/67/1036705267.db2.gz AHCJEWVYRLKDFH-JTQLQIEISA-N 1 1 309.391 3.806 20 5 DHBDMO CCOc1cc(C[N@H+]2CCCC[C@H](SC)C2)ccc1[N+](=O)[O-] ZINC000492556454 1036919287 /nfs/dbraw/zinc/91/92/87/1036919287.db2.gz FZBPVPQNXHIZND-AWEZNQCLSA-N 1 1 324.446 3.711 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(F)(C2CC2)CC1 ZINC001198386625 1037010925 /nfs/dbraw/zinc/01/09/25/1037010925.db2.gz FTDGOOYFUDBESU-UHFFFAOYSA-N 1 1 312.772 3.962 20 5 DHBDMO Cc1cccnc1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001198641365 1037089932 /nfs/dbraw/zinc/08/99/32/1037089932.db2.gz PYAAPGDOSPEDJR-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774863494 1037131521 /nfs/dbraw/zinc/13/15/21/1037131521.db2.gz NRNKXDOOEUULSZ-CQSZACIVSA-N 1 1 321.377 3.904 20 5 DHBDMO COc1ccc(C[N@H+]2CC=CC23CCCCC3)cc1[N+](=O)[O-] ZINC001198800982 1037138748 /nfs/dbraw/zinc/13/87/48/1037138748.db2.gz PCUZVCJYHBSAMZ-UHFFFAOYSA-N 1 1 302.374 3.678 20 5 DHBDMO CC1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000774910275 1037203358 /nfs/dbraw/zinc/20/33/58/1037203358.db2.gz VCLVVQVUSSNKCD-UHFFFAOYSA-N 1 1 307.350 3.515 20 5 DHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)C1 ZINC000775052445 1037499432 /nfs/dbraw/zinc/49/94/32/1037499432.db2.gz DHJRFZABHSYDCG-MLGOLLRUSA-N 1 1 319.361 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c(Cl)c1 ZINC001186872265 1037510817 /nfs/dbraw/zinc/51/08/17/1037510817.db2.gz LQQSXBJBVNAUGU-GJZGRUSLSA-N 1 1 309.797 3.677 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000490397653 1037703209 /nfs/dbraw/zinc/70/32/09/1037703209.db2.gz IUZBMXYUNNEFTG-AWEZNQCLSA-N 1 1 312.410 3.842 20 5 DHBDMO COc1cccc([C@H](C)[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153004999 1038036416 /nfs/dbraw/zinc/03/64/16/1038036416.db2.gz LFEFNGGAVYQFQU-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc([C@H](C)[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153004999 1038036435 /nfs/dbraw/zinc/03/64/35/1038036435.db2.gz LFEFNGGAVYQFQU-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000570983714 1038063191 /nfs/dbraw/zinc/06/31/91/1038063191.db2.gz PAQAVJHPJODWLG-QGZVFWFLSA-N 1 1 316.401 3.758 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000570983714 1038063208 /nfs/dbraw/zinc/06/32/08/1038063208.db2.gz PAQAVJHPJODWLG-QGZVFWFLSA-N 1 1 316.401 3.758 20 5 DHBDMO CC[N@@H+](c1ccc(Nc2cccnc2[N+](=O)[O-])cc1)C(C)C ZINC000916976813 1038100836 /nfs/dbraw/zinc/10/08/36/1038100836.db2.gz GWHQJULZOSXXIL-UHFFFAOYSA-N 1 1 300.362 3.968 20 5 DHBDMO CC[N@H+](c1ccc(Nc2cccnc2[N+](=O)[O-])cc1)C(C)C ZINC000916976813 1038100846 /nfs/dbraw/zinc/10/08/46/1038100846.db2.gz GWHQJULZOSXXIL-UHFFFAOYSA-N 1 1 300.362 3.968 20 5 DHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H](C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000164537528 1038205438 /nfs/dbraw/zinc/20/54/38/1038205438.db2.gz KRKJEKIYLICCJG-CYBMUJFWSA-N 1 1 321.421 3.598 20 5 DHBDMO CC[C@@H](C)[C@H](C)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001190911986 1038406734 /nfs/dbraw/zinc/40/67/34/1038406734.db2.gz AFPQGVUBKJXXKZ-KGLIPLIRSA-N 1 1 306.406 3.873 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cs1 ZINC000589743974 1038535776 /nfs/dbraw/zinc/53/57/76/1038535776.db2.gz VKOWHAMJPSQMSM-RBSFLKMASA-N 1 1 324.446 3.562 20 5 DHBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001192173259 1038597425 /nfs/dbraw/zinc/59/74/25/1038597425.db2.gz HLALPGJZLCQODO-PBHICJAKSA-N 1 1 306.406 3.874 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC3(CC3)CC2)c1 ZINC000590169368 1038597909 /nfs/dbraw/zinc/59/79/09/1038597909.db2.gz ZGPLMQAXWAHTOJ-UHFFFAOYSA-N 1 1 314.307 3.990 20 5 DHBDMO Cc1nc(C)c(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000590757627 1038700024 /nfs/dbraw/zinc/70/00/24/1038700024.db2.gz RZMHAUGXXYHSBQ-OAHLLOKOSA-N 1 1 315.373 3.579 20 5 DHBDMO CC[C@@H](C)C[N@@H+](CC)Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761294729 1038942466 /nfs/dbraw/zinc/94/24/66/1038942466.db2.gz ZORDTKGHJBPOCS-GFCCVEGCSA-N 1 1 304.394 3.578 20 5 DHBDMO CSc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])o1 ZINC000603430199 1038972002 /nfs/dbraw/zinc/97/20/02/1038972002.db2.gz VWZYVJVDTRUJDA-UHFFFAOYSA-N 1 1 306.387 3.935 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H]2CC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599075008 1039030968 /nfs/dbraw/zinc/03/09/68/1039030968.db2.gz ZNASPFKFWVYSRR-WMLDXEAASA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599075008 1039030989 /nfs/dbraw/zinc/03/09/89/1039030989.db2.gz ZNASPFKFWVYSRR-WMLDXEAASA-N 1 1 317.433 3.571 20 5 DHBDMO CC(C)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131245 1039125644 /nfs/dbraw/zinc/12/56/44/1039125644.db2.gz URQVHHVRZBNDEF-QAQDUYKDSA-N 1 1 320.433 3.746 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccccc3F)CCC2)cs1 ZINC000592144585 1039137989 /nfs/dbraw/zinc/13/79/89/1039137989.db2.gz OHIYFTANYJXESZ-UHFFFAOYSA-N 1 1 306.362 3.964 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592183144 1039163448 /nfs/dbraw/zinc/16/34/48/1039163448.db2.gz RURKPMQXSBNOEL-KBPBESRZSA-N 1 1 304.390 3.547 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592181773 1039163904 /nfs/dbraw/zinc/16/39/04/1039163904.db2.gz HUXBUABTYYJEOY-UONOGXRCSA-N 1 1 304.390 3.547 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592183970 1039171712 /nfs/dbraw/zinc/17/17/12/1039171712.db2.gz MQCNYCKYRDTVQG-HUUCEWRRSA-N 1 1 318.417 3.855 20 5 DHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000603845908 1039180501 /nfs/dbraw/zinc/18/05/01/1039180501.db2.gz AQICZPWHSPOVJK-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCCC[C@H]3C3CCC3)nc2c1 ZINC000592197410 1039181212 /nfs/dbraw/zinc/18/12/12/1039181212.db2.gz CBSNUROMCMRDDG-INIZCTEOSA-N 1 1 314.389 3.626 20 5 DHBDMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000573985075 1039193935 /nfs/dbraw/zinc/19/39/35/1039193935.db2.gz MPOFCJAKOXCHFV-VHSXEESVSA-N 1 1 302.296 3.844 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c(Cl)c1 ZINC000599552623 1039212220 /nfs/dbraw/zinc/21/22/20/1039212220.db2.gz GPXNMSGKSLGBGG-OLZOCXBDSA-N 1 1 312.822 3.718 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000599572947 1039218028 /nfs/dbraw/zinc/21/80/28/1039218028.db2.gz DCYBHAQSFPZVGH-QGZVFWFLSA-N 1 1 315.348 3.760 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000604013227 1039279678 /nfs/dbraw/zinc/27/96/78/1039279678.db2.gz TXWXRJSSYAGGLA-QGZVFWFLSA-N 1 1 304.390 3.628 20 5 DHBDMO CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000604011989 1039280775 /nfs/dbraw/zinc/28/07/75/1039280775.db2.gz BLTKHOJNEAXEBD-UHFFFAOYSA-N 1 1 314.385 3.886 20 5 DHBDMO CC(C)O[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000593054228 1039378578 /nfs/dbraw/zinc/37/85/78/1039378578.db2.gz RTHIUJIFVNQLHV-AWEZNQCLSA-N 1 1 312.797 3.638 20 5 DHBDMO CC(C)O[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000593054228 1039378596 /nfs/dbraw/zinc/37/85/96/1039378596.db2.gz RTHIUJIFVNQLHV-AWEZNQCLSA-N 1 1 312.797 3.638 20 5 DHBDMO CCC(CC)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000604434806 1039474030 /nfs/dbraw/zinc/47/40/30/1039474030.db2.gz PSVUEBROQXMZOQ-UHFFFAOYSA-N 1 1 320.389 3.614 20 5 DHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000059391546 1039952369 /nfs/dbraw/zinc/95/23/69/1039952369.db2.gz ZWJSNPQZLPRHCE-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594027736 1039956715 /nfs/dbraw/zinc/95/67/15/1039956715.db2.gz ZFXLKPYNJPRCOU-PBHICJAKSA-N 1 1 318.417 3.998 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1(c2ccccc2)CC1 ZINC000595023383 1039983714 /nfs/dbraw/zinc/98/37/14/1039983714.db2.gz QBQHWZCJSHDYKC-CYBMUJFWSA-N 1 1 312.369 3.943 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000595327813 1040097806 /nfs/dbraw/zinc/09/78/06/1040097806.db2.gz SGESCYQOHABNGJ-MRXNPFEDSA-N 1 1 322.380 3.658 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@@H](c3ccccc3C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000595323571 1040108840 /nfs/dbraw/zinc/10/88/40/1040108840.db2.gz ZKJKAIRKRVOLBB-JSGCOSHPSA-N 1 1 315.373 3.578 20 5 DHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595377401 1040127501 /nfs/dbraw/zinc/12/75/01/1040127501.db2.gz NHUBLGDQQIJJGT-NSHDSACASA-N 1 1 300.399 3.697 20 5 DHBDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595408213 1040129997 /nfs/dbraw/zinc/12/99/97/1040129997.db2.gz JTAGIEBFKLJHOE-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO Cc1noc(C[NH2+][C@H](c2ccc(F)c(C)c2)C2CC2)c1[N+](=O)[O-] ZINC000595425582 1040135233 /nfs/dbraw/zinc/13/52/33/1040135233.db2.gz UKXUKGPILGRTQA-HNNXBMFYSA-N 1 1 319.336 3.580 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)c1[N+](=O)[O-] ZINC000595425172 1040136625 /nfs/dbraw/zinc/13/66/25/1040136625.db2.gz YSJLGTWPNHOTNV-HNNXBMFYSA-N 1 1 315.373 3.912 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@H](c3ccc(C)cc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000595479628 1040150683 /nfs/dbraw/zinc/15/06/83/1040150683.db2.gz GAVFXZPOIFXNLC-IUODEOHRSA-N 1 1 315.373 3.578 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@H](c2ccccn2)C1 ZINC000595501328 1040154502 /nfs/dbraw/zinc/15/45/02/1040154502.db2.gz OEQGFJZHGBBEMT-ZDUSSCGKSA-N 1 1 315.348 3.509 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000595501328 1040154509 /nfs/dbraw/zinc/15/45/09/1040154509.db2.gz OEQGFJZHGBBEMT-ZDUSSCGKSA-N 1 1 315.348 3.509 20 5 DHBDMO Cc1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)o1 ZINC000595522057 1040159837 /nfs/dbraw/zinc/15/98/37/1040159837.db2.gz IEMLGTMHVKNMDG-OAHLLOKOSA-N 1 1 315.373 3.579 20 5 DHBDMO CC[C@@H](C)[N@@H+](CC)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000595600868 1040201629 /nfs/dbraw/zinc/20/16/29/1040201629.db2.gz QGQMOKNWAUDFRC-GFCCVEGCSA-N 1 1 303.362 3.870 20 5 DHBDMO COc1ccc2c(c1)CC[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000595760290 1040231735 /nfs/dbraw/zinc/23/17/35/1040231735.db2.gz SKOVQATWBPBUII-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc2c(c1)CC[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000595760290 1040231754 /nfs/dbraw/zinc/23/17/54/1040231754.db2.gz SKOVQATWBPBUII-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000595786424 1040254191 /nfs/dbraw/zinc/25/41/91/1040254191.db2.gz ABWJJNLNMRRKSG-VKJFTORMSA-N 1 1 318.417 3.937 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000595788268 1040256733 /nfs/dbraw/zinc/25/67/33/1040256733.db2.gz HXAVPYIEVWQWRP-KYJSFNMBSA-N 1 1 318.417 3.937 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1NCc1c(C)cc(C)[nH+]c1C ZINC000601924813 1040823141 /nfs/dbraw/zinc/82/31/41/1040823141.db2.gz FRIZIMSHAFLKIX-UHFFFAOYSA-N 1 1 301.346 3.536 20 5 DHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000602846143 1041275342 /nfs/dbraw/zinc/27/53/42/1041275342.db2.gz NDBMLJCRTVWMAO-GFCCVEGCSA-N 1 1 322.434 3.633 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C[C@H](C)O1 ZINC000016049963 182031363 /nfs/dbraw/zinc/03/13/63/182031363.db2.gz MPVKCONTWVYEQH-OKILXGFUSA-N 1 1 323.392 3.555 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C[C@H](C)O1 ZINC000016049963 182031365 /nfs/dbraw/zinc/03/13/65/182031365.db2.gz MPVKCONTWVYEQH-OKILXGFUSA-N 1 1 323.392 3.555 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000042976780 183325493 /nfs/dbraw/zinc/32/54/93/183325493.db2.gz CUOMYHOCOSEOQH-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCC2(CCOCC2)C1 ZINC000272293130 130017623 /nfs/dbraw/zinc/01/76/23/130017623.db2.gz HKBKCFOWEUPSNX-HNNXBMFYSA-N 1 1 318.417 3.857 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000272409645 130028010 /nfs/dbraw/zinc/02/80/10/130028010.db2.gz FOQPBSMSGHVPKD-KGLIPLIRSA-N 1 1 314.389 3.567 20 5 DHBDMO CO[C@@]1(C)CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000280497698 130804668 /nfs/dbraw/zinc/80/46/68/130804668.db2.gz MRWAAGZRCPRZKP-PBHICJAKSA-N 1 1 306.406 3.855 20 5 DHBDMO C[C@H]([NH2+]C1(c2ccccc2F)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284917779 131122255 /nfs/dbraw/zinc/12/22/55/131122255.db2.gz CYIAZMPZNVFQKT-NSHDSACASA-N 1 1 315.348 3.656 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H](c3ccncc3)C2)cccc1[N+](=O)[O-] ZINC000289269839 131370108 /nfs/dbraw/zinc/37/01/08/131370108.db2.gz DYOCVTVPHWJNHC-QGZVFWFLSA-N 1 1 311.385 3.678 20 5 DHBDMO C[C@]12CC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000298195022 132050413 /nfs/dbraw/zinc/05/04/13/132050413.db2.gz BUDBJPGHVZKBPK-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@]12CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000298195022 132050414 /nfs/dbraw/zinc/05/04/14/132050414.db2.gz BUDBJPGHVZKBPK-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000120079363 132139817 /nfs/dbraw/zinc/13/98/17/132139817.db2.gz UGTJVLCOMINNSF-GFCCVEGCSA-N 1 1 315.329 3.662 20 5 DHBDMO CCc1cc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc(C)[nH+]1 ZINC000543877288 435648709 /nfs/dbraw/zinc/64/87/09/435648709.db2.gz VFDAJBKAQBJQLW-NSHDSACASA-N 1 1 300.362 3.737 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccn(C(C)C)n1 ZINC000584284684 332211304 /nfs/dbraw/zinc/21/13/04/332211304.db2.gz PHBIXXZGCMDHSY-CYBMUJFWSA-N 1 1 302.378 3.531 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000584292314 332220718 /nfs/dbraw/zinc/22/07/18/332220718.db2.gz GFXYTLHLCIRJOF-MZLJFPOFSA-N 1 1 316.401 3.642 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000584292311 332220781 /nfs/dbraw/zinc/22/07/81/332220781.db2.gz GFXYTLHLCIRJOF-AAWPKVBNSA-N 1 1 316.401 3.642 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cn3ccccc3n2)cc1[N+](=O)[O-] ZINC000559918132 332292796 /nfs/dbraw/zinc/29/27/96/332292796.db2.gz RSZINSUYMFYSHX-KBPBESRZSA-N 1 1 324.384 3.963 20 5 DHBDMO CC(C)c1ccc(CNCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000518763444 333007014 /nfs/dbraw/zinc/00/70/14/333007014.db2.gz LJPDSAPKHZKGCG-OAHLLOKOSA-N 1 1 319.449 3.682 20 5 DHBDMO CC(C)c1ccc(CNCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000518763444 333007015 /nfs/dbraw/zinc/00/70/15/333007015.db2.gz LJPDSAPKHZKGCG-OAHLLOKOSA-N 1 1 319.449 3.682 20 5 DHBDMO COc1cccc(Cl)c1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000118447756 333219158 /nfs/dbraw/zinc/21/91/58/333219158.db2.gz OQEZXRLSVFDCIS-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO CCC[C@H]([NH2+]C1CCN(CCC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000120711095 333307135 /nfs/dbraw/zinc/30/71/35/333307135.db2.gz WNNQFETVTZDAGJ-SFHVURJKSA-N 1 1 319.449 3.900 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)cn2c1 ZINC000571338258 333760550 /nfs/dbraw/zinc/76/05/50/333760550.db2.gz CEHCDOGWQWKCGT-AWEZNQCLSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)[N@@H+]1CCC[C@H](C)C1 ZINC000531937943 334295849 /nfs/dbraw/zinc/29/58/49/334295849.db2.gz ZFLMOJVPHOXSIH-BPUTZDHNSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000531937943 334295851 /nfs/dbraw/zinc/29/58/51/334295851.db2.gz ZFLMOJVPHOXSIH-BPUTZDHNSA-N 1 1 319.449 3.674 20 5 DHBDMO C[N@@H+](CCCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000534601033 334296361 /nfs/dbraw/zinc/29/63/61/334296361.db2.gz QPQHFVCLHMAEIK-UHFFFAOYSA-N 1 1 302.349 3.799 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCN(C)c1ccccc1 ZINC000303317513 334316581 /nfs/dbraw/zinc/31/65/81/334316581.db2.gz SNLJLTVFUZRKPU-OAHLLOKOSA-N 1 1 313.401 3.724 20 5 DHBDMO COCC[C@H]1CCCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000332341293 336169192 /nfs/dbraw/zinc/16/91/92/336169192.db2.gz QWOFVUCYDRVDDJ-HUUCEWRRSA-N 1 1 306.406 3.794 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2sccc2C)ccc1[N+](=O)[O-] ZINC000351970716 336184365 /nfs/dbraw/zinc/18/43/65/336184365.db2.gz HYIYEDLLYZHYSS-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@@H+]2C/C=C/c2ccccc2[N+](=O)[O-])on1 ZINC000352087512 336194171 /nfs/dbraw/zinc/19/41/71/336194171.db2.gz OGDOVMOANWKYBY-RRGWEWPQSA-N 1 1 313.357 3.742 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@H+]2C/C=C/c2ccccc2[N+](=O)[O-])on1 ZINC000352087512 336194174 /nfs/dbraw/zinc/19/41/74/336194174.db2.gz OGDOVMOANWKYBY-RRGWEWPQSA-N 1 1 313.357 3.742 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352426756 336217943 /nfs/dbraw/zinc/21/79/43/336217943.db2.gz XUDCUIJUVGKGOA-CQSZACIVSA-N 1 1 324.446 3.711 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCO[C@@H](C)C1 ZINC000352717261 336231996 /nfs/dbraw/zinc/23/19/96/336231996.db2.gz HXCSRZLOFNDIBS-HOCLYGCPSA-N 1 1 306.406 3.620 20 5 DHBDMO C[C@H]([N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)(C)C ZINC000532489320 336250264 /nfs/dbraw/zinc/25/02/64/336250264.db2.gz AAOIAHLKBGQESG-NSHDSACASA-N 1 1 318.377 3.511 20 5 DHBDMO CC(=O)c1ccc(Nc2ccc3c(c2)[nH+]c(C)n3C)c([N+](=O)[O-])c1 ZINC000301463661 336308359 /nfs/dbraw/zinc/30/83/59/336308359.db2.gz VVIDFQPNQIQUSH-UHFFFAOYSA-N 1 1 324.340 3.736 20 5 DHBDMO Cc1ccc(CNc2sccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000302038361 336344779 /nfs/dbraw/zinc/34/47/79/336344779.db2.gz GQEXUPVEZVYRHG-UHFFFAOYSA-N 1 1 318.402 3.572 20 5 DHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000376551861 337036565 /nfs/dbraw/zinc/03/65/65/337036565.db2.gz JFDQXWPSCWOEPG-SJCJKPOMSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000376551861 337036566 /nfs/dbraw/zinc/03/65/66/337036566.db2.gz JFDQXWPSCWOEPG-SJCJKPOMSA-N 1 1 315.348 3.712 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC3(C2)CCOCC3)cc1[N+](=O)[O-] ZINC000376820098 337041966 /nfs/dbraw/zinc/04/19/66/337041966.db2.gz YHDCUCYRRIDZLY-UHFFFAOYSA-N 1 1 318.417 3.721 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(c2ccccn2)CC1 ZINC000378260551 337068933 /nfs/dbraw/zinc/06/89/33/337068933.db2.gz MUMHZWJHCYZKEI-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000173404542 337135060 /nfs/dbraw/zinc/13/50/60/337135060.db2.gz RTDNVRRHHGRNHZ-MEDUHNTESA-N 1 1 316.332 3.908 20 5 DHBDMO CSCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182339462 337188052 /nfs/dbraw/zinc/18/80/52/337188052.db2.gz NIXZRXPFDOWUHJ-JTQLQIEISA-N 1 1 302.827 3.822 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCCOc2cc(F)ccc21 ZINC000182127852 337186637 /nfs/dbraw/zinc/18/66/37/337186637.db2.gz VBVQJUHOOVVVQT-OAHLLOKOSA-N 1 1 316.332 3.737 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000189239916 337277555 /nfs/dbraw/zinc/27/75/55/337277555.db2.gz FUQLNIMPJSXRPP-INIZCTEOSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@H](C[C@@H]1CCCCC[NH2+]1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423142611 337701544 /nfs/dbraw/zinc/70/15/44/337701544.db2.gz AUDFXRAEUMRQFX-YCPHGPKFSA-N 1 1 305.422 3.556 20 5 DHBDMO CCc1ccc([C@H]([NH2+][C@@H]2CC23CC3)c2ccc([N+](=O)[O-])cc2)o1 ZINC000424318796 337820210 /nfs/dbraw/zinc/82/02/10/337820210.db2.gz HSVGJSZKNAHKOT-IAGOWNOFSA-N 1 1 312.369 3.982 20 5 DHBDMO Cc1nsc(C)c1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000516489069 338012669 /nfs/dbraw/zinc/01/26/69/338012669.db2.gz VMUGFCQEDWOLDO-UHFFFAOYSA-N 1 1 305.403 3.693 20 5 DHBDMO C[C@@]12CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C[C@@H]1C2(F)F ZINC000428716017 338059412 /nfs/dbraw/zinc/05/94/12/338059412.db2.gz ZMOVPAGTRLQILZ-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@@]12CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C[C@@H]1C2(F)F ZINC000428716017 338059413 /nfs/dbraw/zinc/05/94/13/338059413.db2.gz ZMOVPAGTRLQILZ-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO Cc1cccc2c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)CC2 ZINC000429576683 338084803 /nfs/dbraw/zinc/08/48/03/338084803.db2.gz NQEDUZFHPZVODT-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cccc2c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)CC2 ZINC000429576683 338084804 /nfs/dbraw/zinc/08/48/04/338084804.db2.gz NQEDUZFHPZVODT-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCc2ccccc21 ZINC000430213978 338101711 /nfs/dbraw/zinc/10/17/11/338101711.db2.gz DHLNJTUDFZVWNM-KRWDZBQOSA-N 1 1 312.369 3.723 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)c1 ZINC000433188996 338184959 /nfs/dbraw/zinc/18/49/59/338184959.db2.gz DVTNNEPNIXCERP-UHFFFAOYSA-N 1 1 312.703 3.816 20 5 DHBDMO Cc1ccsc1C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434832938 338226074 /nfs/dbraw/zinc/22/60/74/338226074.db2.gz HNPVCPOWSGMFEH-UHFFFAOYSA-N 1 1 317.370 3.738 20 5 DHBDMO Cc1ccsc1C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434832938 338226075 /nfs/dbraw/zinc/22/60/75/338226075.db2.gz HNPVCPOWSGMFEH-UHFFFAOYSA-N 1 1 317.370 3.738 20 5 DHBDMO Cc1ccnc(NC[C@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000435593642 338243125 /nfs/dbraw/zinc/24/31/25/338243125.db2.gz RZYHRHTXYOUUBI-OAHLLOKOSA-N 1 1 318.421 3.507 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCN(C)c1ccccc1 ZINC000436394482 338270615 /nfs/dbraw/zinc/27/06/15/338270615.db2.gz WMLTUQJUCCCVJT-OAHLLOKOSA-N 1 1 313.401 3.724 20 5 DHBDMO COc1ccc(C[N@H+]2CCCC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000438354305 338340792 /nfs/dbraw/zinc/34/07/92/338340792.db2.gz LTAKCUFVKGSIQB-UHFFFAOYSA-N 1 1 304.390 3.760 20 5 DHBDMO Cc1cn2cc(Nc3c(F)cc([N+](=O)[O-])cc3F)ccc2[nH+]1 ZINC000440594190 338391703 /nfs/dbraw/zinc/39/17/03/338391703.db2.gz IESNIRGKPIVDQM-UHFFFAOYSA-N 1 1 304.256 3.573 20 5 DHBDMO CCc1ncc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000453350522 338829528 /nfs/dbraw/zinc/82/95/28/338829528.db2.gz BMMUOSJYSWGNEF-OAHLLOKOSA-N 1 1 315.373 3.657 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(C)c(Cl)c1 ZINC000195441429 338899879 /nfs/dbraw/zinc/89/98/79/338899879.db2.gz OQTZCTYHKKZEIZ-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO COCCC1(C)C[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000459634253 339039529 /nfs/dbraw/zinc/03/95/29/339039529.db2.gz RNEHRJVIWBSLLM-UHFFFAOYSA-N 1 1 306.406 3.577 20 5 DHBDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000459650318 339040403 /nfs/dbraw/zinc/04/04/03/339040403.db2.gz MFOLYNFRGPCHSG-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1nc2c(s1)CCC2 ZINC000459651590 339040576 /nfs/dbraw/zinc/04/05/76/339040576.db2.gz PIZSUFYKISAEQL-LLVKDONJSA-N 1 1 317.414 3.699 20 5 DHBDMO C[C@@H](C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000459785319 339048432 /nfs/dbraw/zinc/04/84/32/339048432.db2.gz ARKWXSHHWSNXTI-STQMWFEESA-N 1 1 322.405 3.565 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(NCCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000462788162 339088589 /nfs/dbraw/zinc/08/85/89/339088589.db2.gz GGCKCPMIUOZHKW-AWEZNQCLSA-N 1 1 321.421 3.670 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CC(c2ccccc2F)C1 ZINC000462827148 339092723 /nfs/dbraw/zinc/09/27/23/339092723.db2.gz OUPFUKCAZWICCE-UHFFFAOYSA-N 1 1 300.333 3.642 20 5 DHBDMO COc1cc(C[N@H+](C)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1F ZINC000463476834 339119131 /nfs/dbraw/zinc/11/91/31/339119131.db2.gz CFAPKSPNDODWCC-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1F ZINC000463476834 339119132 /nfs/dbraw/zinc/11/91/32/339119132.db2.gz CFAPKSPNDODWCC-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1cc(C[N@@H+](C)CC2CCCCC2)c([N+](=O)[O-])cc1F ZINC000463479197 339119277 /nfs/dbraw/zinc/11/92/77/339119277.db2.gz PZBYKGSYMCRTBL-UHFFFAOYSA-N 1 1 310.369 3.755 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000464770172 339152169 /nfs/dbraw/zinc/15/21/69/339152169.db2.gz FKZWSYVGCWKDEI-BBRMVZONSA-N 1 1 324.446 3.580 20 5 DHBDMO COc1cc(C[NH+]2CCC(C(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000466199597 339196430 /nfs/dbraw/zinc/19/64/30/339196430.db2.gz FRKUCLIXLNDRPI-UHFFFAOYSA-N 1 1 310.369 3.611 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000470009407 339308431 /nfs/dbraw/zinc/30/84/31/339308431.db2.gz PETQKSPCIHTQLG-LBPRGKRZSA-N 1 1 302.296 3.758 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1scnc1C ZINC000470169832 339312572 /nfs/dbraw/zinc/31/25/72/339312572.db2.gz KRXBBQNWMATRPA-KPKJPENVSA-N 1 1 317.414 3.895 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCc2ncsc2C1 ZINC000470220241 339314565 /nfs/dbraw/zinc/31/45/65/339314565.db2.gz XJDDUNXHFXCIBS-KPKJPENVSA-N 1 1 315.398 3.513 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2ncsc2C1 ZINC000470220241 339314566 /nfs/dbraw/zinc/31/45/66/339314566.db2.gz XJDDUNXHFXCIBS-KPKJPENVSA-N 1 1 315.398 3.513 20 5 DHBDMO Cc1c(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000470956268 339332798 /nfs/dbraw/zinc/33/27/98/339332798.db2.gz BJKKQINTAZCMGG-JQWIXIFHSA-N 1 1 302.296 3.676 20 5 DHBDMO CSc1ccccc1C[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000470992809 339333894 /nfs/dbraw/zinc/33/38/94/339333894.db2.gz AQPRFFANKCMVNY-UHFFFAOYSA-N 1 1 316.426 3.991 20 5 DHBDMO COc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(Cl)c1 ZINC000480495638 339574962 /nfs/dbraw/zinc/57/49/62/339574962.db2.gz JDCNQJYXXWTVQG-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO CCCCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C ZINC000501138308 340075006 /nfs/dbraw/zinc/07/50/06/340075006.db2.gz XTOFRSWCRJNOGH-UHFFFAOYSA-N 1 1 321.421 3.824 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000503594922 340132049 /nfs/dbraw/zinc/13/20/49/340132049.db2.gz TXFZMZPMRZFWMT-GFCCVEGCSA-N 1 1 318.323 3.863 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000503594922 340132050 /nfs/dbraw/zinc/13/20/50/340132050.db2.gz TXFZMZPMRZFWMT-GFCCVEGCSA-N 1 1 318.323 3.863 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c1 ZINC000503684132 340133485 /nfs/dbraw/zinc/13/34/85/340133485.db2.gz HRMWTSLMHGYEPA-AWEZNQCLSA-N 1 1 300.333 3.723 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]C1(C(F)F)CC1 ZINC000503928880 340137202 /nfs/dbraw/zinc/13/72/02/340137202.db2.gz UQMYDVBBJQZFOH-DGCLKSJQSA-N 1 1 310.344 3.693 20 5 DHBDMO C[N@H+](CCc1ccc(F)cc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505881436 340180637 /nfs/dbraw/zinc/18/06/37/340180637.db2.gz LNUXKKJXSKHSGU-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[N@@H+](CCc1ccc(F)cc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505881436 340180638 /nfs/dbraw/zinc/18/06/38/340180638.db2.gz LNUXKKJXSKHSGU-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO CC[N@@H+](CCOC)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000506465309 340195015 /nfs/dbraw/zinc/19/50/15/340195015.db2.gz HOFQTPFHZDNJBO-UHFFFAOYSA-N 1 1 320.414 3.792 20 5 DHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000507181023 340211608 /nfs/dbraw/zinc/21/16/08/340211608.db2.gz MXGYNLUCTDSEQE-QGZVFWFLSA-N 1 1 310.397 3.935 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCOc1ccccc1 ZINC000302750307 340281340 /nfs/dbraw/zinc/28/13/40/340281340.db2.gz VWVAVNJOIQXUKG-AWEZNQCLSA-N 1 1 300.358 3.667 20 5 DHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC000512697629 340373498 /nfs/dbraw/zinc/37/34/98/340373498.db2.gz CYSJWHUVBJRSJZ-HOCLYGCPSA-N 1 1 311.385 3.842 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCc1ccsc1)C2 ZINC000543063744 341030117 /nfs/dbraw/zinc/03/01/17/341030117.db2.gz SHCRWTOVUQCYEK-UHFFFAOYSA-N 1 1 302.399 3.647 20 5 DHBDMO C[C@@H](Cc1ccsc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000543096349 341031667 /nfs/dbraw/zinc/03/16/67/341031667.db2.gz XEZCWDYZGZNEKT-LBPRGKRZSA-N 1 1 302.399 3.646 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1Cc2ccccc2OC[C@H]1C ZINC000544599327 341087994 /nfs/dbraw/zinc/08/79/94/341087994.db2.gz BFGHFPQNSPTXIC-CQSZACIVSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1Cc2ccccc2OC[C@H]1C ZINC000544599327 341087995 /nfs/dbraw/zinc/08/79/95/341087995.db2.gz BFGHFPQNSPTXIC-CQSZACIVSA-N 1 1 312.369 3.686 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cnc(C3CC3)s2)c(Cl)c1 ZINC000547341496 341207222 /nfs/dbraw/zinc/20/72/22/341207222.db2.gz GZCTWRTTWKKPKI-UHFFFAOYSA-N 1 1 323.805 3.872 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000548508512 341265039 /nfs/dbraw/zinc/26/50/39/341265039.db2.gz JIPODKRWNVFSGX-WQGACYEGSA-N 1 1 314.389 3.624 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccc(O)c1 ZINC000080932462 341276789 /nfs/dbraw/zinc/27/67/89/341276789.db2.gz VTOADBOMGCLJDB-ZDUSSCGKSA-N 1 1 300.358 3.884 20 5 DHBDMO CC1C[NH+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000549410507 341293823 /nfs/dbraw/zinc/29/38/23/341293823.db2.gz APOSWVLGLLSOFA-UHFFFAOYSA-N 1 1 316.332 3.978 20 5 DHBDMO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000263661836 341574722 /nfs/dbraw/zinc/57/47/22/341574722.db2.gz HJQILQSUCJIOFK-CYBMUJFWSA-N 1 1 300.358 3.844 20 5 DHBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ncc([N+](=O)[O-])s1 ZINC000190317047 519630895 /nfs/dbraw/zinc/63/08/95/519630895.db2.gz LOHKASWDQZXRFT-UHFFFAOYSA-N 1 1 320.418 3.504 20 5 DHBDMO Cc1ccc(C[NH+]2CCC(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000127190003 524437525 /nfs/dbraw/zinc/43/75/25/524437525.db2.gz AABJMUXJUJXKGR-UHFFFAOYSA-N 1 1 302.296 3.678 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]1c1cnn(C)c1 ZINC000182745023 526090076 /nfs/dbraw/zinc/09/00/76/526090076.db2.gz XPAQCXRGYUEYEQ-SUMWQHHRSA-N 1 1 314.389 3.535 20 5 DHBDMO C[C@H](c1cccc(O)c1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000109780990 1013749833 /nfs/dbraw/zinc/74/98/33/1013749833.db2.gz OGNVQVUITJQIIJ-CYBMUJFWSA-N 1 1 300.358 3.536 20 5 DHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]3CCC[C@@H]32)cc1 ZINC000441444728 1013883794 /nfs/dbraw/zinc/88/37/94/1013883794.db2.gz HLBKOJPJUIIWPR-PBHICJAKSA-N 1 1 304.390 3.628 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000441460673 1013908360 /nfs/dbraw/zinc/90/83/60/1013908360.db2.gz DRGBQTWIJKALKZ-JKIFEVAISA-N 1 1 304.390 3.627 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+]([C@@H]1CCc3ccc(F)cc31)C2 ZINC000533801668 1013989787 /nfs/dbraw/zinc/98/97/87/1013989787.db2.gz IVLCYIKHLKYBEP-QGZVFWFLSA-N 1 1 312.344 3.780 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+]([C@@H]1CCc3ccc(F)cc31)C2 ZINC000533801668 1013989790 /nfs/dbraw/zinc/98/97/90/1013989790.db2.gz IVLCYIKHLKYBEP-QGZVFWFLSA-N 1 1 312.344 3.780 20 5 DHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC000064915963 1014044803 /nfs/dbraw/zinc/04/48/03/1014044803.db2.gz CYSJWHUVBJRSJZ-GDBMZVCRSA-N 1 1 311.385 3.842 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000441464275 1014167616 /nfs/dbraw/zinc/16/76/16/1014167616.db2.gz AIVCFAACSYKGRX-CKEIUWERSA-N 1 1 304.390 3.627 20 5 DHBDMO CC[C@@H](NCCC[N@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000319889052 1014269679 /nfs/dbraw/zinc/26/96/79/1014269679.db2.gz WUVHQPHXNKJXDT-CRAIPNDOSA-N 1 1 319.449 3.900 20 5 DHBDMO CC1(C)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@H]2O1 ZINC000442967924 1014780564 /nfs/dbraw/zinc/78/05/64/1014780564.db2.gz VNNAWCCLNRUUFA-QXUXXFOKSA-N 1 1 316.401 3.640 20 5 DHBDMO CC1(C)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@H]2O1 ZINC000442967924 1014780572 /nfs/dbraw/zinc/78/05/72/1014780572.db2.gz VNNAWCCLNRUUFA-QXUXXFOKSA-N 1 1 316.401 3.640 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1C[C@H](O)c2ccccc21 ZINC000895369989 1015105929 /nfs/dbraw/zinc/10/59/29/1015105929.db2.gz ZCTQNDVCQGNXCO-ZBFHGGJFSA-N 1 1 318.760 3.516 20 5 DHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 ZINC000065532942 1016204751 /nfs/dbraw/zinc/20/47/51/1016204751.db2.gz XMPFSAJDCOJKQR-SFHVURJKSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@H](c1ccccc1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000051428936 1016356592 /nfs/dbraw/zinc/35/65/92/1016356592.db2.gz JGONRMWKUPLNGF-CQSZACIVSA-N 1 1 300.358 3.667 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000051453684 1016391821 /nfs/dbraw/zinc/39/18/21/1016391821.db2.gz DCQACKKTQXKIAA-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO C[C@@H](Nc1sccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000611583558 1016506809 /nfs/dbraw/zinc/50/68/09/1016506809.db2.gz NYBOUXLFJQEEIB-VXGBXAGGSA-N 1 1 309.435 3.721 20 5 DHBDMO C[N@@H+](CCCOc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000479552608 1016996797 /nfs/dbraw/zinc/99/67/97/1016996797.db2.gz CHMAOUDDZNGSPT-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO CCOC(C[N@@H+](CC)[C@@H](C)c1cc([N+](=O)[O-])ccc1C)OCC ZINC000846977027 1032175060 /nfs/dbraw/zinc/17/50/60/1032175060.db2.gz YFUCYFJULBIJLG-AWEZNQCLSA-N 1 1 324.421 3.685 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000037563037 1032618230 /nfs/dbraw/zinc/61/82/30/1032618230.db2.gz JHYKMPFSNNSGTO-LLVKDONJSA-N 1 1 306.387 3.906 20 5 DHBDMO COc1cccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000126979443 1012511466 /nfs/dbraw/zinc/51/14/66/1012511466.db2.gz FMQPIVXDROBNSD-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO Cn1c[nH+]c2cc(N[C@H]3CCCc4ccc([N+](=O)[O-])cc43)ccc21 ZINC000515288092 1012595121 /nfs/dbraw/zinc/59/51/21/1012595121.db2.gz JUGAJXPJUWNQOE-INIZCTEOSA-N 1 1 322.368 3.971 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)cc1[N+](=O)[O-] ZINC000342833978 1017533394 /nfs/dbraw/zinc/53/33/94/1017533394.db2.gz DKNLQVHWUFJVRE-GOSISDBHSA-N 1 1 318.417 3.721 20 5 DHBDMO CC(C)CC[N@@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000053364143 1017550086 /nfs/dbraw/zinc/55/00/86/1017550086.db2.gz HSEAXDJWULWMOG-LBPRGKRZSA-N 1 1 318.377 3.684 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2cccs2)CC1 ZINC000121481223 1017582464 /nfs/dbraw/zinc/58/24/64/1017582464.db2.gz QXXQUFAAMKZSBJ-CYBMUJFWSA-N 1 1 317.414 3.540 20 5 DHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCC[C@H]1C ZINC000444673659 1017625979 /nfs/dbraw/zinc/62/59/79/1017625979.db2.gz IITMKKQMGSHJPO-WBMJQRKESA-N 1 1 316.405 3.872 20 5 DHBDMO Cc1ccc(F)c(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])c1 ZINC000444742249 1017655033 /nfs/dbraw/zinc/65/50/33/1017655033.db2.gz WKIOUVIICJRFFL-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@H](c2nccs2)C1 ZINC000171637405 1017966833 /nfs/dbraw/zinc/96/68/33/1017966833.db2.gz QZBAICCAYGQXQS-NSHDSACASA-N 1 1 321.377 3.570 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000171637405 1017966843 /nfs/dbraw/zinc/96/68/43/1017966843.db2.gz QZBAICCAYGQXQS-NSHDSACASA-N 1 1 321.377 3.570 20 5 DHBDMO COc1cc(C[N@H+]2CCCC3(CCCC3)C2)ccc1[N+](=O)[O-] ZINC000445855836 1017990836 /nfs/dbraw/zinc/99/08/36/1017990836.db2.gz OKMPWSIVLLRQAQ-UHFFFAOYSA-N 1 1 304.390 3.760 20 5 DHBDMO CC1(C)CCCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000446060486 1018046063 /nfs/dbraw/zinc/04/60/63/1018046063.db2.gz KEBJXJPJLMZRKV-UHFFFAOYSA-N 1 1 303.362 3.748 20 5 DHBDMO COc1cc(C[N@@H+](C2CC2)C2CCCC2)c([N+](=O)[O-])cc1F ZINC000184211728 1018068578 /nfs/dbraw/zinc/06/85/78/1018068578.db2.gz OPYQRCVZHXYJLZ-UHFFFAOYSA-N 1 1 308.353 3.650 20 5 DHBDMO CCCCCC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000780763152 1032745463 /nfs/dbraw/zinc/74/54/63/1032745463.db2.gz XOMIMNXHXPHLJY-INIZCTEOSA-N 1 1 316.405 3.588 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cnc3ccccc3c1)C2 ZINC000525290070 1018233827 /nfs/dbraw/zinc/23/38/27/1018233827.db2.gz XNXTYSFRBKOZBW-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cnc3ccccc3c1)C2 ZINC000525290070 1018233837 /nfs/dbraw/zinc/23/38/37/1018233837.db2.gz XNXTYSFRBKOZBW-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO C[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000926920289 1032774189 /nfs/dbraw/zinc/77/41/89/1032774189.db2.gz RIMYAZZOXSJRIG-NSHDSACASA-N 1 1 317.414 3.781 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000278417500 1018671452 /nfs/dbraw/zinc/67/14/52/1018671452.db2.gz IEWQPGKZADQXOJ-CYBMUJFWSA-N 1 1 311.385 3.719 20 5 DHBDMO C[C@H]1CC[C@H](C)[NH+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000706480087 1018718992 /nfs/dbraw/zinc/71/89/92/1018718992.db2.gz YTIPVSFYBDKNSD-UWVGGRQHSA-N 1 1 313.195 3.730 20 5 DHBDMO O=[N+]([O-])c1ccc(CN(Cc2[nH]nc3ccccc32)C2CC2)cc1 ZINC000611254769 1019421739 /nfs/dbraw/zinc/42/17/39/1019421739.db2.gz RULLWTFCSNVYPB-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2[nH]nc3ccccc32)C2CC2)cc1 ZINC000611254769 1019421746 /nfs/dbraw/zinc/42/17/46/1019421746.db2.gz RULLWTFCSNVYPB-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2[nH]nc3ccccc32)C2CC2)cc1 ZINC000611254769 1019421754 /nfs/dbraw/zinc/42/17/54/1019421754.db2.gz RULLWTFCSNVYPB-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccsc2[N+](=O)[O-])C1 ZINC000611370283 1019455925 /nfs/dbraw/zinc/45/59/25/1019455925.db2.gz FOWLEMNOTJNMAG-OCCSQVGLSA-N 1 1 317.414 3.904 20 5 DHBDMO CSCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000128205885 1019466008 /nfs/dbraw/zinc/46/60/08/1019466008.db2.gz FTVFZTGSKGLRSW-UHFFFAOYSA-N 1 1 306.387 3.650 20 5 DHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2sccc2[N+](=O)[O-])C1 ZINC000611411628 1019477469 /nfs/dbraw/zinc/47/74/69/1019477469.db2.gz GKXMLSGOKYZQPM-GXTWGEPZSA-N 1 1 317.414 3.904 20 5 DHBDMO CC(C)([NH2+]Cc1cccc2c1OCC2)c1ccccc1[N+](=O)[O-] ZINC000922144028 1019517754 /nfs/dbraw/zinc/51/77/54/1019517754.db2.gz RVMQNVGANWIMQW-UHFFFAOYSA-N 1 1 312.369 3.555 20 5 DHBDMO C[C@H](C[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000727436968 1019705624 /nfs/dbraw/zinc/70/56/24/1019705624.db2.gz ASEOBUIFMAKDCJ-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO Cc1ccncc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000611939552 1019905899 /nfs/dbraw/zinc/90/58/99/1019905899.db2.gz RJUYTJKZXTUDHY-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO CC(C)[N@H+]1CC[C@H](Oc2ccc([N+](=O)[O-])c(Cl)c2Cl)C1 ZINC001230040670 1020053456 /nfs/dbraw/zinc/05/34/56/1020053456.db2.gz OBYLJWUQDOQIQK-VIFPVBQESA-N 1 1 319.188 3.763 20 5 DHBDMO COC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(C)o1 ZINC000156444968 1020351527 /nfs/dbraw/zinc/35/15/27/1020351527.db2.gz ZJSZFVQMVRCHLT-DZGCQCFKSA-N 1 1 318.373 3.843 20 5 DHBDMO CCC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccccn1 ZINC000179470373 1020356160 /nfs/dbraw/zinc/35/61/60/1020356160.db2.gz HJPSBAOQLGEGBQ-HNNXBMFYSA-N 1 1 315.373 3.629 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cc1F ZINC000282578407 1020466506 /nfs/dbraw/zinc/46/65/06/1020466506.db2.gz VUCZTCRJNYZWNZ-JTQLQIEISA-N 1 1 306.259 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cc1F ZINC000282578407 1020466510 /nfs/dbraw/zinc/46/65/10/1020466510.db2.gz VUCZTCRJNYZWNZ-JTQLQIEISA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H]1C ZINC000480642921 1020597275 /nfs/dbraw/zinc/59/72/75/1020597275.db2.gz NVZDPDMTENYCOE-KFWWJZLASA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1C ZINC000480642921 1020597282 /nfs/dbraw/zinc/59/72/82/1020597282.db2.gz NVZDPDMTENYCOE-KFWWJZLASA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccs1 ZINC000612517125 1020600944 /nfs/dbraw/zinc/60/09/44/1020600944.db2.gz JMUTUAPIJPLGFX-UHFFFAOYSA-N 1 1 317.370 3.822 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCOc2ccccc2[C@@H]1C ZINC000612577260 1020628764 /nfs/dbraw/zinc/62/87/64/1020628764.db2.gz BRFSTZCOYVSSKD-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCOc2ccccc2[C@@H]1C ZINC000612577260 1020628769 /nfs/dbraw/zinc/62/87/69/1020628769.db2.gz BRFSTZCOYVSSKD-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO CCCCCC[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000735647277 1020759391 /nfs/dbraw/zinc/75/93/91/1020759391.db2.gz XSYZXOVEWWGKCF-UHFFFAOYSA-N 1 1 321.421 3.662 20 5 DHBDMO Cc1ccc([C@H]2[C@H](C)CCC[N@@H+]2Cn2nccc2[N+](=O)[O-])cc1 ZINC000738282638 1020866847 /nfs/dbraw/zinc/86/68/47/1020866847.db2.gz AJEMPBHEBAJMQT-RHSMWYFYSA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1ccc([C@H]2[C@H](C)CCC[N@H+]2Cn2nccc2[N+](=O)[O-])cc1 ZINC000738282638 1020866852 /nfs/dbraw/zinc/86/68/52/1020866852.db2.gz AJEMPBHEBAJMQT-RHSMWYFYSA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1cccc(F)c1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000742381588 1021109782 /nfs/dbraw/zinc/10/97/82/1021109782.db2.gz YGQDGHMRHOOFBZ-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2C2CCCCC2)cc1 ZINC000776276459 1021220072 /nfs/dbraw/zinc/22/00/72/1021220072.db2.gz KAIJZDXKITWLEX-MSOLQXFVSA-N 1 1 318.417 3.673 20 5 DHBDMO CCCC[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)[C@H](C)CC ZINC000917437818 1021260324 /nfs/dbraw/zinc/26/03/24/1021260324.db2.gz LRJNIJPPNCRZMN-CYBMUJFWSA-N 1 1 304.394 3.803 20 5 DHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000917620705 1021323064 /nfs/dbraw/zinc/32/30/64/1021323064.db2.gz VLZJOGDQRKPGLA-INIZCTEOSA-N 1 1 314.389 3.557 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccncc2Cl)cc1[N+](=O)[O-] ZINC000181832843 1021361602 /nfs/dbraw/zinc/36/16/02/1021361602.db2.gz FFSBYMYNXRVNKG-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1c(C)cccc1F ZINC000850440044 1021534513 /nfs/dbraw/zinc/53/45/13/1021534513.db2.gz VMXAONHSRLEHNG-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO CCOc1ccc([C@H](C)Nc2cc(C)cc[nH+]2)cc1[N+](=O)[O-] ZINC000182637775 1021754356 /nfs/dbraw/zinc/75/43/56/1021754356.db2.gz XTYUBANVTIYJCS-LBPRGKRZSA-N 1 1 301.346 3.870 20 5 DHBDMO Cc1nn(C[N@H+](CCC(C)C)C2CCCC2)c(C)c1[N+](=O)[O-] ZINC000746064208 1021844355 /nfs/dbraw/zinc/84/43/55/1021844355.db2.gz IJJZDBQNWNVZGH-UHFFFAOYSA-N 1 1 308.426 3.656 20 5 DHBDMO COc1cccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1F ZINC000619715444 1021845958 /nfs/dbraw/zinc/84/59/58/1021845958.db2.gz FOZKGTTXJVIQMK-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc2ccccc2[nH]1 ZINC000619846230 1021921910 /nfs/dbraw/zinc/92/19/10/1021921910.db2.gz OZJXNURILWVLMN-UHFFFAOYSA-N 1 1 309.369 3.751 20 5 DHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580134 1022098082 /nfs/dbraw/zinc/09/80/82/1022098082.db2.gz RKSMMOGEFRYPMQ-HZPDHXFCSA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2C)n1 ZINC000183350477 1022112423 /nfs/dbraw/zinc/11/24/23/1022112423.db2.gz SWCYZBLUQWQQIA-SFHVURJKSA-N 1 1 311.385 3.944 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000752313929 1022124322 /nfs/dbraw/zinc/12/43/22/1022124322.db2.gz JGXCPJVJHBANTD-MRXNPFEDSA-N 1 1 300.333 3.551 20 5 DHBDMO C[N@@H+](Cc1ccccc1C(F)(F)F)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169033592 1022218696 /nfs/dbraw/zinc/21/86/96/1022218696.db2.gz CDHSUQCFVLDJPE-AAEUAGOBSA-N 1 1 316.323 3.583 20 5 DHBDMO CCOc1ccc([C@@H]2CCC[N@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169032923 1022220041 /nfs/dbraw/zinc/22/00/41/1022220041.db2.gz AAAJEVDIHUXJMO-HFTRVMKXSA-N 1 1 318.417 3.668 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)C1 ZINC001169039720 1022222389 /nfs/dbraw/zinc/22/23/89/1022222389.db2.gz SPXIJRBSLXUUCP-XNRPHZJLSA-N 1 1 308.809 3.575 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H]2c2cc(F)ccc2F)C1 ZINC001169038488 1022222729 /nfs/dbraw/zinc/22/27/29/1022222729.db2.gz ZDQDLMOLRKYMBW-KFNAQCHYSA-N 1 1 310.344 3.547 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+](Cc2ccccn2)C2CCCCC2)C1 ZINC001169039128 1022222983 /nfs/dbraw/zinc/22/29/83/1022222983.db2.gz NMNXDPBJGSETAA-MAUKXSAKSA-N 1 1 317.433 3.662 20 5 DHBDMO C[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035641 1022223019 /nfs/dbraw/zinc/22/30/19/1022223019.db2.gz KYSYWMBIJLOKLQ-OCCSQVGLSA-N 1 1 316.323 3.583 20 5 DHBDMO CSc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169041683 1022224849 /nfs/dbraw/zinc/22/48/49/1022224849.db2.gz CAGXBNJQFKFCTL-FMKPAKJESA-N 1 1 320.458 3.991 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2F)C1 ZINC001169048374 1022228503 /nfs/dbraw/zinc/22/85/03/1022228503.db2.gz UZJIYWJFTTUSLJ-AXAPSJFSSA-N 1 1 310.344 3.547 20 5 DHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1cccnc1 ZINC000183658838 1022245324 /nfs/dbraw/zinc/24/53/24/1022245324.db2.gz JBMGTVCEZZNEMY-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1cccnc1 ZINC000183658838 1022245333 /nfs/dbraw/zinc/24/53/33/1022245333.db2.gz JBMGTVCEZZNEMY-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO CCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000232972003 1022267157 /nfs/dbraw/zinc/26/71/57/1022267157.db2.gz HDZJNFCZJZYKJZ-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO CCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000232972003 1022267165 /nfs/dbraw/zinc/26/71/65/1022267165.db2.gz HDZJNFCZJZYKJZ-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO CC(C)[N@@H+](CCOc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350419 1022279634 /nfs/dbraw/zinc/27/96/34/1022279634.db2.gz JOJQSJGFJSFHON-UHFFFAOYSA-N 1 1 314.385 3.884 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1 ZINC000609916586 1022381086 /nfs/dbraw/zinc/38/10/86/1022381086.db2.gz YKQFGKKWVBWKBR-MRXNPFEDSA-N 1 1 314.360 3.799 20 5 DHBDMO C[N@@H+](CCCCCCCO)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000175514526 1022392700 /nfs/dbraw/zinc/39/27/00/1022392700.db2.gz WDMVDLROFFISNO-UHFFFAOYSA-N 1 1 314.813 3.623 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2nccn21 ZINC000179696274 1022511910 /nfs/dbraw/zinc/51/19/10/1022511910.db2.gz XVNUEVMVDSKYSC-UHFFFAOYSA-N 1 1 324.384 3.653 20 5 DHBDMO CC(C)[N@@H+](Cc1cnc2ccccn12)Cc1ccc([N+](=O)[O-])cc1 ZINC000158638925 1022651801 /nfs/dbraw/zinc/65/18/01/1022651801.db2.gz VQWUBEFPDQCJMP-UHFFFAOYSA-N 1 1 324.384 3.653 20 5 DHBDMO CCOc1cc(C[N@H+]2CC[C@H](c3ccco3)C2)ccc1[N+](=O)[O-] ZINC000617201096 1022888272 /nfs/dbraw/zinc/88/82/72/1022888272.db2.gz FJAYOZXIIDBFDP-AWEZNQCLSA-N 1 1 316.357 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc3c(c2)COC3)C2CC2)cc1 ZINC000768338008 1022948158 /nfs/dbraw/zinc/94/81/58/1022948158.db2.gz YCYIKSJAQLJAAB-UHFFFAOYSA-N 1 1 324.380 3.790 20 5 DHBDMO NC(=[NH+]OCc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000768520740 1022977750 /nfs/dbraw/zinc/97/77/50/1022977750.db2.gz AAFHIQYPVYAZGL-UHFFFAOYSA-N 1 1 311.769 3.827 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3ccco3)C2)ccc1Cl ZINC000768541925 1022985752 /nfs/dbraw/zinc/98/57/52/1022985752.db2.gz MYMVPNOLFNHZPL-LBPRGKRZSA-N 1 1 306.749 3.831 20 5 DHBDMO COc1cc(C)c([N+](=O)[O-])cc1NCCC[N@H+]1CCCC[C@@H]1C ZINC001167753270 1023044732 /nfs/dbraw/zinc/04/47/32/1023044732.db2.gz NGOLJBOWUYQXFF-AWEZNQCLSA-N 1 1 321.421 3.588 20 5 DHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCc1ccccc1F ZINC000769029615 1023070054 /nfs/dbraw/zinc/07/00/54/1023070054.db2.gz LYDHWJSDCPBUGK-TWGQIWQCSA-N 1 1 314.360 3.922 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000746674390 1023784200 /nfs/dbraw/zinc/78/42/00/1023784200.db2.gz VUYJPCZVILMEJV-NSHDSACASA-N 1 1 306.749 3.831 20 5 DHBDMO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]1c1ccccc1 ZINC000788483919 1023900335 /nfs/dbraw/zinc/90/03/35/1023900335.db2.gz YVQMCWFZOBPEPJ-YVEFUNNKSA-N 1 1 300.333 3.927 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]1c1ccccc1 ZINC000788483919 1023900340 /nfs/dbraw/zinc/90/03/40/1023900340.db2.gz YVQMCWFZOBPEPJ-YVEFUNNKSA-N 1 1 300.333 3.927 20 5 DHBDMO COC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000193687717 1023969088 /nfs/dbraw/zinc/96/90/88/1023969088.db2.gz UEYAALNIDBAHGU-OAHLLOKOSA-N 1 1 320.776 3.726 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cn2ccc(C)cc2n1)c1cccc([N+](=O)[O-])c1 ZINC000268956047 1024203451 /nfs/dbraw/zinc/20/34/51/1024203451.db2.gz YSIVDZDSGWYUSQ-QGZVFWFLSA-N 1 1 324.384 3.792 20 5 DHBDMO CC[C@@H]([NH2+]C1CCN(C2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000268995747 1024216259 /nfs/dbraw/zinc/21/62/59/1024216259.db2.gz KMMLKWZGTBKBEY-GOSISDBHSA-N 1 1 317.433 3.652 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1cc3ccccc3o1)CC2 ZINC000531757201 1024301055 /nfs/dbraw/zinc/30/10/55/1024301055.db2.gz KWAOGGYJDBEJIJ-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cc3ccccc3o1)CC2 ZINC000531757201 1024301068 /nfs/dbraw/zinc/30/10/68/1024301068.db2.gz KWAOGGYJDBEJIJ-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)cc1 ZINC000269851917 1024323742 /nfs/dbraw/zinc/32/37/42/1024323742.db2.gz PKJBCVQYRQWGJJ-HNNXBMFYSA-N 1 1 304.296 3.650 20 5 DHBDMO CC[N@@H+](CCc1nccs1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000270789640 1024429459 /nfs/dbraw/zinc/42/94/59/1024429459.db2.gz JQULAHDEHRGIKF-LBPRGKRZSA-N 1 1 305.403 3.677 20 5 DHBDMO CCC[C@H]([NH2+]Cc1ncccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000453369006 1024491076 /nfs/dbraw/zinc/49/10/76/1024491076.db2.gz PPSSCOCYNMIXDC-HNNXBMFYSA-N 1 1 315.373 3.629 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000791583166 1024518879 /nfs/dbraw/zinc/51/88/79/1024518879.db2.gz LZNAHFPURXKRCD-KCJUWKMLSA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000791583166 1024518884 /nfs/dbraw/zinc/51/88/84/1024518884.db2.gz LZNAHFPURXKRCD-KCJUWKMLSA-N 1 1 306.259 3.507 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OC3CCCC3)CC2)cc1F ZINC000283460865 1024668289 /nfs/dbraw/zinc/66/82/89/1024668289.db2.gz HZHNIXAZTJBHFX-UHFFFAOYSA-N 1 1 322.380 3.658 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCCC23CC3)c([N+](=O)[O-])c1 ZINC001170353107 1024748093 /nfs/dbraw/zinc/74/80/93/1024748093.db2.gz VXFDTYMGWCEIOO-CYBMUJFWSA-N 1 1 304.390 3.553 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]2C(C)C)c([N+](=O)[O-])c1 ZINC001170354506 1024750620 /nfs/dbraw/zinc/75/06/20/1024750620.db2.gz MLSJOLTUOUYIPX-BBRMVZONSA-N 1 1 306.406 3.655 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H]2C(C)C)c([N+](=O)[O-])c1 ZINC001170354507 1024751916 /nfs/dbraw/zinc/75/19/16/1024751916.db2.gz MLSJOLTUOUYIPX-CJNGLKHVSA-N 1 1 306.406 3.655 20 5 DHBDMO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000111312481 1024753358 /nfs/dbraw/zinc/75/33/58/1024753358.db2.gz VIYWPUDNLPXMBG-OAHLLOKOSA-N 1 1 317.414 3.869 20 5 DHBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000111312481 1024753372 /nfs/dbraw/zinc/75/33/72/1024753372.db2.gz VIYWPUDNLPXMBG-OAHLLOKOSA-N 1 1 317.414 3.869 20 5 DHBDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000792868208 1024811693 /nfs/dbraw/zinc/81/16/93/1024811693.db2.gz SDTICLKYVXYNEK-NEPJUHHUSA-N 1 1 321.377 3.902 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000877139848 1033256235 /nfs/dbraw/zinc/25/62/35/1033256235.db2.gz CVCHTNQWDNDPOR-GOSISDBHSA-N 1 1 318.417 3.603 20 5 DHBDMO CC[C@H]1CCC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000353703791 1025207425 /nfs/dbraw/zinc/20/74/25/1025207425.db2.gz AWFQEDRGVYRWRM-ZDUSSCGKSA-N 1 1 322.405 3.624 20 5 DHBDMO CC(C)(C)[N@H+]1CCCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804390699 1025270597 /nfs/dbraw/zinc/27/05/97/1025270597.db2.gz AWHDVRGZBRKSEN-UHFFFAOYSA-N 1 1 311.813 3.559 20 5 DHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000353949229 1025302739 /nfs/dbraw/zinc/30/27/39/1025302739.db2.gz AOJNCABSLLYKTJ-GFCCVEGCSA-N 1 1 312.435 3.567 20 5 DHBDMO CCOc1ccc2c(c1)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC000354128547 1025363270 /nfs/dbraw/zinc/36/32/70/1025363270.db2.gz VCCFBOPJTBVIHR-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCOc1ccc2c(c1)CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC000354128547 1025363282 /nfs/dbraw/zinc/36/32/82/1025363282.db2.gz VCCFBOPJTBVIHR-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(F)cn2)cc1[N+](=O)[O-] ZINC000090217531 1025454902 /nfs/dbraw/zinc/45/49/02/1025454902.db2.gz WABAERLVZAHBFQ-NWDGAFQWSA-N 1 1 303.337 3.849 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000804814794 1025486488 /nfs/dbraw/zinc/48/64/88/1025486488.db2.gz JLPZJGNRZNEGLL-FUNVUKJBSA-N 1 1 323.824 3.618 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000886112150 1025511844 /nfs/dbraw/zinc/51/18/44/1025511844.db2.gz QOGHFEUWYRJFTQ-OAHLLOKOSA-N 1 1 321.327 3.899 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000886201998 1025558349 /nfs/dbraw/zinc/55/83/49/1025558349.db2.gz YVCRVUBAOWDSLP-KURKYZTESA-N 1 1 323.396 3.758 20 5 DHBDMO CC(C)CCC(N)=[NH+]OCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000729675195 1025906582 /nfs/dbraw/zinc/90/65/82/1025906582.db2.gz ZOVGHTOZFFSEFG-UHFFFAOYSA-N 1 1 323.393 3.817 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1O ZINC000080962442 1025974493 /nfs/dbraw/zinc/97/44/93/1025974493.db2.gz CKTFOAVKMYKEET-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO COCC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000356785489 1026168026 /nfs/dbraw/zinc/16/80/26/1026168026.db2.gz NQZPOHZMFCYGBR-DOMZBBRYSA-N 1 1 304.346 3.616 20 5 DHBDMO CCCC1CCC([N@@H+](Cc2c([N+](=O)[O-])ncn2C)C(C)C)CC1 ZINC000356836499 1026188265 /nfs/dbraw/zinc/18/82/65/1026188265.db2.gz JFCFYSLQHDFBTG-UHFFFAOYSA-N 1 1 322.453 3.898 20 5 DHBDMO C[N@H+](CCc1ccccc1F)Cc1ccc([N+](=O)[O-])cc1F ZINC000747530243 1026392289 /nfs/dbraw/zinc/39/22/89/1026392289.db2.gz SOIXXADVRBAPHZ-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[N@@H+](CCc1ccccc1F)Cc1ccc([N+](=O)[O-])cc1F ZINC000747530243 1026392300 /nfs/dbraw/zinc/39/23/00/1026392300.db2.gz SOIXXADVRBAPHZ-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C[C@@H]1CCCCO1 ZINC000513446854 1026510011 /nfs/dbraw/zinc/51/00/11/1026510011.db2.gz JGWNPKJNLYGZIY-INIZCTEOSA-N 1 1 306.406 3.684 20 5 DHBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000280166778 1026604874 /nfs/dbraw/zinc/60/48/74/1026604874.db2.gz FSONCCVBZFSYNT-OAHLLOKOSA-N 1 1 312.797 3.639 20 5 DHBDMO CC1=C(C)C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000280508993 1026662157 /nfs/dbraw/zinc/66/21/57/1026662157.db2.gz CVELVRJTZDWSIR-UHFFFAOYSA-N 1 1 313.357 3.792 20 5 DHBDMO CC1=C(C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000280508993 1026662163 /nfs/dbraw/zinc/66/21/63/1026662163.db2.gz CVELVRJTZDWSIR-UHFFFAOYSA-N 1 1 313.357 3.792 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cs1 ZINC000420954061 1026889346 /nfs/dbraw/zinc/88/93/46/1026889346.db2.gz UEDIOFQKOXDVFQ-VIFPVBQESA-N 1 1 308.325 3.821 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cs1 ZINC000420954061 1026889348 /nfs/dbraw/zinc/88/93/48/1026889348.db2.gz UEDIOFQKOXDVFQ-VIFPVBQESA-N 1 1 308.325 3.821 20 5 DHBDMO C[C@H]1C[C@@H](Nc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000228852782 1027149550 /nfs/dbraw/zinc/14/95/50/1027149550.db2.gz IJBKLTKFVMWOCC-IUCAKERBSA-N 1 1 318.204 3.796 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000228852771 1027150288 /nfs/dbraw/zinc/15/02/88/1027150288.db2.gz IJBKLTKFVMWOCC-BDAKNGLRSA-N 1 1 318.204 3.796 20 5 DHBDMO Cc1nsc(C)c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000571860801 1027153790 /nfs/dbraw/zinc/15/37/90/1027153790.db2.gz CTMIDSSASYFOBS-UHFFFAOYSA-N 1 1 317.414 3.833 20 5 DHBDMO Cc1nsc(C)c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000571860801 1027153802 /nfs/dbraw/zinc/15/38/02/1027153802.db2.gz CTMIDSSASYFOBS-UHFFFAOYSA-N 1 1 317.414 3.833 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000362385007 1027174743 /nfs/dbraw/zinc/17/47/43/1027174743.db2.gz QBJWFJJNCJYKLM-HIFRSBDPSA-N 1 1 324.446 3.709 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000362384840 1027175509 /nfs/dbraw/zinc/17/55/09/1027175509.db2.gz MLUJRNNCQLBQDM-UONOGXRCSA-N 1 1 324.446 3.580 20 5 DHBDMO Cc1ccc(F)cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000183799214 1027231648 /nfs/dbraw/zinc/23/16/48/1027231648.db2.gz KWTPGBKMGIOVLW-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812851050 1027446194 /nfs/dbraw/zinc/44/61/94/1027446194.db2.gz PSDQVJOMANTLGO-KDOFPFPSSA-N 1 1 314.385 3.539 20 5 DHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812852390 1027449366 /nfs/dbraw/zinc/44/93/66/1027449366.db2.gz FKFVOROCVMYRJH-MLGOLLRUSA-N 1 1 320.414 3.600 20 5 DHBDMO CO[C@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1(C)C ZINC000295976625 1027507054 /nfs/dbraw/zinc/50/70/54/1027507054.db2.gz KTZUACCISLNTRM-CJNGLKHVSA-N 1 1 306.406 3.711 20 5 DHBDMO C[C@H]1CN(c2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000813630504 1027690636 /nfs/dbraw/zinc/69/06/36/1027690636.db2.gz NCARCIUDKRDENY-GFCCVEGCSA-N 1 1 323.824 3.559 20 5 DHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000297056717 1027787884 /nfs/dbraw/zinc/78/78/84/1027787884.db2.gz VTSMXCZZRDQEOE-CHWSQXEVSA-N 1 1 302.378 3.531 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000934836987 1028123274 /nfs/dbraw/zinc/12/32/74/1028123274.db2.gz QHVVXEJQXOOQKY-BZUAXINKSA-N 1 1 318.417 3.794 20 5 DHBDMO C[C@H]([NH2+][C@@H]1c2ccc(F)cc2O[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000367575453 1028208250 /nfs/dbraw/zinc/20/82/50/1028208250.db2.gz KUHVYQINEZDXEC-RVPKQNPDSA-N 1 1 316.332 3.907 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000368612164 1028385200 /nfs/dbraw/zinc/38/52/00/1028385200.db2.gz IFNQOFQYZLIGGG-GDBMZVCRSA-N 1 1 311.385 3.615 20 5 DHBDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000449462328 1028683776 /nfs/dbraw/zinc/68/37/76/1028683776.db2.gz SJRMCMZTDZXNSP-PWSUYJOCSA-N 1 1 302.296 3.758 20 5 DHBDMO CCc1nocc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449503845 1028723552 /nfs/dbraw/zinc/72/35/52/1028723552.db2.gz UXDFRUONKLHGEU-AWEZNQCLSA-N 1 1 315.373 3.525 20 5 DHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1(C)C ZINC000449504825 1028723876 /nfs/dbraw/zinc/72/38/76/1028723876.db2.gz WFAOSLZAKIBFGA-QGZVFWFLSA-N 1 1 320.433 3.965 20 5 DHBDMO Cc1cccnc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449505398 1028728505 /nfs/dbraw/zinc/72/85/05/1028728505.db2.gz XHHDXFWIIIJXII-INIZCTEOSA-N 1 1 311.385 3.678 20 5 DHBDMO CCO[C@@H]1CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000449510318 1028737419 /nfs/dbraw/zinc/73/74/19/1028737419.db2.gz XCGNAKACWQWIKY-ZLTRSOCKSA-N 1 1 318.417 3.745 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@]3(CCSC3)C2)cc1[N+](=O)[O-] ZINC000449733547 1028950712 /nfs/dbraw/zinc/95/07/12/1028950712.db2.gz PAZCCYOXVCWOOU-INIZCTEOSA-N 1 1 306.431 3.622 20 5 DHBDMO CCC(CC)[N@@H+](CC)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000568134094 1029012357 /nfs/dbraw/zinc/01/23/57/1029012357.db2.gz NPKPZIHOEXFIMJ-UHFFFAOYSA-N 1 1 321.421 3.742 20 5 DHBDMO CNC(=O)[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000817414090 1029153466 /nfs/dbraw/zinc/15/34/66/1029153466.db2.gz BVSXHJHVJFZIAY-QGZVFWFLSA-N 1 1 318.420 3.561 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(OCC3CC3)CC2)c1 ZINC000374123390 1029213742 /nfs/dbraw/zinc/21/37/42/1029213742.db2.gz SYAMFRVWTQZDOR-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCCCC1(F)F ZINC000450972978 1029753864 /nfs/dbraw/zinc/75/38/64/1029753864.db2.gz JPDQZVQSIHNIPV-AWEZNQCLSA-N 1 1 312.360 3.895 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](c2ccncc2)C1 ZINC000451002209 1029762697 /nfs/dbraw/zinc/76/26/97/1029762697.db2.gz SEZSOVUMBSVMKO-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451332986 1029850582 /nfs/dbraw/zinc/85/05/82/1029850582.db2.gz ADZADYBRGRVGJP-IIVZCXTMSA-N 1 1 318.417 3.671 20 5 DHBDMO CC[C@@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000533423300 1030344696 /nfs/dbraw/zinc/34/46/96/1030344696.db2.gz BUSHGTJSXFFRMZ-CQSZACIVSA-N 1 1 315.373 3.667 20 5 DHBDMO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805839047 1030388817 /nfs/dbraw/zinc/38/88/17/1030388817.db2.gz NGTCJWRPZMQRKN-UKPHBRMFSA-N 1 1 320.433 3.775 20 5 DHBDMO CC[C@@H](NC[C@@H]1CCCC[N@@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000358357402 1030454105 /nfs/dbraw/zinc/45/41/05/1030454105.db2.gz VTTDJXRTQULAPT-ZWKOTPCHSA-N 1 1 319.449 3.898 20 5 DHBDMO CC[C@@H](NC[C@@H]1CCCC[N@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000358357402 1030454111 /nfs/dbraw/zinc/45/41/11/1030454111.db2.gz VTTDJXRTQULAPT-ZWKOTPCHSA-N 1 1 319.449 3.898 20 5 DHBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1[N+](=O)[O-] ZINC000291798429 1030648745 /nfs/dbraw/zinc/64/87/45/1030648745.db2.gz WXOPKNFWCQSEMT-UHFFFAOYSA-N 1 1 315.329 3.528 20 5 DHBDMO Cc1c(C[NH2+][C@@H]2CCc3c2nccc3Cl)cccc1[N+](=O)[O-] ZINC000926271794 1030682894 /nfs/dbraw/zinc/68/28/94/1030682894.db2.gz SXQSXRDJDVKQJE-CQSZACIVSA-N 1 1 317.776 3.729 20 5 DHBDMO Cc1cc(C)c([N+](=O)[O-])c(NCCCC[N@@H+]2CCCC[C@@H]2C)n1 ZINC000359085730 1030770374 /nfs/dbraw/zinc/77/03/74/1030770374.db2.gz UBJSXXJLPOPMDE-HNNXBMFYSA-N 1 1 320.437 3.673 20 5 DHBDMO CCc1onc(C)c1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000927138804 1031115095 /nfs/dbraw/zinc/11/50/95/1031115095.db2.gz HDFCHRFKIZYSIB-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)c(Cl)c1 ZINC000844441849 1031145772 /nfs/dbraw/zinc/14/57/72/1031145772.db2.gz UUOAXDJGMWZODJ-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c(Cl)c1 ZINC000844441849 1031145780 /nfs/dbraw/zinc/14/57/80/1031145780.db2.gz UUOAXDJGMWZODJ-CYBMUJFWSA-N 1 1 316.735 3.869 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872026315 1031410193 /nfs/dbraw/zinc/41/01/93/1031410193.db2.gz COCXFMIZLHTXOA-NEPJUHHUSA-N 1 1 318.348 3.638 20 5 DHBDMO CC[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccncc1 ZINC000872038548 1031421702 /nfs/dbraw/zinc/42/17/02/1031421702.db2.gz MLSUTOHBZBJBLH-BXUZGUMPSA-N 1 1 303.337 3.931 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCCc1ccncc1)C1CC1 ZINC000360471740 1031438619 /nfs/dbraw/zinc/43/86/19/1031438619.db2.gz CFPXCWNCUAGYQW-UHFFFAOYSA-N 1 1 311.385 3.587 20 5 DHBDMO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052962 1031440021 /nfs/dbraw/zinc/44/00/21/1031440021.db2.gz UQBOBXREXPKPET-GTNSWQLSSA-N 1 1 315.348 3.931 20 5 DHBDMO COc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000035368096 1031634566 /nfs/dbraw/zinc/63/45/66/1031634566.db2.gz YOLDVSJLPBSDPA-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293837492 1031649207 /nfs/dbraw/zinc/64/92/07/1031649207.db2.gz SRMALUSVPCFEDP-ZJUUUORDSA-N 1 1 321.327 3.867 20 5 DHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000361412767 1031915924 /nfs/dbraw/zinc/91/59/24/1031915924.db2.gz MPOABMJFPYXVSG-HNNXBMFYSA-N 1 1 312.797 3.639 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000361558307 1031985495 /nfs/dbraw/zinc/98/54/95/1031985495.db2.gz GVDPYMSODXKMEH-CYBMUJFWSA-N 1 1 324.380 3.909 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000361558307 1031985507 /nfs/dbraw/zinc/98/55/07/1031985507.db2.gz GVDPYMSODXKMEH-CYBMUJFWSA-N 1 1 324.380 3.909 20 5 DHBDMO CCCC[N@@H+](CC)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777955079 1032037537 /nfs/dbraw/zinc/03/75/37/1032037537.db2.gz LBJCTEKPXOKZMT-UHFFFAOYSA-N 1 1 302.378 3.538 20 5 DHBDMO CC[C@@]1(C)CC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963093 1032057321 /nfs/dbraw/zinc/05/73/21/1032057321.db2.gz GSAIIUGSVOIHLN-KRWDZBQOSA-N 1 1 314.389 3.538 20 5 DHBDMO C[C@@H]1CC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1(F)F ZINC001172903260 1033437420 /nfs/dbraw/zinc/43/74/20/1033437420.db2.gz GEQHNGUOLLJWRO-DOMZBBRYSA-N 1 1 324.371 3.819 20 5 DHBDMO C[C@@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1(F)F ZINC001172903260 1033437434 /nfs/dbraw/zinc/43/74/34/1033437434.db2.gz GEQHNGUOLLJWRO-DOMZBBRYSA-N 1 1 324.371 3.819 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCCCC(F)(F)C1)CC2 ZINC001172907065 1033440194 /nfs/dbraw/zinc/44/01/94/1033440194.db2.gz CICIYLFZOWSPOR-HNNXBMFYSA-N 1 1 324.371 3.963 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCCCC(F)(F)C1)CC2 ZINC001172907065 1033440201 /nfs/dbraw/zinc/44/02/01/1033440201.db2.gz CICIYLFZOWSPOR-HNNXBMFYSA-N 1 1 324.371 3.963 20 5 DHBDMO Cc1csc([C@@H]2CC[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)C2)n1 ZINC000877813024 1033462632 /nfs/dbraw/zinc/46/26/32/1033462632.db2.gz IHHJLORVIUKKDR-CQSZACIVSA-N 1 1 317.414 3.658 20 5 DHBDMO C[C@@H]1CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H]1C ZINC001172917849 1033464687 /nfs/dbraw/zinc/46/46/87/1033464687.db2.gz XMKXZPZYBPNMLB-JKIFEVAISA-N 1 1 302.418 3.963 20 5 DHBDMO CCC[N@@H+](CC1CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910020 1033483251 /nfs/dbraw/zinc/48/32/51/1033483251.db2.gz WMWXAQIZCASUQH-QGZVFWFLSA-N 1 1 302.418 3.964 20 5 DHBDMO CCCCC[N@@H+](C)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184784 1033584444 /nfs/dbraw/zinc/58/44/44/1033584444.db2.gz OXSSXIPOXMCJQT-LBPRGKRZSA-N 1 1 312.385 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCCC[C@@H]2C)c1F ZINC001173190081 1033584668 /nfs/dbraw/zinc/58/46/68/1033584668.db2.gz QAZOKDWCAKDRLF-QWHCGFSZSA-N 1 1 324.396 3.938 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2C[C@H](C)CC23CC3)c1F ZINC001173191699 1033585107 /nfs/dbraw/zinc/58/51/07/1033585107.db2.gz GKMQIBXHCYOWRE-VXGBXAGGSA-N 1 1 322.380 3.548 20 5 DHBDMO CC[C@@H]1CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173197363 1033590813 /nfs/dbraw/zinc/59/08/13/1033590813.db2.gz UNLUWAYDNLZKMY-CHWSQXEVSA-N 1 1 324.396 3.796 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC001173228379 1033605866 /nfs/dbraw/zinc/60/58/66/1033605866.db2.gz VTXOBXIQDUQEOQ-AAEUAGOBSA-N 1 1 316.323 3.800 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2c(F)cccc2C1 ZINC001173235720 1033609351 /nfs/dbraw/zinc/60/93/51/1033609351.db2.gz YVKIBSCAQWPSKK-ZDUSSCGKSA-N 1 1 314.360 3.723 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC2(CCOCC2)C1 ZINC000266041291 1033904881 /nfs/dbraw/zinc/90/48/81/1033904881.db2.gz VYCLQCGVLDEYIU-AWEZNQCLSA-N 1 1 304.390 3.548 20 5 DHBDMO Cc1c([C@H](C)[NH2+]CC2(N(C)C)CCCCC2)cccc1[N+](=O)[O-] ZINC000480087777 1034055412 /nfs/dbraw/zinc/05/54/12/1034055412.db2.gz YQVVWPYEOMVYJD-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1ncc(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])s1 ZINC000179381235 1034304185 /nfs/dbraw/zinc/30/41/85/1034304185.db2.gz NAJVGUJRQUSIQP-FNORWQNLSA-N 1 1 303.387 3.505 20 5 DHBDMO Cc1ncc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])s1 ZINC000179381235 1034304201 /nfs/dbraw/zinc/30/42/01/1034304201.db2.gz NAJVGUJRQUSIQP-FNORWQNLSA-N 1 1 303.387 3.505 20 5 DHBDMO Cc1c([C@@H](C)NC[C@H](CC(C)C)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000480543820 1034308121 /nfs/dbraw/zinc/30/81/21/1034308121.db2.gz XQFRRUUAMXATSA-CABCVRRESA-N 1 1 307.438 3.530 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H](C)[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000480618833 1034352985 /nfs/dbraw/zinc/35/29/85/1034352985.db2.gz WSTULPYHHKXJJA-OAGGEKHMSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000480618833 1034352996 /nfs/dbraw/zinc/35/29/96/1034352996.db2.gz WSTULPYHHKXJJA-OAGGEKHMSA-N 1 1 319.449 3.817 20 5 DHBDMO C[C@H](NC[C@H](C)[N@@H+]1CCCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000480642920 1034363150 /nfs/dbraw/zinc/36/31/50/1034363150.db2.gz NVZDPDMTENYCOE-ILXRZTDVSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](NC[C@H](C)[N@H+]1CCCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000480642920 1034363160 /nfs/dbraw/zinc/36/31/60/1034363160.db2.gz NVZDPDMTENYCOE-ILXRZTDVSA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1ccc(C[N@H+](C)C[C@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000183253644 1034367355 /nfs/dbraw/zinc/36/73/55/1034367355.db2.gz QYAXOJMZDVLTSQ-LBPRGKRZSA-N 1 1 305.403 3.595 20 5 DHBDMO C[C@@H](NCC(C)(C)[N@H+]1CCC[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000481028078 1034560478 /nfs/dbraw/zinc/56/04/78/1034560478.db2.gz XRUSFRYQSBPRCU-LSDHHAIUSA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@@H]([NH2+]CC(C)(C)N1CCC[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000481028078 1034560486 /nfs/dbraw/zinc/56/04/86/1034560486.db2.gz XRUSFRYQSBPRCU-LSDHHAIUSA-N 1 1 319.449 3.756 20 5 DHBDMO Cc1ccc([C@H](C)N[C@H](C)C[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000481169731 1034626706 /nfs/dbraw/zinc/62/67/06/1034626706.db2.gz FKCLYFVFWIARNR-IMJJTQAJSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([C@H](C)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000481169731 1034626718 /nfs/dbraw/zinc/62/67/18/1034626718.db2.gz FKCLYFVFWIARNR-IMJJTQAJSA-N 1 1 319.449 3.674 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2c(O)cccc2C1 ZINC000600209170 1034816262 /nfs/dbraw/zinc/81/62/62/1034816262.db2.gz XVBKQCQJTLWANJ-UVTDQMKNSA-N 1 1 324.380 3.762 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC(C)(C)[C@@H]2CCC[C@H]21 ZINC000555720958 1034875597 /nfs/dbraw/zinc/87/55/97/1034875597.db2.gz BLMYKAZIUQMOAA-HUUCEWRRSA-N 1 1 304.390 3.614 20 5 DHBDMO CC(C)[N@@H+](CCc1nccs1)Cc1csc([N+](=O)[O-])c1 ZINC000159834738 1035095344 /nfs/dbraw/zinc/09/53/44/1035095344.db2.gz AABSBSOSUVNZDP-UHFFFAOYSA-N 1 1 311.432 3.566 20 5 DHBDMO Cc1cc(-n2c3ccccc3cc3c(=O)c(N)ccc2-3)cc(C)[nH+]1 ZINC001176060147 1035198900 /nfs/dbraw/zinc/19/89/00/1035198900.db2.gz LSPDIJKFXKSJPC-UHFFFAOYSA-N 1 1 315.376 3.690 20 5 DHBDMO COCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC[C@H](C)C1 ZINC000483422672 1035268163 /nfs/dbraw/zinc/26/81/63/1035268163.db2.gz YBFHSKZARULJME-MCKRRDHZSA-N 1 1 318.417 3.745 20 5 DHBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC[N@H+]1C ZINC000484640040 1035378684 /nfs/dbraw/zinc/37/86/84/1035378684.db2.gz PSFBRWVDQKPAAU-JSGCOSHPSA-N 1 1 321.421 3.667 20 5 DHBDMO COCC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000485147358 1035478920 /nfs/dbraw/zinc/47/89/20/1035478920.db2.gz ZOLLTWMMRUAFTR-AWEZNQCLSA-N 1 1 322.380 3.539 20 5 DHBDMO CC[C@H](C)[C@@H](C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)OC ZINC001179945671 1035540271 /nfs/dbraw/zinc/54/02/71/1035540271.db2.gz IXNVZORFTFACAG-XHDPSFHLSA-N 1 1 314.813 3.741 20 5 DHBDMO CC[C@H](C)[C@@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)OC ZINC001179945671 1035540289 /nfs/dbraw/zinc/54/02/89/1035540289.db2.gz IXNVZORFTFACAG-XHDPSFHLSA-N 1 1 314.813 3.741 20 5 DHBDMO C[C@@H]1CSCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000539840671 1035905283 /nfs/dbraw/zinc/90/52/83/1035905283.db2.gz JLKXAHKTFVWNMA-GFCCVEGCSA-N 1 1 318.398 3.792 20 5 DHBDMO CO[C@@H]1C[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001194384617 1035917013 /nfs/dbraw/zinc/91/70/13/1035917013.db2.gz LPBBGHZIVPBDHZ-LSDHHAIUSA-N 1 1 324.808 3.638 20 5 DHBDMO CO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001194384617 1035917020 /nfs/dbraw/zinc/91/70/20/1035917020.db2.gz LPBBGHZIVPBDHZ-LSDHHAIUSA-N 1 1 324.808 3.638 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[N@@H+](C)C2(CCCCC2)C1 ZINC001194477546 1035944185 /nfs/dbraw/zinc/94/41/85/1035944185.db2.gz MDVZRVLGAHAWGA-OAHLLOKOSA-N 1 1 317.433 3.606 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(C)C2(CCCCC2)C1 ZINC001194477546 1035944193 /nfs/dbraw/zinc/94/41/93/1035944193.db2.gz MDVZRVLGAHAWGA-OAHLLOKOSA-N 1 1 317.433 3.606 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCN(C)C2(CCCCC2)C1 ZINC001194477546 1035944206 /nfs/dbraw/zinc/94/42/06/1035944206.db2.gz MDVZRVLGAHAWGA-OAHLLOKOSA-N 1 1 317.433 3.606 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1N1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000774516717 1036392137 /nfs/dbraw/zinc/39/21/37/1036392137.db2.gz BDZCBYZZKYZZKV-UXLLHSPISA-N 1 1 317.433 3.745 20 5 DHBDMO CC(C)c1ccc(C[N@@H+]2CC[C@@H](C)C[C@H]2[C@H](C)O)cc1[N+](=O)[O-] ZINC000443774519 1036582106 /nfs/dbraw/zinc/58/21/06/1036582106.db2.gz AHNMELZSDZIONO-KEYYUXOJSA-N 1 1 320.433 3.700 20 5 DHBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000774625066 1036583971 /nfs/dbraw/zinc/58/39/71/1036583971.db2.gz OIEITSTXHLNXRQ-DYVFJYSZSA-N 1 1 314.389 3.536 20 5 DHBDMO CC(C)[N@@H+](CC1CC1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636831 1036601919 /nfs/dbraw/zinc/60/19/19/1036601919.db2.gz YLZNLQTUNVJKJM-UHFFFAOYSA-N 1 1 322.796 3.676 20 5 DHBDMO C[C@@H]([N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C1(C)CC1 ZINC000774638221 1036617396 /nfs/dbraw/zinc/61/73/96/1036617396.db2.gz QNIFRRIZSGKERI-SNVBAGLBSA-N 1 1 322.796 3.676 20 5 DHBDMO Cc1cccc(OCC[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000487681299 1036709723 /nfs/dbraw/zinc/70/97/23/1036709723.db2.gz YMGABLXDHFRZMZ-OAHLLOKOSA-N 1 1 314.385 3.975 20 5 DHBDMO C[C@@]1(c2ccccc2)CCC[N@H+]1Cc1cc([O-])ccc1[N+](=O)[O-] ZINC001197343503 1036743830 /nfs/dbraw/zinc/74/38/30/1036743830.db2.gz SYGAAGZPZROAKG-SFHVURJKSA-N 1 1 312.369 3.812 20 5 DHBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1c(F)cccc1[N+](=O)[O-] ZINC001184999291 1036999364 /nfs/dbraw/zinc/99/93/64/1036999364.db2.gz VZXBXZWVUJCIAW-FRRDWIJNSA-N 1 1 309.385 3.512 20 5 DHBDMO CCC(CC)C[N@@H+](CC)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000488509806 1037053316 /nfs/dbraw/zinc/05/33/16/1037053316.db2.gz BBOQXYORJAELMI-ZDUSSCGKSA-N 1 1 321.421 3.680 20 5 DHBDMO CC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000774903864 1037196022 /nfs/dbraw/zinc/19/60/22/1037196022.db2.gz ALRZYGQEBMYCJX-GFCCVEGCSA-N 1 1 307.350 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c(F)c1 ZINC000490545010 1037730274 /nfs/dbraw/zinc/73/02/74/1037730274.db2.gz MWXTZXMKDKSYOO-MRXNPFEDSA-N 1 1 322.380 3.658 20 5 DHBDMO Cc1cccc(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000570935904 1038040296 /nfs/dbraw/zinc/04/02/96/1038040296.db2.gz LRLBECQFTHNSJH-XHSDSOJGSA-N 1 1 317.433 3.745 20 5 DHBDMO C[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000917040884 1038124455 /nfs/dbraw/zinc/12/44/55/1038124455.db2.gz WJTHIFYHYLLKPJ-CQSZACIVSA-N 1 1 312.369 3.593 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000589199936 1038449023 /nfs/dbraw/zinc/44/90/23/1038449023.db2.gz NPLXEGQBYGPFOE-NVXWUHKLSA-N 1 1 318.417 3.542 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000589199940 1038449929 /nfs/dbraw/zinc/44/99/29/1038449929.db2.gz NPLXEGQBYGPFOE-WBVHZDCISA-N 1 1 318.417 3.542 20 5 DHBDMO Cc1nc(C)c(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000589252521 1038453326 /nfs/dbraw/zinc/45/33/26/1038453326.db2.gz ZUFYAHUZHNCOMG-UHFFFAOYSA-N 1 1 303.362 3.610 20 5 DHBDMO Cc1nc(C)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000589252521 1038453330 /nfs/dbraw/zinc/45/33/30/1038453330.db2.gz ZUFYAHUZHNCOMG-UHFFFAOYSA-N 1 1 303.362 3.610 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000589343987 1038461596 /nfs/dbraw/zinc/46/15/96/1038461596.db2.gz FDBOSUSZEWCRAA-CABCVRRESA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000589343987 1038461600 /nfs/dbraw/zinc/46/16/00/1038461600.db2.gz FDBOSUSZEWCRAA-CABCVRRESA-N 1 1 307.438 3.674 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1nccc2ccccc21 ZINC000589341835 1038461659 /nfs/dbraw/zinc/46/16/59/1038461659.db2.gz AHODPDFMFLMSEZ-CYBMUJFWSA-N 1 1 307.353 3.994 20 5 DHBDMO C[C@@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC001191486911 1038509023 /nfs/dbraw/zinc/50/90/23/1038509023.db2.gz VSMNLAFFFNOAPH-ZJUUUORDSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC001191486911 1038509030 /nfs/dbraw/zinc/50/90/30/1038509030.db2.gz VSMNLAFFFNOAPH-ZJUUUORDSA-N 1 1 313.195 3.588 20 5 DHBDMO Cc1cc(CNc2sccc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000589604158 1038515724 /nfs/dbraw/zinc/51/57/24/1038515724.db2.gz YZSWRBVNXZMTOZ-UHFFFAOYSA-N 1 1 318.402 3.572 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC(C)(C)[C@@H]2CCC[C@H]21 ZINC000590203761 1038604155 /nfs/dbraw/zinc/60/41/55/1038604155.db2.gz ZCOTXRDAFDVAOK-HUUCEWRRSA-N 1 1 304.390 3.614 20 5 DHBDMO CC(C)C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(C)(C)C ZINC001192224940 1038610954 /nfs/dbraw/zinc/61/09/54/1038610954.db2.gz UDOFKCLPKNIOFR-UHFFFAOYSA-N 1 1 308.422 3.978 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@@H](c1ccc(F)cc1F)C1CC1 ZINC001192617590 1038686936 /nfs/dbraw/zinc/68/69/36/1038686936.db2.gz WLKZZPLXXXGPSZ-OAHLLOKOSA-N 1 1 319.311 3.509 20 5 DHBDMO Cc1nc(C)c(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000590757626 1038699508 /nfs/dbraw/zinc/69/95/08/1038699508.db2.gz RZMHAUGXXYHSBQ-HNNXBMFYSA-N 1 1 315.373 3.579 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCCc2scnc21)c1cccc([N+](=O)[O-])c1 ZINC000599023751 1038988143 /nfs/dbraw/zinc/98/81/43/1038988143.db2.gz LGWVYMXYPINZKZ-GWCFXTLKSA-N 1 1 303.387 3.780 20 5 DHBDMO C[C@@H](NC[C@@H]1CC[N@@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000599064137 1039018219 /nfs/dbraw/zinc/01/82/19/1039018219.db2.gz KHLGSEVHASXTMG-KDOFPFPSSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@@H](NC[C@@H]1CC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000599064137 1039018233 /nfs/dbraw/zinc/01/82/33/1039018233.db2.gz KHLGSEVHASXTMG-KDOFPFPSSA-N 1 1 317.433 3.652 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C1CC1)C1CCCCC1 ZINC000061162653 1039057887 /nfs/dbraw/zinc/05/78/87/1039057887.db2.gz VFTORXWGAWSTKI-UHFFFAOYSA-N 1 1 304.390 3.901 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCC[C@@H]3CCOC3)C2)cc1 ZINC000592126849 1039123186 /nfs/dbraw/zinc/12/31/86/1039123186.db2.gz RIOCGXHEODBTLX-NVXWUHKLSA-N 1 1 318.417 3.591 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CC1CCC1)[C@H]1CC[C@H](O)CC1 ZINC000592131038 1039123691 /nfs/dbraw/zinc/12/36/91/1039123691.db2.gz REIZJUXUXAHTAT-QAQDUYKDSA-N 1 1 318.417 3.500 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCC[C@@H]3CCOC3)C2)cc1 ZINC000592126852 1039123806 /nfs/dbraw/zinc/12/38/06/1039123806.db2.gz RIOCGXHEODBTLX-WBVHZDCISA-N 1 1 318.417 3.591 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000592140179 1039135406 /nfs/dbraw/zinc/13/54/06/1039135406.db2.gz NNLOFPASFWHBQZ-ZBFHGGJFSA-N 1 1 311.385 3.849 20 5 DHBDMO Cc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)CC2CC2)cn1 ZINC000592145510 1039137194 /nfs/dbraw/zinc/13/71/94/1039137194.db2.gz UANZSFZMRUFSGZ-UHFFFAOYSA-N 1 1 311.385 3.710 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cccc([N+](=O)[O-])c1C ZINC000603854806 1039188173 /nfs/dbraw/zinc/18/81/73/1039188173.db2.gz LKBGHHLDYMQKFU-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO Cc1ccccc1OCCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000603869836 1039202614 /nfs/dbraw/zinc/20/26/14/1039202614.db2.gz PLFSIDCHKSWQBX-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO Cc1cc(NCCCC[N@@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000603860147 1039204523 /nfs/dbraw/zinc/20/45/23/1039204523.db2.gz SDHPUQYJRCEEII-AWEZNQCLSA-N 1 1 305.422 3.827 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000604484435 1039480879 /nfs/dbraw/zinc/48/08/79/1039480879.db2.gz MQYABAIHOVSDJW-GOSISDBHSA-N 1 1 312.369 3.680 20 5 DHBDMO CC(C)c1ccc(CNCC[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000604532803 1039496203 /nfs/dbraw/zinc/49/62/03/1039496203.db2.gz KXRFOENBUFAGJO-HNNXBMFYSA-N 1 1 319.449 3.540 20 5 DHBDMO CC(C)c1ccc(CNCC[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000604532803 1039496213 /nfs/dbraw/zinc/49/62/13/1039496213.db2.gz KXRFOENBUFAGJO-HNNXBMFYSA-N 1 1 319.449 3.540 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2c2ccccc2)c1 ZINC000058932558 1039632638 /nfs/dbraw/zinc/63/26/38/1039632638.db2.gz FYDAIYBKVQJBDZ-SFHVURJKSA-N 1 1 312.369 3.811 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(C(F)F)nc1 ZINC000595013031 1039973790 /nfs/dbraw/zinc/97/37/90/1039973790.db2.gz FXNOAHYGLSIWQL-SNVBAGLBSA-N 1 1 307.300 3.778 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1(c2ccccc2)CC1 ZINC000595023384 1039984449 /nfs/dbraw/zinc/98/44/49/1039984449.db2.gz QBQHWZCJSHDYKC-ZDUSSCGKSA-N 1 1 312.369 3.943 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)c1c(C)noc1C ZINC000595008380 1040016981 /nfs/dbraw/zinc/01/69/81/1040016981.db2.gz OISLSHXWZMBNJA-NXEZZACHSA-N 1 1 319.361 3.620 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595329911 1040099253 /nfs/dbraw/zinc/09/92/53/1040099253.db2.gz DOVPNIQCTLYIRM-UONOGXRCSA-N 1 1 312.410 3.840 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](c2ccccc2)C(C)(C)C)c1[N+](=O)[O-] ZINC000595359728 1040128129 /nfs/dbraw/zinc/12/81/29/1040128129.db2.gz SVQPKIUEOKIDDE-HNNXBMFYSA-N 1 1 303.362 3.768 20 5 DHBDMO CC(C)Oc1ccnc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000593019783 1040146884 /nfs/dbraw/zinc/14/68/84/1040146884.db2.gz LDHFFJQTBVNONL-ZDUSSCGKSA-N 1 1 315.373 3.628 20 5 DHBDMO Cc1noc(C[N@H+](C)[C@H]2CCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595539398 1040168798 /nfs/dbraw/zinc/16/87/98/1040168798.db2.gz LZIPYNLLYARWIT-CABCVRRESA-N 1 1 315.373 3.659 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000595787653 1040256362 /nfs/dbraw/zinc/25/63/62/1040256362.db2.gz FQSRPGYBVJXGIT-DYVFJYSZSA-N 1 1 322.380 3.515 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)cccc1[N+](=O)[O-] ZINC000595790438 1040258611 /nfs/dbraw/zinc/25/86/11/1040258611.db2.gz QJAVGOUCLIMJCQ-FUHWJXTLSA-N 1 1 318.417 3.684 20 5 DHBDMO Cc1cc(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])s1 ZINC000596174469 1040336812 /nfs/dbraw/zinc/33/68/12/1040336812.db2.gz BDROJHGGOJCJJF-CQSZACIVSA-N 1 1 303.387 3.563 20 5 DHBDMO Cc1cc(N[C@@H]2C[N@H+](C)Cc3ccccc32)c([N+](=O)[O-])s1 ZINC000596174469 1040336825 /nfs/dbraw/zinc/33/68/25/1040336825.db2.gz BDROJHGGOJCJJF-CQSZACIVSA-N 1 1 303.387 3.563 20 5 DHBDMO CC[C@H](C)[N@@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602438585 1041032111 /nfs/dbraw/zinc/03/21/11/1041032111.db2.gz FXAAJCJGGRIJPH-ZETCQYMHSA-N 1 1 307.213 3.649 20 5 DHBDMO Cc1ccc2c(c1)[C@H]([NH2+]Cc1nc3cc([N+](=O)[O-])ccc3o1)CC2 ZINC000602540363 1041082457 /nfs/dbraw/zinc/08/24/57/1041082457.db2.gz MOEKWAUOMAEIDJ-OAHLLOKOSA-N 1 1 323.352 3.822 20 5 DHBDMO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602540582 1041083437 /nfs/dbraw/zinc/08/34/37/1041083437.db2.gz QRIRRWNYXABGNL-ADLMAVQZSA-N 1 1 323.352 3.759 20 5 DHBDMO Cc1cccc2c1CC[C@@H]2[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602540745 1041084619 /nfs/dbraw/zinc/08/46/19/1041084619.db2.gz RCEMHOBYFCSEFC-HNNXBMFYSA-N 1 1 323.352 3.822 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2cccnc2)C1 ZINC000602857964 1041264826 /nfs/dbraw/zinc/26/48/26/1041264826.db2.gz ZNAXGOMQBLNQQG-PBHICJAKSA-N 1 1 311.385 3.930 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@@H](C)C(C)(C)C)c2cc([N+](=O)[O-])ccc12 ZINC000761279215 1041273569 /nfs/dbraw/zinc/27/35/69/1041273569.db2.gz IHDVEMAVWGVTLA-LBPRGKRZSA-N 1 1 304.394 3.577 20 5 DHBDMO Cc1ccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000083170584 185215749 /nfs/dbraw/zinc/21/57/49/185215749.db2.gz FTUPBWNRHFRKDZ-UHFFFAOYSA-N 1 1 317.370 3.738 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000083170584 185215750 /nfs/dbraw/zinc/21/57/50/185215750.db2.gz FTUPBWNRHFRKDZ-UHFFFAOYSA-N 1 1 317.370 3.738 20 5 DHBDMO CC[C@](C)([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1nccs1 ZINC000072684511 191214256 /nfs/dbraw/zinc/21/42/56/191214256.db2.gz QVMRUCLOKWILJF-HNNXBMFYSA-N 1 1 305.403 3.775 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCCCC3)cs2)c1 ZINC000092106858 193160596 /nfs/dbraw/zinc/16/05/96/193160596.db2.gz MWOSOBMBAQYXNV-UHFFFAOYSA-N 1 1 303.387 3.704 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(C(F)(F)F)CC2)cc1F ZINC000094774917 193396181 /nfs/dbraw/zinc/39/61/81/193396181.db2.gz RYTGZTIJOPDWBA-UHFFFAOYSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104661651 194023232 /nfs/dbraw/zinc/02/32/32/194023232.db2.gz JVMLLIDPRWKMDF-CYBMUJFWSA-N 1 1 315.373 3.667 20 5 DHBDMO CN(C)c1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000273085909 130088521 /nfs/dbraw/zinc/08/85/21/130088521.db2.gz LYKKIHCWZXUUPI-UHFFFAOYSA-N 1 1 319.792 3.604 20 5 DHBDMO C[C@]12CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]1C2(Cl)Cl ZINC000284814744 131113629 /nfs/dbraw/zinc/11/36/29/131113629.db2.gz PLJXPVSOHDTODR-OLZOCXBDSA-N 1 1 315.200 3.611 20 5 DHBDMO C[C@]12CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]1C2(Cl)Cl ZINC000284814744 131113631 /nfs/dbraw/zinc/11/36/31/131113631.db2.gz PLJXPVSOHDTODR-OLZOCXBDSA-N 1 1 315.200 3.611 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000289484381 131389989 /nfs/dbraw/zinc/38/99/89/131389989.db2.gz IOROJLZPPYOOGI-XOKHGSTOSA-N 1 1 316.401 3.689 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000120079510 132139378 /nfs/dbraw/zinc/13/93/78/132139378.db2.gz UGTJVLCOMINNSF-LBPRGKRZSA-N 1 1 315.329 3.662 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000408201456 332241135 /nfs/dbraw/zinc/24/11/35/332241135.db2.gz FMSRIMIXJGXCSK-KGLIPLIRSA-N 1 1 304.390 3.547 20 5 DHBDMO CC[C@@H]([NH2+]CCN(C(C)C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000314391072 333107734 /nfs/dbraw/zinc/10/77/34/333107734.db2.gz SGDFUBMLSKTCCQ-QGZVFWFLSA-N 1 1 307.438 3.754 20 5 DHBDMO CC(C)[N@@H+](C)CCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000318989324 333238908 /nfs/dbraw/zinc/23/89/08/333238908.db2.gz LUTDPYMQGLMBAJ-UHFFFAOYSA-N 1 1 319.327 3.756 20 5 DHBDMO COc1ccc(CCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000497475971 333254908 /nfs/dbraw/zinc/25/49/08/333254908.db2.gz RGUCBWNUBQHQOX-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1Cl ZINC000019992278 333294873 /nfs/dbraw/zinc/29/48/73/333294873.db2.gz SKBKMCICTBIDRI-GFCCVEGCSA-N 1 1 311.813 3.925 20 5 DHBDMO COc1ccc(C[N@H+]2CCCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000498904495 333312465 /nfs/dbraw/zinc/31/24/65/333312465.db2.gz ITQPPJIZZLJTBR-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CC(C)[N@H+](Cc1cccs1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269694026 334003388 /nfs/dbraw/zinc/00/33/88/334003388.db2.gz VYTVYOXMFSVBAK-INIZCTEOSA-N 1 1 320.414 3.600 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000286204879 334151684 /nfs/dbraw/zinc/15/16/84/334151684.db2.gz RTZFWQBUCXUFEA-MRXNPFEDSA-N 1 1 314.389 3.729 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2ccc(O)cc2)CC2CC2)cs1 ZINC000345769227 335350110 /nfs/dbraw/zinc/35/01/10/335350110.db2.gz RRJVQFOEBYJMDZ-UHFFFAOYSA-N 1 1 318.398 3.774 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccc(O)cc2)CC2CC2)cs1 ZINC000345769227 335350111 /nfs/dbraw/zinc/35/01/11/335350111.db2.gz RRJVQFOEBYJMDZ-UHFFFAOYSA-N 1 1 318.398 3.774 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3nccs3)CC2)c(F)c1 ZINC000332469731 336172299 /nfs/dbraw/zinc/17/22/99/336172299.db2.gz UDYVRWFNOHIWFX-UHFFFAOYSA-N 1 1 321.377 3.570 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000352546541 336223841 /nfs/dbraw/zinc/22/38/41/336223841.db2.gz WRBFQRBAVPKMGZ-QAPCUYQASA-N 1 1 318.417 3.857 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000532575216 336256967 /nfs/dbraw/zinc/25/69/67/336256967.db2.gz NGIFWAFTOYBCTD-QWHCGFSZSA-N 1 1 315.373 3.523 20 5 DHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000192958644 336286006 /nfs/dbraw/zinc/28/60/06/336286006.db2.gz IIHMUQXWDINZJC-MRXNPFEDSA-N 1 1 311.385 3.529 20 5 DHBDMO Cc1ccc(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302035172 336344626 /nfs/dbraw/zinc/34/46/26/336344626.db2.gz FFXSQYVNENUEST-LSDHHAIUSA-N 1 1 317.433 3.968 20 5 DHBDMO Cc1ccc(CNc2ccc([N+](=O)[O-])cc2)c(N2CCCC2)[nH+]1 ZINC000302065231 336346568 /nfs/dbraw/zinc/34/65/68/336346568.db2.gz VUHPGRHETHAMPT-UHFFFAOYSA-N 1 1 312.373 3.511 20 5 DHBDMO CCc1cc(N(C)Cc2cc([N+](=O)[O-])ccc2Cl)nc(C)[nH+]1 ZINC000302072237 336346947 /nfs/dbraw/zinc/34/69/47/336346947.db2.gz ZDENHTCBLJQCMA-UHFFFAOYSA-N 1 1 320.780 3.545 20 5 DHBDMO CCC(CC)C[N@@H+](CC)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000514120717 336373040 /nfs/dbraw/zinc/37/30/40/336373040.db2.gz MYMZFOYWTVWJAB-UHFFFAOYSA-N 1 1 321.421 3.600 20 5 DHBDMO CCOC1CC2(C1)CC[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C2 ZINC000353016520 336382049 /nfs/dbraw/zinc/38/20/49/336382049.db2.gz AHCJXGDZKPYMAW-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO CCOC1CC2(C1)CC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C2 ZINC000353016520 336382050 /nfs/dbraw/zinc/38/20/50/336382050.db2.gz AHCJXGDZKPYMAW-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1[nH+]ccn1CCCOc1ccc([N+](=O)[O-])c2ccccc12 ZINC000354256689 336464771 /nfs/dbraw/zinc/46/47/71/336464771.db2.gz WGHMKIZEBWJIPL-UHFFFAOYSA-N 1 1 311.341 3.722 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000376558920 337036662 /nfs/dbraw/zinc/03/66/62/337036662.db2.gz RDGBGHDTSGKXCR-PXAZEXFGSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000376558920 337036663 /nfs/dbraw/zinc/03/66/63/337036663.db2.gz RDGBGHDTSGKXCR-PXAZEXFGSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000173404555 337135052 /nfs/dbraw/zinc/13/50/52/337135052.db2.gz RTDNVRRHHGRNHZ-BDJLRTHQSA-N 1 1 316.332 3.908 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000582877417 337209756 /nfs/dbraw/zinc/20/97/56/337209756.db2.gz OBLWUTPFODPYFW-YQCJOKCJSA-N 1 1 310.344 3.975 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000192347210 337304694 /nfs/dbraw/zinc/30/46/94/337304694.db2.gz DAOODHFYARJWAH-HNNXBMFYSA-N 1 1 316.332 3.607 20 5 DHBDMO Cc1c(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000437531573 338312841 /nfs/dbraw/zinc/31/28/41/338312841.db2.gz AORXFTOLMLNDDK-HOTGVXAUSA-N 1 1 306.431 3.763 20 5 DHBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)c2ccccc2O1 ZINC000449426855 338623334 /nfs/dbraw/zinc/62/33/34/338623334.db2.gz QNBHGTDPADZHJE-BDJLRTHQSA-N 1 1 316.332 3.736 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc(C)oc1C ZINC000195270162 338888649 /nfs/dbraw/zinc/88/86/49/338888649.db2.gz QXVBDNIOFRMIEV-NSHDSACASA-N 1 1 304.346 3.664 20 5 DHBDMO CC(C)c1ccc(CNCc2ccc3c[nH+]cn3c2)cc1[N+](=O)[O-] ZINC000459659987 339041299 /nfs/dbraw/zinc/04/12/99/339041299.db2.gz NQTLIACCBAGPLB-UHFFFAOYSA-N 1 1 324.384 3.656 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000463470908 339118957 /nfs/dbraw/zinc/11/89/57/339118957.db2.gz UEMSHJCDWYVCBR-SWLSCSKDSA-N 1 1 322.380 3.897 20 5 DHBDMO C[C@H]([NH2+]C[C@@H](C1CCCCC1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000467834145 339247159 /nfs/dbraw/zinc/24/71/59/339247159.db2.gz PGCJUHZDJJUHQC-KSSFIOAISA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@H](NC[C@H](C)[N@@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000467839284 339247421 /nfs/dbraw/zinc/24/74/21/339247421.db2.gz MXOKHFPCAXTRHV-ILXRZTDVSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](NC[C@H](C)[N@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000467839284 339247422 /nfs/dbraw/zinc/24/74/22/339247422.db2.gz MXOKHFPCAXTRHV-ILXRZTDVSA-N 1 1 305.422 3.508 20 5 DHBDMO COCC[C@@H]1CCCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000468692168 339268677 /nfs/dbraw/zinc/26/86/77/339268677.db2.gz ZZEZSZSFDZWVFN-FSNWXROXSA-N 1 1 318.417 3.747 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000470949204 339332437 /nfs/dbraw/zinc/33/24/37/339332437.db2.gz WBPZSNDJOSTFHS-BREBYQMCSA-N 1 1 302.296 3.929 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000505612108 340172966 /nfs/dbraw/zinc/17/29/66/340172966.db2.gz OJSWMHTVICHEPR-OAHLLOKOSA-N 1 1 314.360 3.941 20 5 DHBDMO COc1cccc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])c1 ZINC000505642512 340174042 /nfs/dbraw/zinc/17/40/42/340174042.db2.gz WKDVWSCRYBZVCK-RMKNXTFCSA-N 1 1 312.369 3.749 20 5 DHBDMO COCC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000508530140 340245894 /nfs/dbraw/zinc/24/58/94/340245894.db2.gz FSRBSZBLYFRVMJ-OAHLLOKOSA-N 1 1 314.385 3.804 20 5 DHBDMO COCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000508530140 340245895 /nfs/dbraw/zinc/24/58/95/340245895.db2.gz FSRBSZBLYFRVMJ-OAHLLOKOSA-N 1 1 314.385 3.804 20 5 DHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c(F)c1 ZINC000509327231 340266282 /nfs/dbraw/zinc/26/62/82/340266282.db2.gz KBWJNIRYJBSHDU-CYBMUJFWSA-N 1 1 318.323 3.863 20 5 DHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CC[C@@H](c3ccccc3)C2)c(F)c1 ZINC000509327231 340266283 /nfs/dbraw/zinc/26/62/83/340266283.db2.gz KBWJNIRYJBSHDU-CYBMUJFWSA-N 1 1 318.323 3.863 20 5 DHBDMO C[N@H+](CCOc1cccc(Cl)c1)Cc1ccccc1[N+](=O)[O-] ZINC000302808298 340282534 /nfs/dbraw/zinc/28/25/34/340282534.db2.gz RXBMPPDVPJQLKC-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1cccc(Cl)c1)Cc1ccccc1[N+](=O)[O-] ZINC000302808298 340282535 /nfs/dbraw/zinc/28/25/35/340282535.db2.gz RXBMPPDVPJQLKC-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO Cc1cc(F)ccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511059002 340319673 /nfs/dbraw/zinc/31/96/73/340319673.db2.gz JFQRBMMUAFSPGS-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO Cc1ccc2c(c1)C[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CCO2 ZINC000512238245 340353537 /nfs/dbraw/zinc/35/35/37/340353537.db2.gz ZHSQOXTVVZHSQU-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CCO2 ZINC000512238245 340353538 /nfs/dbraw/zinc/35/35/38/340353538.db2.gz ZHSQOXTVVZHSQU-AWEZNQCLSA-N 1 1 312.369 3.859 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCSC1 ZINC000130547794 341027275 /nfs/dbraw/zinc/02/72/75/341027275.db2.gz SJSVBBJGHYHRHM-GFCCVEGCSA-N 1 1 318.398 3.792 20 5 DHBDMO C[C@@H]1CCC[C@@H](CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000543481236 341046677 /nfs/dbraw/zinc/04/66/77/341046677.db2.gz SHHUHDRNERMLNJ-KGLIPLIRSA-N 1 1 303.406 3.564 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1C ZINC000071959363 341055756 /nfs/dbraw/zinc/05/57/56/341055756.db2.gz BHDQIRPKPINTQR-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000544608141 341088673 /nfs/dbraw/zinc/08/86/73/341088673.db2.gz LAAMMXFHYDXIBO-WBMJQRKESA-N 1 1 300.358 3.909 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000075612029 341179567 /nfs/dbraw/zinc/17/95/67/341179567.db2.gz FPORMVFKBLRHQJ-AWEZNQCLSA-N 1 1 313.401 3.854 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000075831255 341184973 /nfs/dbraw/zinc/18/49/73/341184973.db2.gz XGJJAERVWACGRZ-AWEZNQCLSA-N 1 1 322.380 3.658 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@]2(O)CCCC[C@H]2C1 ZINC000245516666 341298791 /nfs/dbraw/zinc/29/87/91/341298791.db2.gz FZQDLUUTFKHVGV-RLFYNMQTSA-N 1 1 318.417 3.591 20 5 DHBDMO CCC[N@@H+](C)C[C@H]1CCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245520979 341299682 /nfs/dbraw/zinc/29/96/82/341299682.db2.gz KBKXAQKJQUWKOD-HZPDHXFCSA-N 1 1 319.449 3.628 20 5 DHBDMO C[C@H](Cc1ccsc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549810761 341303692 /nfs/dbraw/zinc/30/36/92/341303692.db2.gz WUBXZMNDIZWXJQ-CYBMUJFWSA-N 1 1 304.415 3.762 20 5 DHBDMO COc1cc(C[N@H+]2CCC=C(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000551707391 341349567 /nfs/dbraw/zinc/34/95/67/341349567.db2.gz HAUOVFDCUSYWBK-UHFFFAOYSA-N 1 1 324.380 3.893 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)C1 ZINC000246918809 341358694 /nfs/dbraw/zinc/35/86/94/341358694.db2.gz YJRIKRLDZAWVPY-NEPJUHHUSA-N 1 1 303.362 3.604 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCO[C@H](C(C)C)C1 ZINC000552443815 341394006 /nfs/dbraw/zinc/39/40/06/341394006.db2.gz AWMQZGFNFKSRTE-KAPURRDVSA-N 1 1 318.417 3.745 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@@H]2CCCc3cn[nH]c32)cc1[N+](=O)[O-] ZINC000363826618 519836244 /nfs/dbraw/zinc/83/62/44/519836244.db2.gz NOXRZPIGYGYYRG-OAHLLOKOSA-N 1 1 314.389 3.609 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)cc1[N+](=O)[O-] ZINC000363826618 519836245 /nfs/dbraw/zinc/83/62/45/519836245.db2.gz NOXRZPIGYGYYRG-OAHLLOKOSA-N 1 1 314.389 3.609 20 5 DHBDMO CCCO[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000266721543 520273321 /nfs/dbraw/zinc/27/33/21/520273321.db2.gz HOPOAESAKZLUNN-LSDHHAIUSA-N 1 1 306.406 3.937 20 5 DHBDMO CC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000180099855 521443082 /nfs/dbraw/zinc/44/30/82/521443082.db2.gz TZDQWFPMYNXAQV-UHFFFAOYSA-N 1 1 303.387 3.703 20 5 DHBDMO CC[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000180099855 521443086 /nfs/dbraw/zinc/44/30/86/521443086.db2.gz TZDQWFPMYNXAQV-UHFFFAOYSA-N 1 1 303.387 3.703 20 5 DHBDMO COC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccco1 ZINC000156631697 522759370 /nfs/dbraw/zinc/75/93/70/522759370.db2.gz MAGGORXIKRUPSJ-WFASDCNBSA-N 1 1 304.346 3.535 20 5 DHBDMO COC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)o1 ZINC000156492700 522768048 /nfs/dbraw/zinc/76/80/48/522768048.db2.gz DHSWUCMOXSAIFP-DOMZBBRYSA-N 1 1 304.346 3.535 20 5 DHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000158055793 524759052 /nfs/dbraw/zinc/75/90/52/524759052.db2.gz DODQDKMVKUETFV-OAHLLOKOSA-N 1 1 312.369 3.593 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cnn1C(C)C ZINC000191350668 525900002 /nfs/dbraw/zinc/90/00/02/525900002.db2.gz GNVZKAWXHXBSBW-GFCCVEGCSA-N 1 1 302.378 3.531 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cnn1C(C)(C)C ZINC000191350704 525900133 /nfs/dbraw/zinc/90/01/33/525900133.db2.gz XFMQHMBZQQPVDW-GFCCVEGCSA-N 1 1 316.405 3.706 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC2(CCOCC2)C1 ZINC000266538280 526119334 /nfs/dbraw/zinc/11/93/34/526119334.db2.gz PBWRHQAOLCYKSI-CQSZACIVSA-N 1 1 304.390 3.548 20 5 DHBDMO COCC[C@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000272389138 536819139 /nfs/dbraw/zinc/81/91/39/536819139.db2.gz CMQBMQGRQHWJGJ-OCCSQVGLSA-N 1 1 304.346 3.616 20 5 DHBDMO CC[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])CC(C)C ZINC000725263943 563570209 /nfs/dbraw/zinc/57/02/09/563570209.db2.gz VUJPCVNPZJFWEG-UHFFFAOYSA-N 1 1 315.211 3.835 20 5 DHBDMO CC[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])CC(C)C ZINC000725263943 563570211 /nfs/dbraw/zinc/57/02/11/563570211.db2.gz VUJPCVNPZJFWEG-UHFFFAOYSA-N 1 1 315.211 3.835 20 5 DHBDMO CCOc1ncccc1C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000151199966 1013067305 /nfs/dbraw/zinc/06/73/05/1013067305.db2.gz MXAMIGBGMNFXIL-INIZCTEOSA-N 1 1 315.373 3.629 20 5 DHBDMO C[N@H+]1C[C@H]2C[C@@H](C1)N2C(=O)c1cccc2cc3ccccc3cc21 ZINC001270532357 1013249141 /nfs/dbraw/zinc/24/91/41/1013249141.db2.gz YXFOWTVASMVSMA-HDICACEKSA-N 1 1 316.404 3.522 20 5 DHBDMO C[N@@H+]1C[C@H]2C[C@@H](C1)N2C(=O)c1cccc2cc3ccccc3cc21 ZINC001270532357 1013249146 /nfs/dbraw/zinc/24/91/46/1013249146.db2.gz YXFOWTVASMVSMA-HDICACEKSA-N 1 1 316.404 3.522 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H]1CC1CCCCC1 ZINC001167255106 1013453484 /nfs/dbraw/zinc/45/34/84/1013453484.db2.gz CVMKXYRFTJUITO-INIZCTEOSA-N 1 1 303.406 3.925 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1N(C)C ZINC000519666796 1013590166 /nfs/dbraw/zinc/59/01/66/1013590166.db2.gz JWPVXMSBYIRAOH-AWEZNQCLSA-N 1 1 313.401 3.854 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1N(C)C ZINC000519666796 1013590170 /nfs/dbraw/zinc/59/01/70/1013590170.db2.gz JWPVXMSBYIRAOH-AWEZNQCLSA-N 1 1 313.401 3.854 20 5 DHBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000126057693 1013863344 /nfs/dbraw/zinc/86/33/44/1013863344.db2.gz NDWGEAVXLJAXLS-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO COc1ccccc1C[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000160416535 1014052296 /nfs/dbraw/zinc/05/22/96/1014052296.db2.gz CJIFNRSPGXRQEH-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1ccccc1C[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000160416535 1014052299 /nfs/dbraw/zinc/05/22/99/1014052299.db2.gz CJIFNRSPGXRQEH-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO C[C@@H]([NH2+]Cc1cccc(O)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000328482948 1014184154 /nfs/dbraw/zinc/18/41/54/1014184154.db2.gz QFOUJMPTWVWWPT-SNVBAGLBSA-N 1 1 306.749 3.805 20 5 DHBDMO CC(C)c1[nH+]ccn1Cc1cccc([N+](=O)[O-])c1Br ZINC000232749984 1014205394 /nfs/dbraw/zinc/20/53/94/1014205394.db2.gz KAYXNPCKWAXTLB-UHFFFAOYSA-N 1 1 324.178 3.726 20 5 DHBDMO COCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@H]1CC=CCC1 ZINC000485101072 1014444286 /nfs/dbraw/zinc/44/42/86/1014444286.db2.gz BFPYRJXEBXIMAV-INIZCTEOSA-N 1 1 318.417 3.708 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000121330563 1014794847 /nfs/dbraw/zinc/79/48/47/1014794847.db2.gz PZWZOMGPACDLKV-UHFFFAOYSA-N 1 1 313.195 3.730 20 5 DHBDMO CCC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC(C)C ZINC000521819955 1014812417 /nfs/dbraw/zinc/81/24/17/1014812417.db2.gz OSJASRNDPLDSAQ-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000610518232 1015090680 /nfs/dbraw/zinc/09/06/80/1015090680.db2.gz WBXSGCZBJFPGBD-CYBMUJFWSA-N 1 1 324.384 3.641 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H]([C@H]3CCCO3)C2)cc1[N+](=O)[O-] ZINC000895846877 1015331875 /nfs/dbraw/zinc/33/18/75/1015331875.db2.gz RJLMQVJIJLEKQO-MAUKXSAKSA-N 1 1 318.417 3.719 20 5 DHBDMO COc1c(O)ccc(C[N@H+](C)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000891504109 1015334228 /nfs/dbraw/zinc/33/42/28/1015334228.db2.gz ORWAKPARSSEVIZ-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1c(O)ccc(C[N@@H+](C)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000891504109 1015334238 /nfs/dbraw/zinc/33/42/38/1015334238.db2.gz ORWAKPARSSEVIZ-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1cccs1 ZINC000051231144 1015344023 /nfs/dbraw/zinc/34/40/23/1015344023.db2.gz BZGUSRRYMRKXDN-CQSZACIVSA-N 1 1 318.398 3.872 20 5 DHBDMO CC(=O)c1ccc(OCc2c(C)cc(C)[nH+]c2C)c([N+](=O)[O-])c1 ZINC000601080113 1015384069 /nfs/dbraw/zinc/38/40/69/1015384069.db2.gz IRDJEHBKDYJOTR-UHFFFAOYSA-N 1 1 314.341 3.697 20 5 DHBDMO CC(C)c1[nH+]ccn1CCNc1ccc([N+](=O)[O-])cc1C(F)F ZINC000895989428 1015396565 /nfs/dbraw/zinc/39/65/65/1015396565.db2.gz LTFPJFSOARLEIJ-UHFFFAOYSA-N 1 1 324.331 3.964 20 5 DHBDMO Cc1cc(F)ncc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000891624170 1015462921 /nfs/dbraw/zinc/46/29/21/1015462921.db2.gz UHYWPBMXEQTDLD-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cc1cc(F)ncc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000891624170 1015462927 /nfs/dbraw/zinc/46/29/27/1015462927.db2.gz UHYWPBMXEQTDLD-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccc(F)cc2)C2CC2)cc1 ZINC000522660924 1015790302 /nfs/dbraw/zinc/79/03/02/1015790302.db2.gz XAHOKBVBDMWEIB-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO CCC[C@@H](N[C@H](C)C[N@@H+](C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000320343929 1016101688 /nfs/dbraw/zinc/10/16/88/1016101688.db2.gz JSNSAPAWDDDAPL-RHSMWYFYSA-N 1 1 307.438 3.754 20 5 DHBDMO CCC[C@@H]([NH2+][C@H](C)CN(C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000320343929 1016101694 /nfs/dbraw/zinc/10/16/94/1016101694.db2.gz JSNSAPAWDDDAPL-RHSMWYFYSA-N 1 1 307.438 3.754 20 5 DHBDMO CCC[C@@H](N[C@@H](C)C[N@@H+](C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000320343933 1016101873 /nfs/dbraw/zinc/10/18/73/1016101873.db2.gz JSNSAPAWDDDAPL-WMLDXEAASA-N 1 1 307.438 3.754 20 5 DHBDMO CCC[C@@H]([NH2+][C@@H](C)CN(C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000320343933 1016101875 /nfs/dbraw/zinc/10/18/75/1016101875.db2.gz JSNSAPAWDDDAPL-WMLDXEAASA-N 1 1 307.438 3.754 20 5 DHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCc1ccccc1 ZINC000065534904 1016202360 /nfs/dbraw/zinc/20/23/60/1016202360.db2.gz IYOYNAQTNPBKMN-UHFFFAOYSA-N 1 1 314.385 3.538 20 5 DHBDMO Cc1ccc([C@H](C)[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065534833 1016204927 /nfs/dbraw/zinc/20/49/27/1016204927.db2.gz CTKAINFEZIZZTB-HNNXBMFYSA-N 1 1 314.385 3.975 20 5 DHBDMO C[C@@H](c1ccccc1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000051428934 1016358718 /nfs/dbraw/zinc/35/87/18/1016358718.db2.gz JGONRMWKUPLNGF-AWEZNQCLSA-N 1 1 300.358 3.667 20 5 DHBDMO Cc1cnc(C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)s1 ZINC000277495516 1016437068 /nfs/dbraw/zinc/43/70/68/1016437068.db2.gz NPCKGBYAZDVBHJ-UHFFFAOYSA-N 1 1 323.443 3.801 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000611579707 1016458991 /nfs/dbraw/zinc/45/89/91/1016458991.db2.gz NRIXTWXRFQJGAR-AAEUAGOBSA-N 1 1 314.332 3.668 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCOc1ccccc1 ZINC000072555595 1016555302 /nfs/dbraw/zinc/55/53/02/1016555302.db2.gz AFGSOGQXSDONKJ-CQSZACIVSA-N 1 1 300.358 3.667 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000582340053 1016599584 /nfs/dbraw/zinc/59/95/84/1016599584.db2.gz ANFQAIBVOWXCJX-FHMRSRPSSA-N 1 1 314.307 3.882 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@@H](O)C2CCCCC2)C2CC2)c1 ZINC000475054967 1016760616 /nfs/dbraw/zinc/76/06/16/1016760616.db2.gz QHPGIKPLCHFGKO-GOSISDBHSA-N 1 1 318.417 3.500 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000847038810 1032189180 /nfs/dbraw/zinc/18/91/80/1032189180.db2.gz WMJTUNIRSZGXES-HNNXBMFYSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000847038810 1032189186 /nfs/dbraw/zinc/18/91/86/1032189186.db2.gz WMJTUNIRSZGXES-HNNXBMFYSA-N 1 1 324.808 3.782 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccccc1OC1CC1)c1ccccc1[N+](=O)[O-] ZINC000295090903 1032271174 /nfs/dbraw/zinc/27/11/74/1032271174.db2.gz ZFBCTPJPPUUZGN-CYBMUJFWSA-N 1 1 312.369 3.987 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000368218128 1032447466 /nfs/dbraw/zinc/44/74/66/1032447466.db2.gz DTCOTJDZMMIRGK-KGLIPLIRSA-N 1 1 304.390 3.547 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000610214984 1012423759 /nfs/dbraw/zinc/42/37/59/1012423759.db2.gz GXEVZIVCHWFJOQ-HNNXBMFYSA-N 1 1 314.360 3.799 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000515184687 1012571893 /nfs/dbraw/zinc/57/18/93/1012571893.db2.gz IJPCXCGUVFJWTL-HOCLYGCPSA-N 1 1 318.417 3.713 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000475271327 1017111289 /nfs/dbraw/zinc/11/12/89/1017111289.db2.gz CLUHHHASYFDDPY-GWCFXTLKSA-N 1 1 302.296 3.676 20 5 DHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083168465 1017596336 /nfs/dbraw/zinc/59/63/36/1017596336.db2.gz WHRIBPWQLLWVLB-NWDGAFQWSA-N 1 1 303.362 3.747 20 5 DHBDMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000444682521 1017627175 /nfs/dbraw/zinc/62/71/75/1017627175.db2.gz AHCITPAUKGBIHD-UHFFFAOYSA-N 1 1 314.360 3.898 20 5 DHBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000444682521 1017627181 /nfs/dbraw/zinc/62/71/81/1017627181.db2.gz AHCITPAUKGBIHD-UHFFFAOYSA-N 1 1 314.360 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]4CCC[C@@H]43)nc2c1 ZINC000083213187 1017638499 /nfs/dbraw/zinc/63/84/99/1017638499.db2.gz AQNUDDXRQQGNAJ-FZMZJTMJSA-N 1 1 301.346 3.501 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000444828577 1017691051 /nfs/dbraw/zinc/69/10/51/1017691051.db2.gz OGRFCVFNXCENNN-RYUDHWBXSA-N 1 1 309.797 3.595 20 5 DHBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2F)C1 ZINC000524266074 1017944715 /nfs/dbraw/zinc/94/47/15/1017944715.db2.gz RHQXTXAFLKLLRJ-GFCCVEGCSA-N 1 1 309.385 3.656 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000613180024 1017963490 /nfs/dbraw/zinc/96/34/90/1017963490.db2.gz FERIRVVAYBWUTC-GDBMZVCRSA-N 1 1 311.385 3.615 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@@H](c2nccs2)C1 ZINC000171637410 1017967934 /nfs/dbraw/zinc/96/79/34/1017967934.db2.gz QZBAICCAYGQXQS-LLVKDONJSA-N 1 1 321.377 3.570 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000171637410 1017967937 /nfs/dbraw/zinc/96/79/37/1017967937.db2.gz QZBAICCAYGQXQS-LLVKDONJSA-N 1 1 321.377 3.570 20 5 DHBDMO CCOc1ccccc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000052164154 1018158139 /nfs/dbraw/zinc/15/81/39/1018158139.db2.gz OIYUMCXAIZHVFN-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO CCOc1ccccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000052164154 1018158144 /nfs/dbraw/zinc/15/81/44/1018158144.db2.gz OIYUMCXAIZHVFN-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO CC(C)CCOCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000441272759 1018397612 /nfs/dbraw/zinc/39/76/12/1018397612.db2.gz VNMMNXWTYOQCJG-UHFFFAOYSA-N 1 1 306.406 3.622 20 5 DHBDMO CC(C)CCOCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000441272759 1018397625 /nfs/dbraw/zinc/39/76/25/1018397625.db2.gz VNMMNXWTYOQCJG-UHFFFAOYSA-N 1 1 306.406 3.622 20 5 DHBDMO CC(C)C[C@@H](CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[NH+](C)C ZINC000447542955 1018413660 /nfs/dbraw/zinc/41/36/60/1018413660.db2.gz QDDWSJNYCGZHPY-FUHWJXTLSA-N 1 1 319.449 3.538 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@H]2CCC[C@H](C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764884231 1018416649 /nfs/dbraw/zinc/41/66/49/1018416649.db2.gz YLYWZQJJVBJQAI-JSGCOSHPSA-N 1 1 316.405 3.721 20 5 DHBDMO CC(C)(C)C1=CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000536173475 1018790093 /nfs/dbraw/zinc/79/00/93/1018790093.db2.gz PQFCVJBBSRIKNT-UHFFFAOYSA-N 1 1 315.373 3.914 20 5 DHBDMO CC(C)(C)C1=CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000536173475 1018790110 /nfs/dbraw/zinc/79/01/10/1018790110.db2.gz PQFCVJBBSRIKNT-UHFFFAOYSA-N 1 1 315.373 3.914 20 5 DHBDMO COc1cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)ccn1 ZINC000340499679 1018793485 /nfs/dbraw/zinc/79/34/85/1018793485.db2.gz DKVNACMAAGSBKH-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO COCC[N@@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1C ZINC000349974074 1018851040 /nfs/dbraw/zinc/85/10/40/1018851040.db2.gz LMQYHAPKZTUQOD-UHFFFAOYSA-N 1 1 320.414 3.613 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)c1cnc(C)s1 ZINC000601299940 1019197837 /nfs/dbraw/zinc/19/78/37/1019197837.db2.gz RLVRTFBIZYUKDQ-VHSXEESVSA-N 1 1 321.402 3.780 20 5 DHBDMO COc1ccc(Cl)cc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000131437682 1019203980 /nfs/dbraw/zinc/20/39/80/1019203980.db2.gz QRXVXLKBNVOBLO-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])CCc2ccc(F)cc21 ZINC001171671214 1032828388 /nfs/dbraw/zinc/82/83/88/1032828388.db2.gz RTOQMNJKHPFZIT-CYBMUJFWSA-N 1 1 314.360 3.896 20 5 DHBDMO C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C1CCCCCC1 ZINC000611253264 1019420601 /nfs/dbraw/zinc/42/06/01/1019420601.db2.gz NYLJHMNRWRIQFA-UHFFFAOYSA-N 1 1 320.389 3.521 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCOc2ccccc2C1 ZINC000611262837 1019423885 /nfs/dbraw/zinc/42/38/85/1019423885.db2.gz MOVOKDFSABWOKW-YVMONPNESA-N 1 1 310.353 3.503 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCOc2ccccc2C1 ZINC000611262837 1019423896 /nfs/dbraw/zinc/42/38/96/1019423896.db2.gz MOVOKDFSABWOKW-YVMONPNESA-N 1 1 310.353 3.503 20 5 DHBDMO C[C@H]1C[C@@H](Nc2sccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000611413469 1019477145 /nfs/dbraw/zinc/47/71/45/1019477145.db2.gz WHVYFBGQGJMMNY-GXTWGEPZSA-N 1 1 317.414 3.731 20 5 DHBDMO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCc1nccs1 ZINC000255673007 1019555382 /nfs/dbraw/zinc/55/53/82/1019555382.db2.gz NYXMRLINIRXZOJ-ALCCZGGFSA-N 1 1 317.414 3.629 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000370671225 1019713360 /nfs/dbraw/zinc/71/33/60/1019713360.db2.gz OPRITEJKMGTBPS-RYRKJORJSA-N 1 1 317.433 3.652 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000370671225 1019713375 /nfs/dbraw/zinc/71/33/75/1019713375.db2.gz OPRITEJKMGTBPS-RYRKJORJSA-N 1 1 317.433 3.652 20 5 DHBDMO CC[C@@H]1CCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000727822869 1019824474 /nfs/dbraw/zinc/82/44/74/1019824474.db2.gz DFUQKWRDQKUVMK-SNVBAGLBSA-N 1 1 307.375 3.704 20 5 DHBDMO CCC[C@@H](NCC1([NH+](C)C)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000318319053 1020037396 /nfs/dbraw/zinc/03/73/96/1020037396.db2.gz VXPSXBJMYHXFCA-MRXNPFEDSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)cc1[N+](=O)[O-] ZINC000093315548 1020146094 /nfs/dbraw/zinc/14/60/94/1020146094.db2.gz CJVGCFNVSYNNAX-ZDUSSCGKSA-N 1 1 300.358 3.802 20 5 DHBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000093445085 1020152316 /nfs/dbraw/zinc/15/23/16/1020152316.db2.gz CJXVVDXTPFSAER-KRWDZBQOSA-N 1 1 311.385 3.944 20 5 DHBDMO C[C@H](NCC(C)(C)[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000154974213 1020173050 /nfs/dbraw/zinc/17/30/50/1020173050.db2.gz RLTTZGPSNGDIME-AWEZNQCLSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@@H](C1CC1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555299250 1020196717 /nfs/dbraw/zinc/19/67/17/1020196717.db2.gz AVUNHVJJLZXKQQ-VIFPVBQESA-N 1 1 302.296 3.844 20 5 DHBDMO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000922668035 1020200261 /nfs/dbraw/zinc/20/02/61/1020200261.db2.gz ZLXVZSHVUFFMJI-NSHDSACASA-N 1 1 304.321 3.599 20 5 DHBDMO Cc1ccc(OCC[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000487546549 1032885040 /nfs/dbraw/zinc/88/50/40/1032885040.db2.gz DBEGYPLWJZNXSF-HNNXBMFYSA-N 1 1 314.385 3.975 20 5 DHBDMO CC(C)[N@@H+]1CCCC[C@@H]1CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000330658670 1020236411 /nfs/dbraw/zinc/23/64/11/1020236411.db2.gz QULQXDXQWNYAEB-WMLDXEAASA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)[N@H+]1CCCC[C@@H]1CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000330658670 1020236415 /nfs/dbraw/zinc/23/64/15/1020236415.db2.gz QULQXDXQWNYAEB-WMLDXEAASA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1cnc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])c(C)c1 ZINC000922740906 1020240787 /nfs/dbraw/zinc/24/07/87/1020240787.db2.gz UAUXHLBWDFIVEG-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCCc2scnc21)c1ccc([N+](=O)[O-])cc1 ZINC000858420370 1032886812 /nfs/dbraw/zinc/88/68/12/1032886812.db2.gz BWBGYMHOYGZIHU-GWCFXTLKSA-N 1 1 303.387 3.780 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2cc(C)c(C)o2)cc1[N+](=O)[O-] ZINC000282280902 1020397637 /nfs/dbraw/zinc/39/76/37/1020397637.db2.gz RRSPMSIUJUMTBM-LLVKDONJSA-N 1 1 304.346 3.664 20 5 DHBDMO COc1cc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000490093168 1020426780 /nfs/dbraw/zinc/42/67/80/1020426780.db2.gz XMDHOOOMNOHTDF-BPLDGKMQSA-N 1 1 304.390 3.756 20 5 DHBDMO C[C@@H](Cc1cccs1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774968 1020517276 /nfs/dbraw/zinc/51/72/76/1020517276.db2.gz CVKBMNRUJSHSDX-NSHDSACASA-N 1 1 308.378 3.858 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000612578236 1020630239 /nfs/dbraw/zinc/63/02/39/1020630239.db2.gz XVZOVARZMCXLDW-GOSISDBHSA-N 1 1 312.369 3.946 20 5 DHBDMO NC(=[NH+]OCc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000734834544 1020668608 /nfs/dbraw/zinc/66/86/08/1020668608.db2.gz VRPLDQKXYFQFMY-UHFFFAOYSA-N 1 1 311.769 3.827 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000580802737 1020861646 /nfs/dbraw/zinc/86/16/46/1020861646.db2.gz OYXZRLTZQHDGRC-RRQGHBQHSA-N 1 1 318.417 3.854 20 5 DHBDMO Cc1ccc([C@H]2[C@@H](C)CCC[N@@H+]2Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000738284081 1020866968 /nfs/dbraw/zinc/86/69/68/1020866968.db2.gz JIKFJIPZXWGXAR-WMLDXEAASA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1ccc([C@H]2[C@@H](C)CCC[N@H+]2Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000738284081 1020866973 /nfs/dbraw/zinc/86/69/73/1020866973.db2.gz JIKFJIPZXWGXAR-WMLDXEAASA-N 1 1 314.389 3.530 20 5 DHBDMO C[C@@H](O)[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000581135389 1020875037 /nfs/dbraw/zinc/87/50/37/1020875037.db2.gz GPPQHIRADVOBMJ-JKDFXYPNSA-N 1 1 318.348 3.507 20 5 DHBDMO Cc1cccc([C@@H]2CCCC[N@@H+]2Cn2cc([N+](=O)[O-])cn2)c1C ZINC000743387714 1021277604 /nfs/dbraw/zinc/27/76/04/1021277604.db2.gz JPVJZARATBGMNY-KRWDZBQOSA-N 1 1 314.389 3.593 20 5 DHBDMO Cc1cccc([C@@H]2CCCC[N@H+]2Cn2cc([N+](=O)[O-])cn2)c1C ZINC000743387714 1021277610 /nfs/dbraw/zinc/27/76/10/1021277610.db2.gz JPVJZARATBGMNY-KRWDZBQOSA-N 1 1 314.389 3.593 20 5 DHBDMO CC(C)CC[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154469909 1021334614 /nfs/dbraw/zinc/33/46/14/1021334614.db2.gz CPQREOUOUPMZFX-RDJZCZTQSA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1ccncc1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000783001609 1021578072 /nfs/dbraw/zinc/57/80/72/1021578072.db2.gz JHRQOCYNSHVTEV-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000619499395 1021775415 /nfs/dbraw/zinc/77/54/15/1021775415.db2.gz KSMQAKWHNMICKA-CQSZACIVSA-N 1 1 317.414 3.590 20 5 DHBDMO COc1cccc([C@@H](C)[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000194984301 1021831905 /nfs/dbraw/zinc/83/19/05/1021831905.db2.gz JZSXDQXNLMDEBF-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1cccc([C@@H](C)[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000194984301 1021831927 /nfs/dbraw/zinc/83/19/27/1021831927.db2.gz JZSXDQXNLMDEBF-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nccc2ccccc21 ZINC000619846236 1021920734 /nfs/dbraw/zinc/92/07/34/1021920734.db2.gz RWUHNDPSOIOCST-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCOC2(CCCCC2)C1 ZINC000556888143 1021932049 /nfs/dbraw/zinc/93/20/49/1021932049.db2.gz ZFLDWKXTUWJXSE-SOFGYWHQSA-N 1 1 316.401 3.643 20 5 DHBDMO CC[N@@H+](Cc1ccccc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000051202756 1022060738 /nfs/dbraw/zinc/06/07/38/1022060738.db2.gz JJUWGKDGMJBFIQ-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc2ccccc2n1)c1ccccc1[N+](=O)[O-] ZINC000341256585 1022067665 /nfs/dbraw/zinc/06/76/65/1022067665.db2.gz JEHJFJXWCWONDJ-ZDUSSCGKSA-N 1 1 307.353 3.994 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000183311788 1022100958 /nfs/dbraw/zinc/10/09/58/1022100958.db2.gz KDZPYNXWLFMOFS-KRWDZBQOSA-N 1 1 311.385 3.590 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H](c3nccs3)C2)cccc1[N+](=O)[O-] ZINC000195340169 1022121322 /nfs/dbraw/zinc/12/13/22/1022121322.db2.gz LKWCUSBEIUBQDB-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000752313928 1022125220 /nfs/dbraw/zinc/12/52/20/1022125220.db2.gz JGXCPJVJHBANTD-INIZCTEOSA-N 1 1 300.333 3.551 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000852598748 1022148256 /nfs/dbraw/zinc/14/82/56/1022148256.db2.gz YNXOJINPNQGFSP-DYVFJYSZSA-N 1 1 322.380 3.515 20 5 DHBDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169036171 1022222842 /nfs/dbraw/zinc/22/28/42/1022222842.db2.gz FPELEXPEHUVXPF-GXTWGEPZSA-N 1 1 316.323 3.583 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H]2c2ccc(F)cc2F)C1 ZINC001169048428 1022229645 /nfs/dbraw/zinc/22/96/45/1022229645.db2.gz UZJIYWJFTTUSLJ-FFSVYQOJSA-N 1 1 310.344 3.547 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C1 ZINC001169057502 1022233503 /nfs/dbraw/zinc/23/35/03/1022233503.db2.gz WDDAPLUWUDDOQH-KNXALSJPSA-N 1 1 310.344 3.547 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C1 ZINC001169057501 1022233943 /nfs/dbraw/zinc/23/39/43/1022233943.db2.gz WDDAPLUWUDDOQH-IUIKQTSFSA-N 1 1 310.344 3.547 20 5 DHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C12CCC2 ZINC000763453600 1022290792 /nfs/dbraw/zinc/29/07/92/1022290792.db2.gz PMQAWMMXZNEKEC-JKSUJKDBSA-N 1 1 322.380 3.513 20 5 DHBDMO C[N@@H+](CCc1ccc(Cl)cc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000609595965 1022315713 /nfs/dbraw/zinc/31/57/13/1022315713.db2.gz UQDFKZLWIHBBJD-UHFFFAOYSA-N 1 1 318.804 3.965 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1ccc(F)cc1)C1CC1 ZINC000609744683 1022340692 /nfs/dbraw/zinc/34/06/92/1022340692.db2.gz STEBWOFSMZJZKM-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCS[C@H](c3ccccc3)C2)c1 ZINC000609800771 1022352089 /nfs/dbraw/zinc/35/20/89/1022352089.db2.gz SCNZCSYOUUONKF-KRWDZBQOSA-N 1 1 314.410 3.885 20 5 DHBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](C)C(C)C ZINC000128464267 1022407100 /nfs/dbraw/zinc/40/71/00/1022407100.db2.gz GUUNYQTWGAXBDD-GFCCVEGCSA-N 1 1 318.377 3.511 20 5 DHBDMO COCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000615836076 1022568494 /nfs/dbraw/zinc/56/84/94/1022568494.db2.gz OEJJBUWLNIRYJO-QINSGFPZSA-N 1 1 318.417 3.889 20 5 DHBDMO CCCOc1ncccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173352509 1022875911 /nfs/dbraw/zinc/87/59/11/1022875911.db2.gz AMGIBECYLQXVGB-CYBMUJFWSA-N 1 1 315.373 3.629 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(c2cccnc2)CC1 ZINC000768752985 1023020284 /nfs/dbraw/zinc/02/02/84/1023020284.db2.gz GRPVDTWASKUSDE-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO COc1cc(NCCC[N@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])c1C ZINC001167753544 1023042371 /nfs/dbraw/zinc/04/23/71/1023042371.db2.gz PNPACULDIOXKJC-CYBMUJFWSA-N 1 1 321.421 3.588 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC3(CCC3)C2)c1 ZINC000339018237 1033101108 /nfs/dbraw/zinc/10/11/08/1033101108.db2.gz TZFOIKVJZOPMRS-UHFFFAOYSA-N 1 1 314.307 3.990 20 5 DHBDMO CC[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])CC1CC1 ZINC000769405339 1023143186 /nfs/dbraw/zinc/14/31/86/1023143186.db2.gz UFUIRJWPEHZINQ-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO CC[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])CC1CC1 ZINC000769405339 1023143188 /nfs/dbraw/zinc/14/31/88/1023143188.db2.gz UFUIRJWPEHZINQ-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCc2c1nccc2Cl)c1ccccc1[N+](=O)[O-] ZINC000925693102 1023180124 /nfs/dbraw/zinc/18/01/24/1023180124.db2.gz OKAAZPKOVZKDDT-HZMBPMFUSA-N 1 1 317.776 3.981 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CCCC4(CC4)C3)c2c1 ZINC000769792618 1023215232 /nfs/dbraw/zinc/21/52/32/1023215232.db2.gz ITUGDHZIFRXAGG-UHFFFAOYSA-N 1 1 319.386 3.705 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCCC4(CC4)C3)c2c1 ZINC000769792618 1023215236 /nfs/dbraw/zinc/21/52/36/1023215236.db2.gz ITUGDHZIFRXAGG-UHFFFAOYSA-N 1 1 319.386 3.705 20 5 DHBDMO CC[C@@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000770306527 1023295372 /nfs/dbraw/zinc/29/53/72/1023295372.db2.gz YFRXDEMENZUEKS-SNVBAGLBSA-N 1 1 313.195 3.589 20 5 DHBDMO CC[N@H+](Cc1ccncc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000049024085 1023833105 /nfs/dbraw/zinc/83/31/05/1023833105.db2.gz DJJXJMANVONBEL-UHFFFAOYSA-N 1 1 305.765 3.665 20 5 DHBDMO CC[N@@H+](Cc1ccncc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000049024085 1023833107 /nfs/dbraw/zinc/83/31/07/1023833107.db2.gz DJJXJMANVONBEL-UHFFFAOYSA-N 1 1 305.765 3.665 20 5 DHBDMO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788570117 1023909195 /nfs/dbraw/zinc/90/91/95/1023909195.db2.gz HJQQWNSOYNGACI-VIFPVBQESA-N 1 1 323.755 3.820 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccs2)cc1[N+](=O)[O-] ZINC000051501875 1024218441 /nfs/dbraw/zinc/21/84/41/1024218441.db2.gz HEJIIPIIAMOATE-LLVKDONJSA-N 1 1 306.387 3.858 20 5 DHBDMO Cc1cc(C)c(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000397033203 1024356804 /nfs/dbraw/zinc/35/68/04/1024356804.db2.gz PSBBVJXEGDLDOM-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000453352215 1024476338 /nfs/dbraw/zinc/47/63/38/1024476338.db2.gz INXUUFMFFFKYGS-WMLDXEAASA-N 1 1 320.458 3.745 20 5 DHBDMO Cc1ccncc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000271260429 1024479626 /nfs/dbraw/zinc/47/96/26/1024479626.db2.gz ANMOKWUFHFAODM-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000101595485 1024516284 /nfs/dbraw/zinc/51/62/84/1024516284.db2.gz ODQZXNIJEAWBHP-OAHLLOKOSA-N 1 1 316.332 3.737 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000791583168 1024519150 /nfs/dbraw/zinc/51/91/50/1024519150.db2.gz LZNAHFPURXKRCD-LDYMZIIASA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000791583168 1024519154 /nfs/dbraw/zinc/51/91/54/1024519154.db2.gz LZNAHFPURXKRCD-LDYMZIIASA-N 1 1 306.259 3.507 20 5 DHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CC1(C)C ZINC000339134376 1024574218 /nfs/dbraw/zinc/57/42/18/1024574218.db2.gz VGBUFKZRVYFGNG-LBPRGKRZSA-N 1 1 302.296 3.844 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000585767910 1024605483 /nfs/dbraw/zinc/60/54/83/1024605483.db2.gz FCFGQEXIBVHJRI-QWSHFYNQSA-N 1 1 316.401 3.501 20 5 DHBDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000106877009 1024606565 /nfs/dbraw/zinc/60/65/65/1024606565.db2.gz XEYTXZHDBZJUKC-LLVKDONJSA-N 1 1 305.403 3.861 20 5 DHBDMO CCc1noc(CC)c1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000166957086 1024663075 /nfs/dbraw/zinc/66/30/75/1024663075.db2.gz SGCNWRGKTIXCGP-LBPRGKRZSA-N 1 1 317.389 3.867 20 5 DHBDMO CCc1noc(CC)c1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000166957194 1024664371 /nfs/dbraw/zinc/66/43/71/1024664371.db2.gz SGCNWRGKTIXCGP-GFCCVEGCSA-N 1 1 317.389 3.867 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H]3CCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC001170334435 1024745733 /nfs/dbraw/zinc/74/57/33/1024745733.db2.gz DSLFKUGPLGOYSP-LZWOXQAQSA-N 1 1 318.417 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC23CCCC3)c([N+](=O)[O-])c1 ZINC001170335663 1024746056 /nfs/dbraw/zinc/74/60/56/1024746056.db2.gz QAEBBMQLNIATKF-ZDUSSCGKSA-N 1 1 304.390 3.553 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+](C)C[C@H]2CC2(C)C)c([N+](=O)[O-])c1 ZINC001170352341 1024747763 /nfs/dbraw/zinc/74/77/63/1024747763.db2.gz MCYSSMPEVIBKEP-GXTWGEPZSA-N 1 1 306.406 3.512 20 5 DHBDMO CC[C@H]1CCC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170353607 1024748806 /nfs/dbraw/zinc/74/88/06/1024748806.db2.gz ZXYCLSMDARBLAJ-KBPBESRZSA-N 1 1 306.406 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+](C)CC2CCCC2)c([N+](=O)[O-])c1 ZINC001170352806 1024749371 /nfs/dbraw/zinc/74/93/71/1024749371.db2.gz QRSKCHYHAHDOJI-ZDUSSCGKSA-N 1 1 306.406 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC3(CCCC3)C2)c([N+](=O)[O-])c1 ZINC001170347153 1024756681 /nfs/dbraw/zinc/75/66/81/1024756681.db2.gz QVUVKILLCAOINR-AWEZNQCLSA-N 1 1 318.417 3.801 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H](C)[C@H]2C)c([N+](=O)[O-])c1 ZINC001170345740 1024757968 /nfs/dbraw/zinc/75/79/68/1024757968.db2.gz LIUYOTNIDBNINF-MELADBBJSA-N 1 1 306.406 3.655 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2C)on1 ZINC000350006074 1024777392 /nfs/dbraw/zinc/77/73/92/1024777392.db2.gz FTXUGDCJXSEYIX-HNNXBMFYSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2C)on1 ZINC000350006074 1024777402 /nfs/dbraw/zinc/77/74/02/1024777402.db2.gz FTXUGDCJXSEYIX-HNNXBMFYSA-N 1 1 301.346 3.537 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3ccccc3n2)c(F)c1 ZINC000350627336 1024833102 /nfs/dbraw/zinc/83/31/02/1024833102.db2.gz QUYBJCHJKNMHQA-UHFFFAOYSA-N 1 1 311.316 3.572 20 5 DHBDMO C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1c(F)cncc1F ZINC000353148085 1024966355 /nfs/dbraw/zinc/96/63/55/1024966355.db2.gz ZJMXBPDCHSJCMQ-DUMNWFOQSA-N 1 1 319.311 3.632 20 5 DHBDMO CO[C@]1(C)CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000793340567 1024984325 /nfs/dbraw/zinc/98/43/25/1024984325.db2.gz QRCMBJJVDYNCFT-OAHLLOKOSA-N 1 1 312.797 3.639 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC000793351209 1025021589 /nfs/dbraw/zinc/02/15/89/1025021589.db2.gz HERMLTBBZBBJCS-CYBMUJFWSA-N 1 1 307.350 3.514 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000353746089 1025228074 /nfs/dbraw/zinc/22/80/74/1025228074.db2.gz KVMWYXZBRBPAIX-JGIVAVPZSA-N 1 1 316.401 3.501 20 5 DHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000015300583 1025373322 /nfs/dbraw/zinc/37/33/22/1025373322.db2.gz CLNLWJMNBAZNEX-KRWDZBQOSA-N 1 1 312.369 3.941 20 5 DHBDMO CC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000885964705 1025422177 /nfs/dbraw/zinc/42/21/77/1025422177.db2.gz DWVRVSGVEKRKAY-ZDUSSCGKSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000885964705 1025422181 /nfs/dbraw/zinc/42/21/81/1025422181.db2.gz DWVRVSGVEKRKAY-ZDUSSCGKSA-N 1 1 315.373 3.582 20 5 DHBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886014614 1025438339 /nfs/dbraw/zinc/43/83/39/1025438339.db2.gz LPEMKDSBRRWEEY-IUODEOHRSA-N 1 1 315.348 3.507 20 5 DHBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886023501 1025442615 /nfs/dbraw/zinc/44/26/15/1025442615.db2.gz QLMUQDPOJAQZBP-WBMJQRKESA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886023501 1025442620 /nfs/dbraw/zinc/44/26/20/1025442620.db2.gz QLMUQDPOJAQZBP-WBMJQRKESA-N 1 1 315.348 3.712 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@H](O)CC2CCCC2)C2CC2)c1 ZINC000354847436 1025523668 /nfs/dbraw/zinc/52/36/68/1025523668.db2.gz BTXPKCJTTNHOIZ-GOSISDBHSA-N 1 1 318.417 3.500 20 5 DHBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C(F)(F)F ZINC000886212822 1025557566 /nfs/dbraw/zinc/55/75/66/1025557566.db2.gz GDRBTZOIDJHBQH-NEPJUHHUSA-N 1 1 317.311 3.543 20 5 DHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C(F)(F)F ZINC000886212822 1025557575 /nfs/dbraw/zinc/55/75/75/1025557575.db2.gz GDRBTZOIDJHBQH-NEPJUHHUSA-N 1 1 317.311 3.543 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[NH2+]C1(c2ccccc2Cl)CCC1 ZINC000886267943 1025575218 /nfs/dbraw/zinc/57/52/18/1025575218.db2.gz XUXVFAOWODMHKH-UHFFFAOYSA-N 1 1 317.776 3.812 20 5 DHBDMO CC(C)c1ccc(C[NH2+]Cc2cc(C3CC3)no2)cc1[N+](=O)[O-] ZINC000886272250 1025577142 /nfs/dbraw/zinc/57/71/42/1025577142.db2.gz LCOBDGSVWSHHSV-UHFFFAOYSA-N 1 1 315.373 3.873 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H](SC)C1 ZINC000355220483 1025645911 /nfs/dbraw/zinc/64/59/11/1025645911.db2.gz LHXDBQWUMRKBST-OAHLLOKOSA-N 1 1 324.446 3.711 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cs1 ZINC000886612983 1025738961 /nfs/dbraw/zinc/73/89/61/1025738961.db2.gz ZVILIPBUHGYMOV-JQWIXIFHSA-N 1 1 320.336 3.821 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cs1 ZINC000886612983 1025738976 /nfs/dbraw/zinc/73/89/76/1025738976.db2.gz ZVILIPBUHGYMOV-JQWIXIFHSA-N 1 1 320.336 3.821 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH2+][C@H]1CCc2c1cccc2F ZINC000886921819 1025981349 /nfs/dbraw/zinc/98/13/49/1025981349.db2.gz DTVINZBOVQDLME-HNNXBMFYSA-N 1 1 304.296 3.650 20 5 DHBDMO CC1(C)CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089892817 1026071635 /nfs/dbraw/zinc/07/16/35/1026071635.db2.gz VJIOKFVGVAZVPL-UHFFFAOYSA-N 1 1 301.346 3.624 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC(C)(C)[C@H]1[C@H]1CCCO1 ZINC000289640439 1026110942 /nfs/dbraw/zinc/11/09/42/1026110942.db2.gz FOLGJPBOHMPOJX-DAXOMENPSA-N 1 1 304.390 3.545 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000576399650 1026279602 /nfs/dbraw/zinc/27/96/02/1026279602.db2.gz YGCUWEUHRYQGPP-KAPURRDVSA-N 1 1 323.396 3.883 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccnc2)C2CC2)cc1Cl ZINC000809762924 1026620980 /nfs/dbraw/zinc/62/09/80/1026620980.db2.gz DWKDQIHWSRDEHL-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccnc2)C2CC2)cc1Cl ZINC000809762924 1026620987 /nfs/dbraw/zinc/62/09/87/1026620987.db2.gz DWKDQIHWSRDEHL-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000420944727 1026886956 /nfs/dbraw/zinc/88/69/56/1026886956.db2.gz JVRYGNFIVPZKOF-GFCCVEGCSA-N 1 1 302.296 3.759 20 5 DHBDMO COCc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000237228581 1027001297 /nfs/dbraw/zinc/00/12/97/1027001297.db2.gz GHRKRFRQXKKUBW-UHFFFAOYSA-N 1 1 320.776 3.684 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccnc(Cl)c2Cl)cc1 ZINC000811486024 1027011125 /nfs/dbraw/zinc/01/11/25/1027011125.db2.gz CWSFXWTTYIGQCN-UHFFFAOYSA-N 1 1 312.156 3.586 20 5 DHBDMO Cc1cc(N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000811812195 1027090442 /nfs/dbraw/zinc/09/04/42/1027090442.db2.gz OFERYRMZHDYSHT-WDEREUQCSA-N 1 1 309.797 3.594 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000355754143 1027105210 /nfs/dbraw/zinc/10/52/10/1027105210.db2.gz ZODQNVVMCJWPQQ-RHSMWYFYSA-N 1 1 304.390 3.548 20 5 DHBDMO Cc1ccc(F)c(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000572047748 1027166249 /nfs/dbraw/zinc/16/62/49/1027166249.db2.gz USEUWZLBFIOGKR-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO CCCCOC1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000362449073 1027212223 /nfs/dbraw/zinc/21/22/23/1027212223.db2.gz GUVMLYXKDMSZDL-UHFFFAOYSA-N 1 1 310.369 3.515 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)cs1 ZINC000931914511 1027303717 /nfs/dbraw/zinc/30/37/17/1027303717.db2.gz BRNSZXWYXDRVMW-JTQLQIEISA-N 1 1 324.299 3.523 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)cs1 ZINC000931914511 1027303735 /nfs/dbraw/zinc/30/37/35/1027303735.db2.gz BRNSZXWYXDRVMW-JTQLQIEISA-N 1 1 324.299 3.523 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CCC(=O)CC1 ZINC000295654198 1027376176 /nfs/dbraw/zinc/37/61/76/1027376176.db2.gz ZMHJKZXDIFYVHG-UHFFFAOYSA-N 1 1 304.390 3.565 20 5 DHBDMO CC(C)Oc1ccnc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000932178397 1027396804 /nfs/dbraw/zinc/39/68/04/1027396804.db2.gz NHSFVWXJSQRHTK-CYBMUJFWSA-N 1 1 315.373 3.628 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000575098366 1027453131 /nfs/dbraw/zinc/45/31/31/1027453131.db2.gz GJZLDRGAMNEGHY-CABCVRRESA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000575098366 1027453139 /nfs/dbraw/zinc/45/31/39/1027453139.db2.gz GJZLDRGAMNEGHY-CABCVRRESA-N 1 1 307.438 3.674 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC1=Cc2ccccc2OC1 ZINC000576314231 1027600980 /nfs/dbraw/zinc/60/09/80/1027600980.db2.gz KBLIOBHWFJDYJP-UHFFFAOYSA-N 1 1 324.380 3.545 20 5 DHBDMO Cc1cnccc1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000576396680 1027613918 /nfs/dbraw/zinc/61/39/18/1027613918.db2.gz KODFFKMJCKRQKG-UHFFFAOYSA-N 1 1 311.385 3.505 20 5 DHBDMO C[C@@]1(Cc2cccs2)CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000932921976 1027650114 /nfs/dbraw/zinc/65/01/14/1027650114.db2.gz JQEZVUXATUPUQB-INIZCTEOSA-N 1 1 317.414 3.649 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000778172923 1027735869 /nfs/dbraw/zinc/73/58/69/1027735869.db2.gz FIBOZQBWXYWHTM-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000778172923 1027735880 /nfs/dbraw/zinc/73/58/80/1027735880.db2.gz FIBOZQBWXYWHTM-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ncoc1-c1ccccc1 ZINC000363876561 1027769787 /nfs/dbraw/zinc/76/97/87/1027769787.db2.gz RGSSXMFWLZTPPM-UHFFFAOYSA-N 1 1 323.352 3.848 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1OCc1c(C)cc(C)[nH+]c1C ZINC000601071130 1027968955 /nfs/dbraw/zinc/96/89/55/1027968955.db2.gz VDBDBVJKGQXWOO-UHFFFAOYSA-N 1 1 302.330 3.503 20 5 DHBDMO Cc1ncsc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449497299 1028709401 /nfs/dbraw/zinc/70/94/01/1028709401.db2.gz IQFXJQBVWGQPIS-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO CS[C@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000687927379 1028751440 /nfs/dbraw/zinc/75/14/40/1028751440.db2.gz WGAAMRLKFMISKX-ZDUSSCGKSA-N 1 1 314.838 3.966 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000816649565 1028975690 /nfs/dbraw/zinc/97/56/90/1028975690.db2.gz CPVDBFHDEJGXLT-MNOVXSKESA-N 1 1 303.387 3.559 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000816649565 1028975702 /nfs/dbraw/zinc/97/57/02/1028975702.db2.gz CPVDBFHDEJGXLT-MNOVXSKESA-N 1 1 303.387 3.559 20 5 DHBDMO CCC[C@]1(CO)CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000570368218 1029358212 /nfs/dbraw/zinc/35/82/12/1029358212.db2.gz YYCQSSNIRBDHBK-SFHVURJKSA-N 1 1 320.433 3.703 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451336762 1029849883 /nfs/dbraw/zinc/84/98/83/1029849883.db2.gz FZOOQBUYNIAATA-PILAGYSTSA-N 1 1 318.417 3.671 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451429042 1029869219 /nfs/dbraw/zinc/86/92/19/1029869219.db2.gz YRIDMKWKCPQNSC-PAYONLEZSA-N 1 1 318.417 3.590 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccc(F)cn3)C2)cc1 ZINC000451552089 1029912962 /nfs/dbraw/zinc/91/29/62/1029912962.db2.gz VLTQQOFISDBVBE-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO Cc1[nH+]ccn1CCCCNc1ccc([N+](=O)[O-])cc1C(F)F ZINC000865555505 1029914851 /nfs/dbraw/zinc/91/48/51/1029914851.db2.gz AOKZEDMWQYEBDL-UHFFFAOYSA-N 1 1 324.331 3.930 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2ncc(C(C)C)s2)cc1[N+](=O)[O-] ZINC000865788016 1030026332 /nfs/dbraw/zinc/02/63/32/1030026332.db2.gz WOEGRBDBUVXDGC-UHFFFAOYSA-N 1 1 305.403 3.773 20 5 DHBDMO C[N@@H+](CCCCNc1ccc([N+](=O)[O-])cc1C(F)F)C1CC1 ZINC000865866683 1030068648 /nfs/dbraw/zinc/06/86/48/1030068648.db2.gz PJDDATWNOVJBOE-UHFFFAOYSA-N 1 1 313.348 3.819 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCc2c1nccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC000924797644 1030190885 /nfs/dbraw/zinc/19/08/85/1030190885.db2.gz HQQKDNZWPNEFRB-BMIGLBTASA-N 1 1 317.776 3.981 20 5 DHBDMO C[C@H](NCc1ccccc1[N+](=O)[O-])c1cccc(C[NH+](C)C)c1 ZINC000925308059 1030341508 /nfs/dbraw/zinc/34/15/08/1030341508.db2.gz AOQLDILMGCXCMG-AWEZNQCLSA-N 1 1 313.401 3.507 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cnn(C2CCC2)c1)c1ccccc1[N+](=O)[O-] ZINC000925696311 1030454681 /nfs/dbraw/zinc/45/46/81/1030454681.db2.gz ZEQABVMEQXHQHR-QWHCGFSZSA-N 1 1 314.389 3.928 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@]3(CC[C@@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000359559001 1031026542 /nfs/dbraw/zinc/02/65/42/1031026542.db2.gz OYNCHYPWQOEQOH-DYVFJYSZSA-N 1 1 304.390 3.616 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1C[C@H]1c1ccccc1 ZINC000559073708 1031089772 /nfs/dbraw/zinc/08/97/72/1031089772.db2.gz UXEFMSXGIPIONL-MJGOQNOKSA-N 1 1 310.397 3.873 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872016267 1031398427 /nfs/dbraw/zinc/39/84/27/1031398427.db2.gz HEUCWQDATPQTBF-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(C)n1 ZINC000872024523 1031407349 /nfs/dbraw/zinc/40/73/49/1031407349.db2.gz SXCBSLOLBITIOE-GFCCVEGCSA-N 1 1 317.414 3.871 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846109770 1031860963 /nfs/dbraw/zinc/86/09/63/1031860963.db2.gz VNDUYDDLZYKSEL-YFCVBGDOSA-N 1 1 308.328 3.729 20 5 DHBDMO C[C@@H]([N@@H+](C)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1(C)CC1 ZINC000777962352 1032046741 /nfs/dbraw/zinc/04/67/41/1032046741.db2.gz AOHPFRHQPHXBJP-CYBMUJFWSA-N 1 1 314.389 3.536 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000877522900 1033333310 /nfs/dbraw/zinc/33/33/10/1033333310.db2.gz DXPJGAISNGMDAG-SFHVURJKSA-N 1 1 311.385 3.944 20 5 DHBDMO CC(C)[N@@H+](CCC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1 ZINC000138404297 1033412317 /nfs/dbraw/zinc/41/23/17/1033412317.db2.gz KENCUPBOBREXEG-UHFFFAOYSA-N 1 1 322.405 3.537 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC13CCCC3)CC2 ZINC001172906175 1033438318 /nfs/dbraw/zinc/43/83/18/1033438318.db2.gz WNSBPFDKCFOKCG-INIZCTEOSA-N 1 1 300.402 3.861 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@@H](CF)C1)CC2 ZINC001172916526 1033464785 /nfs/dbraw/zinc/46/47/85/1033464785.db2.gz TXCOHBFKUBVYKL-BBRMVZONSA-N 1 1 306.381 3.524 20 5 DHBDMO C[N@@H+](C[C@@H]1CC1(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172919230 1033467627 /nfs/dbraw/zinc/46/76/27/1033467627.db2.gz FJXYRRBBRXOCFG-HOTGVXAUSA-N 1 1 302.418 3.820 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC2(C)C)c1F ZINC001173182534 1033583612 /nfs/dbraw/zinc/58/36/12/1033583612.db2.gz STCYRRCMRCMFPF-NSHDSACASA-N 1 1 310.369 3.548 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@H](C)CC2)c1F ZINC001173182800 1033584002 /nfs/dbraw/zinc/58/40/02/1033584002.db2.gz UHSVQBQCRJNRLR-CHWSQXEVSA-N 1 1 324.396 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2C[C@@H](C)CC23CC3)c1F ZINC001173191697 1033584169 /nfs/dbraw/zinc/58/41/69/1033584169.db2.gz GKMQIBXHCYOWRE-NWDGAFQWSA-N 1 1 322.380 3.548 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC3CCC2CC3)c1F ZINC001173195452 1033586204 /nfs/dbraw/zinc/58/62/04/1033586204.db2.gz GBYAIFVYYHRZCW-PNESKVBLSA-N 1 1 322.380 3.548 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](CC2CC2)C2CC2)c1F ZINC001173193152 1033587602 /nfs/dbraw/zinc/58/76/02/1033587602.db2.gz QVHFOENJCJVIQH-LLVKDONJSA-N 1 1 322.380 3.548 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173221262 1033600950 /nfs/dbraw/zinc/60/09/50/1033600950.db2.gz GTFNSOAUTJFCAN-CQSZACIVSA-N 1 1 314.385 3.666 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccsc2C1 ZINC001173226393 1033606164 /nfs/dbraw/zinc/60/61/64/1033606164.db2.gz JMISRCFSHPYHBC-GFCCVEGCSA-N 1 1 302.399 3.646 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](C)C(F)(F)CC1 ZINC001173229513 1033606251 /nfs/dbraw/zinc/60/62/51/1033606251.db2.gz VGRYZWUBFFYMPI-QWHCGFSZSA-N 1 1 312.360 3.893 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccsc2C1 ZINC001173226394 1033606265 /nfs/dbraw/zinc/60/62/65/1033606265.db2.gz JMISRCFSHPYHBC-LBPRGKRZSA-N 1 1 302.399 3.646 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@@H+]2[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)no1 ZINC001173229216 1033606328 /nfs/dbraw/zinc/60/63/28/1033606328.db2.gz RPZJNGSXEIUDDN-SJCJKPOMSA-N 1 1 315.373 3.659 20 5 DHBDMO C[C@@H]1C[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C[C@@H](C)C1(F)F ZINC000862444397 1033860677 /nfs/dbraw/zinc/86/06/77/1033860677.db2.gz WFPCCZGIUFIFEU-NXEZZACHSA-N 1 1 318.751 3.971 20 5 DHBDMO O=S1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000119413424 1034073557 /nfs/dbraw/zinc/07/35/57/1034073557.db2.gz OIVDRZPVENHRTM-UHFFFAOYSA-N 1 1 309.434 3.557 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)O[NH+]=C(N)CCC(F)(F)F ZINC000863490968 1034111369 /nfs/dbraw/zinc/11/13/69/1034111369.db2.gz UPQDRVSRNRVJTF-VIFPVBQESA-N 1 1 319.283 3.805 20 5 DHBDMO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000880004371 1034176475 /nfs/dbraw/zinc/17/64/75/1034176475.db2.gz UMERDBXDJGPICI-GFCCVEGCSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000880004371 1034176483 /nfs/dbraw/zinc/17/64/83/1034176483.db2.gz UMERDBXDJGPICI-GFCCVEGCSA-N 1 1 306.259 3.508 20 5 DHBDMO Cc1cccc2nc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)cn21 ZINC000178059111 1034205098 /nfs/dbraw/zinc/20/50/98/1034205098.db2.gz FAZLRGHJGKWHKE-CQSZACIVSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1ncsc1CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000179518281 1034312153 /nfs/dbraw/zinc/31/21/53/1034312153.db2.gz OOIPKRQPQSVRMB-UHFFFAOYSA-N 1 1 317.414 3.567 20 5 DHBDMO C[C@@H](NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000480604623 1034345360 /nfs/dbraw/zinc/34/53/60/1034345360.db2.gz YXNJAZOZIUIHLF-OWCLPIDISA-N 1 1 319.449 3.613 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H](C)[N@@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000480619915 1034354927 /nfs/dbraw/zinc/35/49/27/1034354927.db2.gz BLHQOLWCUVTHIU-LZWOXQAQSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000480619915 1034354942 /nfs/dbraw/zinc/35/49/42/1034354942.db2.gz BLHQOLWCUVTHIU-LZWOXQAQSA-N 1 1 319.449 3.674 20 5 DHBDMO COc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000555338904 1034630174 /nfs/dbraw/zinc/63/01/74/1034630174.db2.gz OSLJLBADVZUUKT-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO CCOc1cc(F)cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000865521141 1034690332 /nfs/dbraw/zinc/69/03/32/1034690332.db2.gz LSYVYRDCVXQAOO-LBPRGKRZSA-N 1 1 318.348 3.983 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000777440459 1034745263 /nfs/dbraw/zinc/74/52/63/1034745263.db2.gz WUPBOUGZOHJMGK-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1ccc(C[N@H+]2CC[C@H](c3ccc(O)cc3)C2)cc1[N+](=O)[O-] ZINC000600214514 1034815708 /nfs/dbraw/zinc/81/57/08/1034815708.db2.gz RTKXEGGSPVFHKA-INIZCTEOSA-N 1 1 312.369 3.598 20 5 DHBDMO Cc1c([C@H](C)NCC[N@@H+](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000481408871 1034821332 /nfs/dbraw/zinc/82/13/32/1034821332.db2.gz VIWSLCMCWMVAJE-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1c([C@H](C)[NH2+]CCN(C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000481408871 1034821348 /nfs/dbraw/zinc/82/13/48/1034821348.db2.gz VIWSLCMCWMVAJE-HNNXBMFYSA-N 1 1 319.449 3.818 20 5 DHBDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000481756520 1034962176 /nfs/dbraw/zinc/96/21/76/1034962176.db2.gz NMVGVPINYXDSMP-GXFFZTMASA-N 1 1 302.296 3.758 20 5 DHBDMO C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C(C)(C)C ZINC000567810701 1034995331 /nfs/dbraw/zinc/99/53/31/1034995331.db2.gz DFLKZSYZPZINQR-UHFFFAOYSA-N 1 1 301.184 3.588 20 5 DHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000483240990 1035243954 /nfs/dbraw/zinc/24/39/54/1035243954.db2.gz VEOMAXCWZVRABO-LBPRGKRZSA-N 1 1 317.389 3.994 20 5 DHBDMO COc1cc(C[N@@H+](CC2CC2)CC2CCC2)c([N+](=O)[O-])cc1F ZINC000483267034 1035248933 /nfs/dbraw/zinc/24/89/33/1035248933.db2.gz LNEVPJFJYDRQCZ-UHFFFAOYSA-N 1 1 322.380 3.755 20 5 DHBDMO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@H]1CC=CCC1 ZINC000483495019 1035274880 /nfs/dbraw/zinc/27/48/80/1035274880.db2.gz XPDXIGVDTIDPRS-AWEZNQCLSA-N 1 1 322.380 3.539 20 5 DHBDMO CC[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000161098390 1035297045 /nfs/dbraw/zinc/29/70/45/1035297045.db2.gz LWCNOHFBPNOSBP-VYDXJSESSA-N 1 1 305.422 3.508 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@]12CCC[C@H]1OCC2 ZINC001176991996 1035341292 /nfs/dbraw/zinc/34/12/92/1035341292.db2.gz WFXQIHOYIIUJJX-HZPDHXFCSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)nc1 ZINC001179028857 1035463274 /nfs/dbraw/zinc/46/32/74/1035463274.db2.gz YVJBICOENFPBNM-UHFFFAOYSA-N 1 1 323.352 3.848 20 5 DHBDMO COc1c(O)ccc(C[N@@H+](CC(C)C)C2CCCC2)c1[N+](=O)[O-] ZINC001180154561 1035614051 /nfs/dbraw/zinc/61/40/51/1035614051.db2.gz TXFOTLFUANNCNX-UHFFFAOYSA-N 1 1 322.405 3.710 20 5 DHBDMO C[C@H]1[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCC12CCOCC2 ZINC000494631805 1035749108 /nfs/dbraw/zinc/74/91/08/1035749108.db2.gz CGYYPZQCGLBZSZ-GFCCVEGCSA-N 1 1 324.808 3.639 20 5 DHBDMO CCC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)CC1CC1 ZINC000089882932 1035766387 /nfs/dbraw/zinc/76/63/87/1035766387.db2.gz KMBGLADAJUMMDF-UHFFFAOYSA-N 1 1 315.373 3.872 20 5 DHBDMO C[C@H]1CC[C@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089907258 1035784509 /nfs/dbraw/zinc/78/45/09/1035784509.db2.gz WKVKEDDWHOLWGN-STQMWFEESA-N 1 1 315.373 3.870 20 5 DHBDMO Cc1cc(C)cc(CC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC001181154116 1035852895 /nfs/dbraw/zinc/85/28/95/1035852895.db2.gz KNJNXWBMNCAGEO-UHFFFAOYSA-N 1 1 312.413 3.929 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000485707591 1035880485 /nfs/dbraw/zinc/88/04/85/1035880485.db2.gz KKLBEQVHBKYBSK-HUUCEWRRSA-N 1 1 304.390 3.758 20 5 DHBDMO Cc1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000539849011 1035900947 /nfs/dbraw/zinc/90/09/47/1035900947.db2.gz HNQOABOSYNHDBL-GOEBONIOSA-N 1 1 306.431 3.763 20 5 DHBDMO CO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])C12CCC2 ZINC001194384235 1035916238 /nfs/dbraw/zinc/91/62/38/1035916238.db2.gz JTECZFDDJRODNC-HUUCEWRRSA-N 1 1 324.808 3.638 20 5 DHBDMO COC[C@@H](C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C(C)C ZINC001194478414 1035941828 /nfs/dbraw/zinc/94/18/28/1035941828.db2.gz VEUNVNARSUSKII-DLBZAZTESA-N 1 1 320.433 3.693 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)Cc1ccccc1C ZINC000485828323 1035982520 /nfs/dbraw/zinc/98/25/20/1035982520.db2.gz YFJDLGOAXPMKRQ-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000609144483 1036501792 /nfs/dbraw/zinc/50/17/92/1036501792.db2.gz YNAQRLBZMOCMLB-INIZCTEOSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000609144483 1036501806 /nfs/dbraw/zinc/50/18/06/1036501806.db2.gz YNAQRLBZMOCMLB-INIZCTEOSA-N 1 1 316.332 3.777 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2sccc2C)ccc1[N+](=O)[O-] ZINC000492374700 1036853124 /nfs/dbraw/zinc/85/31/24/1036853124.db2.gz HWJKRQCLNZAPTL-UHFFFAOYSA-N 1 1 320.414 3.995 20 5 DHBDMO Cc1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000193508208 1036857789 /nfs/dbraw/zinc/85/77/89/1036857789.db2.gz QPXSSAWSXIVOOQ-UHFFFAOYSA-N 1 1 305.403 3.770 20 5 DHBDMO Cc1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000193508208 1036857809 /nfs/dbraw/zinc/85/78/09/1036857809.db2.gz QPXSSAWSXIVOOQ-UHFFFAOYSA-N 1 1 305.403 3.770 20 5 DHBDMO CCOc1cc(C[N@@H+](C)CCc2ccccc2)ccc1[N+](=O)[O-] ZINC000492543261 1036912653 /nfs/dbraw/zinc/91/26/53/1036912653.db2.gz YSSGZAKEVCUYMJ-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000081599212 1036989025 /nfs/dbraw/zinc/98/90/25/1036989025.db2.gz NCDYGDHKLQKWNT-LBPRGKRZSA-N 1 1 320.414 3.728 20 5 DHBDMO C[C@H](Cc1ccsc1)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000081599061 1036989116 /nfs/dbraw/zinc/98/91/16/1036989116.db2.gz VUDHRSXNSMYWQF-LLVKDONJSA-N 1 1 308.378 3.858 20 5 DHBDMO C[C@H](Cc1ccsc1)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000081599061 1036989130 /nfs/dbraw/zinc/98/91/30/1036989130.db2.gz VUDHRSXNSMYWQF-LLVKDONJSA-N 1 1 308.378 3.858 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCSC[C@H](C)C1 ZINC000488403964 1036998332 /nfs/dbraw/zinc/99/83/32/1036998332.db2.gz ZEGFELISTUATOL-YLHGKKIISA-N 1 1 306.431 3.683 20 5 DHBDMO CCOc1cc(C[NH2+][C@@H](C)c2nc(C)cs2)ccc1[N+](=O)[O-] ZINC000492873944 1037048316 /nfs/dbraw/zinc/04/83/16/1037048316.db2.gz OIKVNENOVXUZQJ-NSHDSACASA-N 1 1 321.402 3.609 20 5 DHBDMO Cc1cc(NCC[N@H+](C)C(C)C)c([N+](=O)[O-])cc1C(F)(F)F ZINC001185181004 1037058972 /nfs/dbraw/zinc/05/89/72/1037058972.db2.gz SHUNCQMLFWPUNC-UHFFFAOYSA-N 1 1 319.327 3.674 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CC[C@H]2CCCCO2)C2CC2)c1 ZINC000347433050 1037195026 /nfs/dbraw/zinc/19/50/26/1037195026.db2.gz GJMVEDMJIVBBGT-QGZVFWFLSA-N 1 1 304.390 3.518 20 5 DHBDMO C[C@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000489072898 1037249016 /nfs/dbraw/zinc/24/90/16/1037249016.db2.gz KMONQWIWJUKFSV-CYBMUJFWSA-N 1 1 302.349 3.797 20 5 DHBDMO C[C@@H](Nc1ccsc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001186071116 1037302683 /nfs/dbraw/zinc/30/26/83/1037302683.db2.gz VMWJDWNEVSMWRH-VXGBXAGGSA-N 1 1 309.435 3.721 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)c1 ZINC000609234554 1037461237 /nfs/dbraw/zinc/46/12/37/1037461237.db2.gz UWFWGVCJHPHJSU-SFHVURJKSA-N 1 1 312.369 3.558 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cccc2[nH]ccc21 ZINC000494036102 1037626060 /nfs/dbraw/zinc/62/60/60/1037626060.db2.gz CRQXJQQLHXRMQT-UHFFFAOYSA-N 1 1 309.369 3.751 20 5 DHBDMO CCc1c[nH]c2nc[nH+]c(N[C@H](C)c3ccccc3[N+](=O)[O-])c12 ZINC001187517327 1037647002 /nfs/dbraw/zinc/64/70/02/1037647002.db2.gz DCBKVKJIFYXPLK-SNVBAGLBSA-N 1 1 311.345 3.602 20 5 DHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H](C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000164537397 1038204371 /nfs/dbraw/zinc/20/43/71/1038204371.db2.gz KRKJEKIYLICCJG-ZDUSSCGKSA-N 1 1 321.421 3.598 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[C@@H](C2CC2)O1 ZINC001190528944 1038338473 /nfs/dbraw/zinc/33/84/73/1038338473.db2.gz OPQVZPHOLMXYSS-MSOLQXFVSA-N 1 1 318.417 3.763 20 5 DHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCC1CCCCC1 ZINC001190707310 1038366472 /nfs/dbraw/zinc/36/64/72/1038366472.db2.gz GUHOCOOYUDNONB-UHFFFAOYSA-N 1 1 306.406 3.876 20 5 DHBDMO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001191330132 1038490850 /nfs/dbraw/zinc/49/08/50/1038490850.db2.gz NHBAHBLHXQPNDT-GFCCVEGCSA-N 1 1 300.333 3.681 20 5 DHBDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001191330132 1038490855 /nfs/dbraw/zinc/49/08/55/1038490855.db2.gz NHBAHBLHXQPNDT-GFCCVEGCSA-N 1 1 300.333 3.681 20 5 DHBDMO C[N@H+](C/C=C\c1ccc(F)cc1)CCc1ccccc1[N+](=O)[O-] ZINC000572801974 1038502789 /nfs/dbraw/zinc/50/27/89/1038502789.db2.gz INQJPSKIJHBGGJ-PLNGDYQASA-N 1 1 314.360 3.922 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H](c3ccccn3)C2)cccc1[N+](=O)[O-] ZINC000590601874 1038674105 /nfs/dbraw/zinc/67/41/05/1038674105.db2.gz SHBPDMILCXDEBY-INIZCTEOSA-N 1 1 311.385 3.678 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCSC(F)(F)F)C2CC2)cc1 ZINC001192929781 1038721779 /nfs/dbraw/zinc/72/17/79/1038721779.db2.gz QURHFPNLFXWIFV-UHFFFAOYSA-N 1 1 320.336 3.812 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000598678934 1038820546 /nfs/dbraw/zinc/82/05/46/1038820546.db2.gz AXIGATKIPRLWNP-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO CCC[C@@H](N[C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000591582329 1038939435 /nfs/dbraw/zinc/93/94/35/1038939435.db2.gz IMLRPSWNBHWWQC-NVXWUHKLSA-N 1 1 317.433 3.700 20 5 DHBDMO CCC[C@@H](N[C@H]1CC[NH2+]C2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000591582328 1038939933 /nfs/dbraw/zinc/93/99/33/1038939933.db2.gz IMLRPSWNBHWWQC-DOTOQJQBSA-N 1 1 317.433 3.700 20 5 DHBDMO Cc1c(C[NH2+][C@@H]2CCCc3scnc32)cccc1[N+](=O)[O-] ZINC000599045039 1039003264 /nfs/dbraw/zinc/00/32/64/1039003264.db2.gz SYRATQQEMRNZAQ-GFCCVEGCSA-N 1 1 303.387 3.527 20 5 DHBDMO C[C@@H](c1cccs1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000046054718 1039059502 /nfs/dbraw/zinc/05/95/02/1039059502.db2.gz GGJNBBHWCVAYOC-LBPRGKRZSA-N 1 1 306.387 3.728 20 5 DHBDMO COc1ccccc1C1([NH2+]Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000592374292 1039169601 /nfs/dbraw/zinc/16/96/01/1039169601.db2.gz KLIFDUWNLJVVIB-UHFFFAOYSA-N 1 1 312.369 3.691 20 5 DHBDMO Cc1ccc(C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000603851725 1039187096 /nfs/dbraw/zinc/18/70/96/1039187096.db2.gz XNYYVAOUMGJSJC-UHFFFAOYSA-N 1 1 316.357 3.540 20 5 DHBDMO O=[N+]([O-])c1ncccc1Nc1ccc2c(c1)[nH+]c1n2CCCCC1 ZINC000603840020 1039193825 /nfs/dbraw/zinc/19/38/25/1039193825.db2.gz OPSLLCVNLDWAKG-UHFFFAOYSA-N 1 1 323.356 3.810 20 5 DHBDMO COc1ccc([C@@H](C)[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000603871975 1039204844 /nfs/dbraw/zinc/20/48/44/1039204844.db2.gz CQGLKHJLDFWNBL-CQSZACIVSA-N 1 1 314.385 3.839 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000604011993 1039281418 /nfs/dbraw/zinc/28/14/18/1039281418.db2.gz BZAUZYOVGGMWMS-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO CC(C)O[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000593054230 1039376052 /nfs/dbraw/zinc/37/60/52/1039376052.db2.gz RTHIUJIFVNQLHV-CQSZACIVSA-N 1 1 312.797 3.638 20 5 DHBDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000593054230 1039376066 /nfs/dbraw/zinc/37/60/66/1039376066.db2.gz RTHIUJIFVNQLHV-CQSZACIVSA-N 1 1 312.797 3.638 20 5 DHBDMO Cc1ccc(C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000604473322 1039480145 /nfs/dbraw/zinc/48/01/45/1039480145.db2.gz NRRJENANXUPZDL-UHFFFAOYSA-N 1 1 316.357 3.540 20 5 DHBDMO CC(C)[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000058933492 1039633025 /nfs/dbraw/zinc/63/30/25/1039633025.db2.gz DHXXKDFLFSIYLO-UHFFFAOYSA-N 1 1 314.385 3.884 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CC3(CC3(F)F)C2)o1 ZINC000594608561 1039866830 /nfs/dbraw/zinc/86/68/30/1039866830.db2.gz CACWJBYBQGBBEI-UHFFFAOYSA-N 1 1 320.295 3.696 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)c1cnccc1C ZINC000595022665 1039984789 /nfs/dbraw/zinc/98/47/89/1039984789.db2.gz UXQMRVRQLXYLCG-CHWSQXEVSA-N 1 1 315.373 3.719 20 5 DHBDMO CC(C)[C@H](O)[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000594991543 1040008638 /nfs/dbraw/zinc/00/86/38/1040008638.db2.gz JCGJSALVHWTXSN-HOTGVXAUSA-N 1 1 320.414 3.504 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCCc2occc21 ZINC000595006828 1040017599 /nfs/dbraw/zinc/01/75/99/1040017599.db2.gz JSJLNWCKLQXPQQ-NHYWBVRUSA-N 1 1 316.357 3.925 20 5 DHBDMO CC[C@@H](N[C@@H]1CC[N@@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056861 1040022609 /nfs/dbraw/zinc/02/26/09/1040022609.db2.gz RWNJGGCBOYGVDZ-GDBMZVCRSA-N 1 1 305.422 3.508 20 5 DHBDMO CC[C@@H](N[C@@H]1CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056861 1040022627 /nfs/dbraw/zinc/02/26/27/1040022627.db2.gz RWNJGGCBOYGVDZ-GDBMZVCRSA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1noc(C[N@@H+](Cc2ccccc2)CC2CCC2)c1[N+](=O)[O-] ZINC000595293722 1040091014 /nfs/dbraw/zinc/09/10/14/1040091014.db2.gz FKKCYPFGZVZNSR-UHFFFAOYSA-N 1 1 315.373 3.694 20 5 DHBDMO Cc1noc(C[N@H+](Cc2ccccc2)CC2CCC2)c1[N+](=O)[O-] ZINC000595293722 1040091025 /nfs/dbraw/zinc/09/10/25/1040091025.db2.gz FKKCYPFGZVZNSR-UHFFFAOYSA-N 1 1 315.373 3.694 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000595324890 1040108628 /nfs/dbraw/zinc/10/86/28/1040108628.db2.gz CRBJREOPFBZFGH-SWLSCSKDSA-N 1 1 315.373 3.517 20 5 DHBDMO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595374895 1040128511 /nfs/dbraw/zinc/12/85/11/1040128511.db2.gz GGCAAGAWPMCSHF-LLVKDONJSA-N 1 1 304.321 3.633 20 5 DHBDMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595374895 1040128524 /nfs/dbraw/zinc/12/85/24/1040128524.db2.gz GGCAAGAWPMCSHF-LLVKDONJSA-N 1 1 304.321 3.633 20 5 DHBDMO CC[C@H]([NH2+]Cc1cc(C2CC2)no1)c1cccc([N+](=O)[O-])c1 ZINC000595421773 1040133823 /nfs/dbraw/zinc/13/38/23/1040133823.db2.gz UWWOOQCGUSMVLV-HNNXBMFYSA-N 1 1 301.346 3.701 20 5 DHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595439050 1040138410 /nfs/dbraw/zinc/13/84/10/1040138410.db2.gz WTFQKYDAPJPDEY-LRDDRELGSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595439050 1040138416 /nfs/dbraw/zinc/13/84/16/1040138416.db2.gz WTFQKYDAPJPDEY-LRDDRELGSA-N 1 1 315.348 3.712 20 5 DHBDMO Cc1noc(C[N@@H+]2CC[C@H](C)C3(CCCCC3)C2)c1[N+](=O)[O-] ZINC000595438911 1040138952 /nfs/dbraw/zinc/13/89/52/1040138952.db2.gz JYTYDWCWDOIFNO-LBPRGKRZSA-N 1 1 307.394 3.684 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@@H](c3ccc(C)cc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000595479627 1040150343 /nfs/dbraw/zinc/15/03/43/1040150343.db2.gz GAVFXZPOIFXNLC-DOMZBBRYSA-N 1 1 315.373 3.578 20 5 DHBDMO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000595491303 1040152703 /nfs/dbraw/zinc/15/27/03/1040152703.db2.gz VFCYZBJMPSCCMI-CQSZACIVSA-N 1 1 310.369 3.513 20 5 DHBDMO C[N@@H+](CCCNc1ccsc1[N+](=O)[O-])Cc1ccccc1 ZINC000063256518 1040164339 /nfs/dbraw/zinc/16/43/39/1040164339.db2.gz WRSMWHQCHLAXII-UHFFFAOYSA-N 1 1 305.403 3.590 20 5 DHBDMO C[C@@H](CNc1ccsc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000063258157 1040164587 /nfs/dbraw/zinc/16/45/87/1040164587.db2.gz JCXFFELDHRJCPT-LBPRGKRZSA-N 1 1 317.414 3.515 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595907332 1040273084 /nfs/dbraw/zinc/27/30/84/1040273084.db2.gz AQVDJPFWLKTXNF-OLMNPRSZSA-N 1 1 316.401 3.548 20 5 DHBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccnc1 ZINC000596593782 1040504572 /nfs/dbraw/zinc/50/45/72/1040504572.db2.gz RRPWFZPZHMUHRT-QGZVFWFLSA-N 1 1 311.385 3.615 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CCS1 ZINC000228087481 1040641009 /nfs/dbraw/zinc/64/10/09/1040641009.db2.gz VLARRYDYCMGIDV-UHFFFAOYSA-N 1 1 314.838 3.966 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000534331859 1040805673 /nfs/dbraw/zinc/80/56/73/1040805673.db2.gz AZGVTRZSXPUFEC-KRZKXXONSA-N 1 1 309.369 3.840 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000491230652 1040971429 /nfs/dbraw/zinc/97/14/29/1040971429.db2.gz YLYPFSOFYIWUFO-ZDUSSCGKSA-N 1 1 318.323 3.863 20 5 DHBDMO Cc1cccc2c1CC[C@H]2[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602540747 1041082095 /nfs/dbraw/zinc/08/20/95/1041082095.db2.gz RCEMHOBYFCSEFC-OAHLLOKOSA-N 1 1 323.352 3.822 20 5 DHBDMO CC[C@H](CC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602619008 1041118172 /nfs/dbraw/zinc/11/81/72/1041118172.db2.gz VOFZESWMGYZTDR-MRVPVSSYSA-N 1 1 317.267 3.557 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]Cc3ccc(C4CC4)cc3)nc2c1 ZINC000602629044 1041137308 /nfs/dbraw/zinc/13/73/08/1041137308.db2.gz DZZBSAFISBRXGV-UHFFFAOYSA-N 1 1 323.352 3.903 20 5 DHBDMO Cc1nn(C[N@@H+](C)Cc2ccc(C)cc2)c2cc([N+](=O)[O-])ccc12 ZINC000761275092 1041174903 /nfs/dbraw/zinc/17/49/03/1041174903.db2.gz RZRQOEHPMCTIHT-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1nn(C[N@H+](C)Cc2ccc(C)cc2)c2cc([N+](=O)[O-])ccc12 ZINC000761275092 1041174912 /nfs/dbraw/zinc/17/49/12/1041174912.db2.gz RZRQOEHPMCTIHT-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO CC[N@H+](Cc1ccccc1)Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761273119 1041175654 /nfs/dbraw/zinc/17/56/54/1041175654.db2.gz MWDOSDQLECHRJB-UHFFFAOYSA-N 1 1 324.384 3.733 20 5 DHBDMO C[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104661274 194022813 /nfs/dbraw/zinc/02/28/13/194022813.db2.gz KMYSCWHONTVEED-ZDUSSCGKSA-N 1 1 315.373 3.524 20 5 DHBDMO CO[C@]1(C)CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000280497700 130804399 /nfs/dbraw/zinc/80/43/99/130804399.db2.gz MRWAAGZRCPRZKP-RHSMWYFYSA-N 1 1 306.406 3.855 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000584292312 332220701 /nfs/dbraw/zinc/22/07/01/332220701.db2.gz GFXYTLHLCIRJOF-HNRFISLBSA-N 1 1 316.401 3.642 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180429002 333028479 /nfs/dbraw/zinc/02/84/79/333028479.db2.gz LMOUAVOMCYQMGV-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO CCC[C@H](NC[C@H](C)C[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000320696584 335125098 /nfs/dbraw/zinc/12/50/98/335125098.db2.gz HQEXLKSPZFEIJK-YJBOKZPZSA-N 1 1 319.449 3.758 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCc1nccs1 ZINC000182929990 333181538 /nfs/dbraw/zinc/18/15/38/333181538.db2.gz AXVIFQHKYUZQHB-LBPRGKRZSA-N 1 1 305.403 3.595 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000187452429 333232899 /nfs/dbraw/zinc/23/28/99/333232899.db2.gz IMXWDDJQRUPFBH-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO CCC[C@@H](NCC[N@@H+](C)[C@@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000318973223 333236031 /nfs/dbraw/zinc/23/60/31/333236031.db2.gz HPVAHOMGTDKASN-WMLDXEAASA-N 1 1 307.438 3.756 20 5 DHBDMO CCC[C@@H]([NH2+]CCN(C)[C@@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000318973223 333236033 /nfs/dbraw/zinc/23/60/33/333236033.db2.gz HPVAHOMGTDKASN-WMLDXEAASA-N 1 1 307.438 3.756 20 5 DHBDMO CCC[C@@H]([NH2+]C1CCN(CCC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000120711231 333307001 /nfs/dbraw/zinc/30/70/01/333307001.db2.gz WNNQFETVTZDAGJ-GOSISDBHSA-N 1 1 319.449 3.900 20 5 DHBDMO COc1ccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000525787624 333313687 /nfs/dbraw/zinc/31/36/87/333313687.db2.gz FUWIRZNOSSYMKD-YUELXQCFSA-N 1 1 304.390 3.756 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H]3C3CC3)co2)cc1 ZINC000366893983 335315021 /nfs/dbraw/zinc/31/50/21/335315021.db2.gz DFHXPHMSGGIQBO-MRXNPFEDSA-N 1 1 313.357 3.624 20 5 DHBDMO CCCc1nc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000352550434 336224177 /nfs/dbraw/zinc/22/41/77/336224177.db2.gz NAENPLLBIVYSSZ-UHFFFAOYSA-N 1 1 319.430 3.678 20 5 DHBDMO CCCc1nc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000352550434 336224178 /nfs/dbraw/zinc/22/41/78/336224178.db2.gz NAENPLLBIVYSSZ-UHFFFAOYSA-N 1 1 319.430 3.678 20 5 DHBDMO CC(C)C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2F)C1 ZINC000301755718 336327942 /nfs/dbraw/zinc/32/79/42/336327942.db2.gz DGRYSSOVDZJEKK-ZDUSSCGKSA-N 1 1 309.385 3.514 20 5 DHBDMO C[C@H](CNc1sccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000301976222 336340927 /nfs/dbraw/zinc/34/09/27/336340927.db2.gz CJYYOPIJJUPPKZ-GFCCVEGCSA-N 1 1 317.414 3.515 20 5 DHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2sccc2[N+](=O)[O-])C1 ZINC000302020522 336343509 /nfs/dbraw/zinc/34/35/09/336343509.db2.gz NQGUAAWUNZOUFO-UONOGXRCSA-N 1 1 323.462 3.747 20 5 DHBDMO Cc1cc(N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000302058276 336346135 /nfs/dbraw/zinc/34/61/35/336346135.db2.gz RMHVQGVPKOCZMR-GJZGRUSLSA-N 1 1 317.433 3.968 20 5 DHBDMO Cc1ccc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000302824081 336370811 /nfs/dbraw/zinc/37/08/11/336370811.db2.gz LMHXOIKUNXEMFB-SJLPKXTDSA-N 1 1 311.385 3.761 20 5 DHBDMO Cc1ccc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000302824080 336370839 /nfs/dbraw/zinc/37/08/39/336370839.db2.gz LMHXOIKUNXEMFB-FUHWJXTLSA-N 1 1 311.385 3.761 20 5 DHBDMO C[C@@H]([NH2+]C[C@]1(N(C)C)CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000320902649 336384250 /nfs/dbraw/zinc/38/42/50/336384250.db2.gz ZWJUVKCGXBSNIP-RKVPGOIHSA-N 1 1 319.449 3.756 20 5 DHBDMO Cc1c[nH+]cn1C1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000376473293 337034228 /nfs/dbraw/zinc/03/42/28/337034228.db2.gz KCDHFBDNMCCFPQ-UHFFFAOYSA-N 1 1 320.780 3.595 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)NC/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000582634971 337116552 /nfs/dbraw/zinc/11/65/52/337116552.db2.gz NSCWIVYEDKMSFP-QZFKAFNDSA-N 1 1 319.449 3.708 20 5 DHBDMO CCCN(CC)C[C@H](C)[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000582634971 337116553 /nfs/dbraw/zinc/11/65/53/337116553.db2.gz NSCWIVYEDKMSFP-QZFKAFNDSA-N 1 1 319.449 3.708 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC000514669659 337151574 /nfs/dbraw/zinc/15/15/74/337151574.db2.gz BAACLPXHTLUFST-KDOFPFPSSA-N 1 1 312.369 3.809 20 5 DHBDMO Cc1ncsc1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000179241183 337168414 /nfs/dbraw/zinc/16/84/14/337168414.db2.gz IBTMSOPVRGRYCF-UHFFFAOYSA-N 1 1 317.414 3.567 20 5 DHBDMO Cc1ccc(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000186441572 337256132 /nfs/dbraw/zinc/25/61/32/337256132.db2.gz SXNHLVXJRACCTN-LJQANCHMSA-N 1 1 324.380 3.535 20 5 DHBDMO CC[C@H](NC[C@@H](C)C[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000321477762 337270592 /nfs/dbraw/zinc/27/05/92/337270592.db2.gz ATJWBJSDEHGCGR-QAPCUYQASA-N 1 1 319.449 3.758 20 5 DHBDMO Cc1cc(F)c(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(F)c1 ZINC000424193615 337805654 /nfs/dbraw/zinc/80/56/54/337805654.db2.gz QYVQTDHMRDWLFI-UHFFFAOYSA-N 1 1 306.312 3.780 20 5 DHBDMO CSC[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000429293180 338076672 /nfs/dbraw/zinc/07/66/72/338076672.db2.gz JNTVQVFWHWPRQL-NSHDSACASA-N 1 1 314.838 3.823 20 5 DHBDMO CC[C@@H]1CC[N@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000430196979 338100910 /nfs/dbraw/zinc/10/09/10/338100910.db2.gz SZCVDTZOYZEABT-GFCCVEGCSA-N 1 1 316.357 3.848 20 5 DHBDMO Cc1cc([N+](=O)[O-])cnc1SCC[N@H+](C)Cc1ccccc1 ZINC000432930741 338173908 /nfs/dbraw/zinc/17/39/08/338173908.db2.gz ZTAMKAKFQXOOQE-UHFFFAOYSA-N 1 1 317.414 3.522 20 5 DHBDMO CC[N@@H+](CCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(C)C ZINC000433160457 338183530 /nfs/dbraw/zinc/18/35/30/338183530.db2.gz ONYMCWNCHHJHSQ-QGZVFWFLSA-N 1 1 319.449 3.637 20 5 DHBDMO CCN(CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(C)C ZINC000433160457 338183531 /nfs/dbraw/zinc/18/35/31/338183531.db2.gz ONYMCWNCHHJHSQ-QGZVFWFLSA-N 1 1 319.449 3.637 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000434681355 338223140 /nfs/dbraw/zinc/22/31/40/338223140.db2.gz NLMFYLIAQFANGP-UHFFFAOYSA-N 1 1 314.838 3.966 20 5 DHBDMO C[C@@H](c1ccco1)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000440899745 338399617 /nfs/dbraw/zinc/39/96/17/338399617.db2.gz UMLUTYAQSUTYFA-ZDUSSCGKSA-N 1 1 316.357 3.792 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000459644336 339040147 /nfs/dbraw/zinc/04/01/47/339040147.db2.gz DXHDLVGFFWLJMD-NSHDSACASA-N 1 1 317.414 3.699 20 5 DHBDMO CCCC[N@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])c(OC)c1 ZINC000462806214 339090369 /nfs/dbraw/zinc/09/03/69/339090369.db2.gz GFPHAOJMRULCPS-HNNXBMFYSA-N 1 1 321.421 3.670 20 5 DHBDMO COc1cc(C[N@H+]2CCCC[C@H]2C(C)C)c([N+](=O)[O-])cc1F ZINC000464686500 339148799 /nfs/dbraw/zinc/14/87/99/339148799.db2.gz CNOROBLHXKUWJY-AWEZNQCLSA-N 1 1 310.369 3.753 20 5 DHBDMO Cc1c([C@@H](C)[NH2+][C@H]2COc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000468052173 339252950 /nfs/dbraw/zinc/25/29/50/339252950.db2.gz RIBVTIBMBNUUAX-ABAIWWIYSA-N 1 1 316.332 3.827 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1scnc1C ZINC000470169831 339312552 /nfs/dbraw/zinc/31/25/52/339312552.db2.gz KRXBBQNWMATRPA-GHXNOFRVSA-N 1 1 317.414 3.895 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2ccc(O)cc2C1 ZINC000470169975 339312629 /nfs/dbraw/zinc/31/26/29/339312629.db2.gz MSDYSFZMOMPOQH-NTEUORMPSA-N 1 1 324.380 3.762 20 5 DHBDMO CCOC[C@@H]1CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470174960 339312807 /nfs/dbraw/zinc/31/28/07/339312807.db2.gz OIAINSPEFDPKPC-IUYQLWOBSA-N 1 1 318.417 3.747 20 5 DHBDMO CC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1ccccn1 ZINC000470178295 339313055 /nfs/dbraw/zinc/31/30/55/339313055.db2.gz XZANNQXBTLLOBP-PTNGSMBKSA-N 1 1 311.385 3.915 20 5 DHBDMO CSC[C@@H]1CCC[N@H+]1C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470179516 339313169 /nfs/dbraw/zinc/31/31/69/339313169.db2.gz YFZCAROPLDTYHX-OVHOFWQVSA-N 1 1 306.431 3.826 20 5 DHBDMO CCc1cccc(F)c1C[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000474627115 339420773 /nfs/dbraw/zinc/42/07/73/339420773.db2.gz NEPAXKKAAJKSBH-UHFFFAOYSA-N 1 1 318.348 3.595 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000497112392 340020621 /nfs/dbraw/zinc/02/06/21/340020621.db2.gz DZUBLUOGVOSYEI-CRAIPNDOSA-N 1 1 320.433 3.701 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cccs1 ZINC000505552711 340170808 /nfs/dbraw/zinc/17/08/08/340170808.db2.gz CTCIQULOTLURRT-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccs1 ZINC000505552711 340170809 /nfs/dbraw/zinc/17/08/09/340170809.db2.gz CTCIQULOTLURRT-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO COc1cccc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000505655658 340174311 /nfs/dbraw/zinc/17/43/11/340174311.db2.gz DABHRRXSUVDXSX-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO Cc1cc(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000506948324 340204131 /nfs/dbraw/zinc/20/41/31/340204131.db2.gz WNBBNNSBDRZODZ-UXLLHSPISA-N 1 1 317.433 3.745 20 5 DHBDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000507162230 340210161 /nfs/dbraw/zinc/21/01/61/340210161.db2.gz CFEGWRZIVDFFIN-AWEZNQCLSA-N 1 1 302.399 3.954 20 5 DHBDMO CC[C@@H]1C[C@@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000507793632 340231726 /nfs/dbraw/zinc/23/17/26/340231726.db2.gz HURPCPBVKZMFJD-WMLDXEAASA-N 1 1 318.417 3.764 20 5 DHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCc1ccc(F)cc1 ZINC000510455578 340299970 /nfs/dbraw/zinc/29/99/70/340299970.db2.gz CFJCNVZSIHXCQE-GQCTYLIASA-N 1 1 314.360 3.922 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(F)c(F)c1 ZINC000511103819 340320935 /nfs/dbraw/zinc/32/09/35/340320935.db2.gz CPXVZWFJLBZNHH-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)CC1CCCC1 ZINC000512702070 340373633 /nfs/dbraw/zinc/37/36/33/340373633.db2.gz ZUYKXEDWJWBCRE-UHFFFAOYSA-N 1 1 314.332 3.818 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cc(F)ccc1F ZINC000521898989 340538819 /nfs/dbraw/zinc/53/88/19/340538819.db2.gz FQHWTGBRENPULK-HNNXBMFYSA-N 1 1 304.296 3.650 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1C[C@@H](C)S[C@H](C)C1 ZINC000525273814 340698482 /nfs/dbraw/zinc/69/84/82/340698482.db2.gz VXBQNQJADRPDRG-CHWSQXEVSA-N 1 1 324.446 3.708 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000544611511 341088928 /nfs/dbraw/zinc/08/89/28/341088928.db2.gz FUYPFYBOVJYNKS-CVEARBPZSA-N 1 1 306.431 3.763 20 5 DHBDMO CC[N@@H+](CCC1CC1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000545519497 341128191 /nfs/dbraw/zinc/12/81/91/341128191.db2.gz NHLQTQKEFCKDCP-UHFFFAOYSA-N 1 1 315.373 3.872 20 5 DHBDMO CC(C)([NH2+]Cc1ccc(F)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000080346929 341273075 /nfs/dbraw/zinc/27/30/75/341273075.db2.gz LGAGJCSNLUVDMH-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c(F)cccc1F ZINC000548933329 341281496 /nfs/dbraw/zinc/28/14/96/341281496.db2.gz DGMZKSJRABVFSD-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c(F)cccc1F ZINC000548933329 341281497 /nfs/dbraw/zinc/28/14/97/341281497.db2.gz DGMZKSJRABVFSD-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000245383756 341290169 /nfs/dbraw/zinc/29/01/69/341290169.db2.gz RHNORRUFCPBXTA-WMLDXEAASA-N 1 1 311.385 3.842 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1F ZINC000549407688 341293604 /nfs/dbraw/zinc/29/36/04/341293604.db2.gz IGMYOJUBJZPMOA-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000245493048 341297126 /nfs/dbraw/zinc/29/71/26/341297126.db2.gz KTCYEQPWUAVVTE-LESCRADOSA-N 1 1 317.433 3.603 20 5 DHBDMO CC(C)C[N@H+]1CCC[C@H](CN[C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000246415852 341347919 /nfs/dbraw/zinc/34/79/19/341347919.db2.gz MWEQXBYTKOBGDY-HZPDHXFCSA-N 1 1 319.449 3.613 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H]3CF)o2)c1 ZINC000552391943 341390882 /nfs/dbraw/zinc/39/08/82/341390882.db2.gz DKVBBGPJYKIBBR-AWEZNQCLSA-N 1 1 304.321 3.789 20 5 DHBDMO Cc1csc([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000565213461 341520233 /nfs/dbraw/zinc/52/02/33/341520233.db2.gz AOYWSMJCQMDXLR-ZWNOBZJWSA-N 1 1 303.387 3.698 20 5 DHBDMO COC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)o1 ZINC000156492342 522375665 /nfs/dbraw/zinc/37/56/65/522375665.db2.gz DHSWUCMOXSAIFP-SWLSCSKDSA-N 1 1 304.346 3.535 20 5 DHBDMO CC[C@@H]([NH2+][C@H](C)c1ccncc1F)c1cccc([N+](=O)[O-])c1 ZINC000338018839 522938737 /nfs/dbraw/zinc/93/87/37/522938737.db2.gz ZQMCDWVYKZSSJV-BDJLRTHQSA-N 1 1 303.337 3.931 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(Cl)nc1 ZINC000181413090 525461771 /nfs/dbraw/zinc/46/17/71/525461771.db2.gz BYCWYDOUYIOAHH-JTQLQIEISA-N 1 1 321.764 3.503 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cn3c(cccc3C)n2)cc1[N+](=O)[O-] ZINC000160310539 525737224 /nfs/dbraw/zinc/73/72/24/525737224.db2.gz AKKBPKGPWGLPGF-CQSZACIVSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1c([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cnn1C(C)C ZINC000191350686 525919588 /nfs/dbraw/zinc/91/95/88/525919588.db2.gz GNVZKAWXHXBSBW-LBPRGKRZSA-N 1 1 302.378 3.531 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000249888201 526085516 /nfs/dbraw/zinc/08/55/16/526085516.db2.gz PVDFUCDBRLPHHT-TZMCWYRMSA-N 1 1 317.414 3.992 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCC1CCOCC1 ZINC000182843817 526087882 /nfs/dbraw/zinc/08/78/82/526087882.db2.gz DVSHFALZPYYHPI-CQSZACIVSA-N 1 1 306.406 3.713 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000266563108 526107820 /nfs/dbraw/zinc/10/78/20/526107820.db2.gz YMXGZKTYIDCWTF-WDEREUQCSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000266563108 526107834 /nfs/dbraw/zinc/10/78/34/526107834.db2.gz YMXGZKTYIDCWTF-WDEREUQCSA-N 1 1 302.296 3.930 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)c(Cl)c1 ZINC000517736057 1013053965 /nfs/dbraw/zinc/05/39/65/1013053965.db2.gz FPRJVBYVXZNZBD-XJKSGUPXSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000359870826 1013057361 /nfs/dbraw/zinc/05/73/61/1013057361.db2.gz JNMKSNPFHSXJLV-KDOFPFPSSA-N 1 1 311.385 3.615 20 5 DHBDMO CC(C)[C@@H](C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000083168508 1013781828 /nfs/dbraw/zinc/78/18/28/1013781828.db2.gz NWSFLVRAWPZMOD-LLVKDONJSA-N 1 1 303.362 3.745 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@H](CCO)c2ccco2)cc1[N+](=O)[O-] ZINC000184510349 1013784366 /nfs/dbraw/zinc/78/43/66/1013784366.db2.gz GDFALFQTHDNVAK-OAHLLOKOSA-N 1 1 318.373 3.525 20 5 DHBDMO Cc1[nH+]c2c(Nc3cccc([N+](=O)[O-])c3F)cccn2c1C ZINC001210381945 1013820918 /nfs/dbraw/zinc/82/09/18/1013820918.db2.gz SNBODSNEKPXCCX-UHFFFAOYSA-N 1 1 300.293 3.742 20 5 DHBDMO CC[C@H]1CCCCC[N@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000441436582 1013839037 /nfs/dbraw/zinc/83/90/37/1013839037.db2.gz HRPQXIRILVTYKS-AWEZNQCLSA-N 1 1 322.405 3.637 20 5 DHBDMO CC[C@H](NCCC[N@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000319889058 1014269632 /nfs/dbraw/zinc/26/96/32/1014269632.db2.gz WUVHQPHXNKJXDT-QAPCUYQASA-N 1 1 319.449 3.900 20 5 DHBDMO CC[C@H](NCCC[N@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000319889061 1014269148 /nfs/dbraw/zinc/26/91/48/1014269148.db2.gz WUVHQPHXNKJXDT-YJBOKZPZSA-N 1 1 319.449 3.900 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cn1 ZINC000276128708 1014701390 /nfs/dbraw/zinc/70/13/90/1014701390.db2.gz ARJJFMWHAGZCGB-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cn1 ZINC000276128708 1014701397 /nfs/dbraw/zinc/70/13/97/1014701397.db2.gz ARJJFMWHAGZCGB-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO CCN(CC)[C@H](C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)CC(C)C ZINC000521818964 1014809891 /nfs/dbraw/zinc/80/98/91/1014809891.db2.gz JJNOMIGWKWEDKW-KRWDZBQOSA-N 1 1 321.465 3.749 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H](C)C1 ZINC000127263126 1015256056 /nfs/dbraw/zinc/25/60/56/1015256056.db2.gz YJRIKRLDZAWVPY-NWDGAFQWSA-N 1 1 303.362 3.604 20 5 DHBDMO CCOc1cc(C[N@H+](C)[C@H](C)c2ccncc2)ccc1[N+](=O)[O-] ZINC000276866773 1015718993 /nfs/dbraw/zinc/71/89/93/1015718993.db2.gz HEBJTHUGHYPMOW-CYBMUJFWSA-N 1 1 315.373 3.582 20 5 DHBDMO CCOc1cc(C[N@@H+](C)[C@H](C)c2ccncc2)ccc1[N+](=O)[O-] ZINC000276866773 1015719008 /nfs/dbraw/zinc/71/90/08/1015719008.db2.gz HEBJTHUGHYPMOW-CYBMUJFWSA-N 1 1 315.373 3.582 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCOC(C)(C)C ZINC000610859667 1015896050 /nfs/dbraw/zinc/89/60/50/1015896050.db2.gz GTPJZUSMVLGGTH-UHFFFAOYSA-N 1 1 324.421 3.629 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCOC(C)(C)C ZINC000610859667 1015896070 /nfs/dbraw/zinc/89/60/70/1015896070.db2.gz GTPJZUSMVLGGTH-UHFFFAOYSA-N 1 1 324.421 3.629 20 5 DHBDMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000538717425 1016163100 /nfs/dbraw/zinc/16/31/00/1016163100.db2.gz ZZFRFIUYSDIFIR-VXGBXAGGSA-N 1 1 317.414 3.949 20 5 DHBDMO Cc1nn(C(C)C)cc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000281472919 1016534060 /nfs/dbraw/zinc/53/40/60/1016534060.db2.gz UWOZAIUUZCMPGI-ZDUSSCGKSA-N 1 1 302.378 3.531 20 5 DHBDMO O=[N+]([O-])c1cccc(CN2C[C@H]3CCC[N@H+]3Cc3ccccc32)c1 ZINC000342527071 1016685112 /nfs/dbraw/zinc/68/51/12/1016685112.db2.gz UGJLQWOLCHVIOZ-GOSISDBHSA-N 1 1 323.396 3.579 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc(C)c(C)o1 ZINC000281982924 1016854338 /nfs/dbraw/zinc/85/43/38/1016854338.db2.gz CCRLFOPTVNVPNO-LLVKDONJSA-N 1 1 304.346 3.664 20 5 DHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H]1CC[C@@H](C)C1 ZINC000362160758 1032255707 /nfs/dbraw/zinc/25/57/07/1032255707.db2.gz YMLDXURRYRPCIQ-CJNGLKHVSA-N 1 1 306.406 3.540 20 5 DHBDMO C[N@@H+](CCOc1ccccc1Cl)Cc1ccc([N+](=O)[O-])cc1 ZINC000479782562 1017071073 /nfs/dbraw/zinc/07/10/73/1017071073.db2.gz MRKYNTQPZRKEMJ-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@]3(CC[C@H](C)C3)C2)c([N+](=O)[O-])cc1F ZINC000362190311 1032266290 /nfs/dbraw/zinc/26/62/90/1032266290.db2.gz LPHUUJBJZBXHEI-SJCJKPOMSA-N 1 1 322.380 3.755 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](OC(C)C)C1 ZINC000593053778 1032501652 /nfs/dbraw/zinc/50/16/52/1032501652.db2.gz MGVLPUWRFBJBQZ-ZBFHGGJFSA-N 1 1 306.406 3.854 20 5 DHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cccc(O)c1 ZINC000037151216 1032640796 /nfs/dbraw/zinc/64/07/96/1032640796.db2.gz TYIWWESNTKMXBW-JTQLQIEISA-N 1 1 306.749 3.805 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N[C@H]1CC[N@@H+](C2CC2)C1 ZINC000515392424 1012612221 /nfs/dbraw/zinc/61/22/21/1012612221.db2.gz VPVYEJQZNXAYFC-VIFPVBQESA-N 1 1 316.188 3.550 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N[C@H]1CC[N@H+](C2CC2)C1 ZINC000515392424 1012612229 /nfs/dbraw/zinc/61/22/29/1012612229.db2.gz VPVYEJQZNXAYFC-VIFPVBQESA-N 1 1 316.188 3.550 20 5 DHBDMO CC[N@@H+](CCc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000515545851 1012656788 /nfs/dbraw/zinc/65/67/88/1012656788.db2.gz BAEJZTGESPSZMJ-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000609075395 1012797660 /nfs/dbraw/zinc/79/76/60/1012797660.db2.gz YAIVBFPVPKCBSQ-UHFFFAOYSA-N 1 1 320.414 3.866 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000475283517 1017116342 /nfs/dbraw/zinc/11/63/42/1017116342.db2.gz IMBLXHJDVCOFMQ-FJYXQWIHSA-N 1 1 314.307 3.881 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cnccc1C ZINC000475555171 1017426663 /nfs/dbraw/zinc/42/66/63/1017426663.db2.gz LIOCZIPFUDZMBW-ZROIWOOFSA-N 1 1 311.385 3.834 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(F)c(C)c1 ZINC000444741473 1017654494 /nfs/dbraw/zinc/65/44/94/1017654494.db2.gz YRAGAVYZRYFJPI-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(F)c(C)c1 ZINC000444741473 1017654498 /nfs/dbraw/zinc/65/44/98/1017654498.db2.gz YRAGAVYZRYFJPI-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000444828571 1017690120 /nfs/dbraw/zinc/69/01/20/1017690120.db2.gz OGRFCVFNXCENNN-NEPJUHHUSA-N 1 1 309.797 3.595 20 5 DHBDMO CC[C@@H](NCC[N@@H+](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000171509894 1017950800 /nfs/dbraw/zinc/95/08/00/1017950800.db2.gz YQQLVLQEVMHRFS-QGZVFWFLSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@@H]([NH2+]CCN(C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000171509894 1017950809 /nfs/dbraw/zinc/95/08/09/1017950809.db2.gz YQQLVLQEVMHRFS-QGZVFWFLSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1ccc([C@H](C)N[C@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153722602 1017992203 /nfs/dbraw/zinc/99/22/03/1017992203.db2.gz RIKVHLGLHPLCEV-HOCLYGCPSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153722602 1017992216 /nfs/dbraw/zinc/99/22/16/1017992216.db2.gz RIKVHLGLHPLCEV-HOCLYGCPSA-N 1 1 317.433 3.571 20 5 DHBDMO C[C@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000278080687 1018047212 /nfs/dbraw/zinc/04/72/12/1018047212.db2.gz GHRVOFGQJDSGDD-OPRDCNLKSA-N 1 1 322.390 3.640 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(F)cc1 ZINC000172673689 1018077709 /nfs/dbraw/zinc/07/77/09/1018077709.db2.gz QRDIDZJRPNYKHO-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO C[C@H]1CCCC[C@@H]1OCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000446715945 1018221013 /nfs/dbraw/zinc/22/10/13/1018221013.db2.gz WGIPGHGXKRWVLF-KSSFIOAISA-N 1 1 318.417 3.548 20 5 DHBDMO C[C@H]1CCCC[C@@H]1OCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000446715945 1018221022 /nfs/dbraw/zinc/22/10/22/1018221022.db2.gz WGIPGHGXKRWVLF-KSSFIOAISA-N 1 1 318.417 3.548 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(c2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000446889357 1018287370 /nfs/dbraw/zinc/28/73/70/1018287370.db2.gz VYPKEBCWNTUPJZ-UHFFFAOYSA-N 1 1 319.449 3.852 20 5 DHBDMO CC[N@H+](Cc1ccccc1)Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000764858957 1018401998 /nfs/dbraw/zinc/40/19/98/1018401998.db2.gz XJURKKJRCUVJGP-UHFFFAOYSA-N 1 1 324.384 3.733 20 5 DHBDMO Cc1ccc(C[N@H+]2CCCc3sccc3C2)cc1[N+](=O)[O-] ZINC000611271119 1019428447 /nfs/dbraw/zinc/42/84/47/1019428447.db2.gz GRPASHSFBSGWID-UHFFFAOYSA-N 1 1 302.399 3.913 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000611350527 1019450056 /nfs/dbraw/zinc/45/00/56/1019450056.db2.gz PUROKMXYMLLHJT-OAGGEKHMSA-N 1 1 318.417 3.794 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000611350963 1019450465 /nfs/dbraw/zinc/45/04/65/1019450465.db2.gz VVZPWLPCPJVZGV-OAGGEKHMSA-N 1 1 318.417 3.794 20 5 DHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])s2)C1 ZINC000611370313 1019456303 /nfs/dbraw/zinc/45/63/03/1019456303.db2.gz XTNLSBYLSWTMIF-JSGCOSHPSA-N 1 1 317.414 3.904 20 5 DHBDMO CSCC[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000128211428 1019467556 /nfs/dbraw/zinc/46/75/56/1019467556.db2.gz TWUGDBLVDLLYSP-UHFFFAOYSA-N 1 1 306.387 3.650 20 5 DHBDMO CC(C)([NH2+]Cc1cnn(C2CCC2)c1)c1ccccc1[N+](=O)[O-] ZINC000922143653 1019515587 /nfs/dbraw/zinc/51/55/87/1019515587.db2.gz MKMFPZBAKYWTMB-UHFFFAOYSA-N 1 1 314.389 3.541 20 5 DHBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000611555045 1019517104 /nfs/dbraw/zinc/51/71/04/1019517104.db2.gz KJEPFHNUOFOWTF-YPMHNXCESA-N 1 1 316.323 3.800 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCc2sccc2C1 ZINC000255870410 1019622971 /nfs/dbraw/zinc/62/29/71/1019622971.db2.gz GOIOWNANWCBTEN-HYXAFXHYSA-N 1 1 300.383 3.728 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCc2sccc2C1 ZINC000255870410 1019622980 /nfs/dbraw/zinc/62/29/80/1019622980.db2.gz GOIOWNANWCBTEN-HYXAFXHYSA-N 1 1 300.383 3.728 20 5 DHBDMO Cc1cnc(CC[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])s1 ZINC000255885886 1019634906 /nfs/dbraw/zinc/63/49/06/1019634906.db2.gz CCDRQKYVTAFODF-ALCCZGGFSA-N 1 1 317.414 3.547 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000370671223 1019712034 /nfs/dbraw/zinc/71/20/34/1019712034.db2.gz OPRITEJKMGTBPS-JZXOWHBKSA-N 1 1 317.433 3.652 20 5 DHBDMO CCC[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000370671223 1019712051 /nfs/dbraw/zinc/71/20/51/1019712051.db2.gz OPRITEJKMGTBPS-JZXOWHBKSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H](C[N@@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000727427990 1019713091 /nfs/dbraw/zinc/71/30/91/1019713091.db2.gz LCBBYBJGAFNRID-CQSZACIVSA-N 1 1 324.384 3.638 20 5 DHBDMO Cc1c([C@H](C)[NH2+]C[C@H](C(C)C)N2CCCC2)cccc1[N+](=O)[O-] ZINC000480552810 1019748312 /nfs/dbraw/zinc/74/83/12/1019748312.db2.gz KLYOJVRHFOVQPI-MAUKXSAKSA-N 1 1 319.449 3.674 20 5 DHBDMO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000131020568 1019819442 /nfs/dbraw/zinc/81/94/42/1019819442.db2.gz BRHXRGNXKIQQDT-INIZCTEOSA-N 1 1 316.357 3.671 20 5 DHBDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000131020568 1019819457 /nfs/dbraw/zinc/81/94/57/1019819457.db2.gz BRHXRGNXKIQQDT-INIZCTEOSA-N 1 1 316.357 3.671 20 5 DHBDMO CC(C)([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000116381041 1019870447 /nfs/dbraw/zinc/87/04/47/1019870447.db2.gz RNDVLUNVBUQZNJ-FNORWQNLSA-N 1 1 303.387 3.589 20 5 DHBDMO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccccc2)O1 ZINC000070695228 1020057074 /nfs/dbraw/zinc/05/70/74/1020057074.db2.gz HCFOFRWMFZMIPN-KBXCAEBGSA-N 1 1 312.369 3.557 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccccc2)O1 ZINC000070695228 1020057088 /nfs/dbraw/zinc/05/70/88/1020057088.db2.gz HCFOFRWMFZMIPN-KBXCAEBGSA-N 1 1 312.369 3.557 20 5 DHBDMO CCOC[C@H]1CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000093419236 1020151777 /nfs/dbraw/zinc/15/17/77/1020151777.db2.gz DIVWEFWPDRSIDR-INIZCTEOSA-N 1 1 320.433 3.967 20 5 DHBDMO CC(C)[N@@H+](C)C[C@H](C)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000390484538 1020199674 /nfs/dbraw/zinc/19/96/74/1020199674.db2.gz GDLDOQOSNHYXBA-JTQLQIEISA-N 1 1 319.327 3.754 20 5 DHBDMO CC(C)[N@H+]1CCCC[C@@H]1CN[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000330668891 1020237917 /nfs/dbraw/zinc/23/79/17/1020237917.db2.gz ZLTKNTIWGCAWHQ-LSDHHAIUSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)N1CCCC[C@@H]1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000330668891 1020237925 /nfs/dbraw/zinc/23/79/25/1020237925.db2.gz ZLTKNTIWGCAWHQ-LSDHHAIUSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(O)c1 ZINC000179320506 1020252133 /nfs/dbraw/zinc/25/21/33/1020252133.db2.gz VREOYKWBYCSYLJ-UHFFFAOYSA-N 1 1 300.358 3.711 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000284203781 1020392753 /nfs/dbraw/zinc/39/27/53/1020392753.db2.gz SOWYAEWDQJVUPX-LBPRGKRZSA-N 1 1 315.329 3.662 20 5 DHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445260460 1020465761 /nfs/dbraw/zinc/46/57/61/1020465761.db2.gz QOYCUQBQWDFTAT-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H](c1ccc(F)cc1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445260460 1020465767 /nfs/dbraw/zinc/46/57/67/1020465767.db2.gz QOYCUQBQWDFTAT-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H](C)[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000480618845 1020466262 /nfs/dbraw/zinc/46/62/62/1020466262.db2.gz WSTULPYHHKXJJA-XHSDSOJGSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000480618845 1020466268 /nfs/dbraw/zinc/46/62/68/1020466268.db2.gz WSTULPYHHKXJJA-XHSDSOJGSA-N 1 1 319.449 3.817 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1sccc1[N+](=O)[O-] ZINC000613184896 1020844547 /nfs/dbraw/zinc/84/45/47/1020844547.db2.gz SKIGMMJKWRUZNB-TZMCWYRMSA-N 1 1 317.414 3.589 20 5 DHBDMO CCC[C@H](NCC[N@@H+]1CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000766271983 1021026070 /nfs/dbraw/zinc/02/60/70/1021026070.db2.gz WVAJPJKTTNAMCH-PBHICJAKSA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@H](NCC[N@H+]1CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000766271983 1021026071 /nfs/dbraw/zinc/02/60/71/1021026071.db2.gz WVAJPJKTTNAMCH-PBHICJAKSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2cccc(Cl)c2F)cc1[N+](=O)[O-] ZINC000742387939 1021110148 /nfs/dbraw/zinc/11/01/48/1021110148.db2.gz KJKOMAXPIQNSEQ-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776279151 1021230419 /nfs/dbraw/zinc/23/04/19/1021230419.db2.gz VPFUCQMFDKULDI-XYPHTWIQSA-N 1 1 306.406 3.529 20 5 DHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000744442063 1021545173 /nfs/dbraw/zinc/54/51/73/1021545173.db2.gz WBZHVTXCGMOFEK-QWRGUYRKSA-N 1 1 321.402 3.950 20 5 DHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000744440701 1021545314 /nfs/dbraw/zinc/54/53/14/1021545314.db2.gz GTMRCDPALZELNZ-BBRMVZONSA-N 1 1 314.389 3.536 20 5 DHBDMO Cc1ccncc1[C@H](C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000783001614 1021578767 /nfs/dbraw/zinc/57/87/67/1021578767.db2.gz JHRQOCYNSHVTEV-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO C[N@@H+](Cc1ccccc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000103457453 1021712535 /nfs/dbraw/zinc/71/25/35/1021712535.db2.gz NNZYYUGXRGPWLI-UHFFFAOYSA-N 1 1 322.368 3.548 20 5 DHBDMO C[N@H+](Cc1ccccc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000103457453 1021712555 /nfs/dbraw/zinc/71/25/55/1021712555.db2.gz NNZYYUGXRGPWLI-UHFFFAOYSA-N 1 1 322.368 3.548 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000851806410 1022009289 /nfs/dbraw/zinc/00/92/89/1022009289.db2.gz OTVZOKLQOYOSRQ-MRXNPFEDSA-N 1 1 300.333 3.551 20 5 DHBDMO CC[C@H](C)[C@@H](C)[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776583134 1022096377 /nfs/dbraw/zinc/09/63/77/1022096377.db2.gz XQHNEDYDKVHNOY-AHIWAGSCSA-N 1 1 306.406 3.527 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC3(CCCCC3)C2)cc1 ZINC000776581644 1022100879 /nfs/dbraw/zinc/10/08/79/1022100879.db2.gz FSUXUVVQWQLHBY-QGZVFWFLSA-N 1 1 318.417 3.675 20 5 DHBDMO CC(C)CC[C@@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587601 1022101814 /nfs/dbraw/zinc/10/18/14/1022101814.db2.gz XHCKMDUGYZMPJM-DOTOQJQBSA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)Cc1ccc(O)cc1 ZINC000183339343 1022102350 /nfs/dbraw/zinc/10/23/50/1022102350.db2.gz LGLAUDVMJGILIK-AWEZNQCLSA-N 1 1 314.385 3.672 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(c2ccco2)CC1 ZINC000852323343 1022104903 /nfs/dbraw/zinc/10/49/03/1022104903.db2.gz HKSWSEYOTCMYPF-UHFFFAOYSA-N 1 1 304.321 3.707 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000852598750 1022147813 /nfs/dbraw/zinc/14/78/13/1022147813.db2.gz YNXOJINPNQGFSP-SUMWQHHRSA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(c2ccon2)CC1 ZINC000852673738 1022156139 /nfs/dbraw/zinc/15/61/39/1022156139.db2.gz XLZMLZUZIYITQZ-UHFFFAOYSA-N 1 1 321.764 3.616 20 5 DHBDMO CC[C@@H]1CO[C@](C)(CCC(C)C)[N@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169038911 1022221484 /nfs/dbraw/zinc/22/14/84/1022221484.db2.gz LGCIPCDGLCNJGR-VVLHAWIVSA-N 1 1 312.454 3.695 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+](Cc2ccccn2)C2CCCCC2)C1 ZINC001169039126 1022222625 /nfs/dbraw/zinc/22/26/25/1022222625.db2.gz NMNXDPBJGSETAA-CRAIPNDOSA-N 1 1 317.433 3.662 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169025298 1022228247 /nfs/dbraw/zinc/22/82/47/1022228247.db2.gz YLPBGMNUDMRFDE-PWSUYJOCSA-N 1 1 317.216 3.871 20 5 DHBDMO Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)c1 ZINC001169046715 1022229503 /nfs/dbraw/zinc/22/95/03/1022229503.db2.gz MGEKNWYCNNRAKY-JQHSSLGASA-N 1 1 302.418 3.886 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC001169026000 1022229767 /nfs/dbraw/zinc/22/97/67/1022229767.db2.gz KKOHYJVBJBOJDS-WQVCFCJDSA-N 1 1 308.809 3.922 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H](CCc3ccccc3)C2)C1 ZINC001169057614 1022234607 /nfs/dbraw/zinc/23/46/07/1022234607.db2.gz WFVGQKAHEGNMBP-OTWHNJEPSA-N 1 1 316.445 3.777 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC[C@@H]1CCCCO1)C1CC1 ZINC000347480634 1022270446 /nfs/dbraw/zinc/27/04/46/1022270446.db2.gz FPPIQYGTJNXENZ-INIZCTEOSA-N 1 1 304.390 3.518 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])s2)c1 ZINC000609560609 1022301286 /nfs/dbraw/zinc/30/12/86/1022301286.db2.gz VVSSROFEMOYRDT-UHFFFAOYSA-N 1 1 305.403 3.720 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000609916444 1022381249 /nfs/dbraw/zinc/38/12/49/1022381249.db2.gz ORYMVCPBNPBEMB-HNNXBMFYSA-N 1 1 314.360 3.799 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cc(Cl)cn1C ZINC000120256915 1022403058 /nfs/dbraw/zinc/40/30/58/1022403058.db2.gz HHDNNMAMXVSDJP-NSHDSACASA-N 1 1 307.781 3.780 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cc(Cl)cn1C ZINC000120256915 1022403064 /nfs/dbraw/zinc/40/30/64/1022403064.db2.gz HHDNNMAMXVSDJP-NSHDSACASA-N 1 1 307.781 3.780 20 5 DHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])s1)[N@@H+]1CCc2sccc2C1 ZINC000139415417 1022725094 /nfs/dbraw/zinc/72/50/94/1022725094.db2.gz NBOCOSHABANWAU-JTQLQIEISA-N 1 1 323.443 3.577 20 5 DHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])s1)[N@H+]1CCc2sccc2C1 ZINC000139415417 1022725105 /nfs/dbraw/zinc/72/51/05/1022725105.db2.gz NBOCOSHABANWAU-JTQLQIEISA-N 1 1 323.443 3.577 20 5 DHBDMO Cc1csc([C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000742376904 1022824496 /nfs/dbraw/zinc/82/44/96/1022824496.db2.gz DGHPHMXJQSDKPS-OAHLLOKOSA-N 1 1 317.414 3.909 20 5 DHBDMO CCOc1cc(C[N@H+]2CC[C@@H](c3ccco3)C2)ccc1[N+](=O)[O-] ZINC000617201097 1022889086 /nfs/dbraw/zinc/88/90/86/1022889086.db2.gz FJAYOZXIIDBFDP-CQSZACIVSA-N 1 1 316.357 3.576 20 5 DHBDMO CC(C)[C@@H](C)[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768270259 1022937092 /nfs/dbraw/zinc/93/70/92/1022937092.db2.gz XUAMTKHYXNGCMU-SNVBAGLBSA-N 1 1 315.211 3.834 20 5 DHBDMO CC(C)[C@@H](C)[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768270259 1022937097 /nfs/dbraw/zinc/93/70/97/1022937097.db2.gz XUAMTKHYXNGCMU-SNVBAGLBSA-N 1 1 315.211 3.834 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1cc([N+](=O)[O-])ccc1Cl ZINC001167752570 1023034068 /nfs/dbraw/zinc/03/40/68/1023034068.db2.gz WKGZMTWPDFPBJS-GFCCVEGCSA-N 1 1 311.813 3.925 20 5 DHBDMO C[C@H]1CCCC[N@H+]1CCCNc1cc2cc[nH]c2c([N+](=O)[O-])c1 ZINC001167753700 1023043715 /nfs/dbraw/zinc/04/37/15/1023043715.db2.gz PUSSGJRNVQDWJA-ZDUSSCGKSA-N 1 1 316.405 3.753 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@H]1C ZINC000770281773 1023290065 /nfs/dbraw/zinc/29/00/65/1023290065.db2.gz ADCYFHGBLUXXPR-ZJUUUORDSA-N 1 1 313.195 3.588 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccnc(F)c3)C2)cc1 ZINC000859324117 1033122147 /nfs/dbraw/zinc/12/21/47/1033122147.db2.gz INGWXCNKMZQTAG-OAHLLOKOSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1ccc(F)cc1 ZINC000108816131 1023590950 /nfs/dbraw/zinc/59/09/50/1023590950.db2.gz WJKKIRNSXDCKMP-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO CO[C@H](C)C[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C(C)C ZINC000538718785 1033147641 /nfs/dbraw/zinc/14/76/41/1033147641.db2.gz NMUURFNIMIRQGL-CQSZACIVSA-N 1 1 308.422 3.964 20 5 DHBDMO CCC(CC)[N@@H+](CCOC)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746666080 1023779706 /nfs/dbraw/zinc/77/97/06/1023779706.db2.gz INKWEBXTNRDRNY-UHFFFAOYSA-N 1 1 314.813 3.885 20 5 DHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000136891642 1023781921 /nfs/dbraw/zinc/78/19/21/1023781921.db2.gz QSYQACRTTJGJDV-CABCVRRESA-N 1 1 318.398 3.527 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000787327930 1023788250 /nfs/dbraw/zinc/78/82/50/1023788250.db2.gz PPLFMXKQCLNPQX-LBPRGKRZSA-N 1 1 320.286 3.897 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000787327930 1023788254 /nfs/dbraw/zinc/78/82/54/1023788254.db2.gz PPLFMXKQCLNPQX-LBPRGKRZSA-N 1 1 320.286 3.897 20 5 DHBDMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)[C@H](C)C(C)C ZINC000112658110 1023815314 /nfs/dbraw/zinc/81/53/14/1023815314.db2.gz QGNPTAGYSZOWLO-CQSZACIVSA-N 1 1 321.421 3.598 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1c(C)noc1C ZINC000788023401 1023846511 /nfs/dbraw/zinc/84/65/11/1023846511.db2.gz LLTYICNJAQKCRW-ZDUSSCGKSA-N 1 1 307.325 3.580 20 5 DHBDMO CC[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000181828973 1023869410 /nfs/dbraw/zinc/86/94/10/1023869410.db2.gz QSCIUGCOWDDZOU-INIZCTEOSA-N 1 1 318.348 3.983 20 5 DHBDMO C[N@H+](Cc1ccc(F)c(F)c1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788473905 1023891670 /nfs/dbraw/zinc/89/16/70/1023891670.db2.gz BWGZVLUDAKFSAR-UHFFFAOYSA-N 1 1 310.275 3.644 20 5 DHBDMO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788473905 1023891675 /nfs/dbraw/zinc/89/16/75/1023891675.db2.gz BWGZVLUDAKFSAR-UHFFFAOYSA-N 1 1 310.275 3.644 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cc1F ZINC000788480115 1023892087 /nfs/dbraw/zinc/89/20/87/1023892087.db2.gz HYAHATRIJXIZLI-HNNXBMFYSA-N 1 1 322.380 3.658 20 5 DHBDMO COc1ccc(C[N@@H+](Cc2cccs2)C2CC2)cc1[N+](=O)[O-] ZINC000051408283 1023995934 /nfs/dbraw/zinc/99/59/34/1023995934.db2.gz QEPMLELTUGUFGL-UHFFFAOYSA-N 1 1 318.398 3.830 20 5 DHBDMO CCCc1[nH+]ccn1Cc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000270153923 1024358080 /nfs/dbraw/zinc/35/80/80/1024358080.db2.gz RVMVMFBOMVRIPS-UHFFFAOYSA-N 1 1 313.279 3.811 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cc(O)ccc1Cl ZINC000883327382 1024379741 /nfs/dbraw/zinc/37/97/41/1024379741.db2.gz XNENODQDUDEOPT-OAHLLOKOSA-N 1 1 318.760 3.731 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+][C@H]2c3ccccc3CC[C@H]2F)c1 ZINC000883384039 1024417238 /nfs/dbraw/zinc/41/72/38/1024417238.db2.gz KOTRLPWNSLZHHS-SJORKVTESA-N 1 1 300.333 3.710 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCCOc2ccc(F)cc21 ZINC000101595486 1024515689 /nfs/dbraw/zinc/51/56/89/1024515689.db2.gz ODQZXNIJEAWBHP-HNNXBMFYSA-N 1 1 316.332 3.737 20 5 DHBDMO CCC[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cccc([N+](=O)[O-])c1 ZINC000271495786 1024522724 /nfs/dbraw/zinc/52/27/24/1024522724.db2.gz LGHFNZRYCOMOBU-HOTGVXAUSA-N 1 1 314.389 3.826 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](CC(C)C)[NH+](C)C ZINC000532202584 1024575970 /nfs/dbraw/zinc/57/59/70/1024575970.db2.gz XHFZFRTXRXKGFH-ZBFHGGJFSA-N 1 1 307.438 3.530 20 5 DHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)(C)c1ccccc1 ZINC000585754560 1024597249 /nfs/dbraw/zinc/59/72/49/1024597249.db2.gz QZYUKFGUSVWUOR-UHFFFAOYSA-N 1 1 324.384 3.838 20 5 DHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000747075593 1024672780 /nfs/dbraw/zinc/67/27/80/1024672780.db2.gz DVTUXYSTVOBHKG-HNNXBMFYSA-N 1 1 316.405 3.803 20 5 DHBDMO Cc1nn(C[N@H+]2CCC[C@@H]2CC2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000747075999 1024673561 /nfs/dbraw/zinc/67/35/61/1024673561.db2.gz HFUSHADEIPPNEI-MRXNPFEDSA-N 1 1 320.437 3.800 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@]2(C)CCCO)cc1[N+](=O)[O-] ZINC000349157606 1024683544 /nfs/dbraw/zinc/68/35/44/1024683544.db2.gz ZCKJJPXAPAKEGU-GOSISDBHSA-N 1 1 320.433 3.845 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2cccs2)c([N+](=O)[O-])c1 ZINC001170345768 1024757595 /nfs/dbraw/zinc/75/75/95/1024757595.db2.gz LOVSAVQHHGNPFL-GFCCVEGCSA-N 1 1 320.414 3.728 20 5 DHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)C12CCC2 ZINC000349959756 1024772872 /nfs/dbraw/zinc/77/28/72/1024772872.db2.gz DMTSALHYHWJQHS-IRXDYDNUSA-N 1 1 318.417 3.683 20 5 DHBDMO CC[C@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728895902 1024782505 /nfs/dbraw/zinc/78/25/05/1024782505.db2.gz DEBDONZSPJQAFX-AWEZNQCLSA-N 1 1 314.389 3.538 20 5 DHBDMO COCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(C)o1 ZINC000350340388 1024804581 /nfs/dbraw/zinc/80/45/81/1024804581.db2.gz DHIAVOLBMAQOTF-HNNXBMFYSA-N 1 1 322.336 3.503 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C ZINC000792880779 1024824525 /nfs/dbraw/zinc/82/45/25/1024824525.db2.gz VLYJHAJWVWROAW-DOMZBBRYSA-N 1 1 321.377 3.904 20 5 DHBDMO CC[C@@H](NC[C@H](C(C)C)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000319960203 1024912803 /nfs/dbraw/zinc/91/28/03/1024912803.db2.gz HEIBWRQENOMSPF-QZTJIDSGSA-N 1 1 319.449 3.756 20 5 DHBDMO CC[C@H](NC[C@H](C(C)C)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000319960220 1024914372 /nfs/dbraw/zinc/91/43/72/1024914372.db2.gz HEIBWRQENOMSPF-ZWKOTPCHSA-N 1 1 319.449 3.756 20 5 DHBDMO Cc1cc(Cl)nc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000282041237 1024981110 /nfs/dbraw/zinc/98/11/10/1024981110.db2.gz OUXAKUQKEOJVGB-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000793338186 1024998762 /nfs/dbraw/zinc/99/87/62/1024998762.db2.gz CYVFNUKEISMOCN-OAHLLOKOSA-N 1 1 312.797 3.639 20 5 DHBDMO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)CO2 ZINC000539058195 1033260060 /nfs/dbraw/zinc/26/00/60/1033260060.db2.gz HUJRHISOGLLIDT-CXAGYDPISA-N 1 1 312.369 3.996 20 5 DHBDMO Cc1cccc(C[N@@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)c1C ZINC000793572079 1025126972 /nfs/dbraw/zinc/12/69/72/1025126972.db2.gz RZSAVANWNCUBNX-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO CC[C@@H]1CCC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000353703790 1025206248 /nfs/dbraw/zinc/20/62/48/1025206248.db2.gz AWFQEDRGVYRWRM-CYBMUJFWSA-N 1 1 322.405 3.624 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(C)cc1Cl ZINC000572369488 1025220211 /nfs/dbraw/zinc/22/02/11/1025220211.db2.gz HXDCSDUNEWKYKT-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO Cc1ccc(C2=CC[N@H+](Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC000885933236 1025409620 /nfs/dbraw/zinc/40/96/20/1025409620.db2.gz OKBCTGWUNJLOPJ-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO Cc1ccc(C2=CC[N@@H+](Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC000885933236 1025409626 /nfs/dbraw/zinc/40/96/26/1025409626.db2.gz OKBCTGWUNJLOPJ-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000886020647 1025442751 /nfs/dbraw/zinc/44/27/51/1025442751.db2.gz FIIZWAPMVLHYGW-WMLDXEAASA-N 1 1 311.385 3.615 20 5 DHBDMO CCC[N@H+](Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136809404 1025487043 /nfs/dbraw/zinc/48/70/43/1025487043.db2.gz CKDHVVRWQKBAMB-SFHVURJKSA-N 1 1 314.385 3.540 20 5 DHBDMO CC(C)[N@H+](Cc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136897220 1025491660 /nfs/dbraw/zinc/49/16/60/1025491660.db2.gz QTDYVAABKMXGEQ-GOSISDBHSA-N 1 1 314.385 3.539 20 5 DHBDMO CC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000886147385 1025530000 /nfs/dbraw/zinc/53/00/00/1025530000.db2.gz RIICUQCLRQTDNW-LBPRGKRZSA-N 1 1 305.403 3.504 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000886201999 1025557684 /nfs/dbraw/zinc/55/76/84/1025557684.db2.gz YVCRVUBAOWDSLP-KZNAEPCWSA-N 1 1 323.396 3.758 20 5 DHBDMO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805840049 1025681666 /nfs/dbraw/zinc/68/16/66/1025681666.db2.gz WIRFSFKJFBBARA-UNEWFSDZSA-N 1 1 320.433 3.775 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@H]1CCc2c1cccc2F ZINC000886921816 1025980337 /nfs/dbraw/zinc/98/03/37/1025980337.db2.gz DQQRMMQPESYQAH-HNNXBMFYSA-N 1 1 304.296 3.650 20 5 DHBDMO COCC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000356785491 1026168872 /nfs/dbraw/zinc/16/88/72/1026168872.db2.gz NQZPOHZMFCYGBR-SWLSCSKDSA-N 1 1 304.346 3.616 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC(C)(C)[C@H]1[C@H]1CCCO1 ZINC000289853366 1026201029 /nfs/dbraw/zinc/20/10/29/1026201029.db2.gz QKURNTJARZUOOC-DAXOMENPSA-N 1 1 304.390 3.545 20 5 DHBDMO C[C@@H]1[C@H](C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1C ZINC000419367605 1026272639 /nfs/dbraw/zinc/27/26/39/1026272639.db2.gz DHIBKNAFUPOZDT-UPJWGTAASA-N 1 1 315.373 3.726 20 5 DHBDMO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809787989 1026625614 /nfs/dbraw/zinc/62/56/14/1026625614.db2.gz LBQKSVXNAQXZMQ-QLJPJBMISA-N 1 1 318.760 3.860 20 5 DHBDMO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809787861 1026625972 /nfs/dbraw/zinc/62/59/72/1026625972.db2.gz LBQKSVXNAQXZMQ-MGPLVRAMSA-N 1 1 318.760 3.860 20 5 DHBDMO COc1ccc(Cl)cc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000016422630 1026999315 /nfs/dbraw/zinc/99/93/15/1026999315.db2.gz VRXSXRKVSDQDML-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000016422630 1026999319 /nfs/dbraw/zinc/99/93/19/1026999319.db2.gz VRXSXRKVSDQDML-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC4CCC3CC4)co2)cc1 ZINC000362341978 1027156741 /nfs/dbraw/zinc/15/67/41/1027156741.db2.gz PELSRIFGOMSMAO-UHFFFAOYSA-N 1 1 313.357 3.624 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC=C(c2ccccn2)C1 ZINC000571962472 1027160175 /nfs/dbraw/zinc/16/01/75/1027160175.db2.gz MMYFBYLQJFSPFD-CQSZACIVSA-N 1 1 309.369 3.840 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812850526 1027446523 /nfs/dbraw/zinc/44/65/23/1027446523.db2.gz UTBAIRUGXXAXPI-RDTXWAMCSA-N 1 1 314.385 3.539 20 5 DHBDMO CCc1ccccc1[C@@H](N)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000423499261 1027564359 /nfs/dbraw/zinc/56/43/59/1027564359.db2.gz JGIZQHMPOFXOJZ-ACJLOTCBSA-N 1 1 313.401 3.508 20 5 DHBDMO CCC[C@H]([NH2+][C@@H](CN)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000423533885 1027577127 /nfs/dbraw/zinc/57/71/27/1027577127.db2.gz UNPSDNPEBIVCLN-IRXDYDNUSA-N 1 1 305.422 3.543 20 5 DHBDMO C[C@]1(Cc2cccs2)CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000932921977 1027651063 /nfs/dbraw/zinc/65/10/63/1027651063.db2.gz JQEZVUXATUPUQB-MRXNPFEDSA-N 1 1 317.414 3.649 20 5 DHBDMO Cc1cc(C)c([N+](=O)[O-])c(OCc2c(C)cc(C)[nH+]c2C)n1 ZINC000601080013 1027973566 /nfs/dbraw/zinc/97/35/66/1027973566.db2.gz KTPKKXGZGXLZSM-UHFFFAOYSA-N 1 1 301.346 3.506 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC(C(F)F)CC3)c2c1 ZINC000601129797 1027996164 /nfs/dbraw/zinc/99/61/64/1027996164.db2.gz BKKKYDXIFMNUPJ-UHFFFAOYSA-N 1 1 307.300 3.625 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000368612169 1028385534 /nfs/dbraw/zinc/38/55/34/1028385534.db2.gz IFNQOFQYZLIGGG-ZBFHGGJFSA-N 1 1 311.385 3.615 20 5 DHBDMO CC(C)[NH+](CCCN[C@@H](C)Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000449190823 1028430096 /nfs/dbraw/zinc/43/00/96/1028430096.db2.gz WRMCBWHQPRUXPP-INIZCTEOSA-N 1 1 321.465 3.624 20 5 DHBDMO COc1cc(C)ccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000449251897 1028475450 /nfs/dbraw/zinc/47/54/50/1028475450.db2.gz REXZRGAPECOREM-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO Cc1ccnc([C@H]2CC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)c1 ZINC000564582357 1028479457 /nfs/dbraw/zinc/47/94/57/1028479457.db2.gz CCPPDSMJDDGQQH-GJZGRUSLSA-N 1 1 311.385 3.849 20 5 DHBDMO C[C@@H]1CCCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000187961782 1028488304 /nfs/dbraw/zinc/48/83/04/1028488304.db2.gz VUNDXRQOUZSHHU-CYBMUJFWSA-N 1 1 315.373 3.872 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCOC2(CCCCC2)C1 ZINC000075832745 1028538529 /nfs/dbraw/zinc/53/85/29/1028538529.db2.gz VPAXEUYLYKBEDE-AWEZNQCLSA-N 1 1 304.390 3.691 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCOC2(CCCCC2)C1 ZINC000075832745 1028538545 /nfs/dbraw/zinc/53/85/45/1028538545.db2.gz VPAXEUYLYKBEDE-AWEZNQCLSA-N 1 1 304.390 3.691 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000010087123 1028555047 /nfs/dbraw/zinc/55/50/47/1028555047.db2.gz DVLFELKAXKUBPD-QGZVFWFLSA-N 1 1 312.369 3.941 20 5 DHBDMO CS[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449444500 1028643117 /nfs/dbraw/zinc/64/31/17/1028643117.db2.gz AZHSOLGHTYPVCG-OAHLLOKOSA-N 1 1 318.398 3.792 20 5 DHBDMO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000449458872 1028661497 /nfs/dbraw/zinc/66/14/97/1028661497.db2.gz JIRJHFSIADFWBU-GXSJLCMTSA-N 1 1 320.286 3.897 20 5 DHBDMO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000449458872 1028661501 /nfs/dbraw/zinc/66/15/01/1028661501.db2.gz JIRJHFSIADFWBU-GXSJLCMTSA-N 1 1 320.286 3.897 20 5 DHBDMO Cc1ncc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449496008 1028710910 /nfs/dbraw/zinc/71/09/10/1028710910.db2.gz FTHIYXHXDUZBLP-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000817280658 1029110414 /nfs/dbraw/zinc/11/04/14/1029110414.db2.gz CDELQCRWHWTIDF-SNVBAGLBSA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000817280658 1029110420 /nfs/dbraw/zinc/11/04/20/1029110420.db2.gz CDELQCRWHWTIDF-SNVBAGLBSA-N 1 1 320.286 3.898 20 5 DHBDMO CCCC[C@H](C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000568743053 1029120486 /nfs/dbraw/zinc/12/04/86/1029120486.db2.gz OVXOMGIENSGHMS-AWEZNQCLSA-N 1 1 321.421 3.742 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CC[C@H]3CCCCO3)C2)cc1 ZINC000451543120 1029906724 /nfs/dbraw/zinc/90/67/24/1029906724.db2.gz AWXCCVSRQMNJQW-SJLPKXTDSA-N 1 1 318.417 3.733 20 5 DHBDMO CCC(=O)CCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550484 1029911918 /nfs/dbraw/zinc/91/19/18/1029911918.db2.gz RXOWRMXIERCNQW-OAHLLOKOSA-N 1 1 304.390 3.534 20 5 DHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)C12CCC2 ZINC000357793184 1030192024 /nfs/dbraw/zinc/19/20/24/1030192024.db2.gz GRJAFCZXXGBMFT-DLBZAZTESA-N 1 1 318.417 3.683 20 5 DHBDMO CCO[C@@H]1C[C@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C12CCC2 ZINC000357792872 1030193904 /nfs/dbraw/zinc/19/39/04/1030193904.db2.gz OJPYPDQCIMLTTA-JKSUJKDBSA-N 1 1 322.380 3.513 20 5 DHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C12CCC2 ZINC000357792872 1030193909 /nfs/dbraw/zinc/19/39/09/1030193909.db2.gz OJPYPDQCIMLTTA-JKSUJKDBSA-N 1 1 322.380 3.513 20 5 DHBDMO Cc1cc(CNc2ccc([N+](=O)[O-])cc2)cc(N2CCCC2)[nH+]1 ZINC000291082981 1030332871 /nfs/dbraw/zinc/33/28/71/1030332871.db2.gz IIVUVUADILQMEA-UHFFFAOYSA-N 1 1 312.373 3.511 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccnn1C1CCC1 ZINC000925692537 1030456316 /nfs/dbraw/zinc/45/63/16/1030456316.db2.gz MGHITRXAPBIGHB-STQMWFEESA-N 1 1 314.389 3.928 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)Nc1ccc(C(=O)CC)cc1[N+](=O)[O-] ZINC000558602705 1030676211 /nfs/dbraw/zinc/67/62/11/1030676211.db2.gz ZZBYNYWPHHWEMC-ZDUSSCGKSA-N 1 1 321.421 3.720 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000359559000 1031029671 /nfs/dbraw/zinc/02/96/71/1031029671.db2.gz OYNCHYPWQOEQOH-CXAGYDPISA-N 1 1 304.390 3.616 20 5 DHBDMO CC[N@@H+](CCCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000536678461 1031387716 /nfs/dbraw/zinc/38/77/16/1031387716.db2.gz BTBVVZBLBSVDLN-UHFFFAOYSA-N 1 1 320.414 3.528 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1F ZINC000872022332 1031405849 /nfs/dbraw/zinc/40/58/49/1031405849.db2.gz XLZHOWKBBYSMKB-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(F)n1 ZINC000872053868 1031442956 /nfs/dbraw/zinc/44/29/56/1031442956.db2.gz XRKJTIFAFRJIMM-SNVBAGLBSA-N 1 1 321.377 3.702 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1 ZINC000872260329 1031563746 /nfs/dbraw/zinc/56/37/46/1031563746.db2.gz MIXXLXARLOVYKY-KRWDZBQOSA-N 1 1 304.390 3.518 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2occc2C)cc1[N+](=O)[O-] ZINC000293756111 1031604127 /nfs/dbraw/zinc/60/41/27/1031604127.db2.gz RRKGXTRKQSSKDG-LBPRGKRZSA-N 1 1 304.346 3.746 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2c(F)cccc2[N+](=O)[O-])C1 ZINC000561133461 1031741103 /nfs/dbraw/zinc/74/11/03/1031741103.db2.gz PHUUZWAUXIILME-MJBXVCDLSA-N 1 1 321.396 3.576 20 5 DHBDMO COc1ccc(C)cc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000873183729 1031745275 /nfs/dbraw/zinc/74/52/75/1031745275.db2.gz DTQWLHQCDNSXTL-ZDUSSCGKSA-N 1 1 300.358 3.763 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H]3CCC[C@@H]3C1)CC2 ZINC001172907003 1033440313 /nfs/dbraw/zinc/44/03/13/1033440313.db2.gz ZLZCZNHTGWJVOB-ZTFGCOKTSA-N 1 1 314.429 3.964 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCCC[C@H](F)C1)CC2 ZINC001172907131 1033440726 /nfs/dbraw/zinc/44/07/26/1033440726.db2.gz DIJVDOPQBFAKEO-JKSUJKDBSA-N 1 1 306.381 3.666 20 5 DHBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908770 1033441070 /nfs/dbraw/zinc/44/10/70/1033441070.db2.gz NZDQDPOQTHRLKF-GOSISDBHSA-N 1 1 310.397 3.974 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@H](F)CC1)CC2 ZINC001172907094 1033441100 /nfs/dbraw/zinc/44/11/00/1033441100.db2.gz CVZOVIHBJDQWJZ-HOTGVXAUSA-N 1 1 306.381 3.666 20 5 DHBDMO C[C@@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H]1C ZINC001172917848 1033464353 /nfs/dbraw/zinc/46/43/53/1033464353.db2.gz XMKXZPZYBPNMLB-CPUCHLNUSA-N 1 1 302.418 3.963 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCCC[C@@H]2C)c1F ZINC001173190082 1033584275 /nfs/dbraw/zinc/58/42/75/1033584275.db2.gz QAZOKDWCAKDRLF-STQMWFEESA-N 1 1 324.396 3.938 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](CC2CC2)C2CC2)c1F ZINC001173193153 1033586619 /nfs/dbraw/zinc/58/66/19/1033586619.db2.gz QVHFOENJCJVIQH-NSHDSACASA-N 1 1 322.380 3.548 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@H]2C(C)C)c1F ZINC001173193144 1033587091 /nfs/dbraw/zinc/58/70/91/1033587091.db2.gz QRSPXWGLZCHHAT-OCCSQVGLSA-N 1 1 324.396 3.794 20 5 DHBDMO Cc1cc([C@H]2CCC[N@@H+]2[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)no1 ZINC001173229219 1033605222 /nfs/dbraw/zinc/60/52/22/1033605222.db2.gz RPZJNGSXEIUDDN-YVEFUNNKSA-N 1 1 315.373 3.659 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1F ZINC001173227230 1033605785 /nfs/dbraw/zinc/60/57/85/1033605785.db2.gz OQOCDWGBYDQYMG-ZDUSSCGKSA-N 1 1 302.349 3.797 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1ccncc1 ZINC001173228816 1033606426 /nfs/dbraw/zinc/60/64/26/1033606426.db2.gz ZACOQKQCJQDSLH-KSSFIOAISA-N 1 1 311.385 3.758 20 5 DHBDMO Cc1c(F)nccc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000862219373 1033784356 /nfs/dbraw/zinc/78/43/56/1033784356.db2.gz KSXZPHNINNOXOE-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cc1c(F)nccc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000862219373 1033784372 /nfs/dbraw/zinc/78/43/72/1033784372.db2.gz KSXZPHNINNOXOE-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CC(Cc3cccs3)C2)cc1Cl ZINC000862539264 1033880077 /nfs/dbraw/zinc/88/00/77/1033880077.db2.gz JZOBFPQXDHAFIR-UHFFFAOYSA-N 1 1 322.817 3.984 20 5 DHBDMO Cc1csc([C@@H]2CC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000880008871 1034180068 /nfs/dbraw/zinc/18/00/68/1034180068.db2.gz FEUVCIYZTSUUGC-QWHCGFSZSA-N 1 1 317.414 3.910 20 5 DHBDMO CC[C@H]([NH2+]Cc1cn2c(cccc2C)n1)c1cccc([N+](=O)[O-])c1 ZINC000178060489 1034205906 /nfs/dbraw/zinc/20/59/06/1034205906.db2.gz CDRUQMPJOVEAQU-KRWDZBQOSA-N 1 1 324.384 3.792 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880318356 1034294242 /nfs/dbraw/zinc/29/42/42/1034294242.db2.gz YCVSEPOFYWYQKR-NWDGAFQWSA-N 1 1 303.387 3.602 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880319662 1034295257 /nfs/dbraw/zinc/29/52/57/1034295257.db2.gz IFYUWWKOHPKTSL-STQMWFEESA-N 1 1 317.414 3.910 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880319660 1034296202 /nfs/dbraw/zinc/29/62/02/1034296202.db2.gz IFYUWWKOHPKTSL-QWHCGFSZSA-N 1 1 317.414 3.910 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H](c3ccccc3)C3CC3)nc2c1 ZINC000179695893 1034328940 /nfs/dbraw/zinc/32/89/40/1034328940.db2.gz XMKPISSLDRYNBR-GOSISDBHSA-N 1 1 323.352 3.977 20 5 DHBDMO CC[N@@H+](CC1CCC1)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000794682725 1034340971 /nfs/dbraw/zinc/34/09/71/1034340971.db2.gz JRZOOETVLHKZDP-UHFFFAOYSA-N 1 1 314.389 3.538 20 5 DHBDMO C[C@H](NCC(C)(C)[N@H+]1CCC[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000481028074 1034561581 /nfs/dbraw/zinc/56/15/81/1034561581.db2.gz XRUSFRYQSBPRCU-GJZGRUSLSA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@H]([NH2+]CC(C)(C)N1CCC[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000481028074 1034561592 /nfs/dbraw/zinc/56/15/92/1034561592.db2.gz XRUSFRYQSBPRCU-GJZGRUSLSA-N 1 1 319.449 3.756 20 5 DHBDMO Cc1c([C@H](C)N[C@H](C)C[N@@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000481183180 1034634861 /nfs/dbraw/zinc/63/48/61/1034634861.db2.gz QPBAFBTYTVQATP-FMKPAKJESA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1c([C@H](C)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000481183180 1034634869 /nfs/dbraw/zinc/63/48/69/1034634869.db2.gz QPBAFBTYTVQATP-FMKPAKJESA-N 1 1 319.449 3.674 20 5 DHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865460961 1034656514 /nfs/dbraw/zinc/65/65/14/1034656514.db2.gz SCVYTDDSGBMLFL-NSHDSACASA-N 1 1 313.348 3.676 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000481724206 1034951563 /nfs/dbraw/zinc/95/15/63/1034951563.db2.gz MFEDCRYDJBGETA-UHFFFAOYSA-N 1 1 324.380 3.521 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1cc[nH+]c1C1CC1 ZINC000600611858 1035008745 /nfs/dbraw/zinc/00/87/45/1035008745.db2.gz VOVJOMMPHJYQCB-UHFFFAOYSA-N 1 1 301.346 3.504 20 5 DHBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000159854001 1035097215 /nfs/dbraw/zinc/09/72/15/1035097215.db2.gz OPYQIFAEESEBQP-GOSISDBHSA-N 1 1 311.385 3.944 20 5 DHBDMO Cc1c(C[N@H+](CCc2nccs2)C(C)C)cccc1[N+](=O)[O-] ZINC000159863670 1035098825 /nfs/dbraw/zinc/09/88/25/1035098825.db2.gz XFCSUNJTRAMJAX-UHFFFAOYSA-N 1 1 319.430 3.813 20 5 DHBDMO Cc1[nH+]c2c(Nc3ccc(/C=C/[N+](=O)[O-])cc3)cccn2c1C ZINC001175903005 1035157580 /nfs/dbraw/zinc/15/75/80/1035157580.db2.gz VRTWAOMBRGQVMH-PKNBQFBNSA-N 1 1 308.341 3.942 20 5 DHBDMO CC[C@@H](C)C[N@@H+](CC)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000482870841 1035190503 /nfs/dbraw/zinc/19/05/03/1035190503.db2.gz QBNIMXCQCGCLMR-CYBMUJFWSA-N 1 1 321.421 3.600 20 5 DHBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC[N@H+]1C ZINC000484640039 1035378914 /nfs/dbraw/zinc/37/89/14/1035378914.db2.gz PSFBRWVDQKPAAU-GXTWGEPZSA-N 1 1 321.421 3.667 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cn2c(n1)CCCC2 ZINC000924798987 1035420103 /nfs/dbraw/zinc/42/01/03/1035420103.db2.gz QKTGQZNKVMXVGD-STQMWFEESA-N 1 1 314.389 3.539 20 5 DHBDMO COCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@@H]1CC=CCC1 ZINC000485101075 1035471833 /nfs/dbraw/zinc/47/18/33/1035471833.db2.gz BFPYRJXEBXIMAV-MRXNPFEDSA-N 1 1 318.417 3.708 20 5 DHBDMO C[N@H+](Cc1cc2ccncc2s1)Cc1ccccc1[N+](=O)[O-] ZINC001180012207 1035564227 /nfs/dbraw/zinc/56/42/27/1035564227.db2.gz XGTWEMOZZHZSLD-UHFFFAOYSA-N 1 1 313.382 3.837 20 5 DHBDMO C[N@@H+](Cc1cc2ccncc2s1)Cc1ccccc1[N+](=O)[O-] ZINC001180012207 1035564242 /nfs/dbraw/zinc/56/42/42/1035564242.db2.gz XGTWEMOZZHZSLD-UHFFFAOYSA-N 1 1 313.382 3.837 20 5 DHBDMO COc1cc(C[N@@H+]2CC[C@H](C)C(C)(C)C2)c([N+](=O)[O-])cc1F ZINC001193208173 1035585530 /nfs/dbraw/zinc/58/55/30/1035585530.db2.gz BRPVSRHYROUHIA-NSHDSACASA-N 1 1 310.369 3.611 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@H](C)C(C)(C)C2)c([N+](=O)[O-])cc1F ZINC001193208173 1035585539 /nfs/dbraw/zinc/58/55/39/1035585539.db2.gz BRPVSRHYROUHIA-NSHDSACASA-N 1 1 310.369 3.611 20 5 DHBDMO CO[C@@](C)(C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C)C1CC1 ZINC001180177945 1035604971 /nfs/dbraw/zinc/60/49/71/1035604971.db2.gz JFTLBZMEQNDAFM-KRWDZBQOSA-N 1 1 306.406 3.620 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089909528 1035794744 /nfs/dbraw/zinc/79/47/44/1035794744.db2.gz JUUXEONIOMPBTQ-TXEJJXNPSA-N 1 1 301.346 3.623 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)C2 ZINC000539829625 1035884437 /nfs/dbraw/zinc/88/44/37/1035884437.db2.gz PUWYCCHLTAAPSH-FUHWJXTLSA-N 1 1 308.381 3.757 20 5 DHBDMO CO[C@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])C12CCC2 ZINC001194384233 1035917299 /nfs/dbraw/zinc/91/72/99/1035917299.db2.gz JTECZFDDJRODNC-GJZGRUSLSA-N 1 1 324.808 3.638 20 5 DHBDMO CC1(C)C[N@H+](Cc2cccc([N+](=O)[O-])c2)CC2(CCCC2)O1 ZINC000443345992 1036091181 /nfs/dbraw/zinc/09/11/81/1036091181.db2.gz LTXOAHHQXMPEHI-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO CC1(C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC2(CCCC2)O1 ZINC000443345992 1036091196 /nfs/dbraw/zinc/09/11/96/1036091196.db2.gz LTXOAHHQXMPEHI-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000540910988 1036185598 /nfs/dbraw/zinc/18/55/98/1036185598.db2.gz XNGZJPOUMLSSNZ-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC001196254882 1036482864 /nfs/dbraw/zinc/48/28/64/1036482864.db2.gz PIYQUJVLVDQSDD-CQSZACIVSA-N 1 1 304.390 3.616 20 5 DHBDMO C[N@@H+](CC1CCCC1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774626829 1036595855 /nfs/dbraw/zinc/59/58/55/1036595855.db2.gz JVKTWDIJIJNNRI-UHFFFAOYSA-N 1 1 322.796 3.677 20 5 DHBDMO CC[C@H](CSC)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492259924 1036801247 /nfs/dbraw/zinc/80/12/47/1036801247.db2.gz QQFKRQGRGGIQGP-SNVBAGLBSA-N 1 1 302.827 3.822 20 5 DHBDMO CC[C@H](CSC)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492259924 1036801270 /nfs/dbraw/zinc/80/12/70/1036801270.db2.gz QQFKRQGRGGIQGP-SNVBAGLBSA-N 1 1 302.827 3.822 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000492373685 1036852065 /nfs/dbraw/zinc/85/20/65/1036852065.db2.gz FROLFPOJGLLPRT-UHFFFAOYSA-N 1 1 314.385 3.934 20 5 DHBDMO CCOc1cc(C[N@@H+]([C@H](C)C2CC2)C2CC2)ccc1[N+](=O)[O-] ZINC000492372296 1036852365 /nfs/dbraw/zinc/85/23/65/1036852365.db2.gz BHAKTDWDCBXTHT-GFCCVEGCSA-N 1 1 304.390 3.756 20 5 DHBDMO CCOc1cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000492631540 1036951383 /nfs/dbraw/zinc/95/13/83/1036951383.db2.gz PYPXGZOSNCPYLH-GASCZTMLSA-N 1 1 304.390 3.616 20 5 DHBDMO Cc1ccc(NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001185158104 1037050214 /nfs/dbraw/zinc/05/02/14/1037050214.db2.gz MQHQEAAIUVZRTD-AWEZNQCLSA-N 1 1 305.422 3.826 20 5 DHBDMO C[C@H](CNc1cccc(C(F)(F)F)c1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC001185230302 1037071484 /nfs/dbraw/zinc/07/14/84/1037071484.db2.gz BRUPEIDDAKNEHV-SECBINFHSA-N 1 1 317.311 3.508 20 5 DHBDMO CCCC[N@@H+](C)CCNc1cccc(C(F)(F)F)c1[N+](=O)[O-] ZINC001185313832 1037104557 /nfs/dbraw/zinc/10/45/57/1037104557.db2.gz QCJKTUMLJUJUDU-UHFFFAOYSA-N 1 1 319.327 3.757 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000153741480 1037217505 /nfs/dbraw/zinc/21/75/05/1037217505.db2.gz OGVIVYYEYMFGSL-GJZGRUSLSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCN(C2CCCC2)C1 ZINC000153741480 1037217508 /nfs/dbraw/zinc/21/75/08/1037217508.db2.gz OGVIVYYEYMFGSL-GJZGRUSLSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000153741190 1037218715 /nfs/dbraw/zinc/21/87/15/1037218715.db2.gz OGVIVYYEYMFGSL-HUUCEWRRSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCN(C2CCCC2)C1 ZINC000153741190 1037218722 /nfs/dbraw/zinc/21/87/22/1037218722.db2.gz OGVIVYYEYMFGSL-HUUCEWRRSA-N 1 1 317.433 3.571 20 5 DHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c(Cl)c1 ZINC001186872264 1037509411 /nfs/dbraw/zinc/50/94/11/1037509411.db2.gz LQQSXBJBVNAUGU-CABCVRRESA-N 1 1 309.797 3.677 20 5 DHBDMO O=[N+]([O-])c1cccc2c(Nc3ccc4[nH+]ccn4c3)nccc21 ZINC001187116508 1037566440 /nfs/dbraw/zinc/56/64/40/1037566440.db2.gz HODVGCBGWDPHRO-UHFFFAOYSA-N 1 1 305.297 3.534 20 5 DHBDMO Cc1cc(F)ccc1C[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000488056791 1037598166 /nfs/dbraw/zinc/59/81/66/1037598166.db2.gz VBXMLUDEDAJBDJ-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1cccc2[nH]ccc21 ZINC000494014001 1037623176 /nfs/dbraw/zinc/62/31/76/1037623176.db2.gz BSMRAYKOXIZNQA-UHFFFAOYSA-N 1 1 301.371 3.770 20 5 DHBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1cccc2[nH]ccc21 ZINC000494014001 1037623195 /nfs/dbraw/zinc/62/31/95/1037623195.db2.gz BSMRAYKOXIZNQA-UHFFFAOYSA-N 1 1 301.371 3.770 20 5 DHBDMO Cc1[nH+]ccn1CCCCNc1ccc([N+](=O)[O-])cc1Cl ZINC000078335955 1037965780 /nfs/dbraw/zinc/96/57/80/1037965780.db2.gz JZHHEDDWZBWYLM-UHFFFAOYSA-N 1 1 308.769 3.645 20 5 DHBDMO CC[N@H+]1CCCC[C@H]1CNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000589113899 1038434325 /nfs/dbraw/zinc/43/43/25/1038434325.db2.gz SNEBBEIPGLYSME-LBPRGKRZSA-N 1 1 313.348 3.819 20 5 DHBDMO CC[C@H]1CCCCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589502096 1038488544 /nfs/dbraw/zinc/48/85/44/1038488544.db2.gz LWVYGEQTMWDFPE-HNNXBMFYSA-N 1 1 320.389 3.536 20 5 DHBDMO Cc1cc(C)nc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC001191682068 1038528191 /nfs/dbraw/zinc/52/81/91/1038528191.db2.gz LHOYEFATIAHQGY-UHFFFAOYSA-N 1 1 311.385 3.771 20 5 DHBDMO Cc1cc(C)nc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC001191682068 1038528197 /nfs/dbraw/zinc/52/81/97/1038528197.db2.gz LHOYEFATIAHQGY-UHFFFAOYSA-N 1 1 311.385 3.771 20 5 DHBDMO CC(C)CC[C@H]1CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001192159179 1038596850 /nfs/dbraw/zinc/59/68/50/1038596850.db2.gz OSHKFFNUGOASOZ-OAHLLOKOSA-N 1 1 306.406 3.874 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CC(C(F)F)C3)o2)c1 ZINC000590968777 1038733244 /nfs/dbraw/zinc/73/32/44/1038733244.db2.gz KILXAPDODYVNAV-UHFFFAOYSA-N 1 1 308.284 3.552 20 5 DHBDMO Cc1nn(C[N@@H+](C)Cc2cccc(C)c2)c2cc([N+](=O)[O-])ccc12 ZINC000761288042 1038862769 /nfs/dbraw/zinc/86/27/69/1038862769.db2.gz IMLRAVXKSSJHFJ-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1nn(C[N@H+](C)Cc2cccc(C)c2)c2cc([N+](=O)[O-])ccc12 ZINC000761288042 1038862800 /nfs/dbraw/zinc/86/28/00/1038862800.db2.gz IMLRAVXKSSJHFJ-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO C[C@H](NCC[N@@H+](C)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000157451253 1038981090 /nfs/dbraw/zinc/98/10/90/1038981090.db2.gz YCEYDOFNNLHWJY-AWEZNQCLSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@H]([NH2+]CCN(C)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000157451253 1038981106 /nfs/dbraw/zinc/98/11/06/1038981106.db2.gz YCEYDOFNNLHWJY-AWEZNQCLSA-N 1 1 305.422 3.510 20 5 DHBDMO CC(C)c1csc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000573576673 1038997452 /nfs/dbraw/zinc/99/74/52/1038997452.db2.gz MFQXTBGAAWLCDG-ZDUSSCGKSA-N 1 1 317.414 3.952 20 5 DHBDMO CC[C@H](C)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130657 1039123638 /nfs/dbraw/zinc/12/36/38/1039123638.db2.gz HPJHNYFFSDGBPR-XIRDDKMYSA-N 1 1 320.433 3.746 20 5 DHBDMO C[N@@H+](CCC(C)(C)C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000592144206 1039137374 /nfs/dbraw/zinc/13/73/74/1039137374.db2.gz DATLUTBIGIXSRI-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO COc1ccccc1C1([NH2+]Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000592143062 1039137685 /nfs/dbraw/zinc/13/76/85/1039137685.db2.gz JZCBHRPLMMQGDT-UHFFFAOYSA-N 1 1 312.369 3.691 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000592193767 1039183596 /nfs/dbraw/zinc/18/35/96/1039183596.db2.gz NDLAOFYQAUATIN-ZIAGYGMSSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000592193767 1039183610 /nfs/dbraw/zinc/18/36/10/1039183610.db2.gz NDLAOFYQAUATIN-ZIAGYGMSSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@@H]1C[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](C)C1(F)F ZINC000599511913 1039184620 /nfs/dbraw/zinc/18/46/20/1039184620.db2.gz CXAMJPMMNMOXBG-NXEZZACHSA-N 1 1 318.751 3.971 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000603850880 1039186301 /nfs/dbraw/zinc/18/63/01/1039186301.db2.gz HIYDPYGJKWRZIY-KRWDZBQOSA-N 1 1 314.360 3.941 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(F)c2)C2CC2)cc1 ZINC000603859186 1039192041 /nfs/dbraw/zinc/19/20/41/1039192041.db2.gz LIKOXYCBCVDHFW-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@H]1C ZINC000573985073 1039192472 /nfs/dbraw/zinc/19/24/72/1039192472.db2.gz MPOFCJAKOXCHFV-UWVGGRQHSA-N 1 1 302.296 3.844 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553669 1039212651 /nfs/dbraw/zinc/21/26/51/1039212651.db2.gz YILPDCURSZKIRI-CFVMTHIKSA-N 1 1 306.431 3.934 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000604016862 1039285345 /nfs/dbraw/zinc/28/53/45/1039285345.db2.gz JMKYPXBCHRXPRI-KRWDZBQOSA-N 1 1 314.360 3.941 20 5 DHBDMO C[C@H](CNc1ccsc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000604432635 1039474320 /nfs/dbraw/zinc/47/43/20/1039474320.db2.gz GZDXGCVQRRJVOL-SNVBAGLBSA-N 1 1 323.443 3.577 20 5 DHBDMO C[C@H](CNc1ccsc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000604432635 1039474330 /nfs/dbraw/zinc/47/43/30/1039474330.db2.gz GZDXGCVQRRJVOL-SNVBAGLBSA-N 1 1 323.443 3.577 20 5 DHBDMO CCOc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000061758887 1039546667 /nfs/dbraw/zinc/54/66/67/1039546667.db2.gz OPSMSRLUCDEWSH-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000061758887 1039546674 /nfs/dbraw/zinc/54/66/74/1039546674.db2.gz OPSMSRLUCDEWSH-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594026292 1039951059 /nfs/dbraw/zinc/95/10/59/1039951059.db2.gz IJASOMHFLJLWRP-HIFRSBDPSA-N 1 1 304.390 3.689 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(F)c(F)c1 ZINC000595007561 1040017424 /nfs/dbraw/zinc/01/74/24/1040017424.db2.gz MFBGKBFHHVGKMA-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO Cc1noc(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000595350340 1040112520 /nfs/dbraw/zinc/11/25/20/1040112520.db2.gz AEKIIYYGIYYLMB-AWEZNQCLSA-N 1 1 307.325 3.517 20 5 DHBDMO Cc1noc(C[NH2+]C2(c3cccc(C)c3)CCCC2)c1[N+](=O)[O-] ZINC000595364356 1040126343 /nfs/dbraw/zinc/12/63/43/1040126343.db2.gz OBIPQAGWRWAWDG-UHFFFAOYSA-N 1 1 315.373 3.759 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](c2ccccc2)C2CCCC2)c1[N+](=O)[O-] ZINC000595375734 1040126828 /nfs/dbraw/zinc/12/68/28/1040126828.db2.gz VIMQYRXHZIVAJV-INIZCTEOSA-N 1 1 315.373 3.912 20 5 DHBDMO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595374896 1040128020 /nfs/dbraw/zinc/12/80/20/1040128020.db2.gz GGCAAGAWPMCSHF-NSHDSACASA-N 1 1 304.321 3.633 20 5 DHBDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595374896 1040128031 /nfs/dbraw/zinc/12/80/31/1040128031.db2.gz GGCAAGAWPMCSHF-NSHDSACASA-N 1 1 304.321 3.633 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000595417516 1040133942 /nfs/dbraw/zinc/13/39/42/1040133942.db2.gz IHUMEJWGBZANDX-UHFFFAOYSA-N 1 1 304.296 3.652 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000595467724 1040147341 /nfs/dbraw/zinc/14/73/41/1040147341.db2.gz VPXXIWUFGIQFPS-VIFPVBQESA-N 1 1 306.259 3.508 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000595467724 1040147349 /nfs/dbraw/zinc/14/73/49/1040147349.db2.gz VPXXIWUFGIQFPS-VIFPVBQESA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595469127 1040148089 /nfs/dbraw/zinc/14/80/89/1040148089.db2.gz MUPZTFFMMGGRFX-LDYMZIIASA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595469127 1040148093 /nfs/dbraw/zinc/14/80/93/1040148093.db2.gz MUPZTFFMMGGRFX-LDYMZIIASA-N 1 1 306.259 3.507 20 5 DHBDMO Cc1noc(C[N@@H+]2Cc3cccc(C)c3CC2(C)C)c1[N+](=O)[O-] ZINC000595535402 1040150314 /nfs/dbraw/zinc/15/03/14/1040150314.db2.gz ZIMIYIRGKLXHKT-UHFFFAOYSA-N 1 1 315.373 3.537 20 5 DHBDMO Cc1noc(C[N@H+]2Cc3cccc(C)c3CC2(C)C)c1[N+](=O)[O-] ZINC000595535402 1040150325 /nfs/dbraw/zinc/15/03/25/1040150325.db2.gz ZIMIYIRGKLXHKT-UHFFFAOYSA-N 1 1 315.373 3.537 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000595501325 1040155118 /nfs/dbraw/zinc/15/51/18/1040155118.db2.gz OEQGFJZHGBBEMT-CYBMUJFWSA-N 1 1 315.348 3.509 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000595501325 1040155128 /nfs/dbraw/zinc/15/51/28/1040155128.db2.gz OEQGFJZHGBBEMT-CYBMUJFWSA-N 1 1 315.348 3.509 20 5 DHBDMO Cc1noc(C[N@H+]2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000595507087 1040155763 /nfs/dbraw/zinc/15/57/63/1040155763.db2.gz JVWOEXZJMKVCGG-UXIGCNINSA-N 1 1 315.373 3.658 20 5 DHBDMO Cc1noc(C[N@H+](C)[C@@H]2CCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595539400 1040168871 /nfs/dbraw/zinc/16/88/71/1040168871.db2.gz LZIPYNLLYARWIT-HUUCEWRRSA-N 1 1 315.373 3.659 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(c2ccco2)CC1 ZINC000595614808 1040206635 /nfs/dbraw/zinc/20/66/35/1040206635.db2.gz INJKUHJRZXYVGY-UHFFFAOYSA-N 1 1 316.357 3.576 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC000595822343 1040249732 /nfs/dbraw/zinc/24/97/32/1040249732.db2.gz RHRSJCYPFCVXPU-CYBMUJFWSA-N 1 1 316.401 3.547 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC000595822343 1040249739 /nfs/dbraw/zinc/24/97/39/1040249739.db2.gz RHRSJCYPFCVXPU-CYBMUJFWSA-N 1 1 316.401 3.547 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)cccc1[N+](=O)[O-] ZINC000595790437 1040259219 /nfs/dbraw/zinc/25/92/19/1040259219.db2.gz QJAVGOUCLIMJCQ-AEFFLSMTSA-N 1 1 318.417 3.684 20 5 DHBDMO COc1cc(C[N@H+]2CC3CC2(c2ccccc2)C3)ccc1[N+](=O)[O-] ZINC000595908066 1040273272 /nfs/dbraw/zinc/27/32/72/1040273272.db2.gz MLWOUEFDHWHFDR-UHFFFAOYSA-N 1 1 324.380 3.725 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](CCC3CC3)CC3CC3)nc2c1 ZINC000595870404 1040275968 /nfs/dbraw/zinc/27/59/68/1040275968.db2.gz BNWLCQXBAPHUBV-UHFFFAOYSA-N 1 1 315.373 3.748 20 5 DHBDMO Cc1nn(C[C@@H]2CCCC[N@@H+]2C(C)C)c2ccc([N+](=O)[O-])cc12 ZINC000596266728 1040349852 /nfs/dbraw/zinc/34/98/52/1040349852.db2.gz UWXQEKHZXJKLAL-HNNXBMFYSA-N 1 1 316.405 3.516 20 5 DHBDMO CC(C)[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000063738989 1040474980 /nfs/dbraw/zinc/47/49/80/1040474980.db2.gz OQCPOJDYKMLYFM-GFCCVEGCSA-N 1 1 311.813 3.781 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCSCC[C@H]1C ZINC000429773946 1040959545 /nfs/dbraw/zinc/95/95/45/1040959545.db2.gz RRZQZRVATRCTJN-CYBMUJFWSA-N 1 1 324.446 3.709 20 5 DHBDMO C[C@H](NCCC[N@H+]1CCCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000122128822 1040983055 /nfs/dbraw/zinc/98/30/55/1040983055.db2.gz BYCBXEDJYIXQOZ-CABCVRRESA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H]3CCCc4ccccc43)nc2c1 ZINC000602504285 1041070715 /nfs/dbraw/zinc/07/07/15/1041070715.db2.gz OQEPBOHDFXLJMM-HNNXBMFYSA-N 1 1 323.352 3.903 20 5 DHBDMO C[C@H]1Cc2ccccc2[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602540584 1041084779 /nfs/dbraw/zinc/08/47/79/1041084779.db2.gz QRIRRWNYXABGNL-VOJFVSQTSA-N 1 1 323.352 3.759 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(C(F)F)nc1 ZINC000602649136 1041132396 /nfs/dbraw/zinc/13/23/96/1041132396.db2.gz HLWLHJQZQQYQSK-UHFFFAOYSA-N 1 1 321.327 3.602 20 5 DHBDMO CC[C@H](c1ccccc1)[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])C(C)C ZINC000602903826 1041301839 /nfs/dbraw/zinc/30/18/39/1041301839.db2.gz STLLNYYLJYHNHB-MRXNPFEDSA-N 1 1 316.405 3.690 20 5 DHBDMO CCCO[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000093316821 193229741 /nfs/dbraw/zinc/22/97/41/193229741.db2.gz VJOCPNJQWAXQGF-ZGRWHYIRSA-N 1 1 318.417 3.889 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)N[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353480651 131109726 /nfs/dbraw/zinc/10/97/26/131109726.db2.gz CGWRCWGYHYDUQA-WMLDXEAASA-N 1 1 307.438 3.756 20 5 DHBDMO CCCN(CC)C[C@H](C)[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353480651 131109728 /nfs/dbraw/zinc/10/97/28/131109728.db2.gz CGWRCWGYHYDUQA-WMLDXEAASA-N 1 1 307.438 3.756 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCC(F)(F)CC1 ZINC000286731836 131247924 /nfs/dbraw/zinc/24/79/24/131247924.db2.gz HFFIFVKXOGXYPZ-UHFFFAOYSA-N 1 1 302.296 3.744 20 5 DHBDMO C[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCC(F)(F)CC1 ZINC000287067793 131262384 /nfs/dbraw/zinc/26/23/84/131262384.db2.gz VKPVRTXDRKERQV-UHFFFAOYSA-N 1 1 320.286 3.883 20 5 DHBDMO C[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCC(F)(F)CC1 ZINC000287067793 131262385 /nfs/dbraw/zinc/26/23/85/131262385.db2.gz VKPVRTXDRKERQV-UHFFFAOYSA-N 1 1 320.286 3.883 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2ccncc2)C1 ZINC000289288954 131370762 /nfs/dbraw/zinc/37/07/62/131370762.db2.gz HABAVYMTCUJVFY-PBHICJAKSA-N 1 1 311.385 3.930 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2ccncc2)C1 ZINC000289288957 131370943 /nfs/dbraw/zinc/37/09/43/131370943.db2.gz HABAVYMTCUJVFY-RHSMWYFYSA-N 1 1 311.385 3.930 20 5 DHBDMO CCOC1(C)CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000298449249 132063443 /nfs/dbraw/zinc/06/34/43/132063443.db2.gz ZOVKPPBTIGRHEZ-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000092757726 332164850 /nfs/dbraw/zinc/16/48/50/332164850.db2.gz NLWRKZBQAGOLPL-IWHGQQBYSA-N 1 1 323.396 3.794 20 5 DHBDMO CC(C)CSCCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000559503217 332267342 /nfs/dbraw/zinc/26/73/42/332267342.db2.gz JLCBITWOPORJMA-UHFFFAOYSA-N 1 1 308.447 3.732 20 5 DHBDMO CCC(CC)[C@@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)N(C)C ZINC000314289404 333098696 /nfs/dbraw/zinc/09/86/96/333098696.db2.gz XIISTHCKZGQOQZ-SUMWQHHRSA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@@H]([NH2+]CC1(N(C)C)CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000314358236 333105046 /nfs/dbraw/zinc/10/50/46/333105046.db2.gz WBYRZRBOXXNOCO-CQSZACIVSA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@@H](NC[C@H](C)C[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000320696580 335125139 /nfs/dbraw/zinc/12/51/39/335125139.db2.gz HQEXLKSPZFEIJK-MAUKXSAKSA-N 1 1 319.449 3.758 20 5 DHBDMO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000571018715 333479687 /nfs/dbraw/zinc/47/96/87/333479687.db2.gz XLNDOROPRPLACI-OLZOCXBDSA-N 1 1 302.378 3.531 20 5 DHBDMO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cn1 ZINC000266767088 333975805 /nfs/dbraw/zinc/97/58/05/333975805.db2.gz IKOFYDZSJXCUGS-OLZOCXBDSA-N 1 1 302.378 3.784 20 5 DHBDMO CC(C)c1ccc([C@H](N)C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000414843138 334113088 /nfs/dbraw/zinc/11/30/88/334113088.db2.gz JLOXYGKLBFACGP-GOSISDBHSA-N 1 1 313.401 3.508 20 5 DHBDMO CC(C)c1ccc([C@@H](N)C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000414849515 334121804 /nfs/dbraw/zinc/12/18/04/334121804.db2.gz RKIPWUSFDQPNMZ-SFHVURJKSA-N 1 1 313.401 3.508 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nccn2CC(C)C)cc1[N+](=O)[O-] ZINC000164792318 334667370 /nfs/dbraw/zinc/66/73/70/334667370.db2.gz WBYPKXJQEYGHNU-CQSZACIVSA-N 1 1 316.405 3.607 20 5 DHBDMO CCc1nc(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)cs1 ZINC000468626150 335364397 /nfs/dbraw/zinc/36/43/97/335364397.db2.gz ZYMLSNOWOFRQAM-KPKJPENVSA-N 1 1 317.414 3.807 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1)c1nc(C)cs1 ZINC000347661706 335514271 /nfs/dbraw/zinc/51/42/71/335514271.db2.gz YXBVMRAHXUOXTE-GFCCVEGCSA-N 1 1 321.402 3.609 20 5 DHBDMO COCC[C@@H]1CCCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000332341290 336169217 /nfs/dbraw/zinc/16/92/17/336169217.db2.gz QWOFVUCYDRVDDJ-CABCVRRESA-N 1 1 306.406 3.794 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(C2CC2)cs1 ZINC000352539188 336223350 /nfs/dbraw/zinc/22/33/50/336223350.db2.gz VAEUAZRRMDUPPO-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(C2CC2)cs1 ZINC000352539188 336223351 /nfs/dbraw/zinc/22/33/51/336223351.db2.gz VAEUAZRRMDUPPO-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO COc1cc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000352539936 336223381 /nfs/dbraw/zinc/22/33/81/336223381.db2.gz FGAUWZCUUJYIQG-ZDUSSCGKSA-N 1 1 312.369 3.550 20 5 DHBDMO COc1cc(C[N@H+]2Cc3ccccc3C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000352539936 336223382 /nfs/dbraw/zinc/22/33/82/336223382.db2.gz FGAUWZCUUJYIQG-ZDUSSCGKSA-N 1 1 312.369 3.550 20 5 DHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C12CCC2 ZINC000352609043 336226726 /nfs/dbraw/zinc/22/67/26/336226726.db2.gz QNDMCYUZANMGQY-CVEARBPZSA-N 1 1 322.380 3.513 20 5 DHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000301606751 336317917 /nfs/dbraw/zinc/31/79/17/336317917.db2.gz NGNJIPKFPRFBRK-LBPRGKRZSA-N 1 1 311.813 3.638 20 5 DHBDMO Cc1[nH+]c2cc(Nc3c(F)cc([N+](=O)[O-])cc3F)ccc2n1C ZINC000301782714 336329531 /nfs/dbraw/zinc/32/95/31/336329531.db2.gz JZIDABWTLDWHAF-UHFFFAOYSA-N 1 1 318.283 3.812 20 5 DHBDMO Cc1cc(N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301970289 336340590 /nfs/dbraw/zinc/34/05/90/336340590.db2.gz DHPNWWIUAIUYNL-WMZOPIPTSA-N 1 1 311.385 3.761 20 5 DHBDMO C[C@@H](Nc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302049792 336345475 /nfs/dbraw/zinc/34/54/75/336345475.db2.gz NFFKEHMOOAXYHN-KGLIPLIRSA-N 1 1 303.406 3.660 20 5 DHBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302067077 336346602 /nfs/dbraw/zinc/34/66/02/336346602.db2.gz WNAAUNNKWOBGDD-OLZOCXBDSA-N 1 1 321.396 3.799 20 5 DHBDMO C[N@H+]1CC[C@@H](Nc2cccc(F)c2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000302797410 336369443 /nfs/dbraw/zinc/36/94/43/336369443.db2.gz ANMPALCOCWECLY-CVEARBPZSA-N 1 1 315.348 3.591 20 5 DHBDMO C[N@H+]1CC[C@@H](Nc2cccc(F)c2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000302797413 336369527 /nfs/dbraw/zinc/36/95/27/336369527.db2.gz ANMPALCOCWECLY-HZPDHXFCSA-N 1 1 315.348 3.591 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1CNc1cc(C2CC2)cc[nH+]1 ZINC000353059246 336391889 /nfs/dbraw/zinc/39/18/89/336391889.db2.gz GAMJCFMPWOBLGH-UHFFFAOYSA-N 1 1 313.357 3.878 20 5 DHBDMO CC[C@@H]([NH2+]Cc1nc(C)sc1C)c1cccc([N+](=O)[O-])c1 ZINC000358358342 336626007 /nfs/dbraw/zinc/62/60/07/336626007.db2.gz RTJRHKDUEDWRFC-CQSZACIVSA-N 1 1 305.403 3.909 20 5 DHBDMO C[C@H]([NH2+][C@H]1c2ccc(F)cc2O[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000368585163 336848629 /nfs/dbraw/zinc/84/86/29/336848629.db2.gz PMTHEHILDJTNRB-WVQJBOLRSA-N 1 1 316.332 3.907 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(Cc3cccnc3)CC2)cs1 ZINC000374504339 336990941 /nfs/dbraw/zinc/99/09/41/336990941.db2.gz MDDKSRKRXGGJIQ-UHFFFAOYSA-N 1 1 317.414 3.506 20 5 DHBDMO CCc1cc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)on1 ZINC000582655669 337121420 /nfs/dbraw/zinc/12/14/20/337121420.db2.gz XQBWKZJFBGDBPI-QGZVFWFLSA-N 1 1 315.373 3.703 20 5 DHBDMO CCSCC[C@H](C)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000174034606 337138782 /nfs/dbraw/zinc/13/87/82/337138782.db2.gz QSNHMYYCTHBQKT-NSHDSACASA-N 1 1 300.399 3.697 20 5 DHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000174034606 337138783 /nfs/dbraw/zinc/13/87/83/337138783.db2.gz QSNHMYYCTHBQKT-NSHDSACASA-N 1 1 300.399 3.697 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000174353485 337141006 /nfs/dbraw/zinc/14/10/06/337141006.db2.gz RWMRJIVZRWSEPX-UONOGXRCSA-N 1 1 324.446 3.709 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000174353496 337141041 /nfs/dbraw/zinc/14/10/41/337141041.db2.gz RWMRJIVZRWSEPX-KBPBESRZSA-N 1 1 324.446 3.709 20 5 DHBDMO O=[N+]([O-])c1cccc([C@H]([NH2+]Cc2cccnc2)c2ccccc2)c1 ZINC000179962977 337172826 /nfs/dbraw/zinc/17/28/26/337172826.db2.gz HJOFTDPBEVCSGM-LJQANCHMSA-N 1 1 319.364 3.869 20 5 DHBDMO CC[C@@H](NC[C@@H](C)C[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000321477757 337270628 /nfs/dbraw/zinc/27/06/28/337270628.db2.gz ATJWBJSDEHGCGR-CRAIPNDOSA-N 1 1 319.449 3.758 20 5 DHBDMO Cn1c[nH+]c2cc(N[C@@H]3CCCc4ccc([N+](=O)[O-])cc43)ccc21 ZINC000515288093 337984305 /nfs/dbraw/zinc/98/43/05/337984305.db2.gz JUGAJXPJUWNQOE-MRXNPFEDSA-N 1 1 322.368 3.971 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCS[C@@H](C)CC1 ZINC000426389399 338030036 /nfs/dbraw/zinc/03/00/36/338030036.db2.gz FDFXPWIBAVPHFZ-UELRPHRMSA-N 1 1 306.431 3.826 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429116015 338071129 /nfs/dbraw/zinc/07/11/29/338071129.db2.gz PTZNSPFJBHNFPP-UONOGXRCSA-N 1 1 312.369 3.939 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429116015 338071130 /nfs/dbraw/zinc/07/11/30/338071130.db2.gz PTZNSPFJBHNFPP-UONOGXRCSA-N 1 1 312.369 3.939 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429137315 338071574 /nfs/dbraw/zinc/07/15/74/338071574.db2.gz SANBMMFFUGSSTJ-ZIAGYGMSSA-N 1 1 312.369 3.939 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429137315 338071575 /nfs/dbraw/zinc/07/15/75/338071575.db2.gz SANBMMFFUGSSTJ-ZIAGYGMSSA-N 1 1 312.369 3.939 20 5 DHBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H](C)CO ZINC000430087866 338095570 /nfs/dbraw/zinc/09/55/70/338095570.db2.gz VGGAWDAHNFPJLH-GFCCVEGCSA-N 1 1 320.414 3.526 20 5 DHBDMO CC[C@@H]1CC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000430195443 338100786 /nfs/dbraw/zinc/10/07/86/338100786.db2.gz JJIUIPLTSJUDDH-CYBMUJFWSA-N 1 1 303.387 3.703 20 5 DHBDMO CC[C@@H]1CC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000430195443 338100787 /nfs/dbraw/zinc/10/07/87/338100787.db2.gz JJIUIPLTSJUDDH-CYBMUJFWSA-N 1 1 303.387 3.703 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430235664 338102461 /nfs/dbraw/zinc/10/24/61/338102461.db2.gz FGXGBPKUYGUUCU-OAHLLOKOSA-N 1 1 324.446 3.711 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(F)cc1C ZINC000430242957 338102718 /nfs/dbraw/zinc/10/27/18/338102718.db2.gz JYZJIGLMABNUCA-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(F)cc1C ZINC000430242957 338102719 /nfs/dbraw/zinc/10/27/19/338102719.db2.gz JYZJIGLMABNUCA-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCOc1ccccc1 ZINC000434991444 338229147 /nfs/dbraw/zinc/22/91/47/338229147.db2.gz MPSNZVYHSNCVTR-CLFYSBASSA-N 1 1 312.369 3.619 20 5 DHBDMO Cc1c(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000437531580 338313001 /nfs/dbraw/zinc/31/30/01/338313001.db2.gz AORXFTOLMLNDDK-JKSUJKDBSA-N 1 1 306.431 3.763 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CF)CC1 ZINC000451387843 338732293 /nfs/dbraw/zinc/73/22/93/338732293.db2.gz HBETVJFCMCMFEZ-UHFFFAOYSA-N 1 1 310.369 3.564 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000462829076 339092912 /nfs/dbraw/zinc/09/29/12/339092912.db2.gz WNACAJVHWHTYSW-LBPRGKRZSA-N 1 1 309.797 3.677 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464772984 339152292 /nfs/dbraw/zinc/15/22/92/339152292.db2.gz KBLWHFQBFBNGSD-JKSUJKDBSA-N 1 1 308.447 3.743 20 5 DHBDMO C[C@@H](NCC[N@@H+]1[C@H](C)CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000467857775 339247811 /nfs/dbraw/zinc/24/78/11/339247811.db2.gz BSDSPJYRFKJDKU-QLFBSQMISA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@@H]([NH2+]CCN1[C@H](C)CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000467857775 339247812 /nfs/dbraw/zinc/24/78/12/339247812.db2.gz BSDSPJYRFKJDKU-QLFBSQMISA-N 1 1 305.422 3.508 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1CCN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467867208 339248220 /nfs/dbraw/zinc/24/82/20/339248220.db2.gz KXEMBDQYWHGLSG-ZBFHGGJFSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@H]1CCCCN1CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467867208 339248221 /nfs/dbraw/zinc/24/82/21/339248221.db2.gz KXEMBDQYWHGLSG-ZBFHGGJFSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1cccc(OCC[N@H+](C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000468396477 339261720 /nfs/dbraw/zinc/26/17/20/339261720.db2.gz CQYOGJFTELYVSO-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1ccc2c(c1)[nH+]cn2C ZINC000468593858 339266978 /nfs/dbraw/zinc/26/69/78/339266978.db2.gz CCYNWRQGECOCLR-JYRVWZFOSA-N 1 1 322.368 3.997 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCCC2CCOCC2)C2CC2)c1 ZINC000469898304 339304079 /nfs/dbraw/zinc/30/40/79/339304079.db2.gz PNZHLAALOLOJGF-UHFFFAOYSA-N 1 1 318.417 3.766 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCn2cccc2[C@H]1C ZINC000470169025 339312615 /nfs/dbraw/zinc/31/26/15/339312615.db2.gz AQVIKXUCLOLXJH-ATGUSINASA-N 1 1 311.385 3.876 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCn2cccc2[C@H]1C ZINC000470169025 339312616 /nfs/dbraw/zinc/31/26/16/339312616.db2.gz AQVIKXUCLOLXJH-ATGUSINASA-N 1 1 311.385 3.876 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000473162735 339383370 /nfs/dbraw/zinc/38/33/70/339383370.db2.gz QAALWRSBNJFNHL-AUUYWEPGSA-N 1 1 324.380 3.787 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1sccc1C ZINC000506005145 340182993 /nfs/dbraw/zinc/18/29/93/340182993.db2.gz PVXDAAKDHLXTFS-UHFFFAOYSA-N 1 1 320.414 3.995 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1sccc1C ZINC000506005145 340182994 /nfs/dbraw/zinc/18/29/94/340182994.db2.gz PVXDAAKDHLXTFS-UHFFFAOYSA-N 1 1 320.414 3.995 20 5 DHBDMO CC[N@@H+](CCc1cccs1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000506597485 340197343 /nfs/dbraw/zinc/19/73/43/340197343.db2.gz ZGXAHTDMTBHUNZ-UHFFFAOYSA-N 1 1 308.378 3.860 20 5 DHBDMO CC[C@H]1C[C@@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCO1 ZINC000507790121 340231519 /nfs/dbraw/zinc/23/15/19/340231519.db2.gz ABTPLEYQSFSZMS-YJBOKZPZSA-N 1 1 318.417 3.764 20 5 DHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000302862968 340284646 /nfs/dbraw/zinc/28/46/46/340284646.db2.gz UMKBLERPEQQHOE-QGZVFWFLSA-N 1 1 311.385 3.671 20 5 DHBDMO CSc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511073415 340320086 /nfs/dbraw/zinc/32/00/86/340320086.db2.gz PJNNMUCOKAKBJD-UHFFFAOYSA-N 1 1 316.426 3.991 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511082543 340320232 /nfs/dbraw/zinc/32/02/32/340320232.db2.gz SCCBNUWBWIUYHN-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511081493 340320238 /nfs/dbraw/zinc/32/02/38/340320238.db2.gz NPPJFICVILRWRU-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000511954934 340343740 /nfs/dbraw/zinc/34/37/40/340343740.db2.gz COYSBKQXWUHYRA-LBPRGKRZSA-N 1 1 316.357 3.705 20 5 DHBDMO C[C@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173422467 340364671 /nfs/dbraw/zinc/36/46/71/340364671.db2.gz RAYAIEHHMFUCFC-XJKSGUPXSA-N 1 1 307.438 3.612 20 5 DHBDMO COc1cccc(C2=CC[N@@H+](Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000512686910 340373080 /nfs/dbraw/zinc/37/30/80/340373080.db2.gz KNTOTLGOAMURAT-UHFFFAOYSA-N 1 1 324.380 3.893 20 5 DHBDMO CCc1cnc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000130529258 341026701 /nfs/dbraw/zinc/02/67/01/341026701.db2.gz SGLBFEDDGHLEPA-LLVKDONJSA-N 1 1 305.403 3.773 20 5 DHBDMO Cc1cccc([C@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)c1 ZINC000544192376 341074078 /nfs/dbraw/zinc/07/40/78/341074078.db2.gz QDRXOGUDKZLMEA-HNNXBMFYSA-N 1 1 302.399 3.954 20 5 DHBDMO CC(C)([NH2+]Cc1cc(F)ccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000080347262 341273053 /nfs/dbraw/zinc/27/30/53/341273053.db2.gz AZKJUTINLUTQJA-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(O)c1 ZINC000080932023 341276763 /nfs/dbraw/zinc/27/67/63/341276763.db2.gz PFZVXDKTAGCRRG-ZDUSSCGKSA-N 1 1 300.358 3.884 20 5 DHBDMO CC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000549334466 341291299 /nfs/dbraw/zinc/29/12/99/341291299.db2.gz NIQYIEVYFORSOI-UHFFFAOYSA-N 1 1 302.296 3.846 20 5 DHBDMO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000245493047 341297058 /nfs/dbraw/zinc/29/70/58/341297058.db2.gz KTCYEQPWUAVVTE-KYJSFNMBSA-N 1 1 317.433 3.603 20 5 DHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000550444414 341317225 /nfs/dbraw/zinc/31/72/25/341317225.db2.gz UXPNMWXZVDLCQN-GXTWGEPZSA-N 1 1 322.380 3.753 20 5 DHBDMO CC(C)C[N@H+]1CCC[C@@H](CN[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246358719 341344894 /nfs/dbraw/zinc/34/48/94/341344894.db2.gz IGDCFXTZXPQTQP-CVEARBPZSA-N 1 1 319.449 3.613 20 5 DHBDMO COCCc1cc[nH+]c(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000552317562 341385936 /nfs/dbraw/zinc/38/59/36/341385936.db2.gz CVLJWNBSMUSOQX-ZDUSSCGKSA-N 1 1 315.373 3.660 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCO[C@@H](C(C)C)C1 ZINC000552443817 341394029 /nfs/dbraw/zinc/39/40/29/341394029.db2.gz AWMQZGFNFKSRTE-SPQRHKFCSA-N 1 1 318.417 3.745 20 5 DHBDMO CC(C)CCOC1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000171629090 341781661 /nfs/dbraw/zinc/78/16/61/341781661.db2.gz XJTXMGMMZCLKMN-UHFFFAOYSA-N 1 1 324.396 3.761 20 5 DHBDMO CCOC[C@@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245530240 520117027 /nfs/dbraw/zinc/11/70/27/520117027.db2.gz SHLXBTAPFVQNBG-HUUCEWRRSA-N 1 1 306.406 3.713 20 5 DHBDMO COC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000156427620 522760827 /nfs/dbraw/zinc/76/08/27/522760827.db2.gz YLPSCAHZKKCAJP-ZFWWWQNUSA-N 1 1 318.373 3.843 20 5 DHBDMO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)o1 ZINC000130908716 523014168 /nfs/dbraw/zinc/01/41/68/523014168.db2.gz HGLPGXZIGXQDHG-INIZCTEOSA-N 1 1 316.357 3.671 20 5 DHBDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)o1 ZINC000130908716 523014183 /nfs/dbraw/zinc/01/41/83/523014183.db2.gz HGLPGXZIGXQDHG-INIZCTEOSA-N 1 1 316.357 3.671 20 5 DHBDMO Cc1cccc2c1OCC[C@@H]2[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000188948592 524955464 /nfs/dbraw/zinc/95/54/64/524955464.db2.gz LMXDQQPIEVCMPO-ZDUSSCGKSA-N 1 1 304.371 3.578 20 5 DHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000366002073 525469246 /nfs/dbraw/zinc/46/92/46/525469246.db2.gz UJOYAVZFCFDDPN-SJKOYZFVSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000366002073 525469255 /nfs/dbraw/zinc/46/92/55/525469255.db2.gz UJOYAVZFCFDDPN-SJKOYZFVSA-N 1 1 315.348 3.712 20 5 DHBDMO Cc1cnc(CC[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000157834635 525996994 /nfs/dbraw/zinc/99/69/94/525996994.db2.gz OQMMNTOCQGWOCH-GFCCVEGCSA-N 1 1 305.403 3.595 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC2(CCOCC2)C1 ZINC000266538274 526107408 /nfs/dbraw/zinc/10/74/08/526107408.db2.gz PBWRHQAOLCYKSI-AWEZNQCLSA-N 1 1 304.390 3.548 20 5 DHBDMO CCOC1CC2(C1)CC[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000285498420 535399509 /nfs/dbraw/zinc/39/95/09/535399509.db2.gz MYISKOXVHYBGLP-TUBUQKNSSA-N 1 1 304.390 3.547 20 5 DHBDMO COCCc1cc[nH+]c(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000287747952 536832557 /nfs/dbraw/zinc/83/25/57/536832557.db2.gz ZBSJMOUPXDKRCX-ZDUSSCGKSA-N 1 1 315.373 3.660 20 5 DHBDMO CC1CC[NH+](Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000725263875 563570256 /nfs/dbraw/zinc/57/02/56/563570256.db2.gz SVTLXHDQTJMQSO-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO COc1cc(C[N@H+](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000184230039 1013427102 /nfs/dbraw/zinc/42/71/02/1013427102.db2.gz HRNCCYOGBVNZHO-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000184230039 1013427108 /nfs/dbraw/zinc/42/71/08/1013427108.db2.gz HRNCCYOGBVNZHO-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1cc(C[N@H+](C)[C@H](C)c2cccs2)c([N+](=O)[O-])cc1F ZINC000184246813 1013438047 /nfs/dbraw/zinc/43/80/47/1013438047.db2.gz SUBABHUZHKNNKD-SNVBAGLBSA-N 1 1 324.377 3.997 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H](C)c2cccs2)c([N+](=O)[O-])cc1F ZINC000184246813 1013438051 /nfs/dbraw/zinc/43/80/51/1013438051.db2.gz SUBABHUZHKNNKD-SNVBAGLBSA-N 1 1 324.377 3.997 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000729481530 1013634560 /nfs/dbraw/zinc/63/45/60/1013634560.db2.gz TYCNWGLFUCHHHQ-ZDUSSCGKSA-N 1 1 318.323 3.863 20 5 DHBDMO CC[C@@H]1CCCCC[N@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000441436584 1013837158 /nfs/dbraw/zinc/83/71/58/1013837158.db2.gz HRPQXIRILVTYKS-CQSZACIVSA-N 1 1 322.405 3.637 20 5 DHBDMO CCC[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000120910196 1013876252 /nfs/dbraw/zinc/87/62/52/1013876252.db2.gz VAQKCGMXUCKRLS-GFCCVEGCSA-N 1 1 303.362 3.748 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000441460670 1013907848 /nfs/dbraw/zinc/90/78/48/1013907848.db2.gz DRGBQTWIJKALKZ-CPUCHLNUSA-N 1 1 304.390 3.627 20 5 DHBDMO C[C@H]1CC[C@H](C)[NH+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000706476947 1014042287 /nfs/dbraw/zinc/04/22/87/1014042287.db2.gz OHBJBYRKTMJXQM-UWVGGRQHSA-N 1 1 313.195 3.730 20 5 DHBDMO CCCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](C)c1ccc(C)o1 ZINC000610447521 1014235299 /nfs/dbraw/zinc/23/52/99/1014235299.db2.gz GKICPCWYUJWPDB-CQSZACIVSA-N 1 1 320.393 3.556 20 5 DHBDMO CC[C@@H](C)[C@H](C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000520592050 1014361520 /nfs/dbraw/zinc/36/15/20/1014361520.db2.gz QQVRYINRDAJNFL-KGLIPLIRSA-N 1 1 306.406 3.873 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000933077957 1014529424 /nfs/dbraw/zinc/52/94/24/1014529424.db2.gz HAMFMOBUBHTHSZ-KRWDZBQOSA-N 1 1 318.417 3.542 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000610476368 1014540415 /nfs/dbraw/zinc/54/04/15/1014540415.db2.gz AYIPXIFYYSAREU-CYBMUJFWSA-N 1 1 316.357 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c(F)c1 ZINC000610481018 1014574303 /nfs/dbraw/zinc/57/43/03/1014574303.db2.gz KAHOLNCDLBPJPS-QGZVFWFLSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)c(F)c1 ZINC000610481018 1014574315 /nfs/dbraw/zinc/57/43/15/1014574315.db2.gz KAHOLNCDLBPJPS-QGZVFWFLSA-N 1 1 316.332 3.777 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]C[C@@H](C(C)C)N2CCCC2)cc1[N+](=O)[O-] ZINC000320113499 1014587889 /nfs/dbraw/zinc/58/78/89/1014587889.db2.gz CMGOSGNWCYZIAQ-YJBOKZPZSA-N 1 1 319.449 3.674 20 5 DHBDMO CCCc1ncc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000581173710 1014603146 /nfs/dbraw/zinc/60/31/46/1014603146.db2.gz XQBIYWAYQPYHDP-LBPRGKRZSA-N 1 1 303.362 3.695 20 5 DHBDMO C[N@@H+](CCc1ccc(F)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000177947455 1014617101 /nfs/dbraw/zinc/61/71/01/1014617101.db2.gz FMYCXVLHPGFUJY-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CC[C@@H]2c2cccc(F)c2)cc1 ZINC000610504860 1014818319 /nfs/dbraw/zinc/81/83/19/1014818319.db2.gz CIGUUOWGSKTIHG-QGZVFWFLSA-N 1 1 316.332 3.560 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H]2c2cccc(F)c2)cc1 ZINC000610504860 1014818326 /nfs/dbraw/zinc/81/83/26/1014818326.db2.gz CIGUUOWGSKTIHG-QGZVFWFLSA-N 1 1 316.332 3.560 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCC2(C)C)c1F ZINC001173182531 1033584306 /nfs/dbraw/zinc/58/43/06/1033584306.db2.gz STCYRRCMRCMFPF-LLVKDONJSA-N 1 1 310.369 3.548 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cn2c(cccc2C)n1)c1cccc([N+](=O)[O-])c1 ZINC000178060505 1014991101 /nfs/dbraw/zinc/99/11/01/1014991101.db2.gz CDRUQMPJOVEAQU-QGZVFWFLSA-N 1 1 324.384 3.792 20 5 DHBDMO Cc1ccnc([C@@H]2CC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000581556928 1014994737 /nfs/dbraw/zinc/99/47/37/1014994737.db2.gz VXPUUJRAXBPUJW-GDBMZVCRSA-N 1 1 311.385 3.849 20 5 DHBDMO Cc1c(C[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)cccc1[N+](=O)[O-] ZINC000119406714 1015031033 /nfs/dbraw/zinc/03/10/33/1015031033.db2.gz QGFLHXKYXKUYOO-ZDUSSCGKSA-N 1 1 314.385 3.672 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)nc2c1 ZINC000361809978 1032109160 /nfs/dbraw/zinc/10/91/60/1032109160.db2.gz BGZQRPQUUDHIRI-LBPRGKRZSA-N 1 1 310.357 3.630 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)[nH]c2c1 ZINC000361809978 1032109166 /nfs/dbraw/zinc/10/91/66/1032109166.db2.gz BGZQRPQUUDHIRI-LBPRGKRZSA-N 1 1 310.357 3.630 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H]([C@H]3CCCO3)C2)cc1[N+](=O)[O-] ZINC000895846876 1015331133 /nfs/dbraw/zinc/33/11/33/1015331133.db2.gz RJLMQVJIJLEKQO-CRAIPNDOSA-N 1 1 318.417 3.719 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CCc1ccc(F)c(F)c1 ZINC000581830190 1015357630 /nfs/dbraw/zinc/35/76/30/1015357630.db2.gz DKQFKDWEYAFAAT-UHFFFAOYSA-N 1 1 320.339 3.590 20 5 DHBDMO CC(C)[N@H+](Cc1ccco1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580918 1015631605 /nfs/dbraw/zinc/63/16/05/1015631605.db2.gz BBYMAENCAWTCHX-UHFFFAOYSA-N 1 1 315.329 3.740 20 5 DHBDMO CC(C)[N@@H+](Cc1ccco1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580918 1015631609 /nfs/dbraw/zinc/63/16/09/1015631609.db2.gz BBYMAENCAWTCHX-UHFFFAOYSA-N 1 1 315.329 3.740 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)C2CCCCC2)C2CC2)cc1 ZINC000474977606 1015744006 /nfs/dbraw/zinc/74/40/06/1015744006.db2.gz TXSBXSUBEHEIMN-GOSISDBHSA-N 1 1 318.417 3.500 20 5 DHBDMO CCOc1cccc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000538727035 1016157101 /nfs/dbraw/zinc/15/71/01/1016157101.db2.gz OOFNYRLTJPPCOP-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCOc1cccc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000538727035 1016157110 /nfs/dbraw/zinc/15/71/10/1016157110.db2.gz OOFNYRLTJPPCOP-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc3c2NCC3)C2CC2)c1 ZINC000346825533 1016581077 /nfs/dbraw/zinc/58/10/77/1016581077.db2.gz QILNCLURGPIVBP-UHFFFAOYSA-N 1 1 323.396 3.727 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000248695582 1017252394 /nfs/dbraw/zinc/25/23/94/1017252394.db2.gz JOUOSQBQAJLPGC-KUHUBIRLSA-N 1 1 324.380 3.787 20 5 DHBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2c2ccccc2C)c(C)c1[N+](=O)[O-] ZINC000054566159 1032346924 /nfs/dbraw/zinc/34/69/24/1032346924.db2.gz ZNPVFDSLLHYZNF-MRXNPFEDSA-N 1 1 314.389 3.511 20 5 DHBDMO Cc1nn(C[N@H+]2CCC[C@@H]2c2ccccc2C)c(C)c1[N+](=O)[O-] ZINC000054566159 1032346932 /nfs/dbraw/zinc/34/69/32/1032346932.db2.gz ZNPVFDSLLHYZNF-MRXNPFEDSA-N 1 1 314.389 3.511 20 5 DHBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000537629293 1032362422 /nfs/dbraw/zinc/36/24/22/1032362422.db2.gz QUOORJVXOJHVQK-GFCCVEGCSA-N 1 1 316.357 3.848 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000430202699 1012340906 /nfs/dbraw/zinc/34/09/06/1012340906.db2.gz HFRSSXMIFCDSCU-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)cc1[N+](=O)[O-] ZINC000537689257 1032641912 /nfs/dbraw/zinc/64/19/12/1032641912.db2.gz JQEHYCODTUAPJO-WBVHZDCISA-N 1 1 318.417 3.719 20 5 DHBDMO COc1ccc([C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1F ZINC000037562970 1032643402 /nfs/dbraw/zinc/64/34/02/1032643402.db2.gz YKKDXMXYGGKKFZ-VIFPVBQESA-N 1 1 310.350 3.655 20 5 DHBDMO CCCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H]1CCC[C@H](C)C1 ZINC000339646868 1012720242 /nfs/dbraw/zinc/72/02/42/1012720242.db2.gz LCOIFOWSGSQSEA-KBPBESRZSA-N 1 1 308.426 3.509 20 5 DHBDMO CO[C@@]1(C)CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000475552649 1017423727 /nfs/dbraw/zinc/42/37/27/1017423727.db2.gz XHQJYDKRYCCSMV-NZHZHZHDSA-N 1 1 318.417 3.889 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCc2ccc(Cl)nc21)c1ccccc1[N+](=O)[O-] ZINC000857905959 1032712525 /nfs/dbraw/zinc/71/25/25/1032712525.db2.gz AGRHPFIZNPRGHS-MFKMUULPSA-N 1 1 317.776 3.981 20 5 DHBDMO Cc1ccc(F)c(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000444743240 1017659131 /nfs/dbraw/zinc/65/91/31/1017659131.db2.gz YIQACOXYIYTVIS-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO Cc1ccc(F)c(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000444743240 1017659139 /nfs/dbraw/zinc/65/91/39/1017659139.db2.gz YIQACOXYIYTVIS-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO CCC[C@H](NC1CC[NH+](CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000268747278 1017711958 /nfs/dbraw/zinc/71/19/58/1017711958.db2.gz VOONZCWTJXYNGN-KRWDZBQOSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000125723628 1032718685 /nfs/dbraw/zinc/71/86/85/1032718685.db2.gz OUDLLUDHHRTLNC-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000125723628 1032718696 /nfs/dbraw/zinc/71/86/96/1032718696.db2.gz OUDLLUDHHRTLNC-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@H]3CCC[C@@H]32)c1 ZINC000428452091 1018242210 /nfs/dbraw/zinc/24/22/10/1018242210.db2.gz JDEOBPAFFYHDKW-MFKMUULPSA-N 1 1 312.316 3.571 20 5 DHBDMO C[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000248330577 1018355310 /nfs/dbraw/zinc/35/53/10/1018355310.db2.gz DOTXXPSPLSLDJE-STQMWFEESA-N 1 1 315.373 3.523 20 5 DHBDMO C[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000926920287 1032773141 /nfs/dbraw/zinc/77/31/41/1032773141.db2.gz RIMYAZZOXSJRIG-LLVKDONJSA-N 1 1 317.414 3.781 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000278417501 1018670552 /nfs/dbraw/zinc/67/05/52/1018670552.db2.gz IEWQPGKZADQXOJ-ZDUSSCGKSA-N 1 1 311.385 3.719 20 5 DHBDMO Cn1cccc1[C@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255361572 1019409302 /nfs/dbraw/zinc/40/93/02/1019409302.db2.gz NVVMAWOJTJQMLM-MPYGFJLXSA-N 1 1 311.385 3.784 20 5 DHBDMO O=[N+]([O-])c1ccccc1CN(Cc1[nH]nc2ccccc21)C1CC1 ZINC000611254804 1019420371 /nfs/dbraw/zinc/42/03/71/1019420371.db2.gz RRESKDBRTZZTTD-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1cccc(CN(Cc2[nH]nc3ccccc32)C2CC2)c1 ZINC000611254805 1019422051 /nfs/dbraw/zinc/42/20/51/1019422051.db2.gz RZSDQXDKCLMQFU-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2[nH]nc3ccccc32)C2CC2)c1 ZINC000611254805 1019422060 /nfs/dbraw/zinc/42/20/60/1019422060.db2.gz RZSDQXDKCLMQFU-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2[nH]nc3ccccc32)C2CC2)c1 ZINC000611254805 1019422063 /nfs/dbraw/zinc/42/20/63/1019422063.db2.gz RZSDQXDKCLMQFU-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000611377501 1019465427 /nfs/dbraw/zinc/46/54/27/1019465427.db2.gz NDYHBBNFVCVWMN-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000347601854 1019762174 /nfs/dbraw/zinc/76/21/74/1019762174.db2.gz PPTYWTJWMFEPTB-UHFFFAOYSA-N 1 1 302.296 3.744 20 5 DHBDMO CC[C@H]1CCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000727822868 1019822251 /nfs/dbraw/zinc/82/22/51/1019822251.db2.gz DFUQKWRDQKUVMK-JTQLQIEISA-N 1 1 307.375 3.704 20 5 DHBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC[N@H+]1C ZINC000317376928 1019977259 /nfs/dbraw/zinc/97/72/59/1019977259.db2.gz HWZMPXVHGVFPLY-NXEZZACHSA-N 1 1 317.311 3.508 20 5 DHBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC[N@H+]1C ZINC000317376929 1019978599 /nfs/dbraw/zinc/97/85/99/1019978599.db2.gz HWZMPXVHGVFPLY-UWVGGRQHSA-N 1 1 317.311 3.508 20 5 DHBDMO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000489832262 1020420575 /nfs/dbraw/zinc/42/05/75/1020420575.db2.gz NBQCLQUTPPVEBN-ZDUSSCGKSA-N 1 1 302.349 3.797 20 5 DHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000030002425 1020559238 /nfs/dbraw/zinc/55/92/38/1020559238.db2.gz LKJMAFVZPPVONS-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO C[C@@H]1C[C@H](C)[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000162910033 1020560253 /nfs/dbraw/zinc/56/02/53/1020560253.db2.gz LXJHLRQBKGHXPJ-ZJUUUORDSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000162910033 1020560260 /nfs/dbraw/zinc/56/02/60/1020560260.db2.gz LXJHLRQBKGHXPJ-ZJUUUORDSA-N 1 1 313.195 3.588 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1csc(C)n1 ZINC000615722636 1020579510 /nfs/dbraw/zinc/57/95/10/1020579510.db2.gz RFUVAAPKUYXDHL-WDZFZDKYSA-N 1 1 303.387 3.553 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccccc1 ZINC000066434501 1020861392 /nfs/dbraw/zinc/86/13/92/1020861392.db2.gz YTESIHADXLECAS-GOSISDBHSA-N 1 1 314.385 3.539 20 5 DHBDMO CC[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)C1CCC1 ZINC000738056089 1020863431 /nfs/dbraw/zinc/86/34/31/1020863431.db2.gz WPLDXZXPFYIFLP-UHFFFAOYSA-N 1 1 307.375 3.704 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000582273911 1020932010 /nfs/dbraw/zinc/93/20/10/1020932010.db2.gz QOZPRQUWGNDIOV-ZDUSSCGKSA-N 1 1 316.405 3.675 20 5 DHBDMO CC[N@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000740870912 1020957426 /nfs/dbraw/zinc/95/74/26/1020957426.db2.gz LZCFCLIEBVCPPB-NEPJUHHUSA-N 1 1 311.813 3.557 20 5 DHBDMO COc1cnccc1[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000188781067 1021173675 /nfs/dbraw/zinc/17/36/75/1021173675.db2.gz WWMIZVJXLVSGIS-STQMWFEESA-N 1 1 315.373 3.719 20 5 DHBDMO CCC[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776272186 1021215272 /nfs/dbraw/zinc/21/52/72/1021215272.db2.gz RFHNWKACIBSSGE-SFHVURJKSA-N 1 1 314.385 3.540 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2c2ccsc2)cc1 ZINC000776273852 1021216164 /nfs/dbraw/zinc/21/61/64/1021216164.db2.gz AZCGGTHKQWXVTC-HOTGVXAUSA-N 1 1 318.398 3.527 20 5 DHBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](CC3CCCCC3)CC2)cc1 ZINC000917391199 1021254723 /nfs/dbraw/zinc/25/47/23/1021254723.db2.gz PIHMYEHHTNVRAM-UHFFFAOYSA-N 1 1 317.433 3.687 20 5 DHBDMO CCC[N@@H+](Cc1ccc(C)cc1)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000917455124 1021270487 /nfs/dbraw/zinc/27/04/87/1021270487.db2.gz QXYKFMDGGIBXLB-UHFFFAOYSA-N 1 1 316.405 3.586 20 5 DHBDMO CCC[N@H+](Cc1ccc(C)cc1)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000917455124 1021270499 /nfs/dbraw/zinc/27/04/99/1021270499.db2.gz QXYKFMDGGIBXLB-UHFFFAOYSA-N 1 1 316.405 3.586 20 5 DHBDMO Cc1cccc([C@H]2CCCC[N@@H+]2Cn2cc([N+](=O)[O-])cn2)c1C ZINC000743387715 1021278877 /nfs/dbraw/zinc/27/88/77/1021278877.db2.gz JPVJZARATBGMNY-QGZVFWFLSA-N 1 1 314.389 3.593 20 5 DHBDMO Cc1cccc([C@H]2CCCC[N@H+]2Cn2cc([N+](=O)[O-])cn2)c1C ZINC000743387715 1021278885 /nfs/dbraw/zinc/27/88/85/1021278885.db2.gz JPVJZARATBGMNY-QGZVFWFLSA-N 1 1 314.389 3.593 20 5 DHBDMO Cc1ccc(C[N@H+]2CCSC3(CCC3)CC2)cc1[N+](=O)[O-] ZINC000414482978 1021492153 /nfs/dbraw/zinc/49/21/53/1021492153.db2.gz YMCLJULAHNVRNJ-UHFFFAOYSA-N 1 1 306.431 3.765 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2C[C@@H](O)c3ccccc32)c1 ZINC000850369870 1021492911 /nfs/dbraw/zinc/49/29/11/1021492911.db2.gz CAJNNVARSUUBHD-HZPDHXFCSA-N 1 1 318.760 3.516 20 5 DHBDMO COc1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c(F)c1 ZINC000194620039 1021497469 /nfs/dbraw/zinc/49/74/69/1021497469.db2.gz VIDPYNSRWSPYBA-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000744440702 1021544444 /nfs/dbraw/zinc/54/44/44/1021544444.db2.gz GTMRCDPALZELNZ-CJNGLKHVSA-N 1 1 314.389 3.536 20 5 DHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000092224061 1021561794 /nfs/dbraw/zinc/56/17/94/1021561794.db2.gz BHDMRXXVBJTLKA-HNNXBMFYSA-N 1 1 315.373 3.582 20 5 DHBDMO COc1cc(C[NH2+][C@H](C)c2ccsc2)c([N+](=O)[O-])cc1F ZINC000619783585 1021895911 /nfs/dbraw/zinc/89/59/11/1021895911.db2.gz SFEAZHKPBGTVGY-SECBINFHSA-N 1 1 310.350 3.655 20 5 DHBDMO COc1cc(C)ccc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893139393 1021994905 /nfs/dbraw/zinc/99/49/05/1021994905.db2.gz LYECDCURIPQPRP-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000290546511 1022071183 /nfs/dbraw/zinc/07/11/83/1022071183.db2.gz CUQXKUDKXGLVQD-NEPJUHHUSA-N 1 1 316.357 3.721 20 5 DHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580136 1022097639 /nfs/dbraw/zinc/09/76/39/1022097639.db2.gz RKSMMOGEFRYPMQ-JKSUJKDBSA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CCc1nccs1)C(C)C ZINC000183378850 1022121594 /nfs/dbraw/zinc/12/15/94/1022121594.db2.gz XIFMYWOORLIPOI-UHFFFAOYSA-N 1 1 319.430 3.813 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H](CCF)C1 ZINC000852532167 1022136129 /nfs/dbraw/zinc/13/61/29/1022136129.db2.gz CSBZMLZVFKFMJT-LLVKDONJSA-N 1 1 300.761 3.820 20 5 DHBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc2c(c1)CCCO2 ZINC000852782065 1022177236 /nfs/dbraw/zinc/17/72/36/1022177236.db2.gz NSPPGXCUMPBVMQ-NSHDSACASA-N 1 1 318.398 3.832 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)cc1Cl)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169005944 1022213388 /nfs/dbraw/zinc/21/33/88/1022213388.db2.gz DKNYITMXFMWXRM-MFKMUULPSA-N 1 1 317.216 3.871 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2ccc(Cl)s2)C1 ZINC001169033309 1022219274 /nfs/dbraw/zinc/21/92/74/1022219274.db2.gz BUFNJMKWNTZNRP-IJLUTSLNSA-N 1 1 314.838 3.984 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](c3ccccc3Cl)C2)C1 ZINC001169034559 1022221622 /nfs/dbraw/zinc/22/16/22/1022221622.db2.gz HUURMWDZEYYJFA-MGPQQGTHSA-N 1 1 308.809 3.575 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)C1 ZINC001169039722 1022221897 /nfs/dbraw/zinc/22/18/97/1022221897.db2.gz SPXIJRBSLXUUCP-XPKDYRNWSA-N 1 1 308.809 3.575 20 5 DHBDMO CSc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169041685 1022223940 /nfs/dbraw/zinc/22/39/40/1022223940.db2.gz CAGXBNJQFKFCTL-LZWOXQAQSA-N 1 1 320.458 3.991 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001169041134 1022224956 /nfs/dbraw/zinc/22/49/56/1022224956.db2.gz BCDHREXMOVGFAQ-APHBMKBZSA-N 1 1 308.809 3.922 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H]2c2c(F)cccc2F)C1 ZINC001169046326 1022229747 /nfs/dbraw/zinc/22/97/47/1022229747.db2.gz KNNAMVYTQGFPSI-JMSVASOKSA-N 1 1 310.344 3.547 20 5 DHBDMO CCn1ccc(C[N@@H+](C)C/C(C)=C\c2cccc([N+](=O)[O-])c2)c1 ZINC000616737761 1022762759 /nfs/dbraw/zinc/76/27/59/1022762759.db2.gz SBNXPDRQUAPRIU-GDNBJRDFSA-N 1 1 313.401 3.952 20 5 DHBDMO CCOc1cc(NC[C@@H]2CCC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000092626546 1022930031 /nfs/dbraw/zinc/93/00/31/1022930031.db2.gz WFUZCEAYZJDULS-AWEZNQCLSA-N 1 1 321.421 3.526 20 5 DHBDMO Cc1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)o1 ZINC000768337521 1022947221 /nfs/dbraw/zinc/94/72/21/1022947221.db2.gz RQAOJHXSDOBTOH-UHFFFAOYSA-N 1 1 300.358 3.969 20 5 DHBDMO Cc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)o1 ZINC000768337521 1022947232 /nfs/dbraw/zinc/94/72/32/1022947232.db2.gz RQAOJHXSDOBTOH-UHFFFAOYSA-N 1 1 300.358 3.969 20 5 DHBDMO C[C@H]1CCCC[N@H+]1CCCNc1cc([N+](=O)[O-])cc2cc[nH]c21 ZINC001167752340 1023032561 /nfs/dbraw/zinc/03/25/61/1023032561.db2.gz FHPVNUBPKOHBFV-ZDUSSCGKSA-N 1 1 316.405 3.753 20 5 DHBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@@H]1C ZINC000781925391 1023086356 /nfs/dbraw/zinc/08/63/56/1023086356.db2.gz TVQDUNDYOHOJED-JQFCIGGWSA-N 1 1 306.406 3.529 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H]1CCOc3ccccc31)C2 ZINC000769425127 1023146924 /nfs/dbraw/zinc/14/69/24/1023146924.db2.gz DMDJJHUFWQQSKA-OAHLLOKOSA-N 1 1 324.380 3.519 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCOC2(CCCC2)C1 ZINC000408144463 1023391749 /nfs/dbraw/zinc/39/17/49/1023391749.db2.gz LPTSTPGMXIRCAI-AWEZNQCLSA-N 1 1 304.390 3.609 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCOC2(CCCC2)C1 ZINC000408144463 1023391754 /nfs/dbraw/zinc/39/17/54/1023391754.db2.gz LPTSTPGMXIRCAI-AWEZNQCLSA-N 1 1 304.390 3.609 20 5 DHBDMO Cc1cnc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)s1 ZINC000788023899 1023839373 /nfs/dbraw/zinc/83/93/73/1023839373.db2.gz NKPGWVXXGYIHDI-AWEZNQCLSA-N 1 1 321.377 3.740 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cccc(F)c1F ZINC000788488780 1023893358 /nfs/dbraw/zinc/89/33/58/1023893358.db2.gz MBGMXDVJXLXNAJ-VIFPVBQESA-N 1 1 310.275 3.863 20 5 DHBDMO CCC[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000296009733 1024105876 /nfs/dbraw/zinc/10/58/76/1024105876.db2.gz QZYGCPILCTXZBR-MMNRESRNSA-N 1 1 317.433 3.651 20 5 DHBDMO CCC[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000296009733 1024105883 /nfs/dbraw/zinc/10/58/83/1024105883.db2.gz QZYGCPILCTXZBR-MMNRESRNSA-N 1 1 317.433 3.651 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CC1CC1)C1CCC1 ZINC000475681051 1024183828 /nfs/dbraw/zinc/18/38/28/1024183828.db2.gz TWJVMVUSWPGORM-UHFFFAOYSA-N 1 1 304.390 3.758 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C ZINC000531714656 1024279494 /nfs/dbraw/zinc/27/94/94/1024279494.db2.gz ZVLHAFHTVLNTFV-YOEHRIQHSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C ZINC000531714656 1024279507 /nfs/dbraw/zinc/27/95/07/1024279507.db2.gz ZVLHAFHTVLNTFV-YOEHRIQHSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(Cl)n1 ZINC000883291508 1024352922 /nfs/dbraw/zinc/35/29/22/1024352922.db2.gz HVOZZPCHAYMMSN-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO Cc1[nH+]ccn1CCCNc1c(C)cc([N+](=O)[O-])cc1Cl ZINC000337872747 1033212423 /nfs/dbraw/zinc/21/24/23/1033212423.db2.gz SFQZSOHIMKOQCJ-UHFFFAOYSA-N 1 1 308.769 3.564 20 5 DHBDMO CCCc1ncc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000453358595 1024481013 /nfs/dbraw/zinc/48/10/13/1024481013.db2.gz DWRVDDQJTPRXLW-MRXNPFEDSA-N 1 1 315.373 3.703 20 5 DHBDMO CCCc1ncc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000453382266 1024482727 /nfs/dbraw/zinc/48/27/27/1024482727.db2.gz LZHRDYYNRKUSTA-GFCCVEGCSA-N 1 1 303.362 3.695 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C(C)C)N1CCCC1 ZINC000532202440 1024575011 /nfs/dbraw/zinc/57/50/11/1024575011.db2.gz CMSKSQKAPKTJAA-MAUKXSAKSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC[N@H+]1[C@H](C)CCC[C@@H]1C ZINC000532231290 1024582243 /nfs/dbraw/zinc/58/22/43/1024582243.db2.gz JVWCBXJMUOBKHJ-OWCLPIDISA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000532231290 1024582247 /nfs/dbraw/zinc/58/22/47/1024582247.db2.gz JVWCBXJMUOBKHJ-OWCLPIDISA-N 1 1 319.449 3.817 20 5 DHBDMO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283114326 1024595068 /nfs/dbraw/zinc/59/50/68/1024595068.db2.gz MOUKXRNMTIFECL-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCCCC[C@@H]2CCO)cc1[N+](=O)[O-] ZINC000585767878 1024604469 /nfs/dbraw/zinc/60/44/69/1024604469.db2.gz UJKZHKLCSTVEND-MRXNPFEDSA-N 1 1 320.433 3.845 20 5 DHBDMO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000317742244 1024624447 /nfs/dbraw/zinc/62/44/47/1024624447.db2.gz QJKQYGKKVRMGNU-QWRGUYRKSA-N 1 1 303.362 3.920 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](Cc1cccnc1)C1CC1 ZINC000349275706 1024694478 /nfs/dbraw/zinc/69/44/78/1024694478.db2.gz IHFFDSYQIAAMEJ-DAXSKMNVSA-N 1 1 309.369 3.668 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001170328634 1024745642 /nfs/dbraw/zinc/74/56/42/1024745642.db2.gz KXVVQYLVYVDLKT-ZDUSSCGKSA-N 1 1 306.406 3.799 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+]2[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170329880 1024746000 /nfs/dbraw/zinc/74/60/00/1024746000.db2.gz WHEAEZIAJHVJMC-MJBXVCDLSA-N 1 1 306.406 3.797 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+](C)C[C@@H]2CC2(C)C)c([N+](=O)[O-])c1 ZINC001170352347 1024748734 /nfs/dbraw/zinc/74/87/34/1024748734.db2.gz MCYSSMPEVIBKEP-JSGCOSHPSA-N 1 1 306.406 3.512 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cnc(C)s1 ZINC000347365906 1024751088 /nfs/dbraw/zinc/75/10/88/1024751088.db2.gz MHNGKLNDYODTRB-KPKJPENVSA-N 1 1 317.414 3.895 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2cccs2)c([N+](=O)[O-])c1 ZINC001170345770 1024756213 /nfs/dbraw/zinc/75/62/13/1024756213.db2.gz LOVSAVQHHGNPFL-LBPRGKRZSA-N 1 1 320.414 3.728 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC3(CCCC3)C2)c([N+](=O)[O-])c1 ZINC001170347154 1024756986 /nfs/dbraw/zinc/75/69/86/1024756986.db2.gz QVUVKILLCAOINR-CQSZACIVSA-N 1 1 318.417 3.801 20 5 DHBDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000792868211 1024811856 /nfs/dbraw/zinc/81/18/56/1024811856.db2.gz SDTICLKYVXYNEK-RYUDHWBXSA-N 1 1 321.377 3.902 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792868908 1024812079 /nfs/dbraw/zinc/81/20/79/1024812079.db2.gz YLZAYXATRFLISS-XUJVJEKNSA-N 1 1 319.361 3.656 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1C ZINC000792880780 1024824335 /nfs/dbraw/zinc/82/43/35/1024824335.db2.gz VLYJHAJWVWROAW-IUODEOHRSA-N 1 1 321.377 3.904 20 5 DHBDMO CC1(C)CC[C@@H](C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)O1 ZINC001170424647 1024865232 /nfs/dbraw/zinc/86/52/32/1024865232.db2.gz OGIGWHLLLVIHQZ-RDJZCZTQSA-N 1 1 318.417 3.732 20 5 DHBDMO Cc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000353204334 1024983589 /nfs/dbraw/zinc/98/35/89/1024983589.db2.gz CAQUAFVIUCAAIH-INIZCTEOSA-N 1 1 316.332 3.656 20 5 DHBDMO Cc1cccc(C[N@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)c1C ZINC000793543203 1025087635 /nfs/dbraw/zinc/08/76/35/1025087635.db2.gz NNZUKMOMUVQRAT-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1cccc(C[N@@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)c1C ZINC000793543203 1025087650 /nfs/dbraw/zinc/08/76/50/1025087650.db2.gz NNZUKMOMUVQRAT-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000353685502 1025200576 /nfs/dbraw/zinc/20/05/76/1025200576.db2.gz IGXIIKWGUDIYKA-KRWDZBQOSA-N 1 1 322.405 3.624 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000353746087 1025230313 /nfs/dbraw/zinc/23/03/13/1025230313.db2.gz KVMWYXZBRBPAIX-BHSUKZTGSA-N 1 1 316.401 3.501 20 5 DHBDMO CSC[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000178566358 1025233494 /nfs/dbraw/zinc/23/34/94/1025233494.db2.gz VGXPXXOKZJEFCQ-LBPRGKRZSA-N 1 1 300.811 3.576 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+](Cc1ccco1)C1CCCC1 ZINC000885959314 1025420115 /nfs/dbraw/zinc/42/01/15/1025420115.db2.gz XOIJMFIKTAIADD-UHFFFAOYSA-N 1 1 301.346 3.528 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000885959314 1025420116 /nfs/dbraw/zinc/42/01/16/1025420116.db2.gz XOIJMFIKTAIADD-UHFFFAOYSA-N 1 1 301.346 3.528 20 5 DHBDMO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(Cl)cc1[N+](=O)[O-] ZINC000747211283 1025467379 /nfs/dbraw/zinc/46/73/79/1025467379.db2.gz DCGCSNDHLRWRGM-VXGBXAGGSA-N 1 1 309.797 3.595 20 5 DHBDMO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])c1 ZINC000886107046 1025508787 /nfs/dbraw/zinc/50/87/87/1025508787.db2.gz JIJCKCZKONDSAA-ZDUSSCGKSA-N 1 1 315.373 3.628 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000355785044 1025839671 /nfs/dbraw/zinc/83/96/71/1025839671.db2.gz PBUMXAZBQRHNES-RHSMWYFYSA-N 1 1 304.390 3.548 20 5 DHBDMO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCc1nccs1 ZINC000093764454 1026123847 /nfs/dbraw/zinc/12/38/47/1026123847.db2.gz NYXMRLINIRXZOJ-FNORWQNLSA-N 1 1 317.414 3.629 20 5 DHBDMO COc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000052074501 1026134594 /nfs/dbraw/zinc/13/45/94/1026134594.db2.gz FTXFIYJVDNRDIM-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000052074501 1026134602 /nfs/dbraw/zinc/13/46/02/1026134602.db2.gz FTXFIYJVDNRDIM-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000289761060 1026163272 /nfs/dbraw/zinc/16/32/72/1026163272.db2.gz FYYFBFAXZHVOAI-GFCCVEGCSA-N 1 1 318.377 3.655 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)cs1 ZINC000513465965 1026514235 /nfs/dbraw/zinc/51/42/35/1026514235.db2.gz ABNLFCNEZXZRDZ-CYBMUJFWSA-N 1 1 306.362 3.785 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)cs1 ZINC000513465965 1026514245 /nfs/dbraw/zinc/51/42/45/1026514245.db2.gz ABNLFCNEZXZRDZ-CYBMUJFWSA-N 1 1 306.362 3.785 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccn2)C2CC2)cc1Cl ZINC000809762829 1026621002 /nfs/dbraw/zinc/62/10/02/1026621002.db2.gz BOYUBIIZDQSTQR-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccn2)C2CC2)cc1Cl ZINC000809762829 1026621006 /nfs/dbraw/zinc/62/10/06/1026621006.db2.gz BOYUBIIZDQSTQR-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809787860 1026625569 /nfs/dbraw/zinc/62/55/69/1026625569.db2.gz LBQKSVXNAQXZMQ-HWPZZCPQSA-N 1 1 318.760 3.860 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1 ZINC000420953595 1026893046 /nfs/dbraw/zinc/89/30/46/1026893046.db2.gz TUHYWLCMWXERSN-ZDUSSCGKSA-N 1 1 316.323 3.802 20 5 DHBDMO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000237177963 1026941892 /nfs/dbraw/zinc/94/18/92/1026941892.db2.gz OUSFVCUJZXVUQK-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000016431178 1026998989 /nfs/dbraw/zinc/99/89/89/1026998989.db2.gz AXWSHJJGQYDBAJ-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000016431178 1026998995 /nfs/dbraw/zinc/99/89/95/1026998995.db2.gz AXWSHJJGQYDBAJ-LBPRGKRZSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2ccncc2Cl)cc1[N+](=O)[O-] ZINC000421827213 1027058983 /nfs/dbraw/zinc/05/89/83/1027058983.db2.gz WUHBKYDYPNHXRS-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cs1 ZINC000293746591 1027110948 /nfs/dbraw/zinc/11/09/48/1027110948.db2.gz NVTKPNHDCRSTJM-ZJUUUORDSA-N 1 1 320.418 3.608 20 5 DHBDMO C[C@H]1C[C@H](Nc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000228852805 1027149335 /nfs/dbraw/zinc/14/93/35/1027149335.db2.gz IJBKLTKFVMWOCC-DTWKUNHWSA-N 1 1 318.204 3.796 20 5 DHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812848636 1027445712 /nfs/dbraw/zinc/44/57/12/1027445712.db2.gz LKJXPVPUZPHMHW-KSSFIOAISA-N 1 1 314.385 3.539 20 5 DHBDMO CCC[C@@H](NC[C@@H]([NH3+])c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423238822 1027459026 /nfs/dbraw/zinc/45/90/26/1027459026.db2.gz JOORDCJSNBRLOM-QZTJIDSGSA-N 1 1 313.401 3.726 20 5 DHBDMO CS[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000296321237 1027605388 /nfs/dbraw/zinc/60/53/88/1027605388.db2.gz OTLZRUJHYZAQQE-NSHDSACASA-N 1 1 320.336 3.551 20 5 DHBDMO CS[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000296321237 1027605390 /nfs/dbraw/zinc/60/53/90/1027605390.db2.gz OTLZRUJHYZAQQE-NSHDSACASA-N 1 1 320.336 3.551 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C2CCOCC2)C1 ZINC000933079267 1027669287 /nfs/dbraw/zinc/66/92/87/1027669287.db2.gz KXFISTXLJRQKPZ-ZBFHGGJFSA-N 1 1 318.417 3.794 20 5 DHBDMO CCCc1nc(C)c(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)o1 ZINC000814177464 1027914280 /nfs/dbraw/zinc/91/42/80/1027914280.db2.gz CJPIESINHQMJJN-UHFFFAOYSA-N 1 1 323.780 3.787 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCCCO2)C1 ZINC000365705306 1027993093 /nfs/dbraw/zinc/99/30/93/1027993093.db2.gz PMIGIWMMBSICOL-RHSMWYFYSA-N 1 1 304.390 3.691 20 5 DHBDMO CC(C)([NH2+]Cc1ccc(C(F)F)nc1)c1ccccc1[N+](=O)[O-] ZINC000601124498 1027994608 /nfs/dbraw/zinc/99/46/08/1027994608.db2.gz PYVPKAULECKXDA-UHFFFAOYSA-N 1 1 321.327 3.952 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cc3cccnc3o2)C2CC2)c1 ZINC000449012013 1028260245 /nfs/dbraw/zinc/26/02/45/1028260245.db2.gz XLTKGXBGQIBFAF-UHFFFAOYSA-N 1 1 323.352 3.901 20 5 DHBDMO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1Cc1cc([O-])ccc1[N+](=O)[O-] ZINC001170769204 1028260754 /nfs/dbraw/zinc/26/07/54/1028260754.db2.gz NQOMFOJPUNTFGP-OCCSQVGLSA-N 1 1 306.406 3.947 20 5 DHBDMO Cc1ccnc([C@@H]2CC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)c1 ZINC000564582365 1028477091 /nfs/dbraw/zinc/47/70/91/1028477091.db2.gz CCPPDSMJDDGQQH-LSDHHAIUSA-N 1 1 311.385 3.849 20 5 DHBDMO Cc1cccc([N+](=O)[O-])c1N1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000565532056 1028600352 /nfs/dbraw/zinc/60/03/52/1028600352.db2.gz NVJJANZSQUHADW-XHSDSOJGSA-N 1 1 317.433 3.745 20 5 DHBDMO Cc1nc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449495964 1028709349 /nfs/dbraw/zinc/70/93/49/1028709349.db2.gz FQLZOEKEXJIMMC-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO Cc1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449495964 1028709361 /nfs/dbraw/zinc/70/93/61/1028709361.db2.gz FQLZOEKEXJIMMC-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO Cc1nc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449495962 1028710967 /nfs/dbraw/zinc/71/09/67/1028710967.db2.gz FQLZOEKEXJIMMC-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO Cc1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449495962 1028710974 /nfs/dbraw/zinc/71/09/74/1028710974.db2.gz FQLZOEKEXJIMMC-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000449507820 1028728604 /nfs/dbraw/zinc/72/86/04/1028728604.db2.gz UIEFCTHZTCGGST-DYVFJYSZSA-N 1 1 306.406 3.575 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC=C(c2ccco2)C1 ZINC000566646184 1028757407 /nfs/dbraw/zinc/75/74/07/1028757407.db2.gz DNSUELMVLLIPBI-XVNBXDOJSA-N 1 1 310.353 3.990 20 5 DHBDMO CCc1ncc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)o1 ZINC000449607450 1028837249 /nfs/dbraw/zinc/83/72/49/1028837249.db2.gz BBNASNMULDVSTB-UHFFFAOYSA-N 1 1 303.362 3.558 20 5 DHBDMO CCC[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)C ZINC000569863191 1029277371 /nfs/dbraw/zinc/27/73/71/1029277371.db2.gz MMUMSMBHTXACMA-UHFFFAOYSA-N 1 1 303.362 3.870 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)c1 ZINC000571008042 1029442668 /nfs/dbraw/zinc/44/26/68/1029442668.db2.gz JEVRQGIXHXTQRJ-IBGZPJMESA-N 1 1 324.380 3.565 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451336759 1029850259 /nfs/dbraw/zinc/85/02/59/1029850259.db2.gz FZOOQBUYNIAATA-BNEJOLLZSA-N 1 1 318.417 3.671 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC(CF)CC2)c1 ZINC000451393703 1029865853 /nfs/dbraw/zinc/86/58/53/1029865853.db2.gz MYPFYVNALDJCDB-UHFFFAOYSA-N 1 1 320.286 3.795 20 5 DHBDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000451412479 1029869885 /nfs/dbraw/zinc/86/98/85/1029869885.db2.gz WRDJUKOEVREVJV-DGCLKSJQSA-N 1 1 316.323 3.800 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CC3CC(F)(F)C3)C2)cc1 ZINC000451546725 1029906249 /nfs/dbraw/zinc/90/62/49/1029906249.db2.gz JMIDRFNAVCQJAV-AWEZNQCLSA-N 1 1 310.344 3.820 20 5 DHBDMO COC1(CC[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCC1 ZINC000451545935 1029908000 /nfs/dbraw/zinc/90/80/00/1029908000.db2.gz HYTSPCWGKXTLFA-MRXNPFEDSA-N 1 1 318.417 3.733 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCSC[C@H]1C1CC1 ZINC000451646324 1029947987 /nfs/dbraw/zinc/94/79/87/1029947987.db2.gz IINKZJIEXTXISM-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCSC[C@H]1C1CC1 ZINC000451646324 1029947969 /nfs/dbraw/zinc/94/79/69/1029947969.db2.gz IINKZJIEXTXISM-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1Cc2ccccc2C[C@@H]1C ZINC000357813225 1030203892 /nfs/dbraw/zinc/20/38/92/1030203892.db2.gz VWXMGIKLHKVMST-ZDUSSCGKSA-N 1 1 312.369 3.550 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1Cc2ccccc2C[C@@H]1C ZINC000357813225 1030203901 /nfs/dbraw/zinc/20/39/01/1030203901.db2.gz VWXMGIKLHKVMST-ZDUSSCGKSA-N 1 1 312.369 3.550 20 5 DHBDMO COc1ccc(C[NH2+][C@@H]2CSc3ccccc32)cc1[N+](=O)[O-] ZINC000358022556 1030285091 /nfs/dbraw/zinc/28/50/91/1030285091.db2.gz OVTFSINJWHZKDO-CYBMUJFWSA-N 1 1 316.382 3.540 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000866539423 1030359283 /nfs/dbraw/zinc/35/92/83/1030359283.db2.gz CACZUDVUPXUSGD-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1cnn(C2CCC2)c1 ZINC000925696308 1030454913 /nfs/dbraw/zinc/45/49/13/1030454913.db2.gz ZEQABVMEQXHQHR-CHWSQXEVSA-N 1 1 314.389 3.928 20 5 DHBDMO CC[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc(OC)n1 ZINC000925693136 1030455731 /nfs/dbraw/zinc/45/57/31/1030455731.db2.gz OOWLJBFNTCKOJI-JSGCOSHPSA-N 1 1 315.373 3.800 20 5 DHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000291522540 1030531512 /nfs/dbraw/zinc/53/15/12/1030531512.db2.gz JIDTYSHGHRFFDL-MNDMWVCDSA-N 1 1 318.417 3.888 20 5 DHBDMO CC(C)[N@H+](Cc1cn2ccccc2n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350012 1030561788 /nfs/dbraw/zinc/56/17/88/1030561788.db2.gz MRJHFCFSNWDCOZ-UHFFFAOYSA-N 1 1 324.384 3.653 20 5 DHBDMO CC(C)[N@@H+](Cc1cn2ccccc2n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350012 1030561793 /nfs/dbraw/zinc/56/17/93/1030561793.db2.gz MRJHFCFSNWDCOZ-UHFFFAOYSA-N 1 1 324.384 3.653 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCSC[C@@H]2C2CC2)c1 ZINC000824914392 1030664075 /nfs/dbraw/zinc/66/40/75/1030664075.db2.gz RVYQEKDMONBEJM-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCSC[C@@H]2C2CC2)c1 ZINC000824914392 1030664085 /nfs/dbraw/zinc/66/40/85/1030664085.db2.gz RVYQEKDMONBEJM-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558742448 1030762944 /nfs/dbraw/zinc/76/29/44/1030762944.db2.gz NPHBAQMBFIICQG-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)C1 ZINC000359558463 1031028697 /nfs/dbraw/zinc/02/86/97/1031028697.db2.gz OJTVDFYGBXGOOS-SJKOYZFVSA-N 1 1 315.373 3.748 20 5 DHBDMO CC(C)[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1cnn(C)c1 ZINC000927067501 1031066321 /nfs/dbraw/zinc/06/63/21/1031066321.db2.gz RKDQMTDQDIJJKL-BDJLRTHQSA-N 1 1 320.368 3.515 20 5 DHBDMO CCOc1cc(C[N@@H+](C2CC2)C2CCCC2)ccc1[N+](=O)[O-] ZINC000559072706 1031086453 /nfs/dbraw/zinc/08/64/53/1031086453.db2.gz AYVBPBXVAQXUMR-UHFFFAOYSA-N 1 1 304.390 3.901 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCc3c(O)cccc32)c(F)c1 ZINC000359807652 1031144935 /nfs/dbraw/zinc/14/49/35/1031144935.db2.gz UXCZJLCCKRRZQP-MRXNPFEDSA-N 1 1 316.332 3.607 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1cc(O)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000872026732 1031409390 /nfs/dbraw/zinc/40/93/90/1031409390.db2.gz FGXKZAIANCWDQN-GHMZBOCLSA-N 1 1 304.321 3.851 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1cccc(O)c1F)c1cccc([N+](=O)[O-])c1 ZINC000872026393 1031410854 /nfs/dbraw/zinc/41/08/54/1031410854.db2.gz AFBIEDWZXJOGIM-GHMZBOCLSA-N 1 1 304.321 3.851 20 5 DHBDMO Cc1nc(C)c(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])s1 ZINC000872038788 1031423481 /nfs/dbraw/zinc/42/34/81/1031423481.db2.gz OKDYBDZXRHCCGH-SECBINFHSA-N 1 1 309.366 3.658 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c(C)c1 ZINC000872050016 1031438135 /nfs/dbraw/zinc/43/81/35/1031438135.db2.gz XVNUSYLCOXKCNM-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cc(O)ccc1F ZINC000872073504 1031469943 /nfs/dbraw/zinc/46/99/43/1031469943.db2.gz QGMFZITUHZMCOZ-WDEREUQCSA-N 1 1 304.321 3.851 20 5 DHBDMO COc1cccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c1C ZINC000872087580 1031484022 /nfs/dbraw/zinc/48/40/22/1031484022.db2.gz FNVMVESIKLTLCV-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c1 ZINC000360663225 1031513438 /nfs/dbraw/zinc/51/34/38/1031513438.db2.gz JINVAMBSXNKMAP-IBGZPJMESA-N 1 1 324.380 3.616 20 5 DHBDMO COc1cc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)ccc1[N+](=O)[O-] ZINC000360704804 1031527760 /nfs/dbraw/zinc/52/77/60/1031527760.db2.gz TZJSMWRYKLIWKS-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO COc1cc(C[N@H+]2Cc3ccccc3C3(CC3)C2)ccc1[N+](=O)[O-] ZINC000360704804 1031527775 /nfs/dbraw/zinc/52/77/75/1031527775.db2.gz TZJSMWRYKLIWKS-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO CCCc1nc(C)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000293800813 1031630454 /nfs/dbraw/zinc/63/04/54/1031630454.db2.gz UZBKVRHJPJUWGU-LLVKDONJSA-N 1 1 303.362 3.695 20 5 DHBDMO COCC1(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)CCC1 ZINC000361284844 1031835850 /nfs/dbraw/zinc/83/58/50/1031835850.db2.gz AZBLFQAABUTHJK-UHFFFAOYSA-N 1 1 306.406 3.622 20 5 DHBDMO CCC[N@@H+](CC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000124842549 1031980931 /nfs/dbraw/zinc/98/09/31/1031980931.db2.gz WLHYNQVNQRQKHX-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1cccc(F)c1F ZINC000294542497 1032054899 /nfs/dbraw/zinc/05/48/99/1032054899.db2.gz AKXVODXPDHUNTK-VHSXEESVSA-N 1 1 321.327 3.867 20 5 DHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000136891581 1033315101 /nfs/dbraw/zinc/31/51/01/1033315101.db2.gz QSYQACRTTJGJDV-HUUCEWRRSA-N 1 1 318.398 3.527 20 5 DHBDMO CC1=C(c2ccco2)C[N@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000338342638 1033326942 /nfs/dbraw/zinc/32/69/42/1033326942.db2.gz JEOZDCMJHOUJRX-UHFFFAOYSA-N 1 1 304.371 3.929 20 5 DHBDMO CC1=C(c2ccco2)C[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000338342638 1033326958 /nfs/dbraw/zinc/32/69/58/1033326958.db2.gz JEOZDCMJHOUJRX-UHFFFAOYSA-N 1 1 304.371 3.929 20 5 DHBDMO Cc1c(C[NH+]2CC(C)(CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000877581996 1033367637 /nfs/dbraw/zinc/36/76/37/1033367637.db2.gz CSGKEMZLEQUCOP-UHFFFAOYSA-N 1 1 302.296 3.678 20 5 DHBDMO C[C@H]1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1(F)F ZINC001172903263 1033436746 /nfs/dbraw/zinc/43/67/46/1033436746.db2.gz GEQHNGUOLLJWRO-SWLSCSKDSA-N 1 1 324.371 3.819 20 5 DHBDMO C[C@H]1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1(F)F ZINC001172903263 1033436755 /nfs/dbraw/zinc/43/67/55/1033436755.db2.gz GEQHNGUOLLJWRO-SWLSCSKDSA-N 1 1 324.371 3.819 20 5 DHBDMO C[C@@]1(F)CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172906114 1033436917 /nfs/dbraw/zinc/43/69/17/1033436917.db2.gz WILNKDKVPPEXOL-NVXWUHKLSA-N 1 1 306.381 3.666 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCCCC(F)(F)C1)CC2 ZINC001172907066 1033439770 /nfs/dbraw/zinc/43/97/70/1033439770.db2.gz CICIYLFZOWSPOR-OAHLLOKOSA-N 1 1 324.371 3.963 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCCCC(F)(F)C1)CC2 ZINC001172907066 1033439777 /nfs/dbraw/zinc/43/97/77/1033439777.db2.gz CICIYLFZOWSPOR-OAHLLOKOSA-N 1 1 324.371 3.963 20 5 DHBDMO Cc1cc2c(cn1)C[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172919881 1033467256 /nfs/dbraw/zinc/46/72/56/1033467256.db2.gz HTPWIVFQMRLZJS-GOSISDBHSA-N 1 1 323.396 3.561 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccc(Cl)n2)C2CC2)c1 ZINC000153292306 1033572979 /nfs/dbraw/zinc/57/29/79/1033572979.db2.gz MJERHWNMSKYDPL-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc(Cl)n2)C2CC2)c1 ZINC000153292306 1033572987 /nfs/dbraw/zinc/57/29/87/1033572987.db2.gz MJERHWNMSKYDPL-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO CCCCC[N@@H+](C)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184781 1033583766 /nfs/dbraw/zinc/58/37/66/1033583766.db2.gz OXSSXIPOXMCJQT-GFCCVEGCSA-N 1 1 312.385 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@H](C)CC2)c1F ZINC001173182802 1033584473 /nfs/dbraw/zinc/58/44/73/1033584473.db2.gz UHSVQBQCRJNRLR-QWHCGFSZSA-N 1 1 324.396 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)C2CCCCC2)c1F ZINC001173185940 1033584689 /nfs/dbraw/zinc/58/46/89/1033584689.db2.gz QCBDPONNFXLUEW-LBPRGKRZSA-N 1 1 324.396 3.938 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)C(F)(F)CC1 ZINC001173229508 1033605628 /nfs/dbraw/zinc/60/56/28/1033605628.db2.gz VGRYZWUBFFYMPI-OLZOCXBDSA-N 1 1 312.360 3.893 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cccc(F)c1F ZINC001173230230 1033605920 /nfs/dbraw/zinc/60/59/20/1033605920.db2.gz CZYFXCGWEDAGKA-LBPRGKRZSA-N 1 1 320.339 3.936 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC001173228382 1033606293 /nfs/dbraw/zinc/60/62/93/1033606293.db2.gz VTXOBXIQDUQEOQ-YPMHNXCESA-N 1 1 316.323 3.800 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](Cc1ccco1)C1CC1 ZINC001173230279 1033606368 /nfs/dbraw/zinc/60/63/68/1033606368.db2.gz DNUGVCBCLIEQBW-CYBMUJFWSA-N 1 1 300.358 3.783 20 5 DHBDMO Cc1csc([C@H]2CC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000880010431 1034184457 /nfs/dbraw/zinc/18/44/57/1034184457.db2.gz UEKLCQWLWFWZRN-JSGCOSHPSA-N 1 1 317.414 3.910 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC(C)(C)O1 ZINC000480511125 1034276107 /nfs/dbraw/zinc/27/61/07/1034276107.db2.gz LBOKHEKHEHCOKT-INIZCTEOSA-N 1 1 306.406 3.763 20 5 DHBDMO C[C@H]([NH2+]C[C@@H](C1CCCCC1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000480693191 1034404782 /nfs/dbraw/zinc/40/47/82/1034404782.db2.gz JSSHHIMPOABZKA-KSSFIOAISA-N 1 1 319.449 3.756 20 5 DHBDMO CCC[C@H]([NH2+]Cc1cccnc1F)c1cccc([N+](=O)[O-])c1 ZINC000794835152 1034593660 /nfs/dbraw/zinc/59/36/60/1034593660.db2.gz KSSFHTCTEUAZNP-HNNXBMFYSA-N 1 1 303.337 3.760 20 5 DHBDMO CCC[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865460960 1034655858 /nfs/dbraw/zinc/65/58/58/1034655858.db2.gz SCVYTDDSGBMLFL-LLVKDONJSA-N 1 1 313.348 3.676 20 5 DHBDMO CC(C)CC[C@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000481709838 1034946578 /nfs/dbraw/zinc/94/65/78/1034946578.db2.gz ARBXOKZZJPYTFP-KRWDZBQOSA-N 1 1 308.422 3.602 20 5 DHBDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000481756593 1034961572 /nfs/dbraw/zinc/96/15/72/1034961572.db2.gz OIFYGEQFAFZSBW-GXFFZTMASA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000481756593 1034961568 /nfs/dbraw/zinc/96/15/68/1034961568.db2.gz OIFYGEQFAFZSBW-GXFFZTMASA-N 1 1 302.296 3.758 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@H](C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000481976073 1035039488 /nfs/dbraw/zinc/03/94/88/1035039488.db2.gz XROYFRFTWWSINV-JKSUJKDBSA-N 1 1 319.449 3.674 20 5 DHBDMO C[C@H]1CCC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000159412730 1035048859 /nfs/dbraw/zinc/04/88/59/1035048859.db2.gz QIARJUMZRKTRSW-JTQLQIEISA-N 1 1 313.195 3.589 20 5 DHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000159412730 1035048864 /nfs/dbraw/zinc/04/88/64/1035048864.db2.gz QIARJUMZRKTRSW-JTQLQIEISA-N 1 1 313.195 3.589 20 5 DHBDMO Cc1c([C@H](C)NCC[NH+]2[C@@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000482627043 1035149668 /nfs/dbraw/zinc/14/96/68/1035149668.db2.gz GRGBGVUPQOVPRP-DZKIICNBSA-N 1 1 319.449 3.817 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](CC1CC1)CC1CCC1 ZINC000483268371 1035249347 /nfs/dbraw/zinc/24/93/47/1035249347.db2.gz ORQRWDODOBNOSI-UHFFFAOYSA-N 1 1 304.390 3.616 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCSCC[C@H]1C ZINC000483424814 1035268377 /nfs/dbraw/zinc/26/83/77/1035268377.db2.gz GEYUGRNJRNYPMM-JWAFFJSPSA-N 1 1 306.431 3.826 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494699989 1035778950 /nfs/dbraw/zinc/77/89/50/1035778950.db2.gz AJCNDYSZYSLEOI-ZFWWWQNUSA-N 1 1 304.390 3.547 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000076069431 1035802815 /nfs/dbraw/zinc/80/28/15/1035802815.db2.gz XAZWUZFMBOSXKP-VXGBXAGGSA-N 1 1 312.410 3.840 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000076069431 1035802832 /nfs/dbraw/zinc/80/28/32/1035802832.db2.gz XAZWUZFMBOSXKP-VXGBXAGGSA-N 1 1 312.410 3.840 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000076069426 1035804155 /nfs/dbraw/zinc/80/41/55/1035804155.db2.gz XAZWUZFMBOSXKP-NWDGAFQWSA-N 1 1 312.410 3.840 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000076069426 1035804178 /nfs/dbraw/zinc/80/41/78/1035804178.db2.gz XAZWUZFMBOSXKP-NWDGAFQWSA-N 1 1 312.410 3.840 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1 ZINC000446889170 1035922146 /nfs/dbraw/zinc/92/21/46/1035922146.db2.gz SRTJVVOZWQAUGP-OWCLPIDISA-N 1 1 317.433 3.745 20 5 DHBDMO CS[C@H]1CCCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000539900453 1035926427 /nfs/dbraw/zinc/92/64/27/1035926427.db2.gz SUOTXMLDHFUHAT-LYASGUKUSA-N 1 1 306.431 3.826 20 5 DHBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCC[C@H](C)C1 ZINC000252209859 1035941906 /nfs/dbraw/zinc/94/19/06/1035941906.db2.gz WASVFEWCECDWBE-NWDGAFQWSA-N 1 1 311.813 3.781 20 5 DHBDMO C[N@@H+](CCCc1cccc(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000485799831 1035973569 /nfs/dbraw/zinc/97/35/69/1035973569.db2.gz JUSLZFFTNFWUEZ-UHFFFAOYSA-N 1 1 302.349 3.799 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c1 ZINC000152917801 1036035291 /nfs/dbraw/zinc/03/52/91/1036035291.db2.gz OEEGBMNQAFUKJF-KRWDZBQOSA-N 1 1 304.390 3.518 20 5 DHBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000773961615 1036071976 /nfs/dbraw/zinc/07/19/76/1036071976.db2.gz SOHKMDRUDHLXRH-INIZCTEOSA-N 1 1 310.369 3.515 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC(C)(CC(F)(F)F)C1 ZINC001182227468 1036135637 /nfs/dbraw/zinc/13/56/37/1036135637.db2.gz NXLCWSBYZLKMMM-UHFFFAOYSA-N 1 1 316.323 3.986 20 5 DHBDMO CCOc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000495071573 1036220826 /nfs/dbraw/zinc/22/08/26/1036220826.db2.gz PUKKPSOFRLIRLF-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000495071573 1036220842 /nfs/dbraw/zinc/22/08/42/1036220842.db2.gz PUKKPSOFRLIRLF-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO C[C@@H](Cc1ccsc1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000541234896 1036267588 /nfs/dbraw/zinc/26/75/88/1036267588.db2.gz RXAXBMGFUJWWNE-LBPRGKRZSA-N 1 1 302.399 3.646 20 5 DHBDMO COc1ccc2c(c1)CCC[N@H+](Cc1ccccc1[N+](=O)[O-])C2 ZINC000609133992 1036395681 /nfs/dbraw/zinc/39/56/81/1036395681.db2.gz VPWWDHUIKCOABX-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCOc1c(Cl)cccc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000486934384 1036477236 /nfs/dbraw/zinc/47/72/36/1036477236.db2.gz BHKQWNUZAZPQKI-UHFFFAOYSA-N 1 1 320.776 3.937 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000542053489 1036502878 /nfs/dbraw/zinc/50/28/78/1036502878.db2.gz URIMHSUVFAEPFD-CFVMTHIKSA-N 1 1 304.390 3.614 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H](C3CCC3)CC2)cc1 ZINC001197202081 1036704964 /nfs/dbraw/zinc/70/49/64/1036704964.db2.gz LORFEQRAMPSWAC-QAPCUYQASA-N 1 1 318.417 3.530 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](C3CCC3)CC2)cc1 ZINC001197201374 1036706695 /nfs/dbraw/zinc/70/66/95/1036706695.db2.gz CONUZHZZIDQHTO-MRXNPFEDSA-N 1 1 318.417 3.876 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H](C3CCC3)CC2)cc1 ZINC001197201373 1036707203 /nfs/dbraw/zinc/70/72/03/1036707203.db2.gz CONUZHZZIDQHTO-INIZCTEOSA-N 1 1 318.417 3.876 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@H]2C2CCC2)ccc1[N+](=O)[O-] ZINC000492391732 1036860772 /nfs/dbraw/zinc/86/07/72/1036860772.db2.gz AOWWTTWHZMUTAH-HNNXBMFYSA-N 1 1 304.390 3.758 20 5 DHBDMO CCOc1cc(C[N@H+](Cc2ccco2)C(C)C)ccc1[N+](=O)[O-] ZINC000492603708 1036940915 /nfs/dbraw/zinc/94/09/15/1036940915.db2.gz CDODWVONDDDLFZ-UHFFFAOYSA-N 1 1 318.373 3.997 20 5 DHBDMO CCOc1cc(C[N@@H+](Cc2ccco2)C(C)C)ccc1[N+](=O)[O-] ZINC000492603708 1036940933 /nfs/dbraw/zinc/94/09/33/1036940933.db2.gz CDODWVONDDDLFZ-UHFFFAOYSA-N 1 1 318.373 3.997 20 5 DHBDMO COc1cc(C[N@H+]2CCCC23CCCCC3)ccc1[N+](=O)[O-] ZINC000492662095 1036957542 /nfs/dbraw/zinc/95/75/42/1036957542.db2.gz UUXMUUUPNXLHBB-UHFFFAOYSA-N 1 1 304.390 3.902 20 5 DHBDMO CC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)Cc1ccccn1 ZINC000094914063 1037071851 /nfs/dbraw/zinc/07/18/51/1037071851.db2.gz UVVITAXAHYGGTK-UHFFFAOYSA-N 1 1 305.765 3.665 20 5 DHBDMO CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)Cc1ccccn1 ZINC000094914063 1037071871 /nfs/dbraw/zinc/07/18/71/1037071871.db2.gz UVVITAXAHYGGTK-UHFFFAOYSA-N 1 1 305.765 3.665 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000489501755 1037455390 /nfs/dbraw/zinc/45/53/90/1037455390.db2.gz QMVUTLMHYIZLHL-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO Cc1[nH+]ccn1Cc1ccc(Nc2cc(O)cc([N+](=O)[O-])c2)cc1 ZINC001201222373 1037579844 /nfs/dbraw/zinc/57/98/44/1037579844.db2.gz LXCCPUISRAQRIC-UHFFFAOYSA-N 1 1 324.340 3.597 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@H](C4CC4)C3)c2c1 ZINC000763334251 1037591176 /nfs/dbraw/zinc/59/11/76/1037591176.db2.gz VTEUMGQHWSZIEY-NSHDSACASA-N 1 1 319.386 3.561 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000490090301 1037608952 /nfs/dbraw/zinc/60/89/52/1037608952.db2.gz PXTSDILIFKBKBI-ZDUSSCGKSA-N 1 1 322.405 3.628 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC001201373454 1037617840 /nfs/dbraw/zinc/61/78/40/1037617840.db2.gz WTCKRPKVIJCURT-CQSZACIVSA-N 1 1 318.760 3.780 20 5 DHBDMO CCOc1ccc(C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)o1 ZINC001201490949 1037712523 /nfs/dbraw/zinc/71/25/23/1037712523.db2.gz GMUMAJNNNWTKNY-OAHLLOKOSA-N 1 1 304.346 3.827 20 5 DHBDMO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490593063 1037747537 /nfs/dbraw/zinc/74/75/37/1037747537.db2.gz UGSGRGZLLOGJPK-LBPRGKRZSA-N 1 1 300.333 3.681 20 5 DHBDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490593063 1037747560 /nfs/dbraw/zinc/74/75/60/1037747560.db2.gz UGSGRGZLLOGJPK-LBPRGKRZSA-N 1 1 300.333 3.681 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c(F)c1 ZINC000491075832 1037894189 /nfs/dbraw/zinc/89/41/89/1037894189.db2.gz ILNJMYOMGTZHGM-CYBMUJFWSA-N 1 1 318.323 3.863 20 5 DHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000571018714 1038055867 /nfs/dbraw/zinc/05/58/67/1038055867.db2.gz XLNDOROPRPLACI-CHWSQXEVSA-N 1 1 302.378 3.531 20 5 DHBDMO Cc1ccccc1OCC[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000916973431 1038099719 /nfs/dbraw/zinc/09/97/19/1038099719.db2.gz JOVYXMIHKNTOGS-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO Cc1ccccc1OCC[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000916973431 1038099736 /nfs/dbraw/zinc/09/97/36/1038099736.db2.gz JOVYXMIHKNTOGS-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO Cc1cc(C)c(Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)c(C)[nH+]1 ZINC001189627533 1038185344 /nfs/dbraw/zinc/18/53/44/1038185344.db2.gz YCJQCWOGNSIOSN-UHFFFAOYSA-N 1 1 322.368 3.827 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1CCCC1(F)F)C1CC1 ZINC000588232713 1038278999 /nfs/dbraw/zinc/27/89/99/1038278999.db2.gz YHXWEAVFPMIZSC-HIFRSBDPSA-N 1 1 310.344 3.693 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[C@H](C2CC2)O1 ZINC001190528948 1038337180 /nfs/dbraw/zinc/33/71/80/1038337180.db2.gz OPQVZPHOLMXYSS-ZWKOTPCHSA-N 1 1 318.417 3.763 20 5 DHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001190590207 1038351919 /nfs/dbraw/zinc/35/19/19/1038351919.db2.gz WOWUEVCRUYTVFV-ZBFHGGJFSA-N 1 1 306.406 3.874 20 5 DHBDMO C[C@H]1[C@H](Nc2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000588854686 1038387731 /nfs/dbraw/zinc/38/77/31/1038387731.db2.gz AMPDOGPEJFXCEI-GXTWGEPZSA-N 1 1 317.414 3.731 20 5 DHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001192173266 1038597925 /nfs/dbraw/zinc/59/79/25/1038597925.db2.gz HLALPGJZLCQODO-YOEHRIQHSA-N 1 1 306.406 3.874 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC(CC(F)(F)F)C1 ZINC000590968718 1038732831 /nfs/dbraw/zinc/73/28/31/1038732831.db2.gz DRARCLCRNZXGDG-VZUCSPMQSA-N 1 1 314.307 3.882 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCCc2scnc21)c1cccc([N+](=O)[O-])c1 ZINC000599023757 1038989464 /nfs/dbraw/zinc/98/94/64/1038989464.db2.gz LGWVYMXYPINZKZ-ZWNOBZJWSA-N 1 1 303.387 3.780 20 5 DHBDMO CCc1noc(CC)c1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000166964735 1039039618 /nfs/dbraw/zinc/03/96/18/1039039618.db2.gz BAFJIVBMCZUQPZ-GFCCVEGCSA-N 1 1 317.389 3.867 20 5 DHBDMO Cc1[nH]c2nc[nH+]c(N[C@H](C)c3ccccc3[N+](=O)[O-])c2c1C ZINC000591927975 1039045119 /nfs/dbraw/zinc/04/51/19/1039045119.db2.gz FPOMQHSJJKELPB-LLVKDONJSA-N 1 1 311.345 3.656 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](C2CC2)C2CCCCC2)c1 ZINC000061162587 1039059903 /nfs/dbraw/zinc/05/99/03/1039059903.db2.gz SFKJPFJNVIHCQF-UHFFFAOYSA-N 1 1 304.390 3.771 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593696017 1039087142 /nfs/dbraw/zinc/08/71/42/1039087142.db2.gz ATZGKNJDOWPEGX-CUXKMMBLSA-N 1 1 308.328 3.729 20 5 DHBDMO Cc1c(NC(=O)CC[N@H+](C)CCC(C)(C)C)cccc1[N+](=O)[O-] ZINC000592145493 1039137508 /nfs/dbraw/zinc/13/75/08/1039137508.db2.gz WJEUHSZCJAPKAY-UHFFFAOYSA-N 1 1 321.421 3.600 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592183146 1039162800 /nfs/dbraw/zinc/16/28/00/1039162800.db2.gz RURKPMQXSBNOEL-KGLIPLIRSA-N 1 1 304.390 3.547 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000592189856 1039167938 /nfs/dbraw/zinc/16/79/38/1039167938.db2.gz XWPJGHVHEAKQPV-UONOGXRCSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000592189856 1039167942 /nfs/dbraw/zinc/16/79/42/1039167942.db2.gz XWPJGHVHEAKQPV-UONOGXRCSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1cc2n(n1)CCCC2 ZINC000592386860 1039183846 /nfs/dbraw/zinc/18/38/46/1039183846.db2.gz KXUAUQIEOHLSQT-CHWSQXEVSA-N 1 1 314.389 3.539 20 5 DHBDMO C/C=C/C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000599691848 1039259949 /nfs/dbraw/zinc/25/99/49/1039259949.db2.gz UAGJPOMHWDABDF-IBUXWKBASA-N 1 1 315.373 3.914 20 5 DHBDMO C/C=C/C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000599691855 1039260241 /nfs/dbraw/zinc/26/02/41/1039260241.db2.gz UAGJPOMHWDABDF-YWVDXFKGSA-N 1 1 315.373 3.914 20 5 DHBDMO CCCC[C@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000574085324 1039388048 /nfs/dbraw/zinc/38/80/48/1039388048.db2.gz ZKOCWFBLPZZSAO-AWEZNQCLSA-N 1 1 321.421 3.742 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3ccc(O)cc32)c(Cl)c1 ZINC000594978406 1039948675 /nfs/dbraw/zinc/94/86/75/1039948675.db2.gz AWLPUZFFVSUFRJ-MRXNPFEDSA-N 1 1 318.760 3.731 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1cnccc1C ZINC000595022673 1039988123 /nfs/dbraw/zinc/98/81/23/1039988123.db2.gz UXQMRVRQLXYLCG-STQMWFEESA-N 1 1 315.373 3.719 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccccc1F ZINC000595007628 1040016790 /nfs/dbraw/zinc/01/67/90/1040016790.db2.gz PCMYOPIVHQFGGS-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1sc(C)nc1C ZINC000595029363 1040036851 /nfs/dbraw/zinc/03/68/51/1040036851.db2.gz XKOVMTKVQIMBRS-SECBINFHSA-N 1 1 321.402 3.528 20 5 DHBDMO Cc1noc(C[N@H+](Cc2cccc(C)c2)CC(C)C)c1[N+](=O)[O-] ZINC000595296857 1040089707 /nfs/dbraw/zinc/08/97/07/1040089707.db2.gz MOZMDBWHMFEUGC-UHFFFAOYSA-N 1 1 317.389 3.858 20 5 DHBDMO Cc1noc(C[N@@H+](Cc2cccc(C)c2)CC(C)C)c1[N+](=O)[O-] ZINC000595296857 1040089726 /nfs/dbraw/zinc/08/97/26/1040089726.db2.gz MOZMDBWHMFEUGC-UHFFFAOYSA-N 1 1 317.389 3.858 20 5 DHBDMO CC[N@H+](Cc1ccc(OC)cc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595296090 1040091701 /nfs/dbraw/zinc/09/17/01/1040091701.db2.gz IDBKKAPDUQJNGW-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595296090 1040091720 /nfs/dbraw/zinc/09/17/20/1040091720.db2.gz IDBKKAPDUQJNGW-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@@H](c3ccccc3C)C[C@H]2C)c1[N+](=O)[O-] ZINC000595323572 1040109353 /nfs/dbraw/zinc/10/93/53/1040109353.db2.gz ZKJKAIRKRVOLBB-OCCSQVGLSA-N 1 1 315.373 3.578 20 5 DHBDMO Cc1noc(C[N@@H+](C(C)C)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000595500966 1040156143 /nfs/dbraw/zinc/15/61/43/1040156143.db2.gz VFAKPTKAIJUAIK-CYBMUJFWSA-N 1 1 303.362 3.863 20 5 DHBDMO Cc1noc(C[N@H+](C(C)C)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000595500966 1040156144 /nfs/dbraw/zinc/15/61/44/1040156144.db2.gz VFAKPTKAIJUAIK-CYBMUJFWSA-N 1 1 303.362 3.863 20 5 DHBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C1CC(OC(C)(C)C)C1 ZINC000595545532 1040170870 /nfs/dbraw/zinc/17/08/70/1040170870.db2.gz IZYLCUDRQHDQLQ-UHFFFAOYSA-N 1 1 310.369 3.512 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(c2ccco2)CC1 ZINC000595616780 1040193782 /nfs/dbraw/zinc/19/37/82/1040193782.db2.gz COBUPRWDFYQCAB-UHFFFAOYSA-N 1 1 304.321 3.707 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2c2c(C)cccc2C)c1[N+](=O)[O-] ZINC000595599781 1040200700 /nfs/dbraw/zinc/20/07/00/1040200700.db2.gz CHIRROPTUMJAMB-AWEZNQCLSA-N 1 1 315.373 3.845 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](CCF)C1 ZINC000595756839 1040243328 /nfs/dbraw/zinc/24/33/28/1040243328.db2.gz XTAPUBCHJNWAGF-NSHDSACASA-N 1 1 300.761 3.820 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC([C@H]2CCCCO2)CC1 ZINC000595787983 1040255293 /nfs/dbraw/zinc/25/52/93/1040255293.db2.gz LNZSSAMBRVGFBT-QGZVFWFLSA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000595785290 1040255384 /nfs/dbraw/zinc/25/53/84/1040255384.db2.gz DACGJCBYMJMLSA-WMLDXEAASA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000595787654 1040256267 /nfs/dbraw/zinc/25/62/67/1040256267.db2.gz FQSRPGYBVJXGIT-GUYCJALGSA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H](C4CCC4)C3)nc2c1 ZINC000595831557 1040266669 /nfs/dbraw/zinc/26/66/69/1040266669.db2.gz FTHDUDGOCWYCML-ZDUSSCGKSA-N 1 1 315.373 3.748 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC2CC1(c1ccccc1)C2 ZINC000595911142 1040272224 /nfs/dbraw/zinc/27/22/24/1040272224.db2.gz NUWULVSIZCEVKK-UHFFFAOYSA-N 1 1 312.344 3.855 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC2CC1(c1ccccc1)C2 ZINC000595911142 1040272256 /nfs/dbraw/zinc/27/22/56/1040272256.db2.gz NUWULVSIZCEVKK-UHFFFAOYSA-N 1 1 312.344 3.855 20 5 DHBDMO C[C@@H]1C[C@H](Nc2ccc(C(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000596154970 1040329783 /nfs/dbraw/zinc/32/97/83/1040329783.db2.gz GLJORNOEWNIEHU-KOLCDFICSA-N 1 1 311.332 3.570 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2ccc(C(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000596154972 1040331874 /nfs/dbraw/zinc/33/18/74/1040331874.db2.gz GLJORNOEWNIEHU-MWLCHTKSSA-N 1 1 311.332 3.570 20 5 DHBDMO Cc1nc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)s1 ZINC000231883773 1040449308 /nfs/dbraw/zinc/44/93/08/1040449308.db2.gz TWAFBMAZGZVNHY-SNVBAGLBSA-N 1 1 305.403 3.827 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000174350036 1040629243 /nfs/dbraw/zinc/62/92/43/1040629243.db2.gz GIGGLRIVAARAGA-UONOGXRCSA-N 1 1 312.410 3.840 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCOC2(CCCCC2)C1 ZINC000075832380 1040826381 /nfs/dbraw/zinc/82/63/81/1040826381.db2.gz CKCFFXLZQQSSLH-AWEZNQCLSA-N 1 1 304.390 3.691 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCOC2(CCCCC2)C1 ZINC000075832380 1040826397 /nfs/dbraw/zinc/82/63/97/1040826397.db2.gz CKCFFXLZQQSSLH-AWEZNQCLSA-N 1 1 304.390 3.691 20 5 DHBDMO C[N@@H+](CCOc1ccccc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000761240330 1040905875 /nfs/dbraw/zinc/90/58/75/1040905875.db2.gz WGIYCADGGBJSEH-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO CC[C@@H](CC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602619009 1041119247 /nfs/dbraw/zinc/11/92/47/1041119247.db2.gz VOFZESWMGYZTDR-QMMMGPOBSA-N 1 1 317.267 3.557 20 5 DHBDMO C[N@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C(C)(C)C ZINC000602697410 1041157219 /nfs/dbraw/zinc/15/72/19/1041157219.db2.gz PTHNGJIVIJHTFW-UHFFFAOYSA-N 1 1 307.213 3.649 20 5 DHBDMO C[N@@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C(C)(C)C ZINC000602697410 1041157224 /nfs/dbraw/zinc/15/72/24/1041157224.db2.gz PTHNGJIVIJHTFW-UHFFFAOYSA-N 1 1 307.213 3.649 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H](c2cccnc2)C1 ZINC000602855938 1041265344 /nfs/dbraw/zinc/26/53/44/1041265344.db2.gz QOZJJFKJXZJMSE-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2cccnc2)C1 ZINC000602857966 1041265975 /nfs/dbraw/zinc/26/59/75/1041265975.db2.gz ZNAXGOMQBLNQQG-WMLDXEAASA-N 1 1 311.385 3.930 20 5 DHBDMO CCn1nc(C)c(C[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000602924552 1041318314 /nfs/dbraw/zinc/31/83/14/1041318314.db2.gz FHZGIUFQPOLLOY-CYBMUJFWSA-N 1 1 316.405 3.621 20 5 DHBDMO CCn1nc(C)c(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000602924552 1041318321 /nfs/dbraw/zinc/31/83/21/1041318321.db2.gz FHZGIUFQPOLLOY-CYBMUJFWSA-N 1 1 316.405 3.621 20 5 DHBDMO Cc1csc(C2([NH2+]Cc3ccccc3[N+](=O)[O-])CCCC2)n1 ZINC000081596418 192299385 /nfs/dbraw/zinc/29/93/85/192299385.db2.gz FICKABZNHBHCOM-UHFFFAOYSA-N 1 1 317.414 3.919 20 5 DHBDMO CCOc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000236947655 202087065 /nfs/dbraw/zinc/08/70/65/202087065.db2.gz OZFRNFVZKOIFAY-UHFFFAOYSA-N 1 1 320.776 3.937 20 5 DHBDMO CCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000104695269 194028297 /nfs/dbraw/zinc/02/82/97/194028297.db2.gz UYCZYPSVGZSVMK-UHFFFAOYSA-N 1 1 315.373 3.667 20 5 DHBDMO CC(C)(C)c1csc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000105498715 194107524 /nfs/dbraw/zinc/10/75/24/194107524.db2.gz TYCSGTMLSBSKTN-UHFFFAOYSA-N 1 1 305.403 3.639 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000106465745 194218569 /nfs/dbraw/zinc/21/85/69/194218569.db2.gz QEMUNTWZVASJKD-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000184222984 335064175 /nfs/dbraw/zinc/06/41/75/335064175.db2.gz RKPQQCPDRJNGHC-RISCZKNCSA-N 1 1 308.353 3.507 20 5 DHBDMO C[C@@H](C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000273109163 130090385 /nfs/dbraw/zinc/09/03/85/130090385.db2.gz XBXPNBSADARDOF-RYUDHWBXSA-N 1 1 305.403 3.848 20 5 DHBDMO C[C@@]12CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]1C2(Cl)Cl ZINC000284814750 131113551 /nfs/dbraw/zinc/11/35/51/131113551.db2.gz PLJXPVSOHDTODR-QWHCGFSZSA-N 1 1 315.200 3.611 20 5 DHBDMO C[C@@]12CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]1C2(Cl)Cl ZINC000284814750 131113552 /nfs/dbraw/zinc/11/35/52/131113552.db2.gz PLJXPVSOHDTODR-QWHCGFSZSA-N 1 1 315.200 3.611 20 5 DHBDMO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000285351796 131159839 /nfs/dbraw/zinc/15/98/39/131159839.db2.gz ASOIVOWTKDPSCW-UHFFFAOYSA-N 1 1 323.780 3.878 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000289484377 131390084 /nfs/dbraw/zinc/39/00/84/131390084.db2.gz IOROJLZPPYOOGI-COXVUDFISA-N 1 1 316.401 3.689 20 5 DHBDMO CCc1nc(C)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000291809260 131601833 /nfs/dbraw/zinc/60/18/33/131601833.db2.gz CPCQQUGUFMRBCF-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(F)cn1 ZINC000297353796 132011799 /nfs/dbraw/zinc/01/17/99/132011799.db2.gz PGQKWBPUKNCGEX-QWRGUYRKSA-N 1 1 319.336 3.549 20 5 DHBDMO CCOC1(C)CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000298421938 132062081 /nfs/dbraw/zinc/06/20/81/132062081.db2.gz XSJYLHRMCVOYJO-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO COC[C@]1(C)CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000449391345 332114842 /nfs/dbraw/zinc/11/48/42/332114842.db2.gz HYFMTEBRZLJVGZ-QGZVFWFLSA-N 1 1 306.406 3.577 20 5 DHBDMO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000449463613 332237631 /nfs/dbraw/zinc/23/76/31/332237631.db2.gz WPTHBRPZDZPNJA-JQWIXIFHSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000408201457 332241106 /nfs/dbraw/zinc/24/11/06/332241106.db2.gz FMSRIMIXJGXCSK-UONOGXRCSA-N 1 1 304.390 3.547 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000195347879 335111181 /nfs/dbraw/zinc/11/11/81/335111181.db2.gz PVDFUCDBRLPHHT-OCCSQVGLSA-N 1 1 317.414 3.992 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@H](CC(C)C)[NH+](C)C)cc1[N+](=O)[O-] ZINC000314069989 333085694 /nfs/dbraw/zinc/08/56/94/333085694.db2.gz SSYCSSRLIDMEQJ-ZBFHGGJFSA-N 1 1 307.438 3.530 20 5 DHBDMO CCC(CC)[C@@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)N(C)C ZINC000314289395 333098709 /nfs/dbraw/zinc/09/87/09/333098709.db2.gz XIISTHCKZGQOQZ-CXAGYDPISA-N 1 1 307.438 3.612 20 5 DHBDMO Cc1c(C[NH2+][C@H](C)c2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000120450543 333283752 /nfs/dbraw/zinc/28/37/52/333283752.db2.gz CMOCULHPOXYBMQ-CYBMUJFWSA-N 1 1 324.384 3.641 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000319370838 333287621 /nfs/dbraw/zinc/28/76/21/333287621.db2.gz VEDVVOXHNQFYQK-GFCCVEGCSA-N 1 1 320.286 3.897 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000319370838 333287622 /nfs/dbraw/zinc/28/76/22/333287622.db2.gz VEDVVOXHNQFYQK-GFCCVEGCSA-N 1 1 320.286 3.897 20 5 DHBDMO Cc1ccc(C[NH2+]C[C@@]2(N(C)C)CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000390603557 333305699 /nfs/dbraw/zinc/30/56/99/333305699.db2.gz GGPARFCSNRZUKO-RDTXWAMCSA-N 1 1 319.449 3.503 20 5 DHBDMO COc1ccc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000525787622 333313696 /nfs/dbraw/zinc/31/36/96/333313696.db2.gz FUWIRZNOSSYMKD-SNPRPXQTSA-N 1 1 304.390 3.756 20 5 DHBDMO COc1ccc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000531378407 333347420 /nfs/dbraw/zinc/34/74/20/333347420.db2.gz ITQGUHQGJULZMN-ACJLOTCBSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1ccc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000531378407 333347421 /nfs/dbraw/zinc/34/74/21/333347421.db2.gz ITQGUHQGJULZMN-ACJLOTCBSA-N 1 1 312.369 3.796 20 5 DHBDMO Cc1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000414521197 334006080 /nfs/dbraw/zinc/00/60/80/334006080.db2.gz DTIUGMWKZDYZDG-QGZVFWFLSA-N 1 1 318.417 3.540 20 5 DHBDMO CC(C)c1ccc(C[NH2+]C[C@H](N)c2ccccc2)cc1[N+](=O)[O-] ZINC000414830918 334110529 /nfs/dbraw/zinc/11/05/29/334110529.db2.gz MNIYYFLOEIYQRT-KRWDZBQOSA-N 1 1 313.401 3.508 20 5 DHBDMO CCOC1CC2(C1)CC[N@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000285482509 334148342 /nfs/dbraw/zinc/14/83/42/334148342.db2.gz LREACOKKSRLDOQ-NXVRBGIVSA-N 1 1 318.417 3.855 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cc3ccccc3o1)C2 ZINC000534513779 334278405 /nfs/dbraw/zinc/27/84/05/334278405.db2.gz WTGMKHAHKQQEEK-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cc3ccccc3o1)C2 ZINC000534513779 334278406 /nfs/dbraw/zinc/27/84/06/334278406.db2.gz WTGMKHAHKQQEEK-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO Cc1ccccc1OCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000535081084 334366097 /nfs/dbraw/zinc/36/60/97/334366097.db2.gz VTBKMKUEZKXPIE-UHFFFAOYSA-N 1 1 320.414 3.866 20 5 DHBDMO Cc1ccccc1OCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000535081084 334366098 /nfs/dbraw/zinc/36/60/98/334366098.db2.gz VTBKMKUEZKXPIE-UHFFFAOYSA-N 1 1 320.414 3.866 20 5 DHBDMO C[C@H](c1ccc(F)cc1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000535250901 334382681 /nfs/dbraw/zinc/38/26/81/334382681.db2.gz GJFNMIYFKMHNHQ-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H](c1ccc(F)cc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000535250901 334382682 /nfs/dbraw/zinc/38/26/82/334382682.db2.gz GJFNMIYFKMHNHQ-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3c(c2)COC3)c(Cl)c1 ZINC000344336653 335242138 /nfs/dbraw/zinc/24/21/38/335242138.db2.gz TWNCSIDSDLRVIP-UHFFFAOYSA-N 1 1 318.760 3.568 20 5 DHBDMO CC(C)(C)C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000444640378 338478037 /nfs/dbraw/zinc/47/80/37/338478037.db2.gz PGMDATSTDJERIU-UHFFFAOYSA-N 1 1 316.405 3.729 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCO[C@H](C)C1 ZINC000352717259 336232049 /nfs/dbraw/zinc/23/20/49/336232049.db2.gz HXCSRZLOFNDIBS-GDBMZVCRSA-N 1 1 306.406 3.620 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000352767980 336233914 /nfs/dbraw/zinc/23/39/14/336233914.db2.gz FHKXVPYXTBQXHE-CYBMUJFWSA-N 1 1 304.390 3.616 20 5 DHBDMO C[C@@H]1C[C@@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000532575109 336257010 /nfs/dbraw/zinc/25/70/10/336257010.db2.gz NGIFWAFTOYBCTD-CHWSQXEVSA-N 1 1 315.373 3.523 20 5 DHBDMO C[C@H]1CCC[N@@H+](CCCCNc2cccc(F)c2[N+](=O)[O-])C1 ZINC000301117789 336290810 /nfs/dbraw/zinc/29/08/10/336290810.db2.gz WEOCOFIYQAOHLY-ZDUSSCGKSA-N 1 1 309.385 3.658 20 5 DHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 ZINC000301986410 336341510 /nfs/dbraw/zinc/34/15/10/336341510.db2.gz MHQRJUSWOJJNMQ-HOTGVXAUSA-N 1 1 317.433 3.686 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])cc2C)c1 ZINC000301990379 336341738 /nfs/dbraw/zinc/34/17/38/336341738.db2.gz PBOYVEVBVUAGPH-UHFFFAOYSA-N 1 1 313.401 3.967 20 5 DHBDMO Cc1ccc(N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302035169 336344556 /nfs/dbraw/zinc/34/45/56/336344556.db2.gz FFXSQYVNENUEST-CABCVRRESA-N 1 1 317.433 3.968 20 5 DHBDMO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1c(F)cncc1F ZINC000353148088 336404707 /nfs/dbraw/zinc/40/47/07/336404707.db2.gz ZJMXBPDCHSJCMQ-QZPNVGJNSA-N 1 1 319.311 3.632 20 5 DHBDMO C[C@H]([NH2+][C@@H]1c2cccc(F)c2O[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000370573372 336887824 /nfs/dbraw/zinc/88/78/24/336887824.db2.gz DHBGNHOVFFVBQM-MMPTUQATSA-N 1 1 316.332 3.907 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000377239255 337049200 /nfs/dbraw/zinc/04/92/00/337049200.db2.gz MGISCYHPZNYCJZ-HZPDHXFCSA-N 1 1 318.417 3.577 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000173404568 337135141 /nfs/dbraw/zinc/13/51/41/337135141.db2.gz RTDNVRRHHGRNHZ-ZBEGNZNMSA-N 1 1 316.332 3.908 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000174353520 337141074 /nfs/dbraw/zinc/14/10/74/337141074.db2.gz RWMRJIVZRWSEPX-KGLIPLIRSA-N 1 1 324.446 3.709 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000182674163 337189279 /nfs/dbraw/zinc/18/92/79/337189279.db2.gz QSVNWUIPYKGSOI-KBPBESRZSA-N 1 1 314.389 3.567 20 5 DHBDMO C[C@@H]([NH2+]Cc1nccn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000190794282 337290857 /nfs/dbraw/zinc/29/08/57/337290857.db2.gz UCROZDCWSKTUDI-CQSZACIVSA-N 1 1 322.368 3.631 20 5 DHBDMO C[C@@H]1CCSCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000191816877 337300447 /nfs/dbraw/zinc/30/04/47/337300447.db2.gz NKWYBIUJBJLNLQ-SNVBAGLBSA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@@H]1CCSCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000191816877 337300448 /nfs/dbraw/zinc/30/04/48/337300448.db2.gz NKWYBIUJBJLNLQ-SNVBAGLBSA-N 1 1 300.811 3.576 20 5 DHBDMO CC(C)([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000255276446 337601830 /nfs/dbraw/zinc/60/18/30/337601830.db2.gz RNDVLUNVBUQZNJ-ALCCZGGFSA-N 1 1 303.387 3.589 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2ccncc2Cl)cc1[N+](=O)[O-] ZINC000421827212 337646749 /nfs/dbraw/zinc/64/67/49/337646749.db2.gz WUHBKYDYPNHXRS-JTQLQIEISA-N 1 1 321.764 3.503 20 5 DHBDMO COc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000580438694 337676952 /nfs/dbraw/zinc/67/69/52/337676952.db2.gz YODWMAVHLJCWIV-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO C[C@H](c1ccco1)[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000086233156 338013711 /nfs/dbraw/zinc/01/37/11/338013711.db2.gz SEQQIQNXOPASKU-CYBMUJFWSA-N 1 1 316.357 3.792 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426456832 338032533 /nfs/dbraw/zinc/03/25/33/338032533.db2.gz FISJWOTWGLFNIG-BBRMVZONSA-N 1 1 304.390 3.756 20 5 DHBDMO C[C@@]12CC[N@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C[C@@H]1C2(F)F ZINC000428728577 338059742 /nfs/dbraw/zinc/05/97/42/338059742.db2.gz LFAKIUZKLDEIIQ-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@@]12CC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C[C@@H]1C2(F)F ZINC000428728577 338059743 /nfs/dbraw/zinc/05/97/43/338059743.db2.gz LFAKIUZKLDEIIQ-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(C(F)(F)F)s1 ZINC000428865884 338063204 /nfs/dbraw/zinc/06/32/04/338063204.db2.gz HSQWJXAXLCZAOO-UHFFFAOYSA-N 1 1 316.304 3.965 20 5 DHBDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000429287642 338076489 /nfs/dbraw/zinc/07/64/89/338076489.db2.gz NKSWSHYXCIRMEE-LLVKDONJSA-N 1 1 314.838 3.823 20 5 DHBDMO Cc1cccc2c1C[N@H+](Cc1nc3cc([N+](=O)[O-])ccc3o1)CC2 ZINC000429579942 338085025 /nfs/dbraw/zinc/08/50/25/338085025.db2.gz SLBYZKFJJYIRKU-UHFFFAOYSA-N 1 1 323.352 3.603 20 5 DHBDMO Cc1cccc2c1C[N@@H+](Cc1nc3cc([N+](=O)[O-])ccc3o1)CC2 ZINC000429579942 338085026 /nfs/dbraw/zinc/08/50/26/338085026.db2.gz SLBYZKFJJYIRKU-UHFFFAOYSA-N 1 1 323.352 3.603 20 5 DHBDMO Cc1c(C[N@H+]2CCS[C@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC000437531569 338312766 /nfs/dbraw/zinc/31/27/66/338312766.db2.gz AORXFTOLMLNDDK-CVEARBPZSA-N 1 1 306.431 3.763 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H]3Cc3ccccc3)nc2c1 ZINC000437827962 338322779 /nfs/dbraw/zinc/32/27/79/338322779.db2.gz IEEMTUPYSBLTIS-AWEZNQCLSA-N 1 1 323.352 3.553 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)CC1(c2ccccc2)CC1 ZINC000438260063 338338017 /nfs/dbraw/zinc/33/80/17/338338017.db2.gz OERADNGNDTUOCW-UHFFFAOYSA-N 1 1 314.360 3.898 20 5 DHBDMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(C)(C)C ZINC000463364919 339115895 /nfs/dbraw/zinc/11/58/95/339115895.db2.gz BVKJKVDXHHQHOJ-UHFFFAOYSA-N 1 1 321.421 3.600 20 5 DHBDMO Cc1c(C[N@@H+](C)CCOCc2ccccc2)cccc1[N+](=O)[O-] ZINC000464853929 339158072 /nfs/dbraw/zinc/15/80/72/339158072.db2.gz VJYFWRVLZJIAJD-UHFFFAOYSA-N 1 1 314.385 3.552 20 5 DHBDMO C[C@@H]([NH2+]C[C@@H](C1CCCCC1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000467834144 339247094 /nfs/dbraw/zinc/24/70/94/339247094.db2.gz PGCJUHZDJJUHQC-KDOFPFPSSA-N 1 1 319.449 3.756 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1ccc2c(c1)[nH+]cn2C ZINC000468593933 339266932 /nfs/dbraw/zinc/26/69/32/339266932.db2.gz CCYNWRQGECOCLR-MDWZMJQESA-N 1 1 322.368 3.997 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC2(C1)CCOCC2 ZINC000470175280 339312792 /nfs/dbraw/zinc/31/27/92/339312792.db2.gz BSHZQMVYFTVPCJ-RVDMUPIBSA-N 1 1 316.401 3.501 20 5 DHBDMO COC[C@@H]1CCCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470209061 339314308 /nfs/dbraw/zinc/31/43/08/339314308.db2.gz XDWUXCRIXQEFPE-IUYQLWOBSA-N 1 1 318.417 3.747 20 5 DHBDMO CCCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](C)c1ccccc1 ZINC000472253914 339367743 /nfs/dbraw/zinc/36/77/43/339367743.db2.gz CSKKHBUJUXRKCM-OAHLLOKOSA-N 1 1 316.405 3.655 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC000506476370 340195186 /nfs/dbraw/zinc/19/51/86/340195186.db2.gz FVOQJJKAJANYKM-QGZVFWFLSA-N 1 1 314.410 3.885 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000506476370 340195187 /nfs/dbraw/zinc/19/51/87/340195187.db2.gz FVOQJJKAJANYKM-QGZVFWFLSA-N 1 1 314.410 3.885 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC000506476665 340195372 /nfs/dbraw/zinc/19/53/72/340195372.db2.gz HNXONNUZKYLUSE-KRWDZBQOSA-N 1 1 314.410 3.885 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC000506476665 340195373 /nfs/dbraw/zinc/19/53/73/340195373.db2.gz HNXONNUZKYLUSE-KRWDZBQOSA-N 1 1 314.410 3.885 20 5 DHBDMO CCC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000507009664 340205367 /nfs/dbraw/zinc/20/53/67/340205367.db2.gz XPTZHHWPQQEMPY-SNVBAGLBSA-N 1 1 302.321 3.817 20 5 DHBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000507151186 340209654 /nfs/dbraw/zinc/20/96/54/340209654.db2.gz BGYXJWWTWOIVDK-ZDUSSCGKSA-N 1 1 314.332 3.817 20 5 DHBDMO COc1ccsc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000507168136 340210580 /nfs/dbraw/zinc/21/05/80/340210580.db2.gz PRMNXYXGCYGILK-UHFFFAOYSA-N 1 1 318.398 3.830 20 5 DHBDMO COc1ccsc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000507168136 340210581 /nfs/dbraw/zinc/21/05/81/340210581.db2.gz PRMNXYXGCYGILK-UHFFFAOYSA-N 1 1 318.398 3.830 20 5 DHBDMO CCc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000507170798 340210875 /nfs/dbraw/zinc/21/08/75/340210875.db2.gz QEYCODBBUPKYQR-UHFFFAOYSA-N 1 1 300.358 3.915 20 5 DHBDMO CCc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000507170798 340210876 /nfs/dbraw/zinc/21/08/76/340210876.db2.gz QEYCODBBUPKYQR-UHFFFAOYSA-N 1 1 300.358 3.915 20 5 DHBDMO CC[C@@H]1C[C@@H](C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCO1 ZINC000507791522 340231558 /nfs/dbraw/zinc/23/15/58/340231558.db2.gz CQCORGJYFZINBD-MAUKXSAKSA-N 1 1 318.417 3.764 20 5 DHBDMO CCC(CC)[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCOC ZINC000508520061 340245615 /nfs/dbraw/zinc/24/56/15/340245615.db2.gz XRCOJIDWJYFFHP-CSKARUKUSA-N 1 1 306.406 3.745 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCSC1 ZINC000130575071 341028745 /nfs/dbraw/zinc/02/87/45/341028745.db2.gz PPSRCNPFMZIHIX-CQSZACIVSA-N 1 1 318.398 3.792 20 5 DHBDMO CCc1cnc(C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)s1 ZINC000130582885 341029558 /nfs/dbraw/zinc/02/95/58/341029558.db2.gz UQMWIUXCGHDERI-CQSZACIVSA-N 1 1 305.403 3.855 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000544440538 341082289 /nfs/dbraw/zinc/08/22/89/341082289.db2.gz SNSRTRIXSNYNIN-XKQJLSEDSA-N 1 1 320.433 3.693 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cccc(N(C)C)c1 ZINC000544611785 341089047 /nfs/dbraw/zinc/08/90/47/341089047.db2.gz XLHMNIJABBGEHB-UHFFFAOYSA-N 1 1 313.401 3.601 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cc(C)ccc2C)cc1[N+](=O)[O-] ZINC000549187935 341288347 /nfs/dbraw/zinc/28/83/47/341288347.db2.gz DQRDPCHQAJFXEZ-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO Cc1ccc([C@H]2CC[N@@H+](Cc3cc([O-])ccc3[N+](=O)[O-])C2)cc1 ZINC000549932458 341307205 /nfs/dbraw/zinc/30/72/05/341307205.db2.gz SJYYBCZVKIGBJL-HNNXBMFYSA-N 1 1 312.369 3.598 20 5 DHBDMO C[C@@H](NCCC[N@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000248407889 341376718 /nfs/dbraw/zinc/37/67/18/341376718.db2.gz DQPPMXZAUPIVGS-LSDHHAIUSA-N 1 1 305.422 3.510 20 5 DHBDMO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000165296554 341710782 /nfs/dbraw/zinc/71/07/82/341710782.db2.gz UFANZTXFAYBVDH-WBMJQRKESA-N 1 1 318.373 3.789 20 5 DHBDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000267054481 520286249 /nfs/dbraw/zinc/28/62/49/520286249.db2.gz RKWVWWLAEPZIKB-HNNXBMFYSA-N 1 1 310.369 3.515 20 5 DHBDMO CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2cccnc21 ZINC000365000703 521386836 /nfs/dbraw/zinc/38/68/36/521386836.db2.gz RARJELQSMAZEBP-QGZVFWFLSA-N 1 1 311.385 3.889 20 5 DHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2cccnc21 ZINC000365000703 521386844 /nfs/dbraw/zinc/38/68/44/521386844.db2.gz RARJELQSMAZEBP-QGZVFWFLSA-N 1 1 311.385 3.889 20 5 DHBDMO COC1CCC([N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000266910890 522684728 /nfs/dbraw/zinc/68/47/28/522684728.db2.gz CZISSVQZZPXNPH-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO CC[C@H]([NH2+][C@H](C)c1ccncc1F)c1cccc([N+](=O)[O-])c1 ZINC000338018841 522742784 /nfs/dbraw/zinc/74/27/84/522742784.db2.gz ZQMCDWVYKZSSJV-BZNIZROVSA-N 1 1 303.337 3.931 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCCC2 ZINC000130240256 525528070 /nfs/dbraw/zinc/52/80/70/525528070.db2.gz CURPVHLQCBVMIW-LLVKDONJSA-N 1 1 317.414 3.781 20 5 DHBDMO Cc1cnc(CC[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000157834510 525995616 /nfs/dbraw/zinc/99/56/16/525995616.db2.gz OQMMNTOCQGWOCH-LBPRGKRZSA-N 1 1 305.403 3.595 20 5 DHBDMO CCOC1CC2(C1)CC[N@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000285482507 535399230 /nfs/dbraw/zinc/39/92/30/535399230.db2.gz LREACOKKSRLDOQ-MXWWQKGMSA-N 1 1 318.417 3.855 20 5 DHBDMO COCC[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000272389135 536807327 /nfs/dbraw/zinc/80/73/27/536807327.db2.gz CMQBMQGRQHWJGJ-GXTWGEPZSA-N 1 1 304.346 3.616 20 5 DHBDMO CC(C)c1ccc(CN[C@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000236658864 1013425532 /nfs/dbraw/zinc/42/55/32/1013425532.db2.gz OWFCRDWDXJRSIU-OAHLLOKOSA-N 1 1 319.449 3.682 20 5 DHBDMO Cc1cc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc(C)n1 ZINC000894965857 1013752945 /nfs/dbraw/zinc/75/29/45/1013752945.db2.gz LCHGXTLGGZVEOR-UHFFFAOYSA-N 1 1 305.765 3.550 20 5 DHBDMO CC[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(C)C ZINC000877983839 1033542776 /nfs/dbraw/zinc/54/27/76/1033542776.db2.gz UVTKYBWBWHLTQJ-UHFFFAOYSA-N 1 1 324.768 3.529 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000441464284 1014168350 /nfs/dbraw/zinc/16/83/50/1014168350.db2.gz AIVCFAACSYKGRX-KEYYUXOJSA-N 1 1 304.390 3.627 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000441487044 1014247177 /nfs/dbraw/zinc/24/71/77/1014247177.db2.gz OFCCKKHOHMFSIF-ILXRZTDVSA-N 1 1 304.390 3.627 20 5 DHBDMO COc1ccccc1CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000520606425 1014371417 /nfs/dbraw/zinc/37/14/17/1014371417.db2.gz DPMUACVSTWEVEO-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000320030445 1014373885 /nfs/dbraw/zinc/37/38/85/1014373885.db2.gz JNRYDSWFPIODPT-RCCFBDPRSA-N 1 1 317.433 3.652 20 5 DHBDMO CCC[C@H]([NH2+][C@@H]1CCN2CCCC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000320030445 1014373899 /nfs/dbraw/zinc/37/38/99/1014373899.db2.gz JNRYDSWFPIODPT-RCCFBDPRSA-N 1 1 317.433 3.652 20 5 DHBDMO CSCC[C@H](C)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000126510730 1014740874 /nfs/dbraw/zinc/74/08/74/1014740874.db2.gz MTEARURSQYNRER-JTQLQIEISA-N 1 1 302.827 3.822 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895583629 1015211445 /nfs/dbraw/zinc/21/14/45/1015211445.db2.gz MISGIMWXPGNWIP-PKXJPQMGSA-N 1 1 315.398 3.554 20 5 DHBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000051180456 1015254374 /nfs/dbraw/zinc/25/43/74/1015254374.db2.gz ADHFVIUBSPRYIG-INIZCTEOSA-N 1 1 312.369 3.941 20 5 DHBDMO COc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000891625729 1015464985 /nfs/dbraw/zinc/46/49/85/1015464985.db2.gz QPFAOKULJPLHPR-UHFFFAOYSA-N 1 1 304.346 3.607 20 5 DHBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000891625729 1015464988 /nfs/dbraw/zinc/46/49/88/1015464988.db2.gz QPFAOKULJPLHPR-UHFFFAOYSA-N 1 1 304.346 3.607 20 5 DHBDMO CC(C)([NH2+]Cc1cnc(Cl)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000846919714 1032136698 /nfs/dbraw/zinc/13/66/98/1032136698.db2.gz RHLBIILJKXDGAE-UHFFFAOYSA-N 1 1 323.755 3.807 20 5 DHBDMO CCc1ccc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)s1 ZINC000538734013 1016166186 /nfs/dbraw/zinc/16/61/86/1016166186.db2.gz RPXFYIKUEPZXAV-UHFFFAOYSA-N 1 1 302.399 3.777 20 5 DHBDMO CCc1ccc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)s1 ZINC000538734013 1016166192 /nfs/dbraw/zinc/16/61/92/1016166192.db2.gz RPXFYIKUEPZXAV-UHFFFAOYSA-N 1 1 302.399 3.777 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000089512544 1032147086 /nfs/dbraw/zinc/14/70/86/1032147086.db2.gz ZHQUZFAWRWCGJM-SECBINFHSA-N 1 1 310.275 3.863 20 5 DHBDMO CS[C@H]1CCCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000539900455 1016415975 /nfs/dbraw/zinc/41/59/75/1016415975.db2.gz SUOTXMLDHFUHAT-VFADXPBXSA-N 1 1 306.431 3.826 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CCCC2)CC1 ZINC000072667084 1016779221 /nfs/dbraw/zinc/77/92/21/1016779221.db2.gz CQZLKBZHXJPKAP-OAHLLOKOSA-N 1 1 317.433 3.606 20 5 DHBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@@H]1C(C)(C)C ZINC001171297980 1032284633 /nfs/dbraw/zinc/28/46/33/1032284633.db2.gz QXCNDVIQCLANJW-ULQDDVLXSA-N 1 1 320.433 3.775 20 5 DHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cncc(F)c1 ZINC000773034653 1032534439 /nfs/dbraw/zinc/53/44/39/1032534439.db2.gz HVWVGLSRUQDGRH-SECBINFHSA-N 1 1 309.728 3.633 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC000517397328 1012978209 /nfs/dbraw/zinc/97/82/09/1012978209.db2.gz WZNADKOQBKKYIA-KRWDZBQOSA-N 1 1 300.333 3.666 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC000517397328 1012978221 /nfs/dbraw/zinc/97/82/21/1012978221.db2.gz WZNADKOQBKKYIA-KRWDZBQOSA-N 1 1 300.333 3.666 20 5 DHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccsc2[N+](=O)[O-])C1 ZINC000611509745 1017225900 /nfs/dbraw/zinc/22/59/00/1017225900.db2.gz ZQWUEZZHERODBW-KBPBESRZSA-N 1 1 323.462 3.747 20 5 DHBDMO CCCOc1ncccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178650640 1017413833 /nfs/dbraw/zinc/41/38/33/1017413833.db2.gz GEVICGZPGSHNEY-CYBMUJFWSA-N 1 1 315.373 3.629 20 5 DHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444652752 1017606454 /nfs/dbraw/zinc/60/64/54/1017606454.db2.gz KCDVPQGGMZGSOM-BLLLJJGKSA-N 1 1 316.405 3.872 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000444659757 1017609284 /nfs/dbraw/zinc/60/92/84/1017609284.db2.gz DZJNWBHZEZGSAZ-SMDDNHRTSA-N 1 1 310.369 3.753 20 5 DHBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000091483087 1017762777 /nfs/dbraw/zinc/76/27/77/1017762777.db2.gz AZVFCLUHXJQSSI-CYBMUJFWSA-N 1 1 321.421 3.526 20 5 DHBDMO CS[C@H]1CCCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000441136339 1018278870 /nfs/dbraw/zinc/27/88/70/1018278870.db2.gz VYYXHPOMIYMYRI-INIZCTEOSA-N 1 1 324.446 3.581 20 5 DHBDMO COc1ccc(OCC[N@@H+](C)C2CCCCCC2)c([N+](=O)[O-])c1 ZINC000441243604 1018368084 /nfs/dbraw/zinc/36/80/84/1018368084.db2.gz AHZUHJNJTXMZQQ-UHFFFAOYSA-N 1 1 322.405 3.637 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1 ZINC000704229941 1018530275 /nfs/dbraw/zinc/53/02/75/1018530275.db2.gz AGXWQISAVWYPCL-OLZOCXBDSA-N 1 1 312.822 3.718 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccco3)C2)c(Cl)c1 ZINC000611785000 1018658923 /nfs/dbraw/zinc/65/89/23/1018658923.db2.gz SJPJXLFWOFNCCJ-LBPRGKRZSA-N 1 1 306.749 3.831 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CC(Cc3ccccc3)C2)c(Cl)c1 ZINC000611794140 1018755663 /nfs/dbraw/zinc/75/56/63/1018755663.db2.gz ZLRDJEMHESMTSR-UHFFFAOYSA-N 1 1 316.788 3.923 20 5 DHBDMO CCc1[nH]nc(Cl)c1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000921817121 1018896864 /nfs/dbraw/zinc/89/68/64/1018896864.db2.gz ILNCDOQPHJNANF-SNVBAGLBSA-N 1 1 322.796 3.693 20 5 DHBDMO CCn1nc(C)c(C[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000611252954 1019422458 /nfs/dbraw/zinc/42/24/58/1019422458.db2.gz UCFWTKIJUCWEIE-CYBMUJFWSA-N 1 1 316.405 3.621 20 5 DHBDMO CCn1nc(C)c(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000611252954 1019422462 /nfs/dbraw/zinc/42/24/62/1019422462.db2.gz UCFWTKIJUCWEIE-CYBMUJFWSA-N 1 1 316.405 3.621 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000611265356 1019428930 /nfs/dbraw/zinc/42/89/30/1019428930.db2.gz AHPDSBQFUQXZTA-QGZVFWFLSA-N 1 1 312.369 3.946 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000611350313 1019449981 /nfs/dbraw/zinc/44/99/81/1019449981.db2.gz ICCQPDDBOPEGOT-HOTGVXAUSA-N 1 1 318.417 3.542 20 5 DHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[N@@H+](C)C1CC1 ZINC000301825873 1019506077 /nfs/dbraw/zinc/50/60/77/1019506077.db2.gz MMOSNRLGXASNRI-VIFPVBQESA-N 1 1 317.311 3.508 20 5 DHBDMO Cc1ncc(C[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])s1 ZINC000255694742 1019568492 /nfs/dbraw/zinc/56/84/92/1019568492.db2.gz NAJVGUJRQUSIQP-ALCCZGGFSA-N 1 1 303.387 3.505 20 5 DHBDMO Cc1ncc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])s1 ZINC000255694742 1019568504 /nfs/dbraw/zinc/56/85/04/1019568504.db2.gz NAJVGUJRQUSIQP-ALCCZGGFSA-N 1 1 303.387 3.505 20 5 DHBDMO CC1(C)CC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000093460206 1019598982 /nfs/dbraw/zinc/59/89/82/1019598982.db2.gz UPCPWFQFFOHDMF-UHFFFAOYSA-N 1 1 303.387 3.703 20 5 DHBDMO CC1(C)CC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000093460206 1019599005 /nfs/dbraw/zinc/59/90/05/1019599005.db2.gz UPCPWFQFFOHDMF-UHFFFAOYSA-N 1 1 303.387 3.703 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000123356114 1020061192 /nfs/dbraw/zinc/06/11/92/1020061192.db2.gz XKIWGBWQLOWNHC-BETUJISGSA-N 1 1 315.373 3.665 20 5 DHBDMO C[N@@H+](CCc1ccccc1F)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000731669170 1020134502 /nfs/dbraw/zinc/13/45/02/1020134502.db2.gz CCCVJHMOASGQDC-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO C[C@@H]([NH2+]Cc1cc(O)ccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC001168605009 1020143717 /nfs/dbraw/zinc/14/37/17/1020143717.db2.gz UZPPHPODXNYLAI-SNVBAGLBSA-N 1 1 306.749 3.805 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cccc3[nH]ccc31)CC2 ZINC000093338416 1020147854 /nfs/dbraw/zinc/14/78/54/1020147854.db2.gz LTHIRMUZKRMRFO-UHFFFAOYSA-N 1 1 307.353 3.634 20 5 DHBDMO CCC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350530 1020167708 /nfs/dbraw/zinc/16/77/08/1020167708.db2.gz WMSRRZBIPYVNSQ-RDTXWAMCSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350530 1020167712 /nfs/dbraw/zinc/16/77/12/1020167712.db2.gz WMSRRZBIPYVNSQ-RDTXWAMCSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350530 1020167717 /nfs/dbraw/zinc/16/77/17/1020167717.db2.gz WMSRRZBIPYVNSQ-RDTXWAMCSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350530 1020167733 /nfs/dbraw/zinc/16/77/33/1020167733.db2.gz WMSRRZBIPYVNSQ-RDTXWAMCSA-N 1 1 317.433 3.510 20 5 DHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1Cc2ccccc2C1 ZINC000732197702 1020205734 /nfs/dbraw/zinc/20/57/34/1020205734.db2.gz WOZDNFQRFHNFBA-UHFFFAOYSA-N 1 1 316.788 3.847 20 5 DHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000155332755 1020218234 /nfs/dbraw/zinc/21/82/34/1020218234.db2.gz YEAIIMABDRTQFY-HNNXBMFYSA-N 1 1 312.369 3.593 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccnc2ccccc12 ZINC000555340318 1020218306 /nfs/dbraw/zinc/21/83/06/1020218306.db2.gz XFSYXVFZODMCIF-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO CC(C)[N@@H+]1CCCC[C@H]1CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000330658668 1020237728 /nfs/dbraw/zinc/23/77/28/1020237728.db2.gz QULQXDXQWNYAEB-PBHICJAKSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)[N@H+]1CCCC[C@H]1CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000330658668 1020237736 /nfs/dbraw/zinc/23/77/36/1020237736.db2.gz QULQXDXQWNYAEB-PBHICJAKSA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1ccc(NC[C@H]2CC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000715647174 1020553973 /nfs/dbraw/zinc/55/39/73/1020553973.db2.gz VXOLIDGUNPPGEK-MRXNPFEDSA-N 1 1 311.385 3.590 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1C[C@H]1c1cccc(F)c1 ZINC000411714823 1020581125 /nfs/dbraw/zinc/58/11/25/1020581125.db2.gz AICJDFXDFNEYPQ-WMZOPIPTSA-N 1 1 314.360 3.764 20 5 DHBDMO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCC1 ZINC000735491646 1020743770 /nfs/dbraw/zinc/74/37/70/1020743770.db2.gz OHYCVXOWKXPKIM-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO CC(C)[C@@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000738241278 1020867392 /nfs/dbraw/zinc/86/73/92/1020867392.db2.gz SNTZBSLKTIIMRK-CQSZACIVSA-N 1 1 316.405 3.660 20 5 DHBDMO CC(C)O[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000581548926 1020891198 /nfs/dbraw/zinc/89/11/98/1020891198.db2.gz ATJQUYAYLVHDHA-OAHLLOKOSA-N 1 1 306.406 3.718 20 5 DHBDMO COc1ccc(C[N@H+]2CC[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000120127714 1021045123 /nfs/dbraw/zinc/04/51/23/1021045123.db2.gz KQYJASOECKAQJK-INIZCTEOSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000742589418 1021139755 /nfs/dbraw/zinc/13/97/55/1021139755.db2.gz HQSYUDNPWLYRSU-AWEZNQCLSA-N 1 1 312.369 3.593 20 5 DHBDMO CC1(C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CCS1 ZINC000122132814 1021158607 /nfs/dbraw/zinc/15/86/07/1021158607.db2.gz SKZKIVDXCYHNTC-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO CC1(C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CCS1 ZINC000122132814 1021158609 /nfs/dbraw/zinc/15/86/09/1021158609.db2.gz SKZKIVDXCYHNTC-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO CC(C)[N@H+](Cc1cccs1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277440 1021209624 /nfs/dbraw/zinc/20/96/24/1021209624.db2.gz PKMKLFISMXKBRV-MRXNPFEDSA-N 1 1 320.414 3.600 20 5 DHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776279146 1021230348 /nfs/dbraw/zinc/23/03/48/1021230348.db2.gz VPFUCQMFDKULDI-XKQJLSEDSA-N 1 1 306.406 3.529 20 5 DHBDMO CCCC[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)[C@@H](C)CC ZINC000917437820 1021260189 /nfs/dbraw/zinc/26/01/89/1021260189.db2.gz LRJNIJPPNCRZMN-ZDUSSCGKSA-N 1 1 304.394 3.803 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2ccc(Cl)cc2F)cc1[N+](=O)[O-] ZINC000189197620 1021349442 /nfs/dbraw/zinc/34/94/42/1021349442.db2.gz SGVOYGJZZAKVAX-UHFFFAOYSA-N 1 1 308.740 3.986 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCSC2(CCC2)CC1 ZINC000414482426 1021492831 /nfs/dbraw/zinc/49/28/31/1021492831.db2.gz XOPPTOKKCOFDBQ-UHFFFAOYSA-N 1 1 306.431 3.765 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cc(C(C)C)no1 ZINC000169245581 1021512582 /nfs/dbraw/zinc/51/25/82/1021512582.db2.gz WHJOALXYMLBUPH-GFCCVEGCSA-N 1 1 303.362 3.865 20 5 DHBDMO O=C(C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000122660045 1021899568 /nfs/dbraw/zinc/89/95/68/1021899568.db2.gz VAXNKWRVTREMCD-GOSISDBHSA-N 1 1 324.380 3.832 20 5 DHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776584004 1022094923 /nfs/dbraw/zinc/09/49/23/1022094923.db2.gz ISTZGCKVMKWIDK-WBVHZDCISA-N 1 1 320.433 3.776 20 5 DHBDMO CC1CCC([N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000776580393 1022097472 /nfs/dbraw/zinc/09/74/72/1022097472.db2.gz UVXIXBNZTSCRFH-LEHRNKBSSA-N 1 1 318.417 3.671 20 5 DHBDMO CC(C)C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000776580396 1022098353 /nfs/dbraw/zinc/09/83/53/1022098353.db2.gz UZXHFQYZINQAFR-QGZVFWFLSA-N 1 1 306.406 3.529 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCCc3sccc3C2)cc1 ZINC000609322578 1022207745 /nfs/dbraw/zinc/20/77/45/1022207745.db2.gz CWUAQEWJBDSYFO-UHFFFAOYSA-N 1 1 302.399 3.647 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169005942 1022212459 /nfs/dbraw/zinc/21/24/59/1022212459.db2.gz DKNYITMXFMWXRM-GXFFZTMASA-N 1 1 317.216 3.871 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169025293 1022226500 /nfs/dbraw/zinc/22/65/00/1022226500.db2.gz YLPBGMNUDMRFDE-CMPLNLGQSA-N 1 1 317.216 3.871 20 5 DHBDMO Cc1cccc(C[N@@H+](C2CC2)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)c1C ZINC001169053917 1022230969 /nfs/dbraw/zinc/23/09/69/1022230969.db2.gz KJMNUZQDOINTMF-MAUKXSAKSA-N 1 1 302.418 3.713 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H](CCc3ccccc3)C2)C1 ZINC001169057613 1022232358 /nfs/dbraw/zinc/23/23/58/1022232358.db2.gz WFVGQKAHEGNMBP-IPMKNSEASA-N 1 1 316.445 3.777 20 5 DHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])s1)[N@@H+](C)Cc1ccccc1 ZINC000609512758 1022296139 /nfs/dbraw/zinc/29/61/39/1022296139.db2.gz IKIRIIKLUWCMBN-LBPRGKRZSA-N 1 1 305.403 3.589 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]2C2CCC2)c([N+](=O)[O-])cc1F ZINC000184198791 1022773431 /nfs/dbraw/zinc/77/34/31/1022773431.db2.gz GEULRWYRWUODCP-AWEZNQCLSA-N 1 1 308.353 3.507 20 5 DHBDMO CC(C)OC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000768541882 1022986804 /nfs/dbraw/zinc/98/68/04/1022986804.db2.gz MMFLHVHPHHYYCC-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1cc2cc[nH]c2c([N+](=O)[O-])c1 ZINC001167753699 1023043316 /nfs/dbraw/zinc/04/33/16/1023043316.db2.gz PUSSGJRNVQDWJA-CYBMUJFWSA-N 1 1 316.405 3.753 20 5 DHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000769447878 1023156633 /nfs/dbraw/zinc/15/66/33/1023156633.db2.gz ZKSBCIAYXQQCLG-CQSZACIVSA-N 1 1 318.398 3.544 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000048054383 1023704097 /nfs/dbraw/zinc/70/40/97/1023704097.db2.gz KKDAGVGBYWXWKX-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@@H](C)[C@H]1C ZINC000112644966 1023817040 /nfs/dbraw/zinc/81/70/40/1023817040.db2.gz ZVHXSIIOIMZUHE-OLZOCXBDSA-N 1 1 324.446 3.708 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@@H](C)[C@H]1C ZINC000112644966 1023817044 /nfs/dbraw/zinc/81/70/44/1023817044.db2.gz ZVHXSIIOIMZUHE-OLZOCXBDSA-N 1 1 324.446 3.708 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000037563038 1023878623 /nfs/dbraw/zinc/87/86/23/1023878623.db2.gz JHYKMPFSNNSGTO-NSHDSACASA-N 1 1 306.387 3.906 20 5 DHBDMO C[C@H]([NH2+][C@H]1CCc2ccc(Cl)nc21)c1cccc([N+](=O)[O-])c1 ZINC000788643693 1023912374 /nfs/dbraw/zinc/91/23/74/1023912374.db2.gz QIKZTVIRNVDSOB-HZMBPMFUSA-N 1 1 317.776 3.981 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000051650298 1024323302 /nfs/dbraw/zinc/32/33/02/1024323302.db2.gz ZXOYHSCEOQLEEM-MRXNPFEDSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc(C[N@H+](C)Cc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000051710007 1024355373 /nfs/dbraw/zinc/35/53/73/1024355373.db2.gz RNKUFKWNIXTYPC-UHFFFAOYSA-N 1 1 322.311 3.514 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000051710007 1024355388 /nfs/dbraw/zinc/35/53/88/1024355388.db2.gz RNKUFKWNIXTYPC-UHFFFAOYSA-N 1 1 322.311 3.514 20 5 DHBDMO Cc1c(C[NH2+][C@H]2COc3c2cccc3Cl)cccc1[N+](=O)[O-] ZINC000790696725 1024356558 /nfs/dbraw/zinc/35/65/58/1024356558.db2.gz VWXIETMZNLEWHR-AWEZNQCLSA-N 1 1 318.760 3.780 20 5 DHBDMO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000883462797 1024440618 /nfs/dbraw/zinc/44/06/18/1024440618.db2.gz AIAVOXATJUJYRJ-AWEZNQCLSA-N 1 1 303.387 3.691 20 5 DHBDMO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000883463248 1024441133 /nfs/dbraw/zinc/44/11/33/1024441133.db2.gz LKUBZSFMRKDBMW-INIZCTEOSA-N 1 1 315.348 3.769 20 5 DHBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000453352213 1024477088 /nfs/dbraw/zinc/47/70/88/1024477088.db2.gz INXUUFMFFFKYGS-RHSMWYFYSA-N 1 1 320.458 3.745 20 5 DHBDMO CC[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000453367948 1024490461 /nfs/dbraw/zinc/49/04/61/1024490461.db2.gz MOZJWUTUGVYFCW-DLBZAZTESA-N 1 1 304.390 3.548 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)[N@@H+]1CCCC[C@H]1C ZINC000532192718 1024573049 /nfs/dbraw/zinc/57/30/49/1024573049.db2.gz DWFDZRPKVVNCGZ-OAGGEKHMSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000532192718 1024573056 /nfs/dbraw/zinc/57/30/56/1024573056.db2.gz DWFDZRPKVVNCGZ-OAGGEKHMSA-N 1 1 319.449 3.817 20 5 DHBDMO CC(C)(C)OC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000283086040 1024589661 /nfs/dbraw/zinc/58/96/61/1024589661.db2.gz LBEGYPFIWCJRNQ-UHFFFAOYSA-N 1 1 310.369 3.513 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000585754379 1024594575 /nfs/dbraw/zinc/59/45/75/1024594575.db2.gz KWZKZGBRNFVEOX-UHFFFAOYSA-N 1 1 314.385 3.971 20 5 DHBDMO Cc1csc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)n1 ZINC000283161085 1024602665 /nfs/dbraw/zinc/60/26/65/1024602665.db2.gz OYJREPCOMLLEQO-CQSZACIVSA-N 1 1 321.377 3.740 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1F ZINC000182019956 1024609762 /nfs/dbraw/zinc/60/97/62/1024609762.db2.gz ZURGWIGACXOQGE-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO CC1(C)C[C@@H]([NH2+]Cc2nccs2)c2cc([N+](=O)[O-])ccc21 ZINC000279117709 1024739667 /nfs/dbraw/zinc/73/96/67/1024739667.db2.gz PSHKAOOBLGBIEO-CYBMUJFWSA-N 1 1 303.387 3.564 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+]2[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170329876 1024747517 /nfs/dbraw/zinc/74/75/17/1024747517.db2.gz WHEAEZIAJHVJMC-HZSPNIEDSA-N 1 1 306.406 3.797 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC001170341249 1024756161 /nfs/dbraw/zinc/75/61/61/1024756161.db2.gz HMXRWBNEBKFGBN-ZIAGYGMSSA-N 1 1 306.406 3.799 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](C)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170347997 1024757316 /nfs/dbraw/zinc/75/73/16/1024757316.db2.gz UNJRKOODBWBGKX-RDBSUJKOSA-N 1 1 306.406 3.655 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CCCO1 ZINC000170774076 1024873617 /nfs/dbraw/zinc/87/36/17/1024873617.db2.gz XWZVSHZMVDYJIL-AWEZNQCLSA-N 1 1 323.392 3.557 20 5 DHBDMO COc1c2ccccc2oc1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000353222143 1024985966 /nfs/dbraw/zinc/98/59/66/1024985966.db2.gz FEGHJUKHSNLKHU-UHFFFAOYSA-N 1 1 312.325 3.639 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000353449757 1025072414 /nfs/dbraw/zinc/07/24/14/1025072414.db2.gz SIYYQVJYHOTUQF-INIZCTEOSA-N 1 1 322.405 3.623 20 5 DHBDMO CCC[N@@H+]1CCC[C@@H]1CN[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353971639 1025308187 /nfs/dbraw/zinc/30/81/87/1025308187.db2.gz LIBJNCNQYJXRPT-IAGOWNOFSA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[N@H+]1CCC[C@@H]1CN[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353971639 1025308197 /nfs/dbraw/zinc/30/81/97/1025308197.db2.gz LIBJNCNQYJXRPT-IAGOWNOFSA-N 1 1 305.422 3.510 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccccc1C ZINC000015295256 1025374342 /nfs/dbraw/zinc/37/43/42/1025374342.db2.gz KWFWSTHTIMWMNU-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccccc1C ZINC000015295256 1025374356 /nfs/dbraw/zinc/37/43/56/1025374356.db2.gz KWFWSTHTIMWMNU-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@@H](O)CC2CCCC2)C2CC2)c1 ZINC000354847445 1025524158 /nfs/dbraw/zinc/52/41/58/1025524158.db2.gz BTXPKCJTTNHOIZ-SFHVURJKSA-N 1 1 318.417 3.500 20 5 DHBDMO CCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H](CC)c1ccccc1 ZINC000355554443 1025763352 /nfs/dbraw/zinc/76/33/52/1025763352.db2.gz NHRWVWMJHIXYFF-OAHLLOKOSA-N 1 1 316.405 3.692 20 5 DHBDMO CCC[C@H](NC[C@@H]1CC[N@H+](CCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000151119798 1026342322 /nfs/dbraw/zinc/34/23/22/1026342322.db2.gz LWNJFPACPKUDJC-YJBOKZPZSA-N 1 1 319.449 3.758 20 5 DHBDMO CCC[C@H](NC[C@@H]1CC[N@@H+](CCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000151119798 1026342336 /nfs/dbraw/zinc/34/23/36/1026342336.db2.gz LWNJFPACPKUDJC-YJBOKZPZSA-N 1 1 319.449 3.758 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000747532693 1026416320 /nfs/dbraw/zinc/41/63/20/1026416320.db2.gz QTJYHOUGVLPSFB-MRXNPFEDSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@]3(CCCOC3)C2)c1 ZINC000747532731 1026417365 /nfs/dbraw/zinc/41/73/65/1026417365.db2.gz RPPNXDQHCXYVBG-INIZCTEOSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1ccc(CNc2cc[nH+]c3ccc(Cl)cc23)cc1 ZINC000513620566 1026546875 /nfs/dbraw/zinc/54/68/75/1026546875.db2.gz SKUGMVFLLDFKFS-UHFFFAOYSA-N 1 1 313.744 3.830 20 5 DHBDMO CO[C@]1(C)CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000280497704 1026656203 /nfs/dbraw/zinc/65/62/03/1026656203.db2.gz MRWAAGZRCPRZKP-WMLDXEAASA-N 1 1 306.406 3.855 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCOC(C)(C)C1 ZINC000810043441 1026666814 /nfs/dbraw/zinc/66/68/14/1026666814.db2.gz WEZPEWRBTQYRQE-ZDUSSCGKSA-N 1 1 310.369 3.513 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ccon3)s2)cc1 ZINC000747622141 1026817062 /nfs/dbraw/zinc/81/70/62/1026817062.db2.gz KZOYHRJLRWRSHE-UHFFFAOYSA-N 1 1 315.354 3.601 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000016431180 1026999198 /nfs/dbraw/zinc/99/91/98/1026999198.db2.gz AXWSHJJGQYDBAJ-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000016431180 1026999204 /nfs/dbraw/zinc/99/92/04/1026999204.db2.gz AXWSHJJGQYDBAJ-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO CC(C)(C)OC[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000932170171 1027392792 /nfs/dbraw/zinc/39/27/92/1027392792.db2.gz DHZKNKJECKNJRF-ZDUSSCGKSA-N 1 1 310.369 3.513 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@H]2[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000932274829 1027438465 /nfs/dbraw/zinc/43/84/65/1027438465.db2.gz KQUFMIWVWIPPCU-WFASDCNBSA-N 1 1 315.373 3.659 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812851048 1027444640 /nfs/dbraw/zinc/44/46/40/1027444640.db2.gz PSDQVJOMANTLGO-KBXCAEBGSA-N 1 1 314.385 3.539 20 5 DHBDMO CCn1nc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000296098476 1027541290 /nfs/dbraw/zinc/54/12/90/1027541290.db2.gz RQVLNNJCUCCXBA-ZDUSSCGKSA-N 1 1 324.384 3.815 20 5 DHBDMO COc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1C ZINC000932576349 1027552230 /nfs/dbraw/zinc/55/22/30/1027552230.db2.gz RKRZOHCAMNKVLZ-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO CC[C@H](CSC)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000576606588 1027638091 /nfs/dbraw/zinc/63/80/91/1027638091.db2.gz NGXYUUXLIZQWHF-GFCCVEGCSA-N 1 1 302.827 3.822 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000577096651 1027708559 /nfs/dbraw/zinc/70/85/59/1027708559.db2.gz FDBOSUSZEWCRAA-LSDHHAIUSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000577096651 1027708571 /nfs/dbraw/zinc/70/85/71/1027708571.db2.gz FDBOSUSZEWCRAA-LSDHHAIUSA-N 1 1 307.438 3.674 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1C ZINC000933492335 1027745555 /nfs/dbraw/zinc/74/55/55/1027745555.db2.gz UBVYEGNMMIXRGL-LLVKDONJSA-N 1 1 306.387 3.824 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cc2cccnc2o1)C1CC1 ZINC000449011634 1028239846 /nfs/dbraw/zinc/23/98/46/1028239846.db2.gz SBTWMNWNCWXDMO-UHFFFAOYSA-N 1 1 323.352 3.901 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cc2cccnc2o1)C1CC1 ZINC000449011634 1028239863 /nfs/dbraw/zinc/23/98/63/1028239863.db2.gz SBTWMNWNCWXDMO-UHFFFAOYSA-N 1 1 323.352 3.901 20 5 DHBDMO C[C@H]1[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCC12CCOCC2 ZINC000368834677 1028413221 /nfs/dbraw/zinc/41/32/21/1028413221.db2.gz PDRKFVNJOYEZBR-GFCCVEGCSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1c(C[N@H+](C)[C@@H]2CCCc3cccnc32)cccc1[N+](=O)[O-] ZINC000369035332 1028436995 /nfs/dbraw/zinc/43/69/95/1028436995.db2.gz LOHWGBYLIZLBLS-QGZVFWFLSA-N 1 1 311.385 3.808 20 5 DHBDMO Cc1csc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000449494678 1028696129 /nfs/dbraw/zinc/69/61/29/1028696129.db2.gz BFDRAVNJNYZMQQ-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO CC[C@@H](C)[N@@H+](Cc1ccccc1)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000077441889 1028874999 /nfs/dbraw/zinc/87/49/99/1028874999.db2.gz OJLPCRWQSYSLAU-CYBMUJFWSA-N 1 1 316.405 3.666 20 5 DHBDMO CC[C@@H](C)[N@H+](Cc1ccccc1)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000077441889 1028875025 /nfs/dbraw/zinc/87/50/25/1028875025.db2.gz OJLPCRWQSYSLAU-CYBMUJFWSA-N 1 1 316.405 3.666 20 5 DHBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@@H](C)[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000816646677 1028970751 /nfs/dbraw/zinc/97/07/51/1028970751.db2.gz HMJTWMZIHJDPJW-VXGBXAGGSA-N 1 1 316.357 3.704 20 5 DHBDMO CCCc1nc(C)c(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])o1 ZINC000568532352 1029087923 /nfs/dbraw/zinc/08/79/23/1029087923.db2.gz DYDNSARSBBLMQQ-CQSZACIVSA-N 1 1 315.373 3.621 20 5 DHBDMO C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CC(OC(C)(C)C)C1 ZINC000817288407 1029114147 /nfs/dbraw/zinc/11/41/47/1029114147.db2.gz XTSPDPIKSXOTPN-UHFFFAOYSA-N 1 1 310.369 3.512 20 5 DHBDMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CC(OC(C)(C)C)C1 ZINC000817288407 1029114153 /nfs/dbraw/zinc/11/41/53/1029114153.db2.gz XTSPDPIKSXOTPN-UHFFFAOYSA-N 1 1 310.369 3.512 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])Cc1cccc2cccnc21 ZINC000026349283 1029119364 /nfs/dbraw/zinc/11/93/64/1029119364.db2.gz CEACNOMYPICUGQ-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO Cc1cnc([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000374229983 1029246220 /nfs/dbraw/zinc/24/62/20/1029246220.db2.gz NXRRCZOITKKCPE-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO CC(C)n1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000569792851 1029267290 /nfs/dbraw/zinc/26/72/90/1029267290.db2.gz QGJFXKFWLZCQIE-QGZVFWFLSA-N 1 1 314.389 3.539 20 5 DHBDMO C[NH+](C)CC[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(C)C ZINC000569941402 1029287555 /nfs/dbraw/zinc/28/75/55/1029287555.db2.gz OLYOXWWGQTXGPW-WBVHZDCISA-N 1 1 319.449 3.538 20 5 DHBDMO CN(C)CC[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(C)C ZINC000569941402 1029287568 /nfs/dbraw/zinc/28/75/68/1029287568.db2.gz OLYOXWWGQTXGPW-WBVHZDCISA-N 1 1 319.449 3.538 20 5 DHBDMO CCC(CC)[N@@H+](CC)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000570243506 1029336474 /nfs/dbraw/zinc/33/64/74/1029336474.db2.gz IDKFLBNYQOWJHD-UHFFFAOYSA-N 1 1 321.421 3.742 20 5 DHBDMO CC[C@H]([NH2+][C@H](C)c1cn(C(C)C)nn1)c1cccc([N+](=O)[O-])c1 ZINC000925227796 1029403974 /nfs/dbraw/zinc/40/39/74/1029403974.db2.gz BHSWYWIHOBTLLI-DOMZBBRYSA-N 1 1 317.393 3.569 20 5 DHBDMO CC[C@H]([NH2+][C@H]1COc2cccc(F)c21)c1cccc([N+](=O)[O-])c1 ZINC000374679703 1029429920 /nfs/dbraw/zinc/42/99/20/1029429920.db2.gz NXNGXEWSKXCGFG-GJZGRUSLSA-N 1 1 316.332 3.908 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nccs3)C2)cc1F ZINC000374774947 1029457862 /nfs/dbraw/zinc/45/78/62/1029457862.db2.gz HHKMCOBAMRXPPY-GFCCVEGCSA-N 1 1 321.377 3.570 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)cs1 ZINC000530280384 1029801176 /nfs/dbraw/zinc/80/11/76/1029801176.db2.gz GUVRKKBFMCZSQN-ZDUSSCGKSA-N 1 1 306.362 3.785 20 5 DHBDMO C[N@H+]1CCC[C@H](CCNc2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865872467 1030071986 /nfs/dbraw/zinc/07/19/86/1030071986.db2.gz RZRGXEDVUVCBSX-LLVKDONJSA-N 1 1 313.348 3.676 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451966815 1030072820 /nfs/dbraw/zinc/07/28/20/1030072820.db2.gz POUKIVDFJDMIJO-CZUORRHYSA-N 1 1 306.431 3.875 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC[C@H]1CC1(Cl)Cl ZINC000823024623 1030193393 /nfs/dbraw/zinc/19/33/93/1030193393.db2.gz AGIZYJDPNLWISE-LBPRGKRZSA-N 1 1 317.216 3.653 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000866539424 1030359985 /nfs/dbraw/zinc/35/99/85/1030359985.db2.gz CACZUDVUPXUSGD-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc(F)nc3)C2)cc1 ZINC000824820614 1030648813 /nfs/dbraw/zinc/64/88/13/1030648813.db2.gz JFPITPJTIZCBGZ-OAHLLOKOSA-N 1 1 315.348 3.509 20 5 DHBDMO COc1ccc(C[N@H+]2CC[C@]3(CC[C@@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000359292240 1030891365 /nfs/dbraw/zinc/89/13/65/1030891365.db2.gz DPBFHBJDNSHZFQ-DYVFJYSZSA-N 1 1 304.390 3.616 20 5 DHBDMO CC(C)O[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000844379300 1031107285 /nfs/dbraw/zinc/10/72/85/1031107285.db2.gz PJNFDBKSVACWJV-CQSZACIVSA-N 1 1 312.797 3.638 20 5 DHBDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000844379300 1031107296 /nfs/dbraw/zinc/10/72/96/1031107296.db2.gz PJNFDBKSVACWJV-CQSZACIVSA-N 1 1 312.797 3.638 20 5 DHBDMO CC1(C)CC[C@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)O1 ZINC000360124917 1031286116 /nfs/dbraw/zinc/28/61/16/1031286116.db2.gz VMEDRXNXRUYJCD-MRXNPFEDSA-N 1 1 304.390 3.517 20 5 DHBDMO COc1ccc(F)c(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000293091710 1031321812 /nfs/dbraw/zinc/32/18/12/1031321812.db2.gz XCZIODWZDZTWAK-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1cccc(O)c1F)c1cccc([N+](=O)[O-])c1 ZINC000872026395 1031409987 /nfs/dbraw/zinc/40/99/87/1031409987.db2.gz AFBIEDWZXJOGIM-QWRGUYRKSA-N 1 1 304.321 3.851 20 5 DHBDMO COc1cc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])ccc1C ZINC000872026820 1031410150 /nfs/dbraw/zinc/41/01/50/1031410150.db2.gz GLLRDPFJBPKWLT-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(O)c1 ZINC000872030220 1031414558 /nfs/dbraw/zinc/41/45/58/1031414558.db2.gz BHBMGMAXNLRXIH-NSHDSACASA-N 1 1 318.398 3.873 20 5 DHBDMO CC(C)[N@H+]1CCC[C@@H](CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872035584 1031418438 /nfs/dbraw/zinc/41/84/38/1031418438.db2.gz XIENAQMDRLSAAG-KBPBESRZSA-N 1 1 323.412 3.505 20 5 DHBDMO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042876 1031429192 /nfs/dbraw/zinc/42/91/92/1031429192.db2.gz DXZGSZLNFGMNMG-NEPJUHHUSA-N 1 1 303.337 3.849 20 5 DHBDMO C[C@H]([NH2+]Cc1ccccc1N(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872044901 1031434182 /nfs/dbraw/zinc/43/41/82/1031434182.db2.gz HFJBQIJOFGIYLM-LBPRGKRZSA-N 1 1 317.364 3.651 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc2c(c1)COC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872050670 1031437895 /nfs/dbraw/zinc/43/78/95/1031437895.db2.gz BEQLYAVEQOBWLJ-LLVKDONJSA-N 1 1 316.332 3.615 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCc2ccncc2)C2CC2)cc1 ZINC000360471968 1031439218 /nfs/dbraw/zinc/43/92/18/1031439218.db2.gz DKSSDVBKJKCJAT-UHFFFAOYSA-N 1 1 311.385 3.587 20 5 DHBDMO Cc1c(C[NH2+][C@@H](C)c2cccc(O)c2F)cccc1[N+](=O)[O-] ZINC000872067223 1031462730 /nfs/dbraw/zinc/46/27/30/1031462730.db2.gz VTBQVZQKNFFCOU-NSHDSACASA-N 1 1 304.321 3.599 20 5 DHBDMO C[C@@H](O)[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872087468 1031483047 /nfs/dbraw/zinc/48/30/47/1031483047.db2.gz FFETUCRRNRBZRW-JKDFXYPNSA-N 1 1 318.348 3.507 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000293837474 1031649049 /nfs/dbraw/zinc/64/90/49/1031649049.db2.gz SRMALUSVPCFEDP-VHSXEESVSA-N 1 1 321.327 3.867 20 5 DHBDMO CO[C@]1(C)CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000361412768 1031914107 /nfs/dbraw/zinc/91/41/07/1031914107.db2.gz MPOABMJFPYXVSG-OAHLLOKOSA-N 1 1 312.797 3.639 20 5 DHBDMO COC1(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCCC1 ZINC000361508264 1031961889 /nfs/dbraw/zinc/96/18/89/1031961889.db2.gz KNQSKGPKNPTPNS-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000361576726 1031995570 /nfs/dbraw/zinc/99/55/70/1031995570.db2.gz JNNZVTZHTWDJMS-CYBMUJFWSA-N 1 1 324.380 3.909 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000361576726 1031995580 /nfs/dbraw/zinc/99/55/80/1031995580.db2.gz JNNZVTZHTWDJMS-CYBMUJFWSA-N 1 1 324.380 3.909 20 5 DHBDMO C[C@@H]1CCCCC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777956570 1032040325 /nfs/dbraw/zinc/04/03/25/1032040325.db2.gz JLGVBBDWHBLOPM-CQSZACIVSA-N 1 1 314.389 3.680 20 5 DHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000136940594 1033317155 /nfs/dbraw/zinc/31/71/55/1033317155.db2.gz WGJREWZSSFLUMJ-CVEARBPZSA-N 1 1 318.398 3.527 20 5 DHBDMO C[C@@H]1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1(F)F ZINC001172903262 1033438083 /nfs/dbraw/zinc/43/80/83/1033438083.db2.gz GEQHNGUOLLJWRO-IUODEOHRSA-N 1 1 324.371 3.819 20 5 DHBDMO C[C@@H]1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1(F)F ZINC001172903262 1033438084 /nfs/dbraw/zinc/43/80/84/1033438084.db2.gz GEQHNGUOLLJWRO-IUODEOHRSA-N 1 1 324.371 3.819 20 5 DHBDMO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000877813149 1033462504 /nfs/dbraw/zinc/46/25/04/1033462504.db2.gz XBLJOVDMHMSHKY-GFCCVEGCSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000877813149 1033462512 /nfs/dbraw/zinc/46/25/12/1033462512.db2.gz XBLJOVDMHMSHKY-GFCCVEGCSA-N 1 1 306.259 3.508 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)CC(C)(C)C)c1F ZINC001173190110 1033582983 /nfs/dbraw/zinc/58/29/83/1033582983.db2.gz QKKUNZBMKWDGBK-NSHDSACASA-N 1 1 312.385 3.651 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@H](C)C[C@H]2C)c1F ZINC001173189892 1033583102 /nfs/dbraw/zinc/58/31/02/1033583102.db2.gz OICIJNPSJOJHKY-XQQFMLRXSA-N 1 1 324.396 3.794 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CC3(C2)CCCC3)c1F ZINC001173182775 1033583668 /nfs/dbraw/zinc/58/36/68/1033583668.db2.gz TYNODPOLNPVWTI-LBPRGKRZSA-N 1 1 322.380 3.550 20 5 DHBDMO CCC(CC)[N@@H+](C)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173195628 1033586935 /nfs/dbraw/zinc/58/69/35/1033586935.db2.gz HPFYWQSGYPKTKY-LLVKDONJSA-N 1 1 312.385 3.794 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173195130 1033587004 /nfs/dbraw/zinc/58/70/04/1033587004.db2.gz CCZFYWMDPYDZFG-CHWSQXEVSA-N 1 1 324.396 3.938 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)C[C@H]2CC2(C)C)c1F ZINC001173198383 1033589462 /nfs/dbraw/zinc/58/94/62/1033589462.db2.gz ZBTPQLBXHSNWLI-NWDGAFQWSA-N 1 1 324.396 3.651 20 5 DHBDMO CC[C@@H]1CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173197365 1033590004 /nfs/dbraw/zinc/59/00/04/1033590004.db2.gz UNLUWAYDNLZKMY-QWHCGFSZSA-N 1 1 324.396 3.796 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001173223127 1033602300 /nfs/dbraw/zinc/60/23/00/1033602300.db2.gz YHJZPTRRBFUQLA-KYOSRNDESA-N 1 1 310.344 3.503 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1cccnc1 ZINC001173226622 1033604941 /nfs/dbraw/zinc/60/49/41/1033604941.db2.gz MWOPDRQJOKNQIQ-KSSFIOAISA-N 1 1 311.385 3.758 20 5 DHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878632720 1033776591 /nfs/dbraw/zinc/77/65/91/1033776591.db2.gz MJNWWRLAPITFQN-GFCCVEGCSA-N 1 1 318.377 3.655 20 5 DHBDMO CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(C)C ZINC000553830445 1033858850 /nfs/dbraw/zinc/85/88/50/1033858850.db2.gz BKNYKZVFJAHEOL-UHFFFAOYSA-N 1 1 321.421 3.600 20 5 DHBDMO Cc1ncc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])s1 ZINC000879251031 1033963922 /nfs/dbraw/zinc/96/39/22/1033963922.db2.gz BRMLVDWUFXABAS-MRVPVSSYSA-N 1 1 311.794 3.864 20 5 DHBDMO Cc1cccc(C[N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])c1C ZINC000794650683 1034328854 /nfs/dbraw/zinc/32/88/54/1034328854.db2.gz SSZPOXCUMWVFQX-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO Cc1cccc(C[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])c1C ZINC000794650683 1034328861 /nfs/dbraw/zinc/32/88/61/1034328861.db2.gz SSZPOXCUMWVFQX-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO Cc1c([C@H](C)NC[C@H](C)[N@@H+]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000480622291 1034359040 /nfs/dbraw/zinc/35/90/40/1034359040.db2.gz GFSOJXMNKBBDFV-DZKIICNBSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1c([C@H](C)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000480622291 1034359055 /nfs/dbraw/zinc/35/90/55/1034359055.db2.gz GFSOJXMNKBBDFV-DZKIICNBSA-N 1 1 319.449 3.817 20 5 DHBDMO C[C@H](CN1CCCCCC1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000480697435 1034410110 /nfs/dbraw/zinc/41/01/10/1034410110.db2.gz KURZHENCZGHMQX-HUUCEWRRSA-N 1 1 305.422 3.510 20 5 DHBDMO CCc1ccc([C@@H](COC)[NH2+]Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000184827394 1034504671 /nfs/dbraw/zinc/50/46/71/1034504671.db2.gz UIMZBCSMHQNZLX-OAHLLOKOSA-N 1 1 318.373 3.536 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2n[nH]cc21 ZINC000600112708 1034746020 /nfs/dbraw/zinc/74/60/20/1034746020.db2.gz RMMZTXYGGAXUPR-UHFFFAOYSA-N 1 1 324.384 3.882 20 5 DHBDMO Cc1ccc([C@@H](C)NCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000481408209 1034819329 /nfs/dbraw/zinc/81/93/29/1034819329.db2.gz SYKSAXUBGDTDDN-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]CCN(C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000481408209 1034819342 /nfs/dbraw/zinc/81/93/42/1034819342.db2.gz SYKSAXUBGDTDDN-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)N[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481578600 1034890210 /nfs/dbraw/zinc/89/02/10/1034890210.db2.gz UVMNCBODKINXCG-QKPAOTATSA-N 1 1 319.449 3.612 20 5 DHBDMO C[C@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481578600 1034890219 /nfs/dbraw/zinc/89/02/19/1034890219.db2.gz UVMNCBODKINXCG-QKPAOTATSA-N 1 1 319.449 3.612 20 5 DHBDMO CC(C)CC[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000481709839 1034947445 /nfs/dbraw/zinc/94/74/45/1034947445.db2.gz ARBXOKZZJPYTFP-QGZVFWFLSA-N 1 1 308.422 3.602 20 5 DHBDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000481756519 1034961434 /nfs/dbraw/zinc/96/14/34/1034961434.db2.gz NMVGVPINYXDSMP-GWCFXTLKSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000481756521 1034961486 /nfs/dbraw/zinc/96/14/86/1034961486.db2.gz NMVGVPINYXDSMP-MFKMUULPSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000481756595 1034962319 /nfs/dbraw/zinc/96/23/19/1034962319.db2.gz OIFYGEQFAFZSBW-ZWNOBZJWSA-N 1 1 302.296 3.758 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000481756595 1034962330 /nfs/dbraw/zinc/96/23/30/1034962330.db2.gz OIFYGEQFAFZSBW-ZWNOBZJWSA-N 1 1 302.296 3.758 20 5 DHBDMO CCCC[N@@H+](CC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159414107 1035048890 /nfs/dbraw/zinc/04/88/90/1035048890.db2.gz SMYJGIGCGRPOIC-UHFFFAOYSA-N 1 1 315.211 3.979 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H](CF)C2)c1 ZINC001175732998 1035094673 /nfs/dbraw/zinc/09/46/73/1035094673.db2.gz KAPRMJJEYIYAHG-JTQLQIEISA-N 1 1 320.286 3.795 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H](CF)C2)c1 ZINC001175732998 1035094679 /nfs/dbraw/zinc/09/46/79/1035094679.db2.gz KAPRMJJEYIYAHG-JTQLQIEISA-N 1 1 320.286 3.795 20 5 DHBDMO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@@H]1CC=CCC1 ZINC000483495020 1035274556 /nfs/dbraw/zinc/27/45/56/1035274556.db2.gz XPDXIGVDTIDPRS-CQSZACIVSA-N 1 1 322.380 3.539 20 5 DHBDMO C[C@@H]1CCCC[C@H]1OCC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001193743593 1035713266 /nfs/dbraw/zinc/71/32/66/1035713266.db2.gz QTJMDDUZPJXWLK-CRAIPNDOSA-N 1 1 320.433 3.664 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1ccnc3ccccc13)CC2 ZINC000539831001 1035889414 /nfs/dbraw/zinc/88/94/14/1035889414.db2.gz FARTWIWKWBQQNH-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1ccnc3ccccc13)CC2 ZINC000539831001 1035889432 /nfs/dbraw/zinc/88/94/32/1035889432.db2.gz FARTWIWKWBQQNH-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO CO[C@@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])C12CCC2 ZINC001194384236 1035916822 /nfs/dbraw/zinc/91/68/22/1035916822.db2.gz JTECZFDDJRODNC-LSDHHAIUSA-N 1 1 324.808 3.638 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](c2ccccc2C)C(C)C)c1[N+](=O)[O-] ZINC000595413971 1036140369 /nfs/dbraw/zinc/14/03/69/1036140369.db2.gz DRHDDUTTYYRVGV-OAHLLOKOSA-N 1 1 303.362 3.687 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000595786421 1036423139 /nfs/dbraw/zinc/42/31/39/1036423139.db2.gz ABWJJNLNMRRKSG-RKVPGOIHSA-N 1 1 318.417 3.937 20 5 DHBDMO Cc1c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000271696987 1036479108 /nfs/dbraw/zinc/47/91/08/1036479108.db2.gz GPIUNDFCVGGUOG-LBPRGKRZSA-N 1 1 315.329 3.662 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000542053491 1036501160 /nfs/dbraw/zinc/50/11/60/1036501160.db2.gz URIMHSUVFAEPFD-NWANDNLSSA-N 1 1 304.390 3.614 20 5 DHBDMO COC[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 ZINC000271790991 1036540672 /nfs/dbraw/zinc/54/06/72/1036540672.db2.gz KBASDSRZKXBTBI-HNNXBMFYSA-N 1 1 320.776 3.726 20 5 DHBDMO CC[C@H]1CCC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000915209295 1036705639 /nfs/dbraw/zinc/70/56/39/1036705639.db2.gz MGWKRBZNGVBCIT-NSHDSACASA-N 1 1 321.402 3.951 20 5 DHBDMO CC[C@H]1CCC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000915209295 1036705659 /nfs/dbraw/zinc/70/56/59/1036705659.db2.gz MGWKRBZNGVBCIT-NSHDSACASA-N 1 1 321.402 3.951 20 5 DHBDMO COc1ccc(C[N@H+]2CCSC[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC001197295459 1036724285 /nfs/dbraw/zinc/72/42/85/1036724285.db2.gz GPUDSWVWCFEHES-OAHLLOKOSA-N 1 1 324.446 3.567 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCSC[C@@H](C)C1 ZINC000488229283 1036912635 /nfs/dbraw/zinc/91/26/35/1036912635.db2.gz GWXDQKJFZOFCFT-ZDUSSCGKSA-N 1 1 324.446 3.567 20 5 DHBDMO CCOc1cc(C[N@H+]2CCS[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000492776606 1037005978 /nfs/dbraw/zinc/00/59/78/1037005978.db2.gz VANMEGXFQSNTSP-MRXNPFEDSA-N 1 1 324.446 3.567 20 5 DHBDMO CCOc1cc(C[N@H+]2CCS[C@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000492776605 1037006849 /nfs/dbraw/zinc/00/68/49/1037006849.db2.gz VANMEGXFQSNTSP-INIZCTEOSA-N 1 1 324.446 3.567 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000492829321 1037025641 /nfs/dbraw/zinc/02/56/41/1037025641.db2.gz KQNVNQMORGVHKH-JYJNAYRXSA-N 1 1 318.417 3.713 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@]12CCC[C@H]1OCC2 ZINC001198790722 1037123162 /nfs/dbraw/zinc/12/31/62/1037123162.db2.gz MYQQKOGJBIXPAO-HZPDHXFCSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCOc1ccccc1F ZINC000487680495 1037261384 /nfs/dbraw/zinc/26/13/84/1037261384.db2.gz UAWZJMNNFVNYOA-ZDUSSCGKSA-N 1 1 318.348 3.806 20 5 DHBDMO C[C@@H](Nc1ccsc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001186071113 1037300525 /nfs/dbraw/zinc/30/05/25/1037300525.db2.gz VMWJDWNEVSMWRH-NEPJUHHUSA-N 1 1 309.435 3.721 20 5 DHBDMO COc1cc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000490063137 1037600651 /nfs/dbraw/zinc/60/06/51/1037600651.db2.gz XBCYTPAXEXURNH-SCLBCKFNSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000490063137 1037600658 /nfs/dbraw/zinc/60/06/58/1037600658.db2.gz XBCYTPAXEXURNH-SCLBCKFNSA-N 1 1 312.369 3.796 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c(F)c1 ZINC000490545006 1037731160 /nfs/dbraw/zinc/73/11/60/1037731160.db2.gz MWXTZXMKDKSYOO-INIZCTEOSA-N 1 1 322.380 3.658 20 5 DHBDMO C[C@@H](CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000301147272 1037740523 /nfs/dbraw/zinc/74/05/23/1037740523.db2.gz HHAUZYNRPJDPSU-VIFPVBQESA-N 1 1 317.311 3.508 20 5 DHBDMO COc1ccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000917039597 1038123667 /nfs/dbraw/zinc/12/36/67/1038123667.db2.gz KCXDJHHCKSUVBG-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000917039597 1038123674 /nfs/dbraw/zinc/12/36/74/1038123674.db2.gz KCXDJHHCKSUVBG-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@H](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000588977868 1038414664 /nfs/dbraw/zinc/41/46/64/1038414664.db2.gz BKKNMMPKGNHAAP-HNNXBMFYSA-N 1 1 304.390 3.616 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000589343989 1038462031 /nfs/dbraw/zinc/46/20/31/1038462031.db2.gz FDBOSUSZEWCRAA-HUUCEWRRSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000589343989 1038462037 /nfs/dbraw/zinc/46/20/37/1038462037.db2.gz FDBOSUSZEWCRAA-HUUCEWRRSA-N 1 1 307.438 3.674 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccccc2)O1 ZINC000249738984 1038464377 /nfs/dbraw/zinc/46/43/77/1038464377.db2.gz HCFOFRWMFZMIPN-KDOFPFPSSA-N 1 1 312.369 3.557 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccccc2)O1 ZINC000249738984 1038464382 /nfs/dbraw/zinc/46/43/82/1038464382.db2.gz HCFOFRWMFZMIPN-KDOFPFPSSA-N 1 1 312.369 3.557 20 5 DHBDMO CC(C)C[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001191899510 1038564776 /nfs/dbraw/zinc/56/47/76/1038564776.db2.gz LFLSIMPTJGIVGF-CQSZACIVSA-N 1 1 321.377 3.904 20 5 DHBDMO CC[C@@H](C)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130655 1039123387 /nfs/dbraw/zinc/12/33/87/1039123387.db2.gz HPJHNYFFSDGBPR-DJIMGWMZSA-N 1 1 320.433 3.746 20 5 DHBDMO Cc1ccccc1C1([NH2+]Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000592140072 1039134259 /nfs/dbraw/zinc/13/42/59/1039134259.db2.gz YCWIGPREJPRFNT-UHFFFAOYSA-N 1 1 300.333 3.821 20 5 DHBDMO Cc1ccccc1C1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000592139455 1039135206 /nfs/dbraw/zinc/13/52/06/1039135206.db2.gz HJOSDLWZUFGXKX-UHFFFAOYSA-N 1 1 322.368 3.558 20 5 DHBDMO C[N@@H+](CCC(C)(C)C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000592145211 1039137143 /nfs/dbraw/zinc/13/71/43/1039137143.db2.gz OKZJVBNXAACZEU-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592183968 1039172521 /nfs/dbraw/zinc/17/25/21/1039172521.db2.gz MQCNYCKYRDTVQG-CABCVRRESA-N 1 1 318.417 3.855 20 5 DHBDMO C[C@H]1C[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000599511914 1039184111 /nfs/dbraw/zinc/18/41/11/1039184111.db2.gz CXAMJPMMNMOXBG-UWVGGRQHSA-N 1 1 318.751 3.971 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@@H]1C ZINC000573985070 1039191667 /nfs/dbraw/zinc/19/16/67/1039191667.db2.gz MPOFCJAKOXCHFV-NXEZZACHSA-N 1 1 302.296 3.844 20 5 DHBDMO CCOc1cc(C[N@@H+]2CCC(F)(F)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000599628236 1039235378 /nfs/dbraw/zinc/23/53/78/1039235378.db2.gz QXYMHUWAANZAEN-LLVKDONJSA-N 1 1 314.332 3.613 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC(F)(F)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000599628236 1039235390 /nfs/dbraw/zinc/23/53/90/1039235390.db2.gz QXYMHUWAANZAEN-LLVKDONJSA-N 1 1 314.332 3.613 20 5 DHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1 ZINC000604012474 1039279219 /nfs/dbraw/zinc/27/92/19/1039279219.db2.gz GUROLKFSSFIJLL-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](OC(C)C)C1 ZINC000593053776 1039378837 /nfs/dbraw/zinc/37/88/37/1039378837.db2.gz MGVLPUWRFBJBQZ-GOEBONIOSA-N 1 1 306.406 3.854 20 5 DHBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000058932506 1039632974 /nfs/dbraw/zinc/63/29/74/1039632974.db2.gz SQCPZQAOGYXNPU-CYBMUJFWSA-N 1 1 318.348 3.806 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CC(Cc2ccccc2)C1 ZINC000761060585 1039762377 /nfs/dbraw/zinc/76/23/77/1039762377.db2.gz MKDMDXULIKDMDM-UHFFFAOYSA-N 1 1 316.788 3.923 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594026274 1039950959 /nfs/dbraw/zinc/95/09/59/1039950959.db2.gz HYUUKDDALPPGGR-DYVFJYSZSA-N 1 1 304.390 3.689 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1cnccc1C ZINC000595022669 1039987365 /nfs/dbraw/zinc/98/73/65/1039987365.db2.gz UXQMRVRQLXYLCG-OLZOCXBDSA-N 1 1 315.373 3.719 20 5 DHBDMO CC(C)[C@H](O)[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000594991540 1040006977 /nfs/dbraw/zinc/00/69/77/1040006977.db2.gz JCGJSALVHWTXSN-CVEARBPZSA-N 1 1 320.414 3.504 20 5 DHBDMO C[C@H](N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595079012 1040071872 /nfs/dbraw/zinc/07/18/72/1040071872.db2.gz BZDKFUMWJVUDIR-GOEBONIOSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCN(C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595079012 1040071882 /nfs/dbraw/zinc/07/18/82/1040071882.db2.gz BZDKFUMWJVUDIR-GOEBONIOSA-N 1 1 317.433 3.652 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@H]2c2ccccc2C)c1[N+](=O)[O-] ZINC000595293474 1040090236 /nfs/dbraw/zinc/09/02/36/1040090236.db2.gz ORFHCALZMVOCSD-AWEZNQCLSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2c2ccccc2C)c1[N+](=O)[O-] ZINC000595293474 1040090255 /nfs/dbraw/zinc/09/02/55/1040090255.db2.gz ORFHCALZMVOCSD-AWEZNQCLSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@@H]2c2cccc(C)c2)c1[N+](=O)[O-] ZINC000595292904 1040092160 /nfs/dbraw/zinc/09/21/60/1040092160.db2.gz DVTYRFNEWNXMDQ-CQSZACIVSA-N 1 1 301.346 3.537 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2c2cccc(C)c2)c1[N+](=O)[O-] ZINC000595292904 1040092175 /nfs/dbraw/zinc/09/21/75/1040092175.db2.gz DVTYRFNEWNXMDQ-CQSZACIVSA-N 1 1 301.346 3.537 20 5 DHBDMO CC(C)CCOC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595297825 1040092845 /nfs/dbraw/zinc/09/28/45/1040092845.db2.gz PFVXSXCNDFDWHI-UHFFFAOYSA-N 1 1 324.396 3.761 20 5 DHBDMO CCC[N@H+](Cc1onc(C)c1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000595297323 1040095857 /nfs/dbraw/zinc/09/58/57/1040095857.db2.gz RCAKGTNGNDLQNG-OAHLLOKOSA-N 1 1 315.373 3.791 20 5 DHBDMO CCC[N@@H+](Cc1onc(C)c1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000595297323 1040095874 /nfs/dbraw/zinc/09/58/74/1040095874.db2.gz RCAKGTNGNDLQNG-OAHLLOKOSA-N 1 1 315.373 3.791 20 5 DHBDMO Cc1noc(C[NH2+][C@H](c2ccccc2)C2CCCC2)c1[N+](=O)[O-] ZINC000595375735 1040127631 /nfs/dbraw/zinc/12/76/31/1040127631.db2.gz VIMQYRXHZIVAJV-MRXNPFEDSA-N 1 1 315.373 3.912 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCSC2(CCC2)CC1 ZINC000595535855 1040150289 /nfs/dbraw/zinc/15/02/89/1040150289.db2.gz ROHLKLOFUVGQCJ-UHFFFAOYSA-N 1 1 310.394 3.596 20 5 DHBDMO Cc1noc(C[N@H+](C)[C@H]2CCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595539399 1040168008 /nfs/dbraw/zinc/16/80/08/1040168008.db2.gz LZIPYNLLYARWIT-GJZGRUSLSA-N 1 1 315.373 3.659 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@@H](c3ccccc3)C2(C)C)c1[N+](=O)[O-] ZINC000595544926 1040170118 /nfs/dbraw/zinc/17/01/18/1040170118.db2.gz BYOSKGPFJNLJHZ-AWEZNQCLSA-N 1 1 315.373 3.659 20 5 DHBDMO O=C1CCCC12CC[NH+](Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000595817575 1040249510 /nfs/dbraw/zinc/24/95/10/1040249510.db2.gz NVWWCRONSOWQAD-UHFFFAOYSA-N 1 1 322.792 3.583 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000595785288 1040251899 /nfs/dbraw/zinc/25/18/99/1040251899.db2.gz DACGJCBYMJMLSA-RHSMWYFYSA-N 1 1 322.380 3.515 20 5 DHBDMO CCOc1cc(NC[C@@H]2CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000596306545 1040374754 /nfs/dbraw/zinc/37/47/54/1040374754.db2.gz FKSWKAKGNJNNEJ-ZDUSSCGKSA-N 1 1 321.421 3.526 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(C(C)C)no2)cc1[N+](=O)[O-] ZINC000169238252 1040388355 /nfs/dbraw/zinc/38/83/55/1040388355.db2.gz BCVLSSXUVJBPNR-LBPRGKRZSA-N 1 1 303.362 3.865 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccc(F)cc3)CCC2)cs1 ZINC000608837235 1040624540 /nfs/dbraw/zinc/62/45/40/1040624540.db2.gz KFJLQUDPJAIJMG-UHFFFAOYSA-N 1 1 306.362 3.964 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000491206186 1040642224 /nfs/dbraw/zinc/64/22/24/1040642224.db2.gz CVQJHEMCCKFEPH-AWEZNQCLSA-N 1 1 304.390 3.614 20 5 DHBDMO COc1ccc(C[N@@H+](C)C[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000608976714 1040656402 /nfs/dbraw/zinc/65/64/02/1040656402.db2.gz JTBTYGKEEQSEKJ-AWEZNQCLSA-N 1 1 314.385 3.839 20 5 DHBDMO C[C@@H](C[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000608976696 1040656729 /nfs/dbraw/zinc/65/67/29/1040656729.db2.gz IMBFYNLBKCNPOQ-HNNXBMFYSA-N 1 1 314.385 3.709 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000597224046 1040703143 /nfs/dbraw/zinc/70/31/43/1040703143.db2.gz CNHXEGLQNZRTQK-FUHWJXTLSA-N 1 1 318.417 3.684 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000534331861 1040805486 /nfs/dbraw/zinc/80/54/86/1040805486.db2.gz AZGVTRZSXPUFEC-MTIYJEKLSA-N 1 1 309.369 3.840 20 5 DHBDMO CC(C)(CC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602631524 1041137198 /nfs/dbraw/zinc/13/71/98/1041137198.db2.gz YMQDXYPLUYALCF-UHFFFAOYSA-N 1 1 317.267 3.557 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H](c2cccnc2)C1 ZINC000602855937 1041266079 /nfs/dbraw/zinc/26/60/79/1041266079.db2.gz QOZJJFKJXZJMSE-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO Cc1c(C[N@H+](C)Cc2ccc(Cl)nc2)cccc1[N+](=O)[O-] ZINC000080909877 192201564 /nfs/dbraw/zinc/20/15/64/192201564.db2.gz SRPWDPDOENBOQQ-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO Cc1c(C[N@@H+](C)Cc2ccc(Cl)nc2)cccc1[N+](=O)[O-] ZINC000080909877 192201567 /nfs/dbraw/zinc/20/15/67/192201567.db2.gz SRPWDPDOENBOQQ-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H](c3ccncc3)C2)cccc1[N+](=O)[O-] ZINC000289269838 131370454 /nfs/dbraw/zinc/37/04/54/131370454.db2.gz DYOCVTVPHWJNHC-KRWDZBQOSA-N 1 1 311.385 3.678 20 5 DHBDMO CCC[C@@H](NCC[N@@H+](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000320520121 335070600 /nfs/dbraw/zinc/07/06/00/335070600.db2.gz GOAZFTHRIIVYAF-GOSISDBHSA-N 1 1 319.449 3.900 20 5 DHBDMO CCC[C@@H]([NH2+]CCN(C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000320520121 335070601 /nfs/dbraw/zinc/07/06/01/335070601.db2.gz GOAZFTHRIIVYAF-GOSISDBHSA-N 1 1 319.449 3.900 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccccc2OC(F)F)cs1 ZINC000037562600 331579718 /nfs/dbraw/zinc/57/97/18/331579718.db2.gz LRMJRHIFHWDKJC-UHFFFAOYSA-N 1 1 314.313 3.548 20 5 DHBDMO CC[N@@H+]1CCCC[C@@H]1CNCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000518450520 332047354 /nfs/dbraw/zinc/04/73/54/332047354.db2.gz IWUNGZILDSNCHG-MRXNPFEDSA-N 1 1 319.449 3.682 20 5 DHBDMO CC[N@H+]1CCCC[C@@H]1CNCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000518450520 332047355 /nfs/dbraw/zinc/04/73/55/332047355.db2.gz IWUNGZILDSNCHG-MRXNPFEDSA-N 1 1 319.449 3.682 20 5 DHBDMO C[C@@H]1COCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000091800901 332087681 /nfs/dbraw/zinc/08/76/81/332087681.db2.gz KLLAZRHCEXGCQA-GFCCVEGCSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@@H]1COCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000091800901 332087682 /nfs/dbraw/zinc/08/76/82/332087682.db2.gz KLLAZRHCEXGCQA-GFCCVEGCSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000449463614 332237649 /nfs/dbraw/zinc/23/76/49/332237649.db2.gz WPTHBRPZDZPNJA-PWSUYJOCSA-N 1 1 302.296 3.758 20 5 DHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000559431935 332258542 /nfs/dbraw/zinc/25/85/42/332258542.db2.gz MHKLYXURHBLFSG-ZIAGYGMSSA-N 1 1 304.390 3.614 20 5 DHBDMO CCC[N@H+]1CCC[C@H]1c1nc(-c2ccc([N+](=O)[O-])cc2C)no1 ZINC000564405326 332276424 /nfs/dbraw/zinc/27/64/24/332276424.db2.gz PTLSXYAFGJBWFX-AWEZNQCLSA-N 1 1 316.361 3.500 20 5 DHBDMO CC[C@@H](NC[C@@H](CC(C)C)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000314060733 333085068 /nfs/dbraw/zinc/08/50/68/333085068.db2.gz AIGKPSLLIJXROF-IAGOWNOFSA-N 1 1 307.438 3.612 20 5 DHBDMO CCC[C@@H](NC[C@@H](C)C[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000320696579 335125147 /nfs/dbraw/zinc/12/51/47/335125147.db2.gz HQEXLKSPZFEIJK-CRAIPNDOSA-N 1 1 319.449 3.758 20 5 DHBDMO C[C@H]1CCCC[C@@H]1OCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000534509758 334279558 /nfs/dbraw/zinc/27/95/58/334279558.db2.gz NLOSPLIWFGEJLX-KSSFIOAISA-N 1 1 318.417 3.548 20 5 DHBDMO C[C@H]1CCCC[C@@H]1OCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000534509758 334279560 /nfs/dbraw/zinc/27/95/60/334279560.db2.gz NLOSPLIWFGEJLX-KSSFIOAISA-N 1 1 318.417 3.548 20 5 DHBDMO Cc1csc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000417332846 334709315 /nfs/dbraw/zinc/70/93/15/334709315.db2.gz YAEAOIAGBXENKC-OAHLLOKOSA-N 1 1 317.414 3.917 20 5 DHBDMO CC[C@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000344096568 335217802 /nfs/dbraw/zinc/21/78/02/335217802.db2.gz HGAJQAZQJMIKKM-JKSUJKDBSA-N 1 1 316.332 3.908 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1)c1nc(C)cs1 ZINC000347661708 335514215 /nfs/dbraw/zinc/51/42/15/335514215.db2.gz YXBVMRAHXUOXTE-LBPRGKRZSA-N 1 1 321.402 3.609 20 5 DHBDMO CCSCC[C@H](C)[N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351720540 336062366 /nfs/dbraw/zinc/06/23/66/336062366.db2.gz PWDGCEJFCWCKEJ-JTQLQIEISA-N 1 1 318.389 3.837 20 5 DHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351720540 336062367 /nfs/dbraw/zinc/06/23/67/336062367.db2.gz PWDGCEJFCWCKEJ-JTQLQIEISA-N 1 1 318.389 3.837 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3nccs3)C2)c(F)c1 ZINC000332360534 336169831 /nfs/dbraw/zinc/16/98/31/336169831.db2.gz UXZYFUBOUPYXSK-GFCCVEGCSA-N 1 1 321.377 3.570 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nccs3)C2)c(F)c1 ZINC000332360534 336169832 /nfs/dbraw/zinc/16/98/32/336169832.db2.gz UXZYFUBOUPYXSK-GFCCVEGCSA-N 1 1 321.377 3.570 20 5 DHBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000351933485 336180897 /nfs/dbraw/zinc/18/08/97/336180897.db2.gz CVGBSBDLTSFFCK-GFCCVEGCSA-N 1 1 310.369 3.513 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000103471351 336241026 /nfs/dbraw/zinc/24/10/26/336241026.db2.gz DJSXPVPCIMUJLE-AWEZNQCLSA-N 1 1 300.333 3.723 20 5 DHBDMO CC[C@@H](N[C@H](C)C[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000192846533 336268519 /nfs/dbraw/zinc/26/85/19/336268519.db2.gz NGKQJCIICVKLCV-RHSMWYFYSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])cc2F)C1 ZINC000301091065 336289533 /nfs/dbraw/zinc/28/95/33/336289533.db2.gz LCDNJDAJLLQEOX-CYBMUJFWSA-N 1 1 309.385 3.658 20 5 DHBDMO Cc1ccc(N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000302824082 336370836 /nfs/dbraw/zinc/37/08/36/336370836.db2.gz LMHXOIKUNXEMFB-WMZOPIPTSA-N 1 1 311.385 3.761 20 5 DHBDMO C[C@H]([NH2+][C@@H]1c2ccc(F)cc2O[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000367575448 336825623 /nfs/dbraw/zinc/82/56/23/336825623.db2.gz KUHVYQINEZDXEC-DINDLPBHSA-N 1 1 316.332 3.907 20 5 DHBDMO CSC[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182242041 337187673 /nfs/dbraw/zinc/18/76/73/337187673.db2.gz QUZYIYYMLUHLLJ-LBPRGKRZSA-N 1 1 300.811 3.576 20 5 DHBDMO Cc1ccc[nH+]c1NCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000184828464 337200403 /nfs/dbraw/zinc/20/04/03/337200403.db2.gz PPCTZAQIRPYXSU-UHFFFAOYSA-N 1 1 309.272 3.512 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000582877415 337209673 /nfs/dbraw/zinc/20/96/73/337209673.db2.gz OBLWUTPFODPYFW-LLBKUYECSA-N 1 1 310.344 3.975 20 5 DHBDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000429293178 338076898 /nfs/dbraw/zinc/07/68/98/338076898.db2.gz JNTVQVFWHWPRQL-LLVKDONJSA-N 1 1 314.838 3.823 20 5 DHBDMO COc1ccc(C[N@H+]2CC3(CCC3)[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000430081370 338095214 /nfs/dbraw/zinc/09/52/14/338095214.db2.gz AVTRVSZYDXCNND-MRXNPFEDSA-N 1 1 304.390 3.614 20 5 DHBDMO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430218558 338101858 /nfs/dbraw/zinc/10/18/58/338101858.db2.gz JDJXSLLVFYFDHS-INIZCTEOSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430218558 338101859 /nfs/dbraw/zinc/10/18/59/338101859.db2.gz JDJXSLLVFYFDHS-INIZCTEOSA-N 1 1 315.373 3.582 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCC2)C[C@@H]1C ZINC000432797273 338168326 /nfs/dbraw/zinc/16/83/26/338168326.db2.gz LCCGUARSYADVLA-ZDUSSCGKSA-N 1 1 304.390 3.758 20 5 DHBDMO CCCCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)C ZINC000434700196 338223628 /nfs/dbraw/zinc/22/36/28/338223628.db2.gz RPXREYCJIZCNAM-UHFFFAOYSA-N 1 1 321.421 3.742 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCSC(C)(C)C1 ZINC000434904471 338227610 /nfs/dbraw/zinc/22/76/10/338227610.db2.gz FGOHPDRNQDUTIM-UHFFFAOYSA-N 1 1 324.446 3.709 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCSC(C)(C)C1 ZINC000434904471 338227611 /nfs/dbraw/zinc/22/76/11/338227611.db2.gz FGOHPDRNQDUTIM-UHFFFAOYSA-N 1 1 324.446 3.709 20 5 DHBDMO CCC[N@@H+](CC)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000434990573 338229234 /nfs/dbraw/zinc/22/92/34/338229234.db2.gz JLXZRKSJAVUWHZ-UHFFFAOYSA-N 1 1 305.403 3.950 20 5 DHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000435066931 338231614 /nfs/dbraw/zinc/23/16/14/338231614.db2.gz XDWMOAKVIZGHPO-CYBMUJFWSA-N 1 1 317.389 3.994 20 5 DHBDMO C[C@H](C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)cc1 ZINC000438121194 338333296 /nfs/dbraw/zinc/33/32/96/338333296.db2.gz YAJCAHXARNPGKI-CYBMUJFWSA-N 1 1 314.360 3.896 20 5 DHBDMO CCCc1csc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000449347789 338615808 /nfs/dbraw/zinc/61/58/08/338615808.db2.gz IZCUEIUYIPTKRE-NSHDSACASA-N 1 1 305.403 3.855 20 5 DHBDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000459650183 339040432 /nfs/dbraw/zinc/04/04/32/339040432.db2.gz MFOLYNFRGPCHSG-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463195033 339108874 /nfs/dbraw/zinc/10/88/74/339108874.db2.gz UXEFMSXGIPIONL-HKUYNNGSSA-N 1 1 310.397 3.873 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@H]2C2CCCC2)c([N+](=O)[O-])cc1F ZINC000463482209 339119305 /nfs/dbraw/zinc/11/93/05/339119305.db2.gz AOGWGQSOLRMXLY-HNNXBMFYSA-N 1 1 322.380 3.897 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000464499011 339143580 /nfs/dbraw/zinc/14/35/80/339143580.db2.gz LRNNUIQHHPLEFE-NJZAAPMLSA-N 1 1 322.380 3.753 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)c1 ZINC000469450314 339289788 /nfs/dbraw/zinc/28/97/88/339289788.db2.gz NHMHWHNDGVQQOM-CYBMUJFWSA-N 1 1 318.323 3.863 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](OCC(C)C)C1 ZINC000470184665 339313418 /nfs/dbraw/zinc/31/34/18/339313418.db2.gz SUFOFGUUVUGPAH-YHTSIIMFSA-N 1 1 318.417 3.745 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000470954778 339332599 /nfs/dbraw/zinc/33/25/99/339332599.db2.gz CCAYTKHMDBMQTM-SCVCMEIPSA-N 1 1 302.296 3.929 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000485689399 339709253 /nfs/dbraw/zinc/70/92/53/339709253.db2.gz DLABZWMGAMEPAY-UHFFFAOYSA-N 1 1 324.739 3.686 20 5 DHBDMO CCOc1cc(C[NH2+][C@H](CC)c2nccs2)ccc1[N+](=O)[O-] ZINC000491612397 339868542 /nfs/dbraw/zinc/86/85/42/339868542.db2.gz IWKNONYWCRAZEO-GFCCVEGCSA-N 1 1 321.402 3.691 20 5 DHBDMO Cc1ccc(C)c(OCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000501778296 340088560 /nfs/dbraw/zinc/08/85/60/340088560.db2.gz SPJFGIWWAXUYHS-UHFFFAOYSA-N 1 1 314.385 3.722 20 5 DHBDMO C[C@@H]1CCCC[C@@H]1OCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000501861397 340089861 /nfs/dbraw/zinc/08/98/61/340089861.db2.gz JFPMBJFBMHLSOO-PBHICJAKSA-N 1 1 306.406 3.622 20 5 DHBDMO C[C@@H]1CCCC[C@@H]1OCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000501861397 340089862 /nfs/dbraw/zinc/08/98/62/340089862.db2.gz JFPMBJFBMHLSOO-PBHICJAKSA-N 1 1 306.406 3.622 20 5 DHBDMO C[C@H]1CCCC[C@@H]1OCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000501861403 340089900 /nfs/dbraw/zinc/08/99/00/340089900.db2.gz JFPMBJFBMHLSOO-YOEHRIQHSA-N 1 1 306.406 3.622 20 5 DHBDMO C[C@H]1CCCC[C@@H]1OCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000501861403 340089901 /nfs/dbraw/zinc/08/99/01/340089901.db2.gz JFPMBJFBMHLSOO-YOEHRIQHSA-N 1 1 306.406 3.622 20 5 DHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1CCCCC1 ZINC000505363270 340167157 /nfs/dbraw/zinc/16/71/57/340167157.db2.gz ZMBPZDYYBZXWAX-UHFFFAOYSA-N 1 1 314.332 3.961 20 5 DHBDMO COc1cccc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])c1 ZINC000505642513 340174065 /nfs/dbraw/zinc/17/40/65/340174065.db2.gz WKDVWSCRYBZVCK-TWGQIWQCSA-N 1 1 312.369 3.749 20 5 DHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000506761581 340201083 /nfs/dbraw/zinc/20/10/83/340201083.db2.gz ZTBLTRAMQOCVQZ-GQCTYLIASA-N 1 1 300.333 3.879 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)cs1 ZINC000507668108 340227743 /nfs/dbraw/zinc/22/77/43/340227743.db2.gz GNKSLJBKYWDIRK-AWEZNQCLSA-N 1 1 302.399 3.721 20 5 DHBDMO C[N@@H+](CCOc1cccc(Cl)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000302808212 340282517 /nfs/dbraw/zinc/28/25/17/340282517.db2.gz RAYWVFZGFIBKJN-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000511072700 340320069 /nfs/dbraw/zinc/32/00/69/340320069.db2.gz LTOPVZFZEVPCIM-UHFFFAOYSA-N 1 1 304.777 3.923 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc2ccccc2n1 ZINC000511092597 340320341 /nfs/dbraw/zinc/32/03/41/340320341.db2.gz BOBXIYIHWSPEMO-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@]3(CC=CCC3)C2)cc1 ZINC000512164863 340350465 /nfs/dbraw/zinc/35/04/65/340350465.db2.gz NTPCGGDOYUIATD-GOSISDBHSA-N 1 1 316.401 3.796 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](COC(F)F)C1 ZINC000512844226 340380559 /nfs/dbraw/zinc/38/05/59/340380559.db2.gz MCBXRHZWJBREKE-VXGBXAGGSA-N 1 1 314.332 3.525 20 5 DHBDMO Cc1ccc([C@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)cc1 ZINC000543246192 341037836 /nfs/dbraw/zinc/03/78/36/341037836.db2.gz OKGWJKZIQCKPNA-HNNXBMFYSA-N 1 1 302.399 3.954 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(F)c(F)c1 ZINC000543630742 341051938 /nfs/dbraw/zinc/05/19/38/341051938.db2.gz ANJBCJYDBXVAHY-UHFFFAOYSA-N 1 1 306.312 3.813 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000543630742 341051939 /nfs/dbraw/zinc/05/19/39/341051939.db2.gz ANJBCJYDBXVAHY-UHFFFAOYSA-N 1 1 306.312 3.813 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000544611515 341088865 /nfs/dbraw/zinc/08/88/65/341088865.db2.gz FUYPFYBOVJYNKS-HZPDHXFCSA-N 1 1 306.431 3.763 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1(C)C ZINC000546832269 341183373 /nfs/dbraw/zinc/18/33/73/341183373.db2.gz ZKXTZMFXCLTOSV-NSHDSACASA-N 1 1 303.362 3.604 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2cccc(F)c2)C2CC2)c1 ZINC000078704891 341246427 /nfs/dbraw/zinc/24/64/27/341246427.db2.gz HAIGAEUANZLLLG-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000550063121 341309225 /nfs/dbraw/zinc/30/92/25/341309225.db2.gz GGPUTEGRWGOJLK-YJBOKZPZSA-N 1 1 320.433 3.695 20 5 DHBDMO CCOc1cc(C[N@H+]2CC[C@H](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000550409485 341316396 /nfs/dbraw/zinc/31/63/96/341316396.db2.gz JRMXUJLFNBCFLC-OAHLLOKOSA-N 1 1 304.390 3.616 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C3(CF)CCC3)o2)c1 ZINC000576466163 341847720 /nfs/dbraw/zinc/84/77/20/341847720.db2.gz QTFZDERFTDQGBC-UHFFFAOYSA-N 1 1 304.321 3.837 20 5 DHBDMO CC[C@H]([NH2+][C@H](COC)c1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000156480046 522747475 /nfs/dbraw/zinc/74/74/75/522747475.db2.gz JQJYVTYONVMFLK-JKSUJKDBSA-N 1 1 318.373 3.925 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc(C2CC2)cs1 ZINC000338348848 522947661 /nfs/dbraw/zinc/94/76/61/522947661.db2.gz MCHRLFRJZDTHSQ-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc(C2CC2)cs1 ZINC000338348848 522947674 /nfs/dbraw/zinc/94/76/74/522947674.db2.gz MCHRLFRJZDTHSQ-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO C[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000157670015 524235627 /nfs/dbraw/zinc/23/56/27/524235627.db2.gz LEQLUQXXQOWVRF-GFCCVEGCSA-N 1 1 317.414 3.950 20 5 DHBDMO C[C@@H]1[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CCC12CCOCC2 ZINC000368813218 525546390 /nfs/dbraw/zinc/54/63/90/525546390.db2.gz DKIUEUSRTRNNTD-LBPRGKRZSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](OCC(C)C)C1 ZINC000245534022 526090705 /nfs/dbraw/zinc/09/07/05/526090705.db2.gz VVNHUCHFPWARAM-GDBMZVCRSA-N 1 1 306.406 3.711 20 5 DHBDMO COCCc1cc[nH+]c(N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000287643659 536832130 /nfs/dbraw/zinc/83/21/30/536832130.db2.gz URNWPSONHHHFQQ-CYBMUJFWSA-N 1 1 315.373 3.660 20 5 DHBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000359870820 1013058898 /nfs/dbraw/zinc/05/88/98/1013058898.db2.gz JNMKSNPFHSXJLV-KBXCAEBGSA-N 1 1 311.385 3.615 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H]1CC1CCCCC1 ZINC001167255107 1013452907 /nfs/dbraw/zinc/45/29/07/1013452907.db2.gz CVMKXYRFTJUITO-MRXNPFEDSA-N 1 1 303.406 3.925 20 5 DHBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000120851002 1013527698 /nfs/dbraw/zinc/52/76/98/1013527698.db2.gz FDXHONLZOWNVEW-UHFFFAOYSA-N 1 1 319.405 3.576 20 5 DHBDMO C[C@H]1c2ccsc2CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000052070781 1013796107 /nfs/dbraw/zinc/79/61/07/1013796107.db2.gz MXLVXTOKUOYIHE-LBPRGKRZSA-N 1 1 302.399 3.818 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000441487049 1014247250 /nfs/dbraw/zinc/24/72/50/1014247250.db2.gz OFCCKKHOHMFSIF-RBSFLKMASA-N 1 1 304.390 3.627 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCOc1ccccc1F ZINC000050507867 1014353811 /nfs/dbraw/zinc/35/38/11/1014353811.db2.gz GIRPTLJNRUFBJU-ZDUSSCGKSA-N 1 1 318.348 3.806 20 5 DHBDMO CC[C@H](C)C[N@@H+](CC)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000177846145 1014414935 /nfs/dbraw/zinc/41/49/35/1014414935.db2.gz CPDQITPGKUSDPX-LBPRGKRZSA-N 1 1 318.377 3.513 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(F)c(Cl)c2)cs1 ZINC000053149017 1014490920 /nfs/dbraw/zinc/49/09/20/1014490920.db2.gz NEMIICKHQORYLS-UHFFFAOYSA-N 1 1 300.742 3.739 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@@H]3CCc4c3cccc4[N+](=O)[O-])nc2c1 ZINC000581380055 1014751949 /nfs/dbraw/zinc/75/19/49/1014751949.db2.gz GNZRMXWLIKCEFA-CQSZACIVSA-N 1 1 322.368 3.557 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@@H]3CCc4c3cccc4[N+](=O)[O-])[nH]c2c1 ZINC000581380055 1014751953 /nfs/dbraw/zinc/75/19/53/1014751953.db2.gz GNZRMXWLIKCEFA-CQSZACIVSA-N 1 1 322.368 3.557 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3C3CCCC3)nc2c1 ZINC000610581216 1014862148 /nfs/dbraw/zinc/86/21/48/1014862148.db2.gz NONPHSWTVAHYJI-HNNXBMFYSA-N 1 1 315.373 3.891 20 5 DHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)cc1 ZINC000522269158 1014992598 /nfs/dbraw/zinc/99/25/98/1014992598.db2.gz RQZGRYIEEMAUKX-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO CN(C)c1cc[nH+]c(CNc2ccc([N+](=O)[O-])cc2C(F)F)c1 ZINC000895470779 1015171871 /nfs/dbraw/zinc/17/18/71/1015171871.db2.gz DEAVFTNHOQAVOE-UHFFFAOYSA-N 1 1 322.315 3.606 20 5 DHBDMO C[C@@]1([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])CCOc2ccccc21 ZINC000933366005 1015189913 /nfs/dbraw/zinc/18/99/13/1015189913.db2.gz LHWGISJJFVGGNZ-QGZVFWFLSA-N 1 1 316.332 3.521 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895583628 1015210502 /nfs/dbraw/zinc/21/05/02/1015210502.db2.gz MISGIMWXPGNWIP-MFBWXBCUSA-N 1 1 315.398 3.554 20 5 DHBDMO CC[C@@H](NC[C@H](CC)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000151692140 1015404214 /nfs/dbraw/zinc/40/42/14/1015404214.db2.gz FIDCHDICGOCJJP-DOTOQJQBSA-N 1 1 305.422 3.510 20 5 DHBDMO CSCC1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000896210547 1015507501 /nfs/dbraw/zinc/50/75/01/1015507501.db2.gz MSYSNBSBJWZWNF-UHFFFAOYSA-N 1 1 317.414 3.722 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000492379821 1015623249 /nfs/dbraw/zinc/62/32/49/1015623249.db2.gz YMYOJNGCPFLEBZ-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1cccc(Cl)c1 ZINC000065208713 1015971853 /nfs/dbraw/zinc/97/18/53/1015971853.db2.gz WTJJSGUKOHOQSL-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000172573901 1015975100 /nfs/dbraw/zinc/97/51/00/1015975100.db2.gz IKWVLAFUWIBOEZ-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO C[C@H]([NH2+]C[C@]1(N(C)C)CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000320290611 1016076562 /nfs/dbraw/zinc/07/65/62/1016076562.db2.gz YOUKQHJLCQKCGT-VKJFTORMSA-N 1 1 319.449 3.756 20 5 DHBDMO Cc1ccc(CNc2ccc([N+](=O)[O-])s2)c(N2CCCC2)[nH+]1 ZINC000611583884 1016552105 /nfs/dbraw/zinc/55/21/05/1016552105.db2.gz JKGOABREWHTQPE-UHFFFAOYSA-N 1 1 318.402 3.572 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(O)cc2)CC2CC2)c1 ZINC000349035157 1012119214 /nfs/dbraw/zinc/11/92/14/1012119214.db2.gz GYDSZGRBQCMAHU-UHFFFAOYSA-N 1 1 312.369 3.713 20 5 DHBDMO C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1CCCC1 ZINC000425386981 1012541180 /nfs/dbraw/zinc/54/11/80/1012541180.db2.gz SOTGADLPYLTFKX-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000608856170 1012591165 /nfs/dbraw/zinc/59/11/65/1012591165.db2.gz ZZJGVXVZFNHWSP-GFCCVEGCSA-N 1 1 309.385 3.656 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)cc1 ZINC000516998808 1012884895 /nfs/dbraw/zinc/88/48/95/1012884895.db2.gz BWMWRJGDSSZVDW-LJQANCHMSA-N 1 1 324.380 3.565 20 5 DHBDMO Cc1ccc(C(=O)CC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000186494919 1017342324 /nfs/dbraw/zinc/34/23/24/1017342324.db2.gz ZWOOJKRZGVKRFB-UHFFFAOYSA-N 1 1 312.369 3.608 20 5 DHBDMO Cc1ccc(C(=O)CC[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000186494919 1017342333 /nfs/dbraw/zinc/34/23/33/1017342333.db2.gz ZWOOJKRZGVKRFB-UHFFFAOYSA-N 1 1 312.369 3.608 20 5 DHBDMO Cc1cc(N[C@H](C)C[N@@H+](C)C(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000323983354 1017467310 /nfs/dbraw/zinc/46/73/10/1017467310.db2.gz AFFKOFIRSGRHEP-CYBMUJFWSA-N 1 1 316.405 3.592 20 5 DHBDMO Cc1cc(N[C@H](C)C[N@H+](C)C(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000323983354 1017467324 /nfs/dbraw/zinc/46/73/24/1017467324.db2.gz AFFKOFIRSGRHEP-CYBMUJFWSA-N 1 1 316.405 3.592 20 5 DHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000444609446 1017588498 /nfs/dbraw/zinc/58/84/98/1017588498.db2.gz NCQPGHHXESBWSV-VXGBXAGGSA-N 1 1 316.405 3.870 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083198428 1017615466 /nfs/dbraw/zinc/61/54/66/1017615466.db2.gz FRWHYOIVWHMZJY-JMSVASOKSA-N 1 1 315.373 3.889 20 5 DHBDMO Cc1cc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C)o1 ZINC000444680526 1017627153 /nfs/dbraw/zinc/62/71/53/1017627153.db2.gz PPGYLOCGMQAAAN-JTQLQIEISA-N 1 1 314.345 3.532 20 5 DHBDMO Cc1c(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000444692708 1017634436 /nfs/dbraw/zinc/63/44/36/1017634436.db2.gz MSCRSEVTDKQINF-NSHDSACASA-N 1 1 302.296 3.678 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCc2ccc(Cl)nc21)c1ccccc1[N+](=O)[O-] ZINC000857905963 1032714069 /nfs/dbraw/zinc/71/40/69/1032714069.db2.gz AGRHPFIZNPRGHS-ZWNOBZJWSA-N 1 1 317.776 3.981 20 5 DHBDMO Cc1nc(CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cs1 ZINC000125637079 1032714301 /nfs/dbraw/zinc/71/43/01/1032714301.db2.gz QIYGCHHQFDAOGH-UHFFFAOYSA-N 1 1 317.414 3.567 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1COc2c1cccc2Cl ZINC000612580762 1017830595 /nfs/dbraw/zinc/83/05/95/1017830595.db2.gz MHJFLJJZPYRCPY-OAHLLOKOSA-N 1 1 318.760 3.780 20 5 DHBDMO Cc1c(C[N@H+]2CC[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000525121246 1018175303 /nfs/dbraw/zinc/17/53/03/1018175303.db2.gz BWSVILHLAZGXNZ-QGZVFWFLSA-N 1 1 310.397 3.968 20 5 DHBDMO Cc1cc(C)cc(C[N@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)c1 ZINC000766089057 1018231741 /nfs/dbraw/zinc/23/17/41/1018231741.db2.gz BJZGURWGERMRSP-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO Cc1cc(C)cc(C[N@@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)c1 ZINC000766089057 1018231753 /nfs/dbraw/zinc/23/17/53/1018231753.db2.gz BJZGURWGERMRSP-UHFFFAOYSA-N 1 1 324.384 3.651 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCCC1CCOCC1)C2 ZINC000525802695 1018379602 /nfs/dbraw/zinc/37/96/02/1018379602.db2.gz OYOYSTYCDGVWFF-UHFFFAOYSA-N 1 1 318.417 3.550 20 5 DHBDMO CC[N@@H+](Cn1nc(C)c2cc([N+](=O)[O-])ccc21)C1CCCCC1 ZINC000764846088 1018402723 /nfs/dbraw/zinc/40/27/23/1018402723.db2.gz YDAKSNCLPPHNCC-UHFFFAOYSA-N 1 1 316.405 3.865 20 5 DHBDMO CC(C)C[C@@H](CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)[NH+](C)C ZINC000447542957 1018415265 /nfs/dbraw/zinc/41/52/65/1018415265.db2.gz QDDWSJNYCGZHPY-WMZOPIPTSA-N 1 1 319.449 3.538 20 5 DHBDMO C[C@@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCOc2ccccc21 ZINC000923026309 1018991315 /nfs/dbraw/zinc/99/13/15/1018991315.db2.gz RZEZWJHLWJEXGC-QGZVFWFLSA-N 1 1 316.332 3.521 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])CCc2ccc(F)cc21 ZINC001171671215 1032826285 /nfs/dbraw/zinc/82/62/85/1032826285.db2.gz RTOQMNJKHPFZIT-ZDUSSCGKSA-N 1 1 314.360 3.896 20 5 DHBDMO CC(C)N(Cc1n[nH]c2ccccc21)Cc1ccc([N+](=O)[O-])cc1 ZINC000611254838 1019421593 /nfs/dbraw/zinc/42/15/93/1019421593.db2.gz GDWTZPFKNCVNOM-UHFFFAOYSA-N 1 1 324.384 3.882 20 5 DHBDMO CC(C)N(Cc1[nH]nc2ccccc21)Cc1ccc([N+](=O)[O-])cc1 ZINC000611254838 1019421598 /nfs/dbraw/zinc/42/15/98/1019421598.db2.gz GDWTZPFKNCVNOM-UHFFFAOYSA-N 1 1 324.384 3.882 20 5 DHBDMO CC(C)[N@H+](Cc1n[nH]c2ccccc21)Cc1ccc([N+](=O)[O-])cc1 ZINC000611254838 1019421604 /nfs/dbraw/zinc/42/16/04/1019421604.db2.gz GDWTZPFKNCVNOM-UHFFFAOYSA-N 1 1 324.384 3.882 20 5 DHBDMO CC(C)[N@@H+](Cc1n[nH]c2ccccc21)Cc1ccc([N+](=O)[O-])cc1 ZINC000611254838 1019421611 /nfs/dbraw/zinc/42/16/11/1019421611.db2.gz GDWTZPFKNCVNOM-UHFFFAOYSA-N 1 1 324.384 3.882 20 5 DHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])Cc1nccc2ccccc21 ZINC000611254756 1019421993 /nfs/dbraw/zinc/42/19/93/1019421993.db2.gz KBGDTSZCXFZURX-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])Cc1nccc2ccccc21 ZINC000611254756 1019421996 /nfs/dbraw/zinc/42/19/96/1019421996.db2.gz KBGDTSZCXFZURX-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2sccc2[N+](=O)[O-])C1 ZINC000611411631 1019477402 /nfs/dbraw/zinc/47/74/02/1019477402.db2.gz GKXMLSGOKYZQPM-TZMCWYRMSA-N 1 1 317.414 3.904 20 5 DHBDMO Cc1cc(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000611519637 1019508268 /nfs/dbraw/zinc/50/82/68/1019508268.db2.gz DGZDEVZUYBIOJM-SFHVURJKSA-N 1 1 322.368 3.506 20 5 DHBDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000611555044 1019518471 /nfs/dbraw/zinc/51/84/71/1019518471.db2.gz KJEPFHNUOFOWTF-WCQYABFASA-N 1 1 316.323 3.800 20 5 DHBDMO CCOc1cc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC001307602955 1019553990 /nfs/dbraw/zinc/55/39/90/1019553990.db2.gz KURWTCVEQKWFBM-CQSZACIVSA-N 1 1 306.406 3.862 20 5 DHBDMO CCn1nc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000922538391 1020118945 /nfs/dbraw/zinc/11/89/45/1020118945.db2.gz RQVLNNJCUCCXBA-CYBMUJFWSA-N 1 1 324.384 3.815 20 5 DHBDMO C[C@H](Nc1c(F)cccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000553184241 1020217473 /nfs/dbraw/zinc/21/74/73/1020217473.db2.gz ADWKBELWAFWDBU-STQMWFEESA-N 1 1 321.396 3.799 20 5 DHBDMO CC(C)[N@H+]1CCCC[C@H]1CN[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000330668888 1020237792 /nfs/dbraw/zinc/23/77/92/1020237792.db2.gz ZLTKNTIWGCAWHQ-CABCVRRESA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)N1CCCC[C@H]1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000330668888 1020237803 /nfs/dbraw/zinc/23/78/03/1020237803.db2.gz ZLTKNTIWGCAWHQ-CABCVRRESA-N 1 1 305.422 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000177170860 1020491762 /nfs/dbraw/zinc/49/17/62/1020491762.db2.gz JVBMSWFMIPJNQE-UHFFFAOYSA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000177170860 1020491764 /nfs/dbraw/zinc/49/17/64/1020491764.db2.gz JVBMSWFMIPJNQE-UHFFFAOYSA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494669019 1020570062 /nfs/dbraw/zinc/57/00/62/1020570062.db2.gz SQVKTQFGYGJUGL-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494669019 1020570076 /nfs/dbraw/zinc/57/00/76/1020570076.db2.gz SQVKTQFGYGJUGL-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO CC[C@H](N[C@@H]1CC[N@@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000153770321 1020572188 /nfs/dbraw/zinc/57/21/88/1020572188.db2.gz FCJIZHJQKLZKMY-QAPCUYQASA-N 1 1 317.433 3.652 20 5 DHBDMO CC[C@H](N[C@@H]1CC[N@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000153770321 1020572190 /nfs/dbraw/zinc/57/21/90/1020572190.db2.gz FCJIZHJQKLZKMY-QAPCUYQASA-N 1 1 317.433 3.652 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H]1c1cccc(F)c1 ZINC000411714822 1020581868 /nfs/dbraw/zinc/58/18/68/1020581868.db2.gz AICJDFXDFNEYPQ-FUHWJXTLSA-N 1 1 314.360 3.764 20 5 DHBDMO COc1ccc(C)cc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892505151 1020630543 /nfs/dbraw/zinc/63/05/43/1020630543.db2.gz MNDGZJVEQQRQJG-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]Cc2nn(C)c3ccccc23)cccc1[N+](=O)[O-] ZINC000612829289 1020722845 /nfs/dbraw/zinc/72/28/45/1020722845.db2.gz PORBCRNVDXHUIM-CYBMUJFWSA-N 1 1 324.384 3.641 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(Cl)cs1 ZINC000580128630 1020824119 /nfs/dbraw/zinc/82/41/19/1020824119.db2.gz POZXJLGDQLTYAR-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000738052954 1020860314 /nfs/dbraw/zinc/86/03/14/1020860314.db2.gz FZALQAWPUPFYBG-CZUORRHYSA-N 1 1 316.405 3.803 20 5 DHBDMO Cc1ccc([C@@H]2[C@@H](C)CCC[N@@H+]2Cn2nccc2[N+](=O)[O-])cc1 ZINC000738282640 1020868332 /nfs/dbraw/zinc/86/83/32/1020868332.db2.gz AJEMPBHEBAJMQT-YOEHRIQHSA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2Cn2nccc2[N+](=O)[O-])cc1 ZINC000738282640 1020868336 /nfs/dbraw/zinc/86/83/36/1020868336.db2.gz AJEMPBHEBAJMQT-YOEHRIQHSA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1ccnc([C@H]2CC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000581556931 1020890377 /nfs/dbraw/zinc/89/03/77/1020890377.db2.gz VXPUUJRAXBPUJW-ZBFHGGJFSA-N 1 1 311.385 3.849 20 5 DHBDMO C[C@H]1C[C@H](C)[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000740860734 1020955209 /nfs/dbraw/zinc/95/52/09/1020955209.db2.gz RJSVNIHYZCMGAE-UWVGGRQHSA-N 1 1 307.375 3.560 20 5 DHBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1ccc([N+](=O)[O-])cc1Cl ZINC000742418216 1021118633 /nfs/dbraw/zinc/11/86/33/1021118633.db2.gz ABAPPEXZCZCEOR-GFCCVEGCSA-N 1 1 311.813 3.559 20 5 DHBDMO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000537978291 1032957632 /nfs/dbraw/zinc/95/76/32/1032957632.db2.gz OIKJJFKRCIQQLZ-GUYCJALGSA-N 1 1 312.369 3.996 20 5 DHBDMO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000537978292 1032958190 /nfs/dbraw/zinc/95/81/90/1032958190.db2.gz OIKJJFKRCIQQLZ-SUMWQHHRSA-N 1 1 312.369 3.996 20 5 DHBDMO CC(C)[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275855 1021217885 /nfs/dbraw/zinc/21/78/85/1021217885.db2.gz LRNWVZOWKPZRKU-GOSISDBHSA-N 1 1 314.385 3.539 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2c2cccs2)cc1 ZINC000776276445 1021219557 /nfs/dbraw/zinc/21/95/57/1021219557.db2.gz NCFKWNPMPLKTBD-HUUCEWRRSA-N 1 1 318.398 3.527 20 5 DHBDMO CCC1CCC([N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C2CC2)CC1 ZINC000917439531 1021261156 /nfs/dbraw/zinc/26/11/56/1021261156.db2.gz OTJHBLDPYKPSCY-UHFFFAOYSA-N 1 1 320.437 3.799 20 5 DHBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)CC1(c2ccccc2)CC1 ZINC000189316714 1021357239 /nfs/dbraw/zinc/35/72/39/1021357239.db2.gz QNNNNOQMUFUCKS-UHFFFAOYSA-N 1 1 302.399 3.820 20 5 DHBDMO C[N@H+](Cc1ccc2cnccc2c1)Cc1ccccc1[N+](=O)[O-] ZINC000618808868 1021534144 /nfs/dbraw/zinc/53/41/44/1021534144.db2.gz AANKQLKWTFKLRE-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO C[N@@H+](Cc1ccc2cnccc2c1)Cc1ccccc1[N+](=O)[O-] ZINC000618808868 1021534153 /nfs/dbraw/zinc/53/41/53/1021534153.db2.gz AANKQLKWTFKLRE-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2cccc(F)c2[N+](=O)[O-])C1 ZINC000919963877 1021991614 /nfs/dbraw/zinc/99/16/14/1021991614.db2.gz OHZCFXHLDGETQW-BETUJISGSA-N 1 1 309.385 3.514 20 5 DHBDMO CC(C)(C)[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776584001 1022095511 /nfs/dbraw/zinc/09/55/11/1022095511.db2.gz ISTZGCKVMKWIDK-DOTOQJQBSA-N 1 1 320.433 3.776 20 5 DHBDMO CC(C)CC[C@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587607 1022102987 /nfs/dbraw/zinc/10/29/87/1022102987.db2.gz XHCKMDUGYZMPJM-WBVHZDCISA-N 1 1 306.406 3.529 20 5 DHBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CCC(C)(C)CC1 ZINC000776588841 1022115939 /nfs/dbraw/zinc/11/59/39/1022115939.db2.gz CJFUJVZRGWWUEB-INIZCTEOSA-N 1 1 306.406 3.529 20 5 DHBDMO CC1(C)CCC[C@@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)O1 ZINC001168847665 1022162169 /nfs/dbraw/zinc/16/21/69/1022162169.db2.gz FVFBEODMOOFGQT-KRWDZBQOSA-N 1 1 318.417 3.907 20 5 DHBDMO C[N@@H+](Cc1c(Cl)cccc1Cl)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169038560 1022221170 /nfs/dbraw/zinc/22/11/70/1022221170.db2.gz ZPIJDGDBNBZHMY-MNOVXSKESA-N 1 1 317.216 3.871 20 5 DHBDMO C[N@@H+](Cc1c(Cl)cccc1Cl)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169038563 1022221762 /nfs/dbraw/zinc/22/17/62/1022221762.db2.gz ZPIJDGDBNBZHMY-WDEREUQCSA-N 1 1 317.216 3.871 20 5 DHBDMO CC[N@@H+](Cc1c(F)cccc1Cl)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169041645 1022225173 /nfs/dbraw/zinc/22/51/73/1022225173.db2.gz BTTZIWQKHYEUGD-RYUDHWBXSA-N 1 1 314.788 3.746 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000853261339 1022247065 /nfs/dbraw/zinc/24/70/65/1022247065.db2.gz UYJYRTMHQFXKIG-NSHDSACASA-N 1 1 322.315 3.640 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccsc2[N+](=O)[O-])c1 ZINC000609560535 1022301159 /nfs/dbraw/zinc/30/11/59/1022301159.db2.gz FCHDXGMUGAKBDZ-UHFFFAOYSA-N 1 1 305.403 3.720 20 5 DHBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](C)C(C)C ZINC000128464020 1022405866 /nfs/dbraw/zinc/40/58/66/1022405866.db2.gz GUUNYQTWGAXBDD-LBPRGKRZSA-N 1 1 318.377 3.511 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc2c(c1)COC2)C1CC1 ZINC000768335639 1022948605 /nfs/dbraw/zinc/94/86/05/1022948605.db2.gz YXRZTDNOHIJOII-UHFFFAOYSA-N 1 1 324.380 3.790 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc2c(c1)COC2)C1CC1 ZINC000768335639 1022948618 /nfs/dbraw/zinc/94/86/18/1022948618.db2.gz YXRZTDNOHIJOII-UHFFFAOYSA-N 1 1 324.380 3.790 20 5 DHBDMO Cc1ncc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000184664914 1023058345 /nfs/dbraw/zinc/05/83/45/1023058345.db2.gz KLAQPTRLKFOZLM-QMMMGPOBSA-N 1 1 311.794 3.864 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC2(CCC[N@@H+]2C)CC1 ZINC000770132358 1023280029 /nfs/dbraw/zinc/28/00/29/1023280029.db2.gz QZAPSZZTXFJSDW-UHFFFAOYSA-N 1 1 323.824 3.621 20 5 DHBDMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000770281772 1023289461 /nfs/dbraw/zinc/28/94/61/1023289461.db2.gz ADCYFHGBLUXXPR-VHSXEESVSA-N 1 1 313.195 3.588 20 5 DHBDMO O=[N+]([O-])c1sccc1NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000063256165 1023470729 /nfs/dbraw/zinc/47/07/29/1023470729.db2.gz MOPRYWGKENASMA-CYBMUJFWSA-N 1 1 321.402 3.888 20 5 DHBDMO C[C@@H]1C[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H](C)C1(F)F ZINC000859412379 1033136978 /nfs/dbraw/zinc/13/69/78/1033136978.db2.gz TZXUMUQSZFRREP-NXEZZACHSA-N 1 1 318.751 3.971 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2ccncc2)C2CC2)ccc1Cl ZINC000772246404 1023537702 /nfs/dbraw/zinc/53/77/02/1023537702.db2.gz WITBAOVCAFWWIU-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccncc2)C2CC2)ccc1Cl ZINC000772246404 1023537708 /nfs/dbraw/zinc/53/77/08/1023537708.db2.gz WITBAOVCAFWWIU-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1c(C)noc1C ZINC000788023391 1023847120 /nfs/dbraw/zinc/84/71/20/1023847120.db2.gz LLTYICNJAQKCRW-CYBMUJFWSA-N 1 1 307.325 3.580 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2Cc2ccccc2)cc1F ZINC000788468098 1023889128 /nfs/dbraw/zinc/88/91/28/1023889128.db2.gz DPCUOBNXFNDZFW-INIZCTEOSA-N 1 1 314.360 3.941 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788481841 1023891519 /nfs/dbraw/zinc/89/15/19/1023891519.db2.gz JNMRUESFQDZGHO-CHWSQXEVSA-N 1 1 312.410 3.840 20 5 DHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788570116 1023908843 /nfs/dbraw/zinc/90/88/43/1023908843.db2.gz HJQQWNSOYNGACI-SECBINFHSA-N 1 1 323.755 3.820 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCc2ccc(Cl)nc21)c1cccc([N+](=O)[O-])c1 ZINC000788643698 1023913219 /nfs/dbraw/zinc/91/32/19/1023913219.db2.gz QIKZTVIRNVDSOB-IINYFYTJSA-N 1 1 317.776 3.981 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2cccnc2Cl)cc1[N+](=O)[O-] ZINC000268804731 1024167017 /nfs/dbraw/zinc/16/70/17/1024167017.db2.gz HDJNTCSZPXBOSY-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C ZINC000531714654 1024279944 /nfs/dbraw/zinc/27/99/44/1024279944.db2.gz ZVLHAFHTVLNTFV-WMLDXEAASA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C ZINC000531714654 1024279953 /nfs/dbraw/zinc/27/99/53/1024279953.db2.gz ZVLHAFHTVLNTFV-WMLDXEAASA-N 1 1 321.465 3.920 20 5 DHBDMO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000883462815 1024440768 /nfs/dbraw/zinc/44/07/68/1024440768.db2.gz APIFXQPKCDCANS-INIZCTEOSA-N 1 1 315.348 3.769 20 5 DHBDMO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000883463249 1024440879 /nfs/dbraw/zinc/44/08/79/1024440879.db2.gz LKUBZSFMRKDBMW-MRXNPFEDSA-N 1 1 315.348 3.769 20 5 DHBDMO CCC[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000453361327 1024487412 /nfs/dbraw/zinc/48/74/12/1024487412.db2.gz QWJOWNWPZODOHQ-RCBQFDQVSA-N 1 1 314.389 3.928 20 5 DHBDMO Cc1ncc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(C)n1 ZINC000271432387 1024503500 /nfs/dbraw/zinc/50/35/00/1024503500.db2.gz CEUARXLQZIYTRD-SECBINFHSA-N 1 1 320.780 3.506 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC(C)(C)[NH+]1CCCCC1 ZINC000532188540 1024571765 /nfs/dbraw/zinc/57/17/65/1024571765.db2.gz LYONNYNYIDKFHY-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)nc2c1 ZINC000532239148 1024586498 /nfs/dbraw/zinc/58/64/98/1024586498.db2.gz SIEJBPOHCMEMHT-CYBMUJFWSA-N 1 1 324.384 3.939 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)[nH]c2c1 ZINC000532239148 1024586504 /nfs/dbraw/zinc/58/65/04/1024586504.db2.gz SIEJBPOHCMEMHT-CYBMUJFWSA-N 1 1 324.384 3.939 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000569973219 1024591519 /nfs/dbraw/zinc/59/15/19/1024591519.db2.gz AIZIGWPYFPKUKC-ZFWWWQNUSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000569973219 1024591527 /nfs/dbraw/zinc/59/15/27/1024591527.db2.gz AIZIGWPYFPKUKC-ZFWWWQNUSA-N 1 1 307.438 3.674 20 5 DHBDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283114323 1024595752 /nfs/dbraw/zinc/59/57/52/1024595752.db2.gz MOUKXRNMTIFECL-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC=C(c2ccncc2)C1 ZINC000348834878 1024628484 /nfs/dbraw/zinc/62/84/84/1024628484.db2.gz RDSOHOQBQAHDTG-ZZXKWVIFSA-N 1 1 321.380 3.792 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC=C(c2ccncc2)C1 ZINC000348834878 1024628487 /nfs/dbraw/zinc/62/84/87/1024628487.db2.gz RDSOHOQBQAHDTG-ZZXKWVIFSA-N 1 1 321.380 3.792 20 5 DHBDMO Cc1c(C[N@H+](C)[C@@H](C)c2cccc(O)c2)cccc1[N+](=O)[O-] ZINC000109780994 1024696050 /nfs/dbraw/zinc/69/60/50/1024696050.db2.gz DXLWAMIYQBMCGH-ZDUSSCGKSA-N 1 1 300.358 3.802 20 5 DHBDMO CC1(C)C[C@H]([NH2+]Cc2nccs2)c2cc([N+](=O)[O-])ccc21 ZINC000279117713 1024739257 /nfs/dbraw/zinc/73/92/57/1024739257.db2.gz PSHKAOOBLGBIEO-ZDUSSCGKSA-N 1 1 303.387 3.564 20 5 DHBDMO C[C@@H]([N@@H+](C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C(C)(C)C ZINC000728897212 1024789939 /nfs/dbraw/zinc/78/99/39/1024789939.db2.gz LSNPBPAPCCUQJT-CYBMUJFWSA-N 1 1 316.405 3.782 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCCC[C@@H]1C ZINC000792880781 1024822703 /nfs/dbraw/zinc/82/27/03/1024822703.db2.gz VLYJHAJWVWROAW-SWLSCSKDSA-N 1 1 321.377 3.904 20 5 DHBDMO CC(C)c1ccc(C[NH2+]Cc2cccnc2F)cc1[N+](=O)[O-] ZINC000793284559 1024973657 /nfs/dbraw/zinc/97/36/57/1024973657.db2.gz IRDXSHXGTQCERK-UHFFFAOYSA-N 1 1 303.337 3.542 20 5 DHBDMO COc1c2ccccc2oc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000353194395 1024979345 /nfs/dbraw/zinc/97/93/45/1024979345.db2.gz RBUMRSQNGMVPAB-UHFFFAOYSA-N 1 1 312.325 3.639 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](CC2CCC2)[C@H](C)CO)cc1[N+](=O)[O-] ZINC000348355981 1025387714 /nfs/dbraw/zinc/38/77/14/1025387714.db2.gz NHCTUGLUTPHUCO-CQSZACIVSA-N 1 1 320.433 3.701 20 5 DHBDMO CC(C)(C)[N@H+](Cc1ccc(F)cc1)Cc1cccnc1[N+](=O)[O-] ZINC000886040823 1025448418 /nfs/dbraw/zinc/44/84/18/1025448418.db2.gz DZXWTNBWOBVXQG-UHFFFAOYSA-N 1 1 317.364 3.930 20 5 DHBDMO CC(C)(C)[N@@H+](Cc1ccc(F)cc1)Cc1cccnc1[N+](=O)[O-] ZINC000886040823 1025448424 /nfs/dbraw/zinc/44/84/24/1025448424.db2.gz DZXWTNBWOBVXQG-UHFFFAOYSA-N 1 1 317.364 3.930 20 5 DHBDMO Cc1ccc([C@H](C)[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000136947945 1025492986 /nfs/dbraw/zinc/49/29/86/1025492986.db2.gz CPRGEVVWYJMLHZ-KSSFIOAISA-N 1 1 314.385 3.630 20 5 DHBDMO CCSc1ccc([C@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1 ZINC000886109607 1025509085 /nfs/dbraw/zinc/50/90/85/1025509085.db2.gz OMUAYGQTEKIRGP-LBPRGKRZSA-N 1 1 317.414 3.953 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000886125403 1025520094 /nfs/dbraw/zinc/52/00/94/1025520094.db2.gz QMNQYQKPHNVRIL-SNVBAGLBSA-N 1 1 311.794 3.946 20 5 DHBDMO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886207447 1025557600 /nfs/dbraw/zinc/55/76/00/1025557600.db2.gz CEZZPZLOHURCTB-MRXNPFEDSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886207447 1025557605 /nfs/dbraw/zinc/55/76/05/1025557605.db2.gz CEZZPZLOHURCTB-MRXNPFEDSA-N 1 1 315.373 3.582 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2c(F)cccc2C1 ZINC000757141054 1025669892 /nfs/dbraw/zinc/66/98/92/1025669892.db2.gz IBUACYOOBDJZAX-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2c(F)cccc2C1 ZINC000757141054 1025669902 /nfs/dbraw/zinc/66/99/02/1025669902.db2.gz IBUACYOOBDJZAX-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO CCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H](CC)c1ccccc1 ZINC000355554441 1025765043 /nfs/dbraw/zinc/76/50/43/1025765043.db2.gz NHRWVWMJHIXYFF-HNNXBMFYSA-N 1 1 316.405 3.692 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCOCC2(CCCC2)C1 ZINC000614222853 1025955245 /nfs/dbraw/zinc/95/52/45/1025955245.db2.gz KHIDMGCJGYIFTG-AWEZNQCLSA-N 1 1 304.390 3.548 20 5 DHBDMO COc1ccc(C[N@H+](C)[C@H](C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000052074502 1026135182 /nfs/dbraw/zinc/13/51/82/1026135182.db2.gz FTXFIYJVDNRDIM-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000052074502 1026135186 /nfs/dbraw/zinc/13/51/86/1026135186.db2.gz FTXFIYJVDNRDIM-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO Cc1nonc1C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000809743962 1026612954 /nfs/dbraw/zinc/61/29/54/1026612954.db2.gz OGCXEPJXKKJHAW-UHFFFAOYSA-N 1 1 303.365 3.974 20 5 DHBDMO CCOCC[N@H+](CC)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809944655 1026643811 /nfs/dbraw/zinc/64/38/11/1026643811.db2.gz QXLYMVBCXBPPIM-UHFFFAOYSA-N 1 1 321.204 3.760 20 5 DHBDMO CCOCC[N@@H+](CC)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809944655 1026643814 /nfs/dbraw/zinc/64/38/14/1026643814.db2.gz QXLYMVBCXBPPIM-UHFFFAOYSA-N 1 1 321.204 3.760 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCOC(C)(C)C1 ZINC000810043440 1026667203 /nfs/dbraw/zinc/66/72/03/1026667203.db2.gz WEZPEWRBTQYRQE-CYBMUJFWSA-N 1 1 310.369 3.513 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](O)CC23CCC3)cc1[N+](=O)[O-] ZINC000421366203 1026965847 /nfs/dbraw/zinc/96/58/47/1026965847.db2.gz BYHKTQXVJVPQMJ-OAHLLOKOSA-N 1 1 318.417 3.598 20 5 DHBDMO Cn1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])c1 ZINC000811483726 1027009159 /nfs/dbraw/zinc/00/91/59/1027009159.db2.gz NWELXUUDNKKOJD-UHFFFAOYSA-N 1 1 314.172 3.530 20 5 DHBDMO Cc1c(NC(=O)CC[N@H+](CC(C)C)C(C)C)cccc1[N+](=O)[O-] ZINC000063495999 1027026874 /nfs/dbraw/zinc/02/68/74/1027026874.db2.gz NKKCMNCKOYEUHF-UHFFFAOYSA-N 1 1 321.421 3.598 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ncco3)CC2)c(Cl)c1 ZINC000931446639 1027125528 /nfs/dbraw/zinc/12/55/28/1027125528.db2.gz NDLXCKINHOGDTB-UHFFFAOYSA-N 1 1 321.764 3.616 20 5 DHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H]1CCC1CCCCC1 ZINC000362951511 1027461164 /nfs/dbraw/zinc/46/11/64/1027461164.db2.gz MUDVAZBFLGKZCB-HNNXBMFYSA-N 1 1 320.437 3.653 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC=C(c2cccnc2)C1 ZINC000295897953 1027480486 /nfs/dbraw/zinc/48/04/86/1027480486.db2.gz IDJBKOXVBYAELQ-CQSZACIVSA-N 1 1 309.369 3.840 20 5 DHBDMO CC[N@@H+](CCc1ccccn1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000778948347 1027629708 /nfs/dbraw/zinc/62/97/08/1027629708.db2.gz ZKNPUAMWAIPSOW-OAHLLOKOSA-N 1 1 313.401 3.924 20 5 DHBDMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000576805948 1027662406 /nfs/dbraw/zinc/66/24/06/1027662406.db2.gz WNFJIWBVGOZDFW-NXEZZACHSA-N 1 1 302.296 3.844 20 5 DHBDMO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000297056731 1027788512 /nfs/dbraw/zinc/78/85/12/1027788512.db2.gz VTSMXCZZRDQEOE-STQMWFEESA-N 1 1 302.378 3.531 20 5 DHBDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000217005703 1028068238 /nfs/dbraw/zinc/06/82/38/1028068238.db2.gz KEEDMOIZCTYQEY-HNNXBMFYSA-N 1 1 310.369 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H](c2ccncc2)C2CC2)c1 ZINC000934692129 1028074045 /nfs/dbraw/zinc/07/40/45/1028074045.db2.gz MRFCLHWANFCTGC-INIZCTEOSA-N 1 1 317.776 3.884 20 5 DHBDMO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1Cc1cc([O-])ccc1[N+](=O)[O-] ZINC001170769205 1028259407 /nfs/dbraw/zinc/25/94/07/1028259407.db2.gz NQOMFOJPUNTFGP-TZMCWYRMSA-N 1 1 306.406 3.947 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449092605 1028366948 /nfs/dbraw/zinc/36/69/48/1028366948.db2.gz UVHXKMPMRVEJJJ-LBPRGKRZSA-N 1 1 322.286 3.789 20 5 DHBDMO C[C@H]([NH2+][C@@H]1c2ccc(F)cc2O[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000368585162 1028379483 /nfs/dbraw/zinc/37/94/83/1028379483.db2.gz PMTHEHILDJTNRB-RVPKQNPDSA-N 1 1 316.332 3.907 20 5 DHBDMO Cc1noc(C)c1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449496226 1028709486 /nfs/dbraw/zinc/70/94/86/1028709486.db2.gz GEWIVPUEEDFBLG-HNNXBMFYSA-N 1 1 315.373 3.579 20 5 DHBDMO CC(C)c1[nH+]ccn1[C@@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 ZINC000374007458 1029186812 /nfs/dbraw/zinc/18/68/12/1029186812.db2.gz HDVKAWVEJAJYJS-CQSZACIVSA-N 1 1 314.389 3.756 20 5 DHBDMO CC(=O)c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000450649080 1029595677 /nfs/dbraw/zinc/59/56/77/1029595677.db2.gz PXWFUWUEPBRDCM-UHFFFAOYSA-N 1 1 324.380 3.962 20 5 DHBDMO CC(=O)c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000450649080 1029595679 /nfs/dbraw/zinc/59/56/79/1029595679.db2.gz PXWFUWUEPBRDCM-UHFFFAOYSA-N 1 1 324.380 3.962 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451336761 1029850336 /nfs/dbraw/zinc/85/03/36/1029850336.db2.gz FZOOQBUYNIAATA-BVPBIZIASA-N 1 1 318.417 3.671 20 5 DHBDMO CCO[C@@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C[C@H]1C ZINC000451542039 1029905925 /nfs/dbraw/zinc/90/59/25/1029905925.db2.gz MRHMNXWELSJVMV-CKEIUWERSA-N 1 1 306.406 3.711 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CC3CC(F)(F)C3)C2)cc1 ZINC000451546726 1029907515 /nfs/dbraw/zinc/90/75/15/1029907515.db2.gz JMIDRFNAVCQJAV-CQSZACIVSA-N 1 1 310.344 3.820 20 5 DHBDMO C[C@@H](c1cccnc1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451547180 1029914212 /nfs/dbraw/zinc/91/42/12/1029914212.db2.gz KMHICDFBWBYUJH-WMLDXEAASA-N 1 1 311.385 3.930 20 5 DHBDMO C[C@@H](c1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451963689 1030068816 /nfs/dbraw/zinc/06/88/16/1030068816.db2.gz HXZXBFZVKDLTAO-XJKSGUPXSA-N 1 1 306.431 3.875 20 5 DHBDMO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000290546516 1030100871 /nfs/dbraw/zinc/10/08/71/1030100871.db2.gz CUQXKUDKXGLVQD-RYUDHWBXSA-N 1 1 316.357 3.721 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC[C@@H]1CC1(Cl)Cl ZINC000823024622 1030194059 /nfs/dbraw/zinc/19/40/59/1030194059.db2.gz AGIZYJDPNLWISE-GFCCVEGCSA-N 1 1 317.216 3.653 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc2c1OCO2 ZINC000925696276 1030455487 /nfs/dbraw/zinc/45/54/87/1030455487.db2.gz YXYMRHARWZQTCY-NWDGAFQWSA-N 1 1 314.341 3.735 20 5 DHBDMO CCC[C@H]([NH2+]C[C@H](C)N(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000359021269 1030734707 /nfs/dbraw/zinc/73/47/07/1030734707.db2.gz UHGOFXXCZHIOIG-YOEHRIQHSA-N 1 1 307.438 3.756 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H]2CCc3c2nccc3Cl)cc1[N+](=O)[O-] ZINC000926795228 1030932122 /nfs/dbraw/zinc/93/21/22/1030932122.db2.gz IKMUPKHMPNPESX-CQSZACIVSA-N 1 1 317.776 3.729 20 5 DHBDMO CCOc1ccc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000536673231 1031384318 /nfs/dbraw/zinc/38/43/18/1031384318.db2.gz DJEOSPZHCWESHN-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCOc1ccc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000536673231 1031384325 /nfs/dbraw/zinc/38/43/25/1031384325.db2.gz DJEOSPZHCWESHN-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCOc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872024200 1031408168 /nfs/dbraw/zinc/40/81/68/1031408168.db2.gz YMKHIQOKULJCTP-LBPRGKRZSA-N 1 1 318.348 3.983 20 5 DHBDMO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042878 1031428384 /nfs/dbraw/zinc/42/83/84/1031428384.db2.gz DXZGSZLNFGMNMG-RYUDHWBXSA-N 1 1 303.337 3.849 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1cccc(O)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000872072786 1031469020 /nfs/dbraw/zinc/46/90/20/1031469020.db2.gz JZQUAQZXYWQDOH-QWRGUYRKSA-N 1 1 304.321 3.851 20 5 DHBDMO C[C@@H](O)[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872087571 1031483213 /nfs/dbraw/zinc/48/32/13/1031483213.db2.gz FFETUCRRNRBZRW-XWCIJXRUSA-N 1 1 318.348 3.507 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2cc(O)ccc2F)cc1[N+](=O)[O-] ZINC000872090394 1031487432 /nfs/dbraw/zinc/48/74/32/1031487432.db2.gz AJICFZWMHLYYOS-LLVKDONJSA-N 1 1 304.321 3.599 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(NCCCC[N@H+]2CCC[C@@H](C)C2)c1 ZINC000360975622 1031655423 /nfs/dbraw/zinc/65/54/23/1031655423.db2.gz VFOMEUMNMMWDGA-CQSZACIVSA-N 1 1 321.421 3.527 20 5 DHBDMO Cc1ccc(C[N@@H+]2Cc3ccc(O)cc3C3(CC3)C2)cc1[N+](=O)[O-] ZINC000361023688 1031684028 /nfs/dbraw/zinc/68/40/28/1031684028.db2.gz YAQKYACMGIRYBR-UHFFFAOYSA-N 1 1 324.380 3.656 20 5 DHBDMO Cc1ccc(C[N@H+]2Cc3ccc(O)cc3C3(CC3)C2)cc1[N+](=O)[O-] ZINC000361023688 1031684029 /nfs/dbraw/zinc/68/40/29/1031684029.db2.gz YAQKYACMGIRYBR-UHFFFAOYSA-N 1 1 324.380 3.656 20 5 DHBDMO CC[C@@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777954175 1032026587 /nfs/dbraw/zinc/02/65/87/1032026587.db2.gz CYZSGLFXTCWFBE-CQSZACIVSA-N 1 1 314.389 3.538 20 5 DHBDMO CC(C)[N@@H+](CC1CC1)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777954149 1032027423 /nfs/dbraw/zinc/02/74/23/1032027423.db2.gz CCVIWOGUKBGNNR-UHFFFAOYSA-N 1 1 314.389 3.536 20 5 DHBDMO C[N@@H+](CC1CCCC1)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777954269 1032027781 /nfs/dbraw/zinc/02/77/81/1032027781.db2.gz ILYKSWPJESBBKN-UHFFFAOYSA-N 1 1 314.389 3.538 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000877603631 1033375644 /nfs/dbraw/zinc/37/56/44/1033375644.db2.gz RKUKFBMKZGJUDQ-CRAIPNDOSA-N 1 1 318.417 3.603 20 5 DHBDMO C[C@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172903283 1033437761 /nfs/dbraw/zinc/43/77/61/1033437761.db2.gz GJXOYQUVZNYNLE-YOEHRIQHSA-N 1 1 302.418 3.964 20 5 DHBDMO C[C@H]1C[C@@H](CF)[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172906708 1033440379 /nfs/dbraw/zinc/44/03/79/1033440379.db2.gz YBJSSXWSTBNQOQ-MJEQTWJJSA-N 1 1 306.381 3.522 20 5 DHBDMO C[C@@H]1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C2(CC2)C1 ZINC001172918757 1033466785 /nfs/dbraw/zinc/46/67/85/1033466785.db2.gz CGCMWBQZKUWBKF-XJKSGUPXSA-N 1 1 300.402 3.717 20 5 DHBDMO C[N@@H+](C[C@H]1CC1(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172919234 1033467341 /nfs/dbraw/zinc/46/73/41/1033467341.db2.gz FJXYRRBBRXOCFG-HZPDHXFCSA-N 1 1 302.418 3.820 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCCCC13CC3)CC2 ZINC001172921308 1033468767 /nfs/dbraw/zinc/46/87/67/1033468767.db2.gz ODTZOAWEWUWQOM-INIZCTEOSA-N 1 1 300.402 3.861 20 5 DHBDMO C[N@@H+](CC1CCCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921805 1033468838 /nfs/dbraw/zinc/46/88/38/1033468838.db2.gz UBADTACTPARCPY-QGZVFWFLSA-N 1 1 302.418 3.964 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC[C@H](C)C2)c1F ZINC001173181800 1033583727 /nfs/dbraw/zinc/58/37/27/1033583727.db2.gz PVANRUZOZKPSFH-STQMWFEESA-N 1 1 324.396 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](CC2CC2)C(C)C)c1F ZINC001173188620 1033585277 /nfs/dbraw/zinc/58/52/77/1033585277.db2.gz GUTWGEZVQLJPCE-LBPRGKRZSA-N 1 1 324.396 3.794 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@H]2C(C)C)c1F ZINC001173193142 1033588105 /nfs/dbraw/zinc/58/81/05/1033588105.db2.gz QRSPXWGLZCHHAT-GXTWGEPZSA-N 1 1 324.396 3.794 20 5 DHBDMO CCC(CC)[N@@H+](C)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173195629 1033588174 /nfs/dbraw/zinc/58/81/74/1033588174.db2.gz HPFYWQSGYPKTKY-NSHDSACASA-N 1 1 312.385 3.794 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)C[C@@H]2CC2(C)C)c1F ZINC001173198386 1033590787 /nfs/dbraw/zinc/59/07/87/1033590787.db2.gz ZBTPQLBXHSNWLI-RYUDHWBXSA-N 1 1 324.396 3.651 20 5 DHBDMO CC[N@@H+](CC(C)C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000153739027 1033590960 /nfs/dbraw/zinc/59/09/60/1033590960.db2.gz WOHHHCYNILLRJF-GFCCVEGCSA-N 1 1 318.377 3.684 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173221261 1033600691 /nfs/dbraw/zinc/60/06/91/1033600691.db2.gz GTFNSOAUTJFCAN-AWEZNQCLSA-N 1 1 314.385 3.666 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2CC(F)(F)C[C@@H]2C1 ZINC001173222002 1033603054 /nfs/dbraw/zinc/60/30/54/1033603054.db2.gz OFBUBUIRBKPDLN-FPMFFAJLSA-N 1 1 310.344 3.503 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1ccncc1 ZINC001173228813 1033605034 /nfs/dbraw/zinc/60/50/34/1033605034.db2.gz ZACOQKQCJQDSLH-KBXCAEBGSA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1Cc2ccccc2C[C@H]1C ZINC001173231215 1033605258 /nfs/dbraw/zinc/60/52/58/1033605258.db2.gz KKJZBFJGIGYWKL-HUUCEWRRSA-N 1 1 310.397 3.973 20 5 DHBDMO COc1cccc2c1C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173231556 1033608631 /nfs/dbraw/zinc/60/86/31/1033608631.db2.gz MRCDZKXCIFXSJJ-ZDUSSCGKSA-N 1 1 312.369 3.550 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H]1Cc1ccccc1 ZINC000479100480 1033659509 /nfs/dbraw/zinc/65/95/09/1033659509.db2.gz LWNQZYPUTCVRJT-CQSZACIVSA-N 1 1 300.333 3.551 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000479100480 1033659515 /nfs/dbraw/zinc/65/95/15/1033659515.db2.gz LWNQZYPUTCVRJT-CQSZACIVSA-N 1 1 300.333 3.551 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)cc1[N+](=O)[O-] ZINC000878647880 1033781883 /nfs/dbraw/zinc/78/18/83/1033781883.db2.gz JVSAIZWHXUXVSQ-MRXNPFEDSA-N 1 1 311.385 3.678 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H](c2cccnc2)C1 ZINC000878756531 1033819970 /nfs/dbraw/zinc/81/99/70/1033819970.db2.gz OWEBKLNRYJKVQZ-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO C[N@@H+](CCC(C)(C)C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878761160 1033822179 /nfs/dbraw/zinc/82/21/79/1033822179.db2.gz HJAQNXDQPWKTRJ-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO CC[C@@H]([NH2+]Cc1cn2ccsc2n1)c1cccc([N+](=O)[O-])c1 ZINC000177760700 1034178831 /nfs/dbraw/zinc/17/88/31/1034178831.db2.gz ARWUYSJEZMTPPZ-CQSZACIVSA-N 1 1 316.386 3.545 20 5 DHBDMO C[C@@H]([NH2+]C[C@H](C1CCCCC1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000480693192 1034404409 /nfs/dbraw/zinc/40/44/09/1034404409.db2.gz JSSHHIMPOABZKA-RDTXWAMCSA-N 1 1 319.449 3.756 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2C2CCOCC2)ccc1Cl ZINC000777442453 1034745133 /nfs/dbraw/zinc/74/51/33/1034745133.db2.gz KHOPQZMIWXSDHC-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000600182364 1034794813 /nfs/dbraw/zinc/79/48/13/1034794813.db2.gz AYHUZLRCEVORHQ-ZVYZJRAXSA-N 1 1 310.344 3.831 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2ccc(O)cc2)C1 ZINC000600214151 1034807006 /nfs/dbraw/zinc/80/70/06/1034807006.db2.gz LGDUQVKTYBYEDM-INIZCTEOSA-N 1 1 312.369 3.598 20 5 DHBDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000481768368 1034969344 /nfs/dbraw/zinc/96/93/44/1034969344.db2.gz MNZHOGHAZULYKR-SMDDNHRTSA-N 1 1 316.323 3.800 20 5 DHBDMO CC[C@H](C)C[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159416549 1035048516 /nfs/dbraw/zinc/04/85/16/1035048516.db2.gz IXLSZTSRLQNIDL-JTQLQIEISA-N 1 1 315.211 3.835 20 5 DHBDMO CC1CC[NH+](Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000159411985 1035049419 /nfs/dbraw/zinc/04/94/19/1035049419.db2.gz PACQABCMYWSBRN-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO C[C@H]([NH2+]CCN1[C@H](C)CCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000482631588 1035151256 /nfs/dbraw/zinc/15/12/56/1035151256.db2.gz SNLBIKNEEMLHGM-ZNMIVQPWSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](NCC[N@@H+]1[C@H](C)CCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000482631588 1035151252 /nfs/dbraw/zinc/15/12/52/1035151252.db2.gz SNLBIKNEEMLHGM-ZNMIVQPWSA-N 1 1 305.422 3.508 20 5 DHBDMO CC[C@H](C)C[N@@H+](CC)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000482883843 1035194444 /nfs/dbraw/zinc/19/44/44/1035194444.db2.gz BEKDALKMNBAYPK-ZDUSSCGKSA-N 1 1 321.421 3.600 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1CCN[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000482947473 1035203535 /nfs/dbraw/zinc/20/35/35/1035203535.db2.gz KGSNXVDEYXTLQE-RDJZCZTQSA-N 1 1 319.449 3.818 20 5 DHBDMO CC[C@H]1CCCCN1CC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000482947473 1035203539 /nfs/dbraw/zinc/20/35/39/1035203539.db2.gz KGSNXVDEYXTLQE-RDJZCZTQSA-N 1 1 319.449 3.818 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1CCN[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000482954624 1035205524 /nfs/dbraw/zinc/20/55/24/1035205524.db2.gz FDRVNKQHJLKRDX-ZBFHGGJFSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@H]1CCCCN1CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000482954624 1035205528 /nfs/dbraw/zinc/20/55/28/1035205528.db2.gz FDRVNKQHJLKRDX-ZBFHGGJFSA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c1 ZINC001176193259 1035217225 /nfs/dbraw/zinc/21/72/25/1035217225.db2.gz OQJBSKGFCYAMGN-JSGCOSHPSA-N 1 1 314.307 3.759 20 5 DHBDMO COc1ccc(Nc2ccc(-n3cc[nH+]c3C)cc2)cc1[N+](=O)[O-] ZINC001176362839 1035257455 /nfs/dbraw/zinc/25/74/55/1035257455.db2.gz JIXDLVVULBNQFQ-UHFFFAOYSA-N 1 1 324.340 3.841 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](CCc1ccccc1)C1CC1 ZINC001176414145 1035267986 /nfs/dbraw/zinc/26/79/86/1035267986.db2.gz XGOZHRWXALMMJN-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO C[C@@]1(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCO1 ZINC001179913627 1035548095 /nfs/dbraw/zinc/54/80/95/1035548095.db2.gz AUXOLNJZAHJWEJ-KRWDZBQOSA-N 1 1 304.390 3.518 20 5 DHBDMO CC[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089883218 1035757971 /nfs/dbraw/zinc/75/79/71/1035757971.db2.gz WEUAZJJLVQZTCQ-ZDUSSCGKSA-N 1 1 315.373 3.872 20 5 DHBDMO C[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)CC1CCCC1 ZINC000089891037 1035770793 /nfs/dbraw/zinc/77/07/93/1035770793.db2.gz LRNORFNXNPKFNS-UHFFFAOYSA-N 1 1 315.373 3.872 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000485707592 1035879574 /nfs/dbraw/zinc/87/95/74/1035879574.db2.gz KKLBEQVHBKYBSK-LSDHHAIUSA-N 1 1 304.390 3.758 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000595359857 1036100883 /nfs/dbraw/zinc/10/08/83/1036100883.db2.gz WCRIREXKONPYHZ-MRXNPFEDSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000595359857 1036100895 /nfs/dbraw/zinc/10/08/95/1036100895.db2.gz WCRIREXKONPYHZ-MRXNPFEDSA-N 1 1 316.332 3.777 20 5 DHBDMO C[C@H](Cc1ccsc1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000541234893 1036265498 /nfs/dbraw/zinc/26/54/98/1036265498.db2.gz RXAXBMGFUJWWNE-GFCCVEGCSA-N 1 1 302.399 3.646 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCOCc1ccccc1 ZINC000464852265 1036473921 /nfs/dbraw/zinc/47/39/21/1036473921.db2.gz QVHLQCYNNUAKLU-OAHLLOKOSA-N 1 1 314.385 3.804 20 5 DHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000774618110 1036570438 /nfs/dbraw/zinc/57/04/38/1036570438.db2.gz JNGWLWZYKFPFMQ-SUMWQHHRSA-N 1 1 314.389 3.536 20 5 DHBDMO C[N@@H+](Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)CC(C)(C)C ZINC000774636061 1036599211 /nfs/dbraw/zinc/59/92/11/1036599211.db2.gz KCYGKAKVGDZQLJ-UHFFFAOYSA-N 1 1 310.785 3.533 20 5 DHBDMO C[C@H]([NH2+]Cc1scnc1C1CC1)c1ccccc1[N+](=O)[O-] ZINC000487554853 1036672435 /nfs/dbraw/zinc/67/24/35/1036672435.db2.gz SVLSEIPOIARACE-JTQLQIEISA-N 1 1 303.387 3.780 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCOc1ccc(F)cc1 ZINC000487561912 1036675695 /nfs/dbraw/zinc/67/56/95/1036675695.db2.gz PLJVTPLZQSBTLB-CYBMUJFWSA-N 1 1 318.348 3.806 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCSC[C@@H](C)C1 ZINC000488403963 1036998197 /nfs/dbraw/zinc/99/81/97/1036998197.db2.gz ZEGFELISTUATOL-MQJVFOOVSA-N 1 1 306.431 3.683 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCSC[C@@H](C)C1 ZINC000488403961 1036998975 /nfs/dbraw/zinc/99/89/75/1036998975.db2.gz ZEGFELISTUATOL-CZAWJFPGSA-N 1 1 306.431 3.683 20 5 DHBDMO COc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)c(F)c1 ZINC000761528411 1037349080 /nfs/dbraw/zinc/34/90/80/1037349080.db2.gz UOWUYDPZGLIVMV-UHFFFAOYSA-N 1 1 324.739 3.686 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)cs1 ZINC000609233159 1037389236 /nfs/dbraw/zinc/38/92/36/1037389236.db2.gz AKUUEENLNDIWMB-HNNXBMFYSA-N 1 1 318.398 3.620 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)cs1 ZINC000609233159 1037389257 /nfs/dbraw/zinc/38/92/57/1037389257.db2.gz AKUUEENLNDIWMB-HNNXBMFYSA-N 1 1 318.398 3.620 20 5 DHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CC1(C)C ZINC000489476488 1037452873 /nfs/dbraw/zinc/45/28/73/1037452873.db2.gz IIQGZOWSISCTGY-OAHLLOKOSA-N 1 1 315.373 3.523 20 5 DHBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)C1 ZINC000775052442 1037499688 /nfs/dbraw/zinc/49/96/88/1037499688.db2.gz DHJRFZABHSYDCG-LRDDRELGSA-N 1 1 319.361 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c(Cl)c1 ZINC001186872266 1037510387 /nfs/dbraw/zinc/51/03/87/1037510387.db2.gz LQQSXBJBVNAUGU-HUUCEWRRSA-N 1 1 309.797 3.677 20 5 DHBDMO COc1cc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000490063134 1037599687 /nfs/dbraw/zinc/59/96/87/1037599687.db2.gz XBCYTPAXEXURNH-ACJLOTCBSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000490063134 1037599701 /nfs/dbraw/zinc/59/97/01/1037599701.db2.gz XBCYTPAXEXURNH-ACJLOTCBSA-N 1 1 312.369 3.796 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000490090298 1037609128 /nfs/dbraw/zinc/60/91/28/1037609128.db2.gz PXTSDILIFKBKBI-CYBMUJFWSA-N 1 1 322.405 3.628 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCOC2(CCCCC2)C1 ZINC000490090479 1037609798 /nfs/dbraw/zinc/60/97/98/1037609798.db2.gz QUFIYOCPTOVOGY-OAHLLOKOSA-N 1 1 318.417 3.999 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCOC2(CCCCC2)C1 ZINC000490090479 1037609810 /nfs/dbraw/zinc/60/98/10/1037609810.db2.gz QUFIYOCPTOVOGY-OAHLLOKOSA-N 1 1 318.417 3.999 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1NC[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001187361128 1037621110 /nfs/dbraw/zinc/62/11/10/1037621110.db2.gz GGQCIOSTDGAGJJ-HNNXBMFYSA-N 1 1 321.396 3.943 20 5 DHBDMO COc1ccccc1CC[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000609194666 1038071712 /nfs/dbraw/zinc/07/17/12/1038071712.db2.gz BNSFZBZSUIEFLF-AWEZNQCLSA-N 1 1 314.385 3.839 20 5 DHBDMO COc1ccc(C[N@H+]2Cc3ccccc3[C@H](C)C2)cc1[N+](=O)[O-] ZINC000917039596 1038123081 /nfs/dbraw/zinc/12/30/81/1038123081.db2.gz KCXDJHHCKSUVBG-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)cc1[N+](=O)[O-] ZINC000917039596 1038123088 /nfs/dbraw/zinc/12/30/88/1038123088.db2.gz KCXDJHHCKSUVBG-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc3c[nH]nc32)C2CC2)c1 ZINC000154283522 1038209338 /nfs/dbraw/zinc/20/93/38/1038209338.db2.gz MULXPVOUCRUTGA-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO C[C@H]1CCC[C@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001190590206 1038350397 /nfs/dbraw/zinc/35/03/97/1038350397.db2.gz WOWUEVCRUYTVFV-HOCLYGCPSA-N 1 1 306.406 3.874 20 5 DHBDMO C[C@@H]1[C@@H](Nc2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000588854691 1038388335 /nfs/dbraw/zinc/38/83/35/1038388335.db2.gz AMPDOGPEJFXCEI-OCCSQVGLSA-N 1 1 317.414 3.731 20 5 DHBDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589187853 1038444901 /nfs/dbraw/zinc/44/49/01/1038444901.db2.gz ZYIXGJCOQUATNG-MJWHDNRXSA-N 1 1 318.417 3.624 20 5 DHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1nccc2ccccc21 ZINC000589341837 1038461451 /nfs/dbraw/zinc/46/14/51/1038461451.db2.gz AHODPDFMFLMSEZ-ZDUSSCGKSA-N 1 1 307.353 3.994 20 5 DHBDMO CC(C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC001191582395 1038518033 /nfs/dbraw/zinc/51/80/33/1038518033.db2.gz QYBDFCWWXGBVKJ-UHFFFAOYSA-N 1 1 319.405 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@H](C(F)F)C2)c1 ZINC000590169363 1038598240 /nfs/dbraw/zinc/59/82/40/1038598240.db2.gz YCDDFVQQGHUKGW-QMMMGPOBSA-N 1 1 324.249 3.701 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](C(F)F)C2)c1 ZINC000590169363 1038598245 /nfs/dbraw/zinc/59/82/45/1038598245.db2.gz YCDDFVQQGHUKGW-QMMMGPOBSA-N 1 1 324.249 3.701 20 5 DHBDMO CC(C)[C@H]1CCCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001192652857 1038687221 /nfs/dbraw/zinc/68/72/21/1038687221.db2.gz ISZSMZNVGGVBNP-OAHLLOKOSA-N 1 1 306.406 3.874 20 5 DHBDMO C[C@H](CCO)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000593693650 1039079816 /nfs/dbraw/zinc/07/98/16/1039079816.db2.gz AXUSTPRUVQBVRQ-GFCCVEGCSA-N 1 1 320.414 3.526 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000592189857 1039172177 /nfs/dbraw/zinc/17/21/77/1039172177.db2.gz XWPJGHVHEAKQPV-ZIAGYGMSSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000592189857 1039172185 /nfs/dbraw/zinc/17/21/85/1039172185.db2.gz XWPJGHVHEAKQPV-ZIAGYGMSSA-N 1 1 304.390 3.689 20 5 DHBDMO Cc1noc(C[NH2+][C@H](c2cccc(C)c2)C(C)C)c1[N+](=O)[O-] ZINC000599630560 1039238284 /nfs/dbraw/zinc/23/82/84/1039238284.db2.gz SDABOVSOOWAWPN-HNNXBMFYSA-N 1 1 303.362 3.687 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCC4(CC4)CC3)nc2c1 ZINC000599673538 1039251733 /nfs/dbraw/zinc/25/17/33/1039251733.db2.gz SPQMIQUSPADIJW-UHFFFAOYSA-N 1 1 301.346 3.502 20 5 DHBDMO CC(C)O[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000593055768 1039381547 /nfs/dbraw/zinc/38/15/47/1039381547.db2.gz ORCHKQWEIPVMRB-AWEZNQCLSA-N 1 1 312.797 3.638 20 5 DHBDMO CC(C)O[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000593055768 1039381563 /nfs/dbraw/zinc/38/15/63/1039381563.db2.gz ORCHKQWEIPVMRB-AWEZNQCLSA-N 1 1 312.797 3.638 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000604484436 1039481292 /nfs/dbraw/zinc/48/12/92/1039481292.db2.gz MQYABAIHOVSDJW-SFHVURJKSA-N 1 1 312.369 3.680 20 5 DHBDMO CC(C)([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000171672176 1039576984 /nfs/dbraw/zinc/57/69/84/1039576984.db2.gz UJYBXWSMGKTPJZ-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CC4(CC4(F)F)C3)o2)c1 ZINC000594609412 1039876154 /nfs/dbraw/zinc/87/61/54/1039876154.db2.gz WTTDILNTGQIUIG-UHFFFAOYSA-N 1 1 320.295 3.696 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000059394378 1039952216 /nfs/dbraw/zinc/95/22/16/1039952216.db2.gz LZNHJQXUDFJSMN-UHFFFAOYSA-N 1 1 323.412 3.682 20 5 DHBDMO COc1cccc(C2([NH2+]Cc3csc([N+](=O)[O-])c3)CCC2)c1 ZINC000594998651 1040011018 /nfs/dbraw/zinc/01/10/18/1040011018.db2.gz YESAAKWZZUGEBL-UHFFFAOYSA-N 1 1 318.398 3.834 20 5 DHBDMO C[C@@H](N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000595078768 1040073464 /nfs/dbraw/zinc/07/34/64/1040073464.db2.gz ATVWWVAOXSQJDT-GDBMZVCRSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCN(C2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000595078768 1040073481 /nfs/dbraw/zinc/07/34/81/1040073481.db2.gz ATVWWVAOXSQJDT-GDBMZVCRSA-N 1 1 317.433 3.652 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(OC2CCCC2)CC1 ZINC000595297108 1040094356 /nfs/dbraw/zinc/09/43/56/1040094356.db2.gz BGRAXOHPXQNHAT-UHFFFAOYSA-N 1 1 322.380 3.658 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595338377 1040102215 /nfs/dbraw/zinc/10/22/15/1040102215.db2.gz RRLPMIJEUNIDOA-BONVTDFDSA-N 1 1 319.336 3.613 20 5 DHBDMO Cc1noc(C[N@@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000595338377 1040102219 /nfs/dbraw/zinc/10/22/19/1040102219.db2.gz RRLPMIJEUNIDOA-BONVTDFDSA-N 1 1 319.336 3.613 20 5 DHBDMO COc1ccc(C[N@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1C ZINC000595309363 1040105433 /nfs/dbraw/zinc/10/54/33/1040105433.db2.gz RQJWAMDGIIOKOF-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1C ZINC000595309363 1040105443 /nfs/dbraw/zinc/10/54/43/1040105443.db2.gz RQJWAMDGIIOKOF-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](CC(C)C)c2ccccc2)c1[N+](=O)[O-] ZINC000595410772 1040131183 /nfs/dbraw/zinc/13/11/83/1040131183.db2.gz VIXUPXQKJJNVGK-AWEZNQCLSA-N 1 1 303.362 3.768 20 5 DHBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1F ZINC000595410821 1040131295 /nfs/dbraw/zinc/13/12/95/1040131295.db2.gz WNVAQBICHONTTJ-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595439049 1040138624 /nfs/dbraw/zinc/13/86/24/1040138624.db2.gz WTFQKYDAPJPDEY-BLLLJJGKSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595439049 1040138631 /nfs/dbraw/zinc/13/86/31/1040138631.db2.gz WTFQKYDAPJPDEY-BLLLJJGKSA-N 1 1 315.348 3.712 20 5 DHBDMO COc1ccc2c(c1)CC[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000595760287 1040230821 /nfs/dbraw/zinc/23/08/21/1040230821.db2.gz SKOVQATWBPBUII-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc2c(c1)CC[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000595760287 1040230831 /nfs/dbraw/zinc/23/08/31/1040230831.db2.gz SKOVQATWBPBUII-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](CCF)C2)ccc1[N+](=O)[O-] ZINC000595755507 1040243249 /nfs/dbraw/zinc/24/32/49/1040243249.db2.gz NBZDOLPQUZSMEP-ZDUSSCGKSA-N 1 1 310.369 3.565 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000595785291 1040250873 /nfs/dbraw/zinc/25/08/73/1040250873.db2.gz DACGJCBYMJMLSA-YOEHRIQHSA-N 1 1 322.380 3.515 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000595786422 1040251845 /nfs/dbraw/zinc/25/18/45/1040251845.db2.gz ABWJJNLNMRRKSG-RVKKMQEKSA-N 1 1 318.417 3.937 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)cccc1[N+](=O)[O-] ZINC000595790440 1040259258 /nfs/dbraw/zinc/25/92/58/1040259258.db2.gz QJAVGOUCLIMJCQ-WMZOPIPTSA-N 1 1 318.417 3.684 20 5 DHBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccncc1 ZINC000596592981 1040505611 /nfs/dbraw/zinc/50/56/11/1040505611.db2.gz OFBIGJQOYMEHSX-KRWDZBQOSA-N 1 1 311.385 3.615 20 5 DHBDMO Cc1ccc(CC2C[NH+](Cc3csc([N+](=O)[O-])c3)C2)cc1 ZINC000597212345 1040687256 /nfs/dbraw/zinc/68/72/56/1040687256.db2.gz RBHMOQJJRVFJPR-UHFFFAOYSA-N 1 1 302.399 3.639 20 5 DHBDMO Cc1ccc2c(c1)CC[C@H]2[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602533630 1041093166 /nfs/dbraw/zinc/09/31/66/1041093166.db2.gz JEHNDFPJEXKIHO-OAHLLOKOSA-N 1 1 323.352 3.822 20 5 DHBDMO CC[N@@H+](Cn1nc(C)c2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000761271811 1041159868 /nfs/dbraw/zinc/15/98/68/1041159868.db2.gz IOJGTQZKVXGGJX-UHFFFAOYSA-N 1 1 316.405 3.865 20 5 DHBDMO Cc1cc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)ccn1 ZINC000598619157 1041362831 /nfs/dbraw/zinc/36/28/31/1041362831.db2.gz BZLHQFQKDOBSCH-KRWDZBQOSA-N 1 1 311.385 3.678 20 5 DHBDMO CCC[C@H]([NH2+][C@H](C)Cc1cc(C)[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000090527802 185300713 /nfs/dbraw/zinc/30/07/13/185300713.db2.gz FMOIEZSJIFVZGK-PXAZEXFGSA-N 1 1 316.405 3.688 20 5 DHBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C ZINC000104680825 194026481 /nfs/dbraw/zinc/02/64/81/194026481.db2.gz ZDYYFLIUOGHVHV-UHFFFAOYSA-N 1 1 303.362 3.523 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000272409641 130027165 /nfs/dbraw/zinc/02/71/65/130027165.db2.gz FOQPBSMSGHVPKD-KBPBESRZSA-N 1 1 314.389 3.567 20 5 DHBDMO COCC[C@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccco1 ZINC000272592210 130045103 /nfs/dbraw/zinc/04/51/03/130045103.db2.gz RBNSKBRSCKNXCH-ZDUSSCGKSA-N 1 1 324.764 3.709 20 5 DHBDMO COC1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000272784245 130063968 /nfs/dbraw/zinc/06/39/68/130063968.db2.gz IGDPQEVSHLPMOG-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO CCOC1CC(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)C1 ZINC000285935910 131211147 /nfs/dbraw/zinc/21/11/47/131211147.db2.gz JBTLAIHJICKNAW-UHFFFAOYSA-N 1 1 306.406 3.620 20 5 DHBDMO CCc1noc(C)c1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000559882120 332288001 /nfs/dbraw/zinc/28/80/01/332288001.db2.gz IRHDZCDMLNQUPA-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO Cc1c(C[NH2+]Cc2cc(F)c(F)cc2F)cccc1[N+](=O)[O-] ZINC000318433357 332723227 /nfs/dbraw/zinc/72/32/27/332723227.db2.gz WXCGZODJKJMDFE-UHFFFAOYSA-N 1 1 310.275 3.610 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@@H](CC(C)C)[NH+](C)C)cc1[N+](=O)[O-] ZINC000314069986 333085766 /nfs/dbraw/zinc/08/57/66/333085766.db2.gz SSYCSSRLIDMEQJ-GDBMZVCRSA-N 1 1 307.438 3.530 20 5 DHBDMO C[C@H]([NH2+]CC1(N(C)C)CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000314358235 333104973 /nfs/dbraw/zinc/10/49/73/333104973.db2.gz WBYRZRBOXXNOCO-AWEZNQCLSA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccccc3)C2)c(F)c1 ZINC000319273472 333279522 /nfs/dbraw/zinc/27/95/22/333279522.db2.gz DJFPXMNRKKGWGU-AWEZNQCLSA-N 1 1 300.333 3.723 20 5 DHBDMO Cc1occc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000414449827 333982362 /nfs/dbraw/zinc/98/23/62/333982362.db2.gz VMWAEAGTOXULTG-UHFFFAOYSA-N 1 1 314.263 3.805 20 5 DHBDMO C[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000388773371 334269947 /nfs/dbraw/zinc/26/99/47/334269947.db2.gz GFWUWAVVRHWXPO-MWLCHTKSSA-N 1 1 317.311 3.508 20 5 DHBDMO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)nc2c1 ZINC000344002382 335206920 /nfs/dbraw/zinc/20/69/20/335206920.db2.gz HOXINUGBTGBXFH-LBPRGKRZSA-N 1 1 310.357 3.630 20 5 DHBDMO COCC[C@@H]1CCCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000332233058 336164216 /nfs/dbraw/zinc/16/42/16/336164216.db2.gz FNTUOAGIQOZEJB-HNNXBMFYSA-N 1 1 306.406 3.542 20 5 DHBDMO CC[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000351970438 336184293 /nfs/dbraw/zinc/18/42/93/336184293.db2.gz BYGVNWKOAFHLBC-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc2cccnc21 ZINC000352543411 336223579 /nfs/dbraw/zinc/22/35/79/336223579.db2.gz FDLNWWHTOJTRHO-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCO[C@@H](C)C1 ZINC000352717260 336232031 /nfs/dbraw/zinc/23/20/31/336232031.db2.gz HXCSRZLOFNDIBS-GOEBONIOSA-N 1 1 306.406 3.620 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)[NH+]1CCC(C)CC1 ZINC000532492293 336250546 /nfs/dbraw/zinc/25/05/46/336250546.db2.gz LSMXOJFWMVQYSV-CVEARBPZSA-N 1 1 319.449 3.674 20 5 DHBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@H]1CCCCO1 ZINC000532714507 336267875 /nfs/dbraw/zinc/26/78/75/336267875.db2.gz OYNKIFQZMULRSI-MRXNPFEDSA-N 1 1 306.406 3.684 20 5 DHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000192958657 336286004 /nfs/dbraw/zinc/28/60/04/336286004.db2.gz IIHMUQXWDINZJC-INIZCTEOSA-N 1 1 311.385 3.529 20 5 DHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2sccc2C1 ZINC000301088905 336289434 /nfs/dbraw/zinc/28/94/34/336289434.db2.gz LUFSOFQKKIGCFO-LBPRGKRZSA-N 1 1 317.414 3.515 20 5 DHBDMO CC(C)C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2F)C1 ZINC000301755717 336327852 /nfs/dbraw/zinc/32/78/52/336327852.db2.gz DGRYSSOVDZJEKK-CYBMUJFWSA-N 1 1 309.385 3.514 20 5 DHBDMO Cc1cc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301970287 336340560 /nfs/dbraw/zinc/34/05/60/336340560.db2.gz DHPNWWIUAIUYNL-FUHWJXTLSA-N 1 1 311.385 3.761 20 5 DHBDMO Cc1cc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301970286 336340582 /nfs/dbraw/zinc/34/05/82/336340582.db2.gz DHPNWWIUAIUYNL-AEFFLSMTSA-N 1 1 311.385 3.761 20 5 DHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 ZINC000301986412 336341446 /nfs/dbraw/zinc/34/14/46/336341446.db2.gz MHQRJUSWOJJNMQ-JKSUJKDBSA-N 1 1 317.433 3.686 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2cccc(F)c2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000302797414 336369487 /nfs/dbraw/zinc/36/94/87/336369487.db2.gz ANMPALCOCWECLY-JKSUJKDBSA-N 1 1 315.348 3.591 20 5 DHBDMO Cc1cccc(NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[nH+]1 ZINC000362683682 336808914 /nfs/dbraw/zinc/80/89/14/336808914.db2.gz LVPYHVJIONVOTO-UHFFFAOYSA-N 1 1 311.263 3.929 20 5 DHBDMO Cc1[nH+]c(CNc2ccc([N+](=O)[O-])cc2Cl)c2n1CCCC2 ZINC000373173793 336950478 /nfs/dbraw/zinc/95/04/78/336950478.db2.gz VAMJJYFHTLSZTE-UHFFFAOYSA-N 1 1 320.780 3.702 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000376551860 337036588 /nfs/dbraw/zinc/03/65/88/337036588.db2.gz JFDQXWPSCWOEPG-PXAZEXFGSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000376551860 337036589 /nfs/dbraw/zinc/03/65/89/337036589.db2.gz JFDQXWPSCWOEPG-PXAZEXFGSA-N 1 1 315.348 3.712 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000174349428 337140858 /nfs/dbraw/zinc/14/08/58/337140858.db2.gz JKLRWVBRFQKMLR-NEPJUHHUSA-N 1 1 300.449 3.762 20 5 DHBDMO CC[N@H+](Cc1cccs1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184226139 337197473 /nfs/dbraw/zinc/19/74/73/337197473.db2.gz VWCKNPDMNNGNAQ-UHFFFAOYSA-N 1 1 324.377 3.826 20 5 DHBDMO CC[N@@H+](Cc1cccs1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184226139 337197474 /nfs/dbraw/zinc/19/74/74/337197474.db2.gz VWCKNPDMNNGNAQ-UHFFFAOYSA-N 1 1 324.377 3.826 20 5 DHBDMO CCOc1cccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000584378148 337232763 /nfs/dbraw/zinc/23/27/63/337232763.db2.gz YMSOVLYQLJZQQU-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cc(O)cc(F)c2)C2CC2)c1 ZINC000186182947 337254390 /nfs/dbraw/zinc/25/43/90/337254390.db2.gz MOCUIYHBIHNEDD-UHFFFAOYSA-N 1 1 316.332 3.604 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cc(O)cc(F)c2)C2CC2)c1 ZINC000186182947 337254391 /nfs/dbraw/zinc/25/43/91/337254391.db2.gz MOCUIYHBIHNEDD-UHFFFAOYSA-N 1 1 316.332 3.604 20 5 DHBDMO CC(C)([NH2+]Cc1ccc2c(n1)CCC2)c1ccccc1[N+](=O)[O-] ZINC000583857808 337349264 /nfs/dbraw/zinc/34/92/64/337349264.db2.gz VAPDSUOJEBCXQA-UHFFFAOYSA-N 1 1 311.385 3.503 20 5 DHBDMO C[C@@H]([N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000532928542 337393176 /nfs/dbraw/zinc/39/31/76/337393176.db2.gz NJPISLIOQGEAJW-LLVKDONJSA-N 1 1 318.377 3.511 20 5 DHBDMO Cc1nc(C(C)(C)[NH2+]Cc2cccc([N+](=O)[O-])c2)sc1C ZINC000076904365 337574393 /nfs/dbraw/zinc/57/43/93/337574393.db2.gz ILVRBDVCASCVDZ-UHFFFAOYSA-N 1 1 305.403 3.693 20 5 DHBDMO CC(C)[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cccs1 ZINC000516307979 338010202 /nfs/dbraw/zinc/01/02/02/338010202.db2.gz YDGUZVKBZSFEBJ-UHFFFAOYSA-N 1 1 320.414 3.946 20 5 DHBDMO CCOc1cc(C[N@H+](C)Cc2occc2C)ccc1[N+](=O)[O-] ZINC000429399235 338079473 /nfs/dbraw/zinc/07/94/73/338079473.db2.gz MNXRLXQGBKTNDG-UHFFFAOYSA-N 1 1 304.346 3.527 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2occc2C)ccc1[N+](=O)[O-] ZINC000429399235 338079474 /nfs/dbraw/zinc/07/94/74/338079474.db2.gz MNXRLXQGBKTNDG-UHFFFAOYSA-N 1 1 304.346 3.527 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000430192469 338100400 /nfs/dbraw/zinc/10/04/00/338100400.db2.gz CFFBCBJDYCTZSC-ACJLOTCBSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000430192469 338100401 /nfs/dbraw/zinc/10/04/01/338100401.db2.gz CFFBCBJDYCTZSC-ACJLOTCBSA-N 1 1 312.369 3.796 20 5 DHBDMO C[C@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000432145349 338147049 /nfs/dbraw/zinc/14/70/49/338147049.db2.gz RNUBLVVWVNRIAQ-GFCCVEGCSA-N 1 1 323.824 3.559 20 5 DHBDMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000433046843 338178271 /nfs/dbraw/zinc/17/82/71/338178271.db2.gz QPHPXSHNTALTBI-PWSUYJOCSA-N 1 1 314.332 3.817 20 5 DHBDMO CCN(CC)C[C@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433163670 338183561 /nfs/dbraw/zinc/18/35/61/338183561.db2.gz CBTQTUBXLNLGCO-GUYCJALGSA-N 1 1 319.449 3.637 20 5 DHBDMO CC1(C)C[C@@H]([NH2+]Cc2ccc(F)cn2)c2cc([N+](=O)[O-])ccc21 ZINC000433297300 338189941 /nfs/dbraw/zinc/18/99/41/338189941.db2.gz VUIJWWSHZTTYGI-MRXNPFEDSA-N 1 1 315.348 3.641 20 5 DHBDMO O=[N+]([O-])c1cc(CNC[C@H]2CCC[N@H+]2C2CCCCC2)cs1 ZINC000435726557 338246360 /nfs/dbraw/zinc/24/63/60/338246360.db2.gz QTCGQJWWPVXLSO-OAHLLOKOSA-N 1 1 323.462 3.543 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)cc1[N+](=O)[O-] ZINC000449573051 338638953 /nfs/dbraw/zinc/63/89/53/338638953.db2.gz PGCULOAEDJOMTR-SWLSCSKDSA-N 1 1 314.389 3.710 20 5 DHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453359680 338831245 /nfs/dbraw/zinc/83/12/45/338831245.db2.gz QEYKLAWEDQELLA-QWHCGFSZSA-N 1 1 302.378 3.531 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC1CCC(F)(F)CC1 ZINC000459455140 339030184 /nfs/dbraw/zinc/03/01/84/339030184.db2.gz CPCFXSPCSKJOSR-UHFFFAOYSA-N 1 1 312.360 3.895 20 5 DHBDMO COc1cc(NCCCC[N@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000462789917 339088783 /nfs/dbraw/zinc/08/87/83/339088783.db2.gz LKANHNHQQHJMIT-CQSZACIVSA-N 1 1 321.421 3.670 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000464499009 339143622 /nfs/dbraw/zinc/14/36/22/339143622.db2.gz LRNNUIQHHPLEFE-CORIIIEPSA-N 1 1 322.380 3.753 20 5 DHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCc1cccs1 ZINC000464755099 339151294 /nfs/dbraw/zinc/15/12/94/339151294.db2.gz FXVPDYIEIWEZJZ-UHFFFAOYSA-N 1 1 320.414 3.600 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2cccs2)CC1 ZINC000466497684 339207472 /nfs/dbraw/zinc/20/74/72/339207472.db2.gz UBCACAMAZAKDJL-ZDUSSCGKSA-N 1 1 317.414 3.540 20 5 DHBDMO CCc1nc(C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)cs1 ZINC000468626149 339267416 /nfs/dbraw/zinc/26/74/16/339267416.db2.gz ZYMLSNOWOFRQAM-GHXNOFRVSA-N 1 1 317.414 3.807 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOC2(CCCC2)C1 ZINC000470178814 339313005 /nfs/dbraw/zinc/31/30/05/339313005.db2.gz OKBIKNHOGNSZCO-PTNGSMBKSA-N 1 1 316.401 3.643 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)CC1CCCC1 ZINC000473733449 339391021 /nfs/dbraw/zinc/39/10/21/339391021.db2.gz IFOUHIQXPJTDMH-SFHVURJKSA-N 1 1 320.433 3.746 20 5 DHBDMO C[C@@H]([NH2+]Cc1scnc1C1CC1)c1ccccc1[N+](=O)[O-] ZINC000487554854 339757037 /nfs/dbraw/zinc/75/70/37/339757037.db2.gz SVLSEIPOIARACE-SNVBAGLBSA-N 1 1 303.387 3.780 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCc2ccccc2C1 ZINC000498921535 340026051 /nfs/dbraw/zinc/02/60/51/340026051.db2.gz FPMOFPSLDSXCHX-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CC[C@@H]1CCCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500101508 340050318 /nfs/dbraw/zinc/05/03/18/340050318.db2.gz YMVHQTNHWDUPIE-CQSZACIVSA-N 1 1 319.405 3.578 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC000503684133 340133449 /nfs/dbraw/zinc/13/34/49/340133449.db2.gz HRMWTSLMHGYEPA-CQSZACIVSA-N 1 1 300.333 3.723 20 5 DHBDMO CC(C)[N@@H+](CCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000506787779 340201796 /nfs/dbraw/zinc/20/17/96/340201796.db2.gz BQIMWGGCVDTPIJ-UHFFFAOYSA-N 1 1 320.414 3.526 20 5 DHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)CC(C)C ZINC000507156597 340210145 /nfs/dbraw/zinc/21/01/45/340210145.db2.gz UEQJJPDVNFUBEK-UHFFFAOYSA-N 1 1 302.321 3.674 20 5 DHBDMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000507209316 340213555 /nfs/dbraw/zinc/21/35/55/340213555.db2.gz IPSIWIKIRHCHPF-SNVBAGLBSA-N 1 1 302.321 3.673 20 5 DHBDMO CC[C@@H]1C[C@H](C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCO1 ZINC000507791520 340231493 /nfs/dbraw/zinc/23/14/93/340231493.db2.gz CQCORGJYFZINBD-CRAIPNDOSA-N 1 1 318.417 3.764 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2cc(F)ccc2C1 ZINC000509433722 340269349 /nfs/dbraw/zinc/26/93/49/340269349.db2.gz BSPSVCGCMXVDST-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2cc(F)ccc2C1 ZINC000509433722 340269350 /nfs/dbraw/zinc/26/93/50/340269350.db2.gz BSPSVCGCMXVDST-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H](c1cccc(F)c1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511061761 340319738 /nfs/dbraw/zinc/31/97/38/340319738.db2.gz BGZXRBRKWOPGAF-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO CC[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000511522690 340329194 /nfs/dbraw/zinc/32/91/94/340329194.db2.gz MVEQOHRLHITXNF-LLVKDONJSA-N 1 1 300.305 3.571 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCSC1 ZINC000130547980 341027373 /nfs/dbraw/zinc/02/73/73/341027373.db2.gz SJSVBBJGHYHRHM-LBPRGKRZSA-N 1 1 318.398 3.792 20 5 DHBDMO Cc1cccc([C@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000543246296 341037831 /nfs/dbraw/zinc/03/78/31/341037831.db2.gz AHSLPFMDHJNQGH-SFHVURJKSA-N 1 1 310.397 3.935 20 5 DHBDMO C[C@H]1CCC[C@@H](CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000543481232 341046681 /nfs/dbraw/zinc/04/66/81/341046681.db2.gz SHHUHDRNERMLNJ-KBPBESRZSA-N 1 1 303.406 3.564 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1COc2ccc(F)cc21 ZINC000546649191 341177170 /nfs/dbraw/zinc/17/71/70/341177170.db2.gz MLMNJYXIZHDAAR-ZBEGNZNMSA-N 1 1 316.332 3.827 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1(C)C ZINC000546832268 341183329 /nfs/dbraw/zinc/18/33/29/341183329.db2.gz ZKXTZMFXCLTOSV-LLVKDONJSA-N 1 1 303.362 3.604 20 5 DHBDMO Cc1ccc(F)cc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549170957 341287981 /nfs/dbraw/zinc/28/79/81/341287981.db2.gz GMBACPKCONQGGJ-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000550444418 341317205 /nfs/dbraw/zinc/31/72/05/341317205.db2.gz UXPNMWXZVDLCQN-OCCSQVGLSA-N 1 1 322.380 3.753 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000245930590 341318716 /nfs/dbraw/zinc/31/87/16/341318716.db2.gz PEJYWBCYMGZTIS-QWHCGFSZSA-N 1 1 315.373 3.728 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCC(F)(F)C2)C2CC2)cc1 ZINC000551094320 341331505 /nfs/dbraw/zinc/33/15/05/341331505.db2.gz XYOGIUQVWDMZQC-CYBMUJFWSA-N 1 1 310.344 3.995 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCC(F)(F)F)CC2CC2)cc1 ZINC000084137379 341357718 /nfs/dbraw/zinc/35/77/18/341357718.db2.gz JTNOREFBGYQYCQ-UHFFFAOYSA-N 1 1 302.296 3.759 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2nc(C)cs2)cc1[N+](=O)[O-] ZINC000152759455 341504751 /nfs/dbraw/zinc/50/47/51/341504751.db2.gz STWYBPOJJGNLRS-LLVKDONJSA-N 1 1 321.402 3.609 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1cc[nH+]c1C(C)C ZINC000123675472 517452012 /nfs/dbraw/zinc/45/20/12/517452012.db2.gz OVSBPEVZCWCUHK-UHFFFAOYSA-N 1 1 303.362 3.750 20 5 DHBDMO CCOC[C@@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182789432 520116794 /nfs/dbraw/zinc/11/67/94/520116794.db2.gz SHLXBTAPFVQNBG-LSDHHAIUSA-N 1 1 306.406 3.713 20 5 DHBDMO CCC[N@@H+](C)C[C@H]1CCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182822780 521498968 /nfs/dbraw/zinc/49/89/68/521498968.db2.gz KBKXAQKJQUWKOD-JKSUJKDBSA-N 1 1 319.449 3.628 20 5 DHBDMO CCc1noc(CC)c1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000124816168 522896473 /nfs/dbraw/zinc/89/64/73/522896473.db2.gz AMVLLWGJLPWMSF-LLVKDONJSA-N 1 1 303.362 3.558 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCc2c1cccc2F ZINC000267074959 525463555 /nfs/dbraw/zinc/46/35/55/525463555.db2.gz TVZFYSCNMHFOSO-INIZCTEOSA-N 1 1 316.332 3.520 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccncc1F ZINC000338018971 525682124 /nfs/dbraw/zinc/68/21/24/525682124.db2.gz GBUVXPXQIOKAGC-DIFFPNOSSA-N 1 1 315.348 3.857 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cnc(Cl)s2)cc1[N+](=O)[O-] ZINC000181824330 525735794 /nfs/dbraw/zinc/73/57/94/525735794.db2.gz MGIOFIBTLXJGOV-SECBINFHSA-N 1 1 311.794 3.864 20 5 DHBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000130613923 526524190 /nfs/dbraw/zinc/52/41/90/526524190.db2.gz DIEJASUTKFAMPC-MRXNPFEDSA-N 1 1 314.389 3.580 20 5 DHBDMO COc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000015309463 1013274782 /nfs/dbraw/zinc/27/47/82/1013274782.db2.gz YTRZNMQPONWUOJ-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC1CCCCC1 ZINC000083133655 1013322776 /nfs/dbraw/zinc/32/27/76/1013322776.db2.gz SKIWAIDNRBWHOJ-UHFFFAOYSA-N 1 1 303.362 3.748 20 5 DHBDMO COc1cc(C[N@H+](C)[C@@H](C)c2cccs2)c([N+](=O)[O-])cc1F ZINC000184246793 1013438373 /nfs/dbraw/zinc/43/83/73/1013438373.db2.gz SUBABHUZHKNNKD-JTQLQIEISA-N 1 1 324.377 3.997 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cccs2)c([N+](=O)[O-])cc1F ZINC000184246793 1013438378 /nfs/dbraw/zinc/43/83/78/1013438378.db2.gz SUBABHUZHKNNKD-JTQLQIEISA-N 1 1 324.377 3.997 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000177199440 1013709949 /nfs/dbraw/zinc/70/99/49/1013709949.db2.gz DKXNPEXPBXIETC-LSDHHAIUSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000177199440 1013709959 /nfs/dbraw/zinc/70/99/59/1013709959.db2.gz DKXNPEXPBXIETC-LSDHHAIUSA-N 1 1 310.394 3.594 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000441487045 1014248170 /nfs/dbraw/zinc/24/81/70/1014248170.db2.gz OFCCKKHOHMFSIF-KFWWJZLASA-N 1 1 304.390 3.627 20 5 DHBDMO Cc1ccc([C@@H](C)NCCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000319920787 1014278593 /nfs/dbraw/zinc/27/85/93/1014278593.db2.gz BQSAQRMLLZGHBV-HZPDHXFCSA-N 1 1 319.449 3.818 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C2CCOCC2)C1 ZINC000933082445 1014540835 /nfs/dbraw/zinc/54/08/35/1014540835.db2.gz NECRDNXVKPCBGH-RHSMWYFYSA-N 1 1 318.417 3.794 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(C(F)F)CC2)c1 ZINC000307882633 1014630344 /nfs/dbraw/zinc/63/03/44/1014630344.db2.gz MCPAKYGAQZYEBI-UHFFFAOYSA-N 1 1 304.724 3.725 20 5 DHBDMO CC(C)([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1 ZINC000175985818 1014639782 /nfs/dbraw/zinc/63/97/82/1014639782.db2.gz HMUYJCRCIGVVLX-UHFFFAOYSA-N 1 1 321.358 3.589 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000276216390 1014865304 /nfs/dbraw/zinc/86/53/04/1014865304.db2.gz IKTLZKRRYAQUNW-VIFPVBQESA-N 1 1 308.325 3.819 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000276216390 1014865314 /nfs/dbraw/zinc/86/53/14/1014865314.db2.gz IKTLZKRRYAQUNW-VIFPVBQESA-N 1 1 308.325 3.819 20 5 DHBDMO Cc1ccnc([C@H]2CC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000581556930 1014995257 /nfs/dbraw/zinc/99/52/57/1014995257.db2.gz VXPUUJRAXBPUJW-HOCLYGCPSA-N 1 1 311.385 3.849 20 5 DHBDMO CCCC[C@H](C)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000581576852 1015008132 /nfs/dbraw/zinc/00/81/32/1015008132.db2.gz ADWWOAZBKTVSAY-LBPRGKRZSA-N 1 1 318.377 3.655 20 5 DHBDMO COc1ccc(C[N@@H+](CC2CC2)CC2CCC2)cc1[N+](=O)[O-] ZINC000475676692 1015269701 /nfs/dbraw/zinc/26/97/01/1015269701.db2.gz REQSUYXVOVGOGE-UHFFFAOYSA-N 1 1 304.390 3.616 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)cs1 ZINC000185303154 1015281250 /nfs/dbraw/zinc/28/12/50/1015281250.db2.gz FNVJDYWEOXDSBX-LLVKDONJSA-N 1 1 324.352 3.924 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)cs1 ZINC000185303154 1015281255 /nfs/dbraw/zinc/28/12/55/1015281255.db2.gz FNVJDYWEOXDSBX-LLVKDONJSA-N 1 1 324.352 3.924 20 5 DHBDMO Cc1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cnc1F ZINC000891623471 1015462686 /nfs/dbraw/zinc/46/26/86/1015462686.db2.gz OLJFNHBBDRHAEH-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cnc1F ZINC000891623471 1015462692 /nfs/dbraw/zinc/46/26/92/1015462692.db2.gz OLJFNHBBDRHAEH-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cn1c2ccccc2nc1C(C)(C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000185643340 1015600788 /nfs/dbraw/zinc/60/07/88/1015600788.db2.gz MCPSJWRSWVOPFN-UHFFFAOYSA-N 1 1 324.384 3.506 20 5 DHBDMO CC(C)Oc1ncccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000320311967 1015657947 /nfs/dbraw/zinc/65/79/47/1015657947.db2.gz CSYLNZMXNJQWMK-CYBMUJFWSA-N 1 1 315.373 3.628 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]CCN2C[C@@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000610799329 1015844532 /nfs/dbraw/zinc/84/45/32/1015844532.db2.gz SICKPKWTOCKBQG-DZKIICNBSA-N 1 1 319.449 3.532 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC=C(c3ccccc3)C2)cs1 ZINC000341992823 1015865831 /nfs/dbraw/zinc/86/58/31/1015865831.db2.gz PVUXFZQDSNUDEP-UHFFFAOYSA-N 1 1 300.383 3.946 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC=C(c3ccccc3)C2)cs1 ZINC000341992823 1015865837 /nfs/dbraw/zinc/86/58/37/1015865837.db2.gz PVUXFZQDSNUDEP-UHFFFAOYSA-N 1 1 300.383 3.946 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000611579722 1016458853 /nfs/dbraw/zinc/45/88/53/1016458853.db2.gz NRIXTWXRFQJGAR-DGCLKSJQSA-N 1 1 314.332 3.668 20 5 DHBDMO Cc1nn(C(C)C)cc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000281333522 1016460345 /nfs/dbraw/zinc/46/03/45/1016460345.db2.gz LKGKQRWKSUNRQL-UHFFFAOYSA-N 1 1 322.796 3.624 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000444230380 1016887228 /nfs/dbraw/zinc/88/72/28/1016887228.db2.gz YEZZQRCAMOGLEM-ZDUSSCGKSA-N 1 1 322.405 3.710 20 5 DHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000479581159 1017006808 /nfs/dbraw/zinc/00/68/08/1017006808.db2.gz UHDFJWJKYVNILY-HNNXBMFYSA-N 1 1 314.385 3.804 20 5 DHBDMO C[C@@H](C1CC1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000235081695 1017054122 /nfs/dbraw/zinc/05/41/22/1017054122.db2.gz CXROJOWOUPKTRR-VIFPVBQESA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000248695584 1017253298 /nfs/dbraw/zinc/25/32/98/1017253298.db2.gz JOUOSQBQAJLPGC-LIRRHRJNSA-N 1 1 324.380 3.787 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@H](C)C3(CCC3)C2)c([N+](=O)[O-])cc1F ZINC000362181291 1032262520 /nfs/dbraw/zinc/26/25/20/1032262520.db2.gz OSCCQYPVAIQENU-LBPRGKRZSA-N 1 1 322.380 3.755 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1cccc(F)n1)c1cccc([N+](=O)[O-])c1 ZINC000773092175 1032554439 /nfs/dbraw/zinc/55/44/39/1032554439.db2.gz ZKKCTMLDVZETAV-OAHLLOKOSA-N 1 1 303.337 3.760 20 5 DHBDMO CCC[C@H]([NH2+]Cc1cccc(F)n1)c1cccc([N+](=O)[O-])c1 ZINC000773092174 1032554960 /nfs/dbraw/zinc/55/49/60/1032554960.db2.gz ZKKCTMLDVZETAV-HNNXBMFYSA-N 1 1 303.337 3.760 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccc(F)c(F)c2)c1 ZINC000049577417 1012051715 /nfs/dbraw/zinc/05/17/15/1012051715.db2.gz ASWCEYZCCQKDAX-UHFFFAOYSA-N 1 1 312.703 3.816 20 5 DHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cccc(O)c1 ZINC000037151218 1032639441 /nfs/dbraw/zinc/63/94/41/1032639441.db2.gz TYIWWESNTKMXBW-SNVBAGLBSA-N 1 1 306.749 3.805 20 5 DHBDMO C[N@H+]1C[C@H]2C[C@@H](C1)N2C(=O)c1ccc2cc3ccccc3cc2c1 ZINC001270141134 1012780327 /nfs/dbraw/zinc/78/03/27/1012780327.db2.gz RMYHPBCZNQLJJL-BGYRXZFFSA-N 1 1 316.404 3.522 20 5 DHBDMO C[N@@H+]1C[C@H]2C[C@@H](C1)N2C(=O)c1ccc2cc3ccccc3cc2c1 ZINC001270141134 1012780342 /nfs/dbraw/zinc/78/03/42/1012780342.db2.gz RMYHPBCZNQLJJL-BGYRXZFFSA-N 1 1 316.404 3.522 20 5 DHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444651437 1017607835 /nfs/dbraw/zinc/60/78/35/1017607835.db2.gz VFZOYRLTQVVBCV-WBMJQRKESA-N 1 1 316.405 3.872 20 5 DHBDMO CCC1CCC([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000444639186 1017613674 /nfs/dbraw/zinc/61/36/74/1017613674.db2.gz LMQUHOQETRMDSI-UHFFFAOYSA-N 1 1 316.405 3.872 20 5 DHBDMO CCC[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444689505 1017630921 /nfs/dbraw/zinc/63/09/21/1017630921.db2.gz NQZOZCURMFPIKB-LBPRGKRZSA-N 1 1 302.378 3.626 20 5 DHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444689504 1017632214 /nfs/dbraw/zinc/63/22/14/1017632214.db2.gz NQZOZCURMFPIKB-GFCCVEGCSA-N 1 1 302.378 3.626 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccc(F)c(C)c2)ccc1[N+](=O)[O-] ZINC000444726809 1017652915 /nfs/dbraw/zinc/65/29/15/1017652915.db2.gz BOVRBISJFXGQBJ-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000444769773 1017668793 /nfs/dbraw/zinc/66/87/93/1017668793.db2.gz JNFGTNPWPCJELP-GFCCVEGCSA-N 1 1 310.369 3.611 20 5 DHBDMO Cc1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000091479628 1017765037 /nfs/dbraw/zinc/76/50/37/1017765037.db2.gz HVIXKGJQXFBQRV-LLVKDONJSA-N 1 1 320.780 3.664 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+]([C@@H]1CCc3ccc(F)cc31)CC2 ZINC000445256904 1017806405 /nfs/dbraw/zinc/80/64/05/1017806405.db2.gz DMCHPQNPHQVBDZ-GOSISDBHSA-N 1 1 312.344 3.780 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+]([C@@H]1CCc3ccc(F)cc31)CC2 ZINC000445256904 1017806424 /nfs/dbraw/zinc/80/64/24/1017806424.db2.gz DMCHPQNPHQVBDZ-GOSISDBHSA-N 1 1 312.344 3.780 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+]([C@H]1CCc3ccc(F)cc31)CC2 ZINC000445256905 1017808633 /nfs/dbraw/zinc/80/86/33/1017808633.db2.gz DMCHPQNPHQVBDZ-SFHVURJKSA-N 1 1 312.344 3.780 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+]([C@H]1CCc3ccc(F)cc31)CC2 ZINC000445256905 1017808657 /nfs/dbraw/zinc/80/86/57/1017808657.db2.gz DMCHPQNPHQVBDZ-SFHVURJKSA-N 1 1 312.344 3.780 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278116450 1018156062 /nfs/dbraw/zinc/15/60/62/1018156062.db2.gz ANFQAIBVOWXCJX-PYEVWLCESA-N 1 1 314.307 3.882 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3coc4ccccc34)nc2c1 ZINC000446847841 1018267998 /nfs/dbraw/zinc/26/79/98/1018267998.db2.gz CEICZVNQURSKBA-UHFFFAOYSA-N 1 1 322.324 3.507 20 5 DHBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000447384595 1018384750 /nfs/dbraw/zinc/38/47/50/1018384750.db2.gz MTVKUALTZMREIY-MRXNPFEDSA-N 1 1 310.369 3.515 20 5 DHBDMO CC1CCC(O)(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000441272339 1018396675 /nfs/dbraw/zinc/39/66/75/1018396675.db2.gz YSOVAHQKHBGXJC-UHFFFAOYSA-N 1 1 318.417 3.500 20 5 DHBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000536023721 1018459961 /nfs/dbraw/zinc/45/99/61/1018459961.db2.gz WOMRNCROIFFNEF-HNNXBMFYSA-N 1 1 317.776 3.847 20 5 DHBDMO COc1ccc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000583578390 1018570121 /nfs/dbraw/zinc/57/01/21/1018570121.db2.gz OPEJTUOMXSGLGO-KBPBESRZSA-N 1 1 304.390 3.614 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)cs1 ZINC000340444120 1018613324 /nfs/dbraw/zinc/61/33/24/1018613324.db2.gz KAWJUSDFTQWLCW-ZDUSSCGKSA-N 1 1 322.361 3.799 20 5 DHBDMO Cc1ccoc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278600231 1018906387 /nfs/dbraw/zinc/90/63/87/1018906387.db2.gz CEYYBLUSFWQKRY-UHFFFAOYSA-N 1 1 314.263 3.805 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc3c(n2)CCC3)C2CC2)c1 ZINC000584158440 1018994516 /nfs/dbraw/zinc/99/45/16/1018994516.db2.gz YRTUSXLLXDCFOB-UHFFFAOYSA-N 1 1 323.396 3.643 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc3c(n2)CCC3)C2CC2)c1 ZINC000584158440 1018994527 /nfs/dbraw/zinc/99/45/27/1018994527.db2.gz YRTUSXLLXDCFOB-UHFFFAOYSA-N 1 1 323.396 3.643 20 5 DHBDMO Cc1cnc(Cl)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000921553040 1019051457 /nfs/dbraw/zinc/05/14/57/1019051457.db2.gz PSTCHKQSRFUJRZ-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc2cc[nH]c21 ZINC000584318680 1019089795 /nfs/dbraw/zinc/08/97/95/1019089795.db2.gz VKLAVWQVOSINSI-UHFFFAOYSA-N 1 1 309.369 3.751 20 5 DHBDMO CC(C)CC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000750037570 1019288823 /nfs/dbraw/zinc/28/88/23/1019288823.db2.gz OIYFHOGDDCEIJM-GOSISDBHSA-N 1 1 320.433 3.919 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cn2)cc1[N+](=O)[O-] ZINC000090217529 1019384472 /nfs/dbraw/zinc/38/44/72/1019384472.db2.gz WABAERLVZAHBFQ-RYUDHWBXSA-N 1 1 303.337 3.849 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H]2C2CC2)c1 ZINC000611268525 1019427953 /nfs/dbraw/zinc/42/79/53/1019427953.db2.gz CRUHQIBYAUXOPQ-CYBMUJFWSA-N 1 1 312.316 3.571 20 5 DHBDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000611555204 1019517183 /nfs/dbraw/zinc/51/71/83/1019517183.db2.gz RHLRQKLAKOXVGL-JQWIXIFHSA-N 1 1 302.296 3.758 20 5 DHBDMO CCc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000347589714 1019746787 /nfs/dbraw/zinc/74/67/87/1019746787.db2.gz NRNLEMZKNDOOQG-UHFFFAOYSA-N 1 1 311.385 3.717 20 5 DHBDMO CCc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000347589714 1019746801 /nfs/dbraw/zinc/74/68/01/1019746801.db2.gz NRNLEMZKNDOOQG-UHFFFAOYSA-N 1 1 311.385 3.717 20 5 DHBDMO CC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000315020239 1019778213 /nfs/dbraw/zinc/77/82/13/1019778213.db2.gz YMSMTZKYGVAJAN-LLVKDONJSA-N 1 1 317.311 3.510 20 5 DHBDMO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000131020810 1019820782 /nfs/dbraw/zinc/82/07/82/1019820782.db2.gz BRHXRGNXKIQQDT-MRXNPFEDSA-N 1 1 316.357 3.671 20 5 DHBDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000131020810 1019820797 /nfs/dbraw/zinc/82/07/97/1019820797.db2.gz BRHXRGNXKIQQDT-MRXNPFEDSA-N 1 1 316.357 3.671 20 5 DHBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CCC1 ZINC000533436640 1020010054 /nfs/dbraw/zinc/01/00/54/1020010054.db2.gz XKKCTNONXOBXMU-UHFFFAOYSA-N 1 1 315.373 3.667 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)c1 ZINC000154917115 1020164594 /nfs/dbraw/zinc/16/45/94/1020164594.db2.gz BVTBHBOOQMCQMN-QGZVFWFLSA-N 1 1 311.385 3.671 20 5 DHBDMO CCC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124349850 1020167484 /nfs/dbraw/zinc/16/74/84/1020167484.db2.gz WMSRRZBIPYVNSQ-KSSFIOAISA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124349850 1020167486 /nfs/dbraw/zinc/16/74/86/1020167486.db2.gz WMSRRZBIPYVNSQ-KSSFIOAISA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124349850 1020167496 /nfs/dbraw/zinc/16/74/96/1020167496.db2.gz WMSRRZBIPYVNSQ-KSSFIOAISA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124349850 1020167503 /nfs/dbraw/zinc/16/75/03/1020167503.db2.gz WMSRRZBIPYVNSQ-KSSFIOAISA-N 1 1 317.433 3.510 20 5 DHBDMO CC(C)[N@H+]1CCCC[C@@H]1CN[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000330668890 1020236900 /nfs/dbraw/zinc/23/69/00/1020236900.db2.gz ZLTKNTIWGCAWHQ-HUUCEWRRSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)N1CCCC[C@@H]1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000330668890 1020236923 /nfs/dbraw/zinc/23/69/23/1020236923.db2.gz ZLTKNTIWGCAWHQ-HUUCEWRRSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)[N@@H+](Cc1cnn2ccccc12)Cc1ccc([N+](=O)[O-])cc1 ZINC000179320486 1020251767 /nfs/dbraw/zinc/25/17/67/1020251767.db2.gz KOBNLXXXNZSMKS-UHFFFAOYSA-N 1 1 324.384 3.653 20 5 DHBDMO CC1(C)CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000732980876 1020310218 /nfs/dbraw/zinc/31/02/18/1020310218.db2.gz OYGAFXPVFTXVDY-UHFFFAOYSA-N 1 1 314.389 3.538 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000922879727 1020324708 /nfs/dbraw/zinc/32/47/08/1020324708.db2.gz AXMNEHFTMGJUAD-AWEZNQCLSA-N 1 1 317.776 3.810 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(C(C)(C)C)o1 ZINC000282454367 1020525033 /nfs/dbraw/zinc/52/50/33/1020525033.db2.gz MCAOZSSSMUYCCB-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(C(C)(C)C)o1 ZINC000282454367 1020525039 /nfs/dbraw/zinc/52/50/39/1020525039.db2.gz MCAOZSSSMUYCCB-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCOc2ccccc2[C@H]1C ZINC000612577265 1020627700 /nfs/dbraw/zinc/62/77/00/1020627700.db2.gz BRFSTZCOYVSSKD-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCOc2ccccc2[C@H]1C ZINC000612577265 1020627707 /nfs/dbraw/zinc/62/77/07/1020627707.db2.gz BRFSTZCOYVSSKD-CQSZACIVSA-N 1 1 312.369 3.859 20 5 DHBDMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000580740460 1020854252 /nfs/dbraw/zinc/85/42/52/1020854252.db2.gz PJKPUUWVJXUHDI-CJNGLKHVSA-N 1 1 314.385 3.986 20 5 DHBDMO COc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000188781105 1021172881 /nfs/dbraw/zinc/17/28/81/1021172881.db2.gz WWMIZVJXLVSGIS-QWHCGFSZSA-N 1 1 315.373 3.719 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2C2CCCCC2)cc1 ZINC000776276461 1021220115 /nfs/dbraw/zinc/22/01/15/1021220115.db2.gz KAIJZDXKITWLEX-QZTJIDSGSA-N 1 1 318.417 3.673 20 5 DHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776279140 1021230988 /nfs/dbraw/zinc/23/09/88/1021230988.db2.gz VPFUCQMFDKULDI-KBRIMQKVSA-N 1 1 306.406 3.529 20 5 DHBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000743381057 1021286108 /nfs/dbraw/zinc/28/61/08/1021286108.db2.gz TUDZNGAUMCHYJK-CJNGLKHVSA-N 1 1 316.405 3.803 20 5 DHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000743381059 1021287014 /nfs/dbraw/zinc/28/70/14/1021287014.db2.gz TUDZNGAUMCHYJK-XJKSGUPXSA-N 1 1 316.405 3.803 20 5 DHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000743380245 1021287600 /nfs/dbraw/zinc/28/76/00/1021287600.db2.gz XLGOCNYUECXYQB-XJKSGUPXSA-N 1 1 316.405 3.803 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccccc1F ZINC000743848745 1021377069 /nfs/dbraw/zinc/37/70/69/1021377069.db2.gz CIUCYYUPJOJGJB-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO COc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1C ZINC000850416335 1021522629 /nfs/dbraw/zinc/52/26/29/1021522629.db2.gz HRBOHVGQLZIVPT-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000619499394 1021774054 /nfs/dbraw/zinc/77/40/54/1021774054.db2.gz KSMQAKWHNMICKA-AWEZNQCLSA-N 1 1 317.414 3.590 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](Cc1ccccn1)C1CC1 ZINC000290347075 1021910347 /nfs/dbraw/zinc/91/03/47/1021910347.db2.gz FVOCEVGBYRSCEJ-FNORWQNLSA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2[C@H]2CCCOC2)ccc1Cl ZINC000828906556 1021934036 /nfs/dbraw/zinc/93/40/36/1021934036.db2.gz XOVGBPKMEWWVRO-ZFWWWQNUSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccccc2F)C2CC2)c1 ZINC000102696592 1021968275 /nfs/dbraw/zinc/96/82/75/1021968275.db2.gz CJAYYBCRAAOFMF-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccccc2F)C2CC2)c1 ZINC000102696592 1021968287 /nfs/dbraw/zinc/96/82/87/1021968287.db2.gz CJAYYBCRAAOFMF-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO Cc1noc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000851937864 1022046300 /nfs/dbraw/zinc/04/63/00/1022046300.db2.gz CTAHORKXOWDVOV-CQSZACIVSA-N 1 1 301.346 3.618 20 5 DHBDMO Cc1noc(C[N@H+]2CCCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000851937864 1022046314 /nfs/dbraw/zinc/04/63/14/1022046314.db2.gz CTAHORKXOWDVOV-CQSZACIVSA-N 1 1 301.346 3.618 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000480949334 1022050838 /nfs/dbraw/zinc/05/08/38/1022050838.db2.gz BWMMBBZDCXAYBT-MRXNPFEDSA-N 1 1 324.446 3.581 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)c1cccnc1 ZINC000290628802 1022103690 /nfs/dbraw/zinc/10/36/90/1022103690.db2.gz XTETUMJSFWIRSG-CYBMUJFWSA-N 1 1 315.373 3.582 20 5 DHBDMO CCC[C@@]1(C)CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776587441 1022104924 /nfs/dbraw/zinc/10/49/24/1022104924.db2.gz GNUAXSNRGSXLMB-SJORKVTESA-N 1 1 306.406 3.530 20 5 DHBDMO CCC1CCC([N@@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000921046782 1022208809 /nfs/dbraw/zinc/20/88/09/1022208809.db2.gz RUJABCSSWLXENR-UHFFFAOYSA-N 1 1 316.405 3.803 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCCC[C@H]2c2ccccc2F)C1 ZINC001169030158 1022218771 /nfs/dbraw/zinc/21/87/71/1022218771.db2.gz XAZPJCZDPWPBBP-CPUCHLNUSA-N 1 1 306.381 3.798 20 5 DHBDMO C[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035639 1022221393 /nfs/dbraw/zinc/22/13/93/1022221393.db2.gz KYSYWMBIJLOKLQ-JSGCOSHPSA-N 1 1 316.323 3.583 20 5 DHBDMO C[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035636 1022223036 /nfs/dbraw/zinc/22/30/36/1022223036.db2.gz KYSYWMBIJLOKLQ-GXTWGEPZSA-N 1 1 316.323 3.583 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)C1 ZINC001169039795 1022224789 /nfs/dbraw/zinc/22/47/89/1022224789.db2.gz UBDYVHANYWMHCE-XPKDYRNWSA-N 1 1 308.809 3.575 20 5 DHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001169041154 1022224823 /nfs/dbraw/zinc/22/48/23/1022224823.db2.gz BCDHREXMOVGFAQ-VBNZEHGJSA-N 1 1 308.809 3.922 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H]2CC[C@@H](C3CC3)O2)C2CC2)c1 ZINC001167735354 1022228403 /nfs/dbraw/zinc/22/84/03/1022228403.db2.gz ZUEZOMHFZJCUDS-ROUUACIJSA-N 1 1 316.401 3.517 20 5 DHBDMO CCCc1csc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000338954830 1022228953 /nfs/dbraw/zinc/22/89/53/1022228953.db2.gz MIEXXXXUCRGRRB-UHFFFAOYSA-N 1 1 319.430 3.678 20 5 DHBDMO CCCc1csc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000338954830 1022228963 /nfs/dbraw/zinc/22/89/63/1022228963.db2.gz MIEXXXXUCRGRRB-UHFFFAOYSA-N 1 1 319.430 3.678 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC001169025996 1022229079 /nfs/dbraw/zinc/22/90/79/1022229079.db2.gz KKOHYJVBJBOJDS-UHOFOFEASA-N 1 1 308.809 3.922 20 5 DHBDMO Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c1 ZINC001169046717 1022229223 /nfs/dbraw/zinc/22/92/23/1022229223.db2.gz MGEKNWYCNNRAKY-NXHRZFHOSA-N 1 1 302.418 3.886 20 5 DHBDMO CC[C@@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104688353 1022231018 /nfs/dbraw/zinc/23/10/18/1022231018.db2.gz DCCOZHUQXXINHH-GFCCVEGCSA-N 1 1 303.362 3.523 20 5 DHBDMO Cc1cccc(C[N@@H+](C2CC2)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)c1C ZINC001169053918 1022231241 /nfs/dbraw/zinc/23/12/41/1022231241.db2.gz KJMNUZQDOINTMF-QAPCUYQASA-N 1 1 302.418 3.713 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)cs1 ZINC000337507175 1033041254 /nfs/dbraw/zinc/04/12/54/1033041254.db2.gz BSIGNDRLMSIFNB-GFCCVEGCSA-N 1 1 306.362 3.785 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)cs1 ZINC000337507175 1033041268 /nfs/dbraw/zinc/04/12/68/1033041268.db2.gz BSIGNDRLMSIFNB-GFCCVEGCSA-N 1 1 306.362 3.785 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCCC34CCCCC4)nc2c1 ZINC000517671659 1022328544 /nfs/dbraw/zinc/32/85/44/1022328544.db2.gz JMOLSBGQSSRUOK-UHFFFAOYSA-N 1 1 314.389 3.770 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@H](c3ccccc3)C2)cc1 ZINC000609800983 1022352485 /nfs/dbraw/zinc/35/24/85/1022352485.db2.gz ZJHDIHBMHQWWKD-KRWDZBQOSA-N 1 1 314.410 3.885 20 5 DHBDMO COc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000080962627 1022583229 /nfs/dbraw/zinc/58/32/29/1022583229.db2.gz HSRBIHBEDFWTFY-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000080962627 1022583235 /nfs/dbraw/zinc/58/32/35/1022583235.db2.gz HSRBIHBEDFWTFY-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000584836614 1022801450 /nfs/dbraw/zinc/80/14/50/1022801450.db2.gz MGTGPCHFRGWNDI-UONOGXRCSA-N 1 1 304.390 3.608 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000584836614 1022801453 /nfs/dbraw/zinc/80/14/53/1022801453.db2.gz MGTGPCHFRGWNDI-UONOGXRCSA-N 1 1 304.390 3.608 20 5 DHBDMO C[N@@H+](CC(N)=O)Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000768245337 1022938766 /nfs/dbraw/zinc/93/87/66/1022938766.db2.gz PHODXTBWZBQILA-UHFFFAOYSA-N 1 1 312.800 3.564 20 5 DHBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@H]1C ZINC000781925390 1023087035 /nfs/dbraw/zinc/08/70/35/1023087035.db2.gz TVQDUNDYOHOJED-COXVUDFISA-N 1 1 306.406 3.529 20 5 DHBDMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769471230 1023161713 /nfs/dbraw/zinc/16/17/13/1023161713.db2.gz RNMAZLFRYQOEAJ-NXEZZACHSA-N 1 1 313.195 3.588 20 5 DHBDMO CNC(=O)CCC[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000769505674 1023170808 /nfs/dbraw/zinc/17/08/08/1023170808.db2.gz KBGMZKGSJYABFM-UHFFFAOYSA-N 1 1 320.436 3.951 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCOC2(CCCC2)C1 ZINC000408144464 1023391695 /nfs/dbraw/zinc/39/16/95/1023391695.db2.gz LPTSTPGMXIRCAI-CQSZACIVSA-N 1 1 304.390 3.609 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCOC2(CCCC2)C1 ZINC000408144464 1023391702 /nfs/dbraw/zinc/39/17/02/1023391702.db2.gz LPTSTPGMXIRCAI-CQSZACIVSA-N 1 1 304.390 3.609 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@@H](C)[C@@H]1C ZINC000112644968 1023816413 /nfs/dbraw/zinc/81/64/13/1023816413.db2.gz ZVHXSIIOIMZUHE-STQMWFEESA-N 1 1 324.446 3.708 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@@H](C)[C@@H]1C ZINC000112644968 1023816416 /nfs/dbraw/zinc/81/64/16/1023816416.db2.gz ZVHXSIIOIMZUHE-STQMWFEESA-N 1 1 324.446 3.708 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)cc1F ZINC000788480117 1023891173 /nfs/dbraw/zinc/89/11/73/1023891173.db2.gz HYAHATRIJXIZLI-OAHLLOKOSA-N 1 1 322.380 3.658 20 5 DHBDMO C[N@@H+](CCc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788477239 1023891874 /nfs/dbraw/zinc/89/18/74/1023891874.db2.gz BTSIMICVLGTNEM-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO Cc1nc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)sc1C ZINC000788485418 1023892670 /nfs/dbraw/zinc/89/26/70/1023892670.db2.gz KLTFKQNCUUPZNK-UHFFFAOYSA-N 1 1 323.393 3.832 20 5 DHBDMO CC(C)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000538790941 1033189429 /nfs/dbraw/zinc/18/94/29/1033189429.db2.gz YPPJWALXJQXRFF-LLVKDONJSA-N 1 1 314.332 3.674 20 5 DHBDMO CCc1ccc([C@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)o1 ZINC000268840947 1024174186 /nfs/dbraw/zinc/17/41/86/1024174186.db2.gz QUTYHJZDCUEHLC-NSHDSACASA-N 1 1 304.346 3.610 20 5 DHBDMO COC1CCC([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000269058711 1024233459 /nfs/dbraw/zinc/23/34/59/1024233459.db2.gz ZGGHEAUGXQHXKT-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCC2(CCOCC2)C1 ZINC000271202107 1024470599 /nfs/dbraw/zinc/47/05/99/1024470599.db2.gz UVMGFBMAHYHZIF-ZZXKWVIFSA-N 1 1 316.401 3.501 20 5 DHBDMO CCC[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000453353451 1024478729 /nfs/dbraw/zinc/47/87/29/1024478729.db2.gz HXTGUJQWPTWRLS-MSOLQXFVSA-N 1 1 318.417 3.939 20 5 DHBDMO COc1cc2c(cc1F)CC[C@@H]2[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000337883671 1033217803 /nfs/dbraw/zinc/21/78/03/1033217803.db2.gz ZZLKFFJZXNEMSB-ZDUSSCGKSA-N 1 1 322.361 3.581 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCC[N@H+]1CCCC[C@@H]1C ZINC000532188091 1024570001 /nfs/dbraw/zinc/57/00/01/1024570001.db2.gz AKRCRWMPHOMCKJ-JKSUJKDBSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC000106876653 1024606408 /nfs/dbraw/zinc/60/64/08/1024606408.db2.gz GPIBDGWUJRTMRG-NSHDSACASA-N 1 1 305.403 3.861 20 5 DHBDMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC000106876653 1024606417 /nfs/dbraw/zinc/60/64/17/1024606417.db2.gz GPIBDGWUJRTMRG-NSHDSACASA-N 1 1 305.403 3.861 20 5 DHBDMO CCn1ccc(C[N@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000792182412 1024643983 /nfs/dbraw/zinc/64/39/83/1024643983.db2.gz DPDGFEMFDBKKAI-UHFFFAOYSA-N 1 1 307.781 3.702 20 5 DHBDMO CCn1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000792182412 1024643988 /nfs/dbraw/zinc/64/39/88/1024643988.db2.gz DPDGFEMFDBKKAI-UHFFFAOYSA-N 1 1 307.781 3.702 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@](C)(F)CC2)c([N+](=O)[O-])c1 ZINC001170330049 1024745481 /nfs/dbraw/zinc/74/54/81/1024745481.db2.gz XGVXQWNYIJANST-DYVFJYSZSA-N 1 1 324.396 3.749 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H](C)CC2)c([N+](=O)[O-])c1 ZINC001170336389 1024747320 /nfs/dbraw/zinc/74/73/20/1024747320.db2.gz XKGRZGGRKRHIIS-KBPBESRZSA-N 1 1 306.406 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H]3CCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001170334437 1024747413 /nfs/dbraw/zinc/74/74/13/1024747413.db2.gz DSLFKUGPLGOYSP-SQWLQELKSA-N 1 1 318.417 3.656 20 5 DHBDMO CC[C@@H]1CCC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170353610 1024751160 /nfs/dbraw/zinc/75/11/60/1024751160.db2.gz ZXYCLSMDARBLAJ-ZIAGYGMSSA-N 1 1 306.406 3.656 20 5 DHBDMO Cc1ccc(C[N@H+]2CCCc3ccccc3CC2)cc1[N+](=O)[O-] ZINC001170342508 1024758135 /nfs/dbraw/zinc/75/81/35/1024758135.db2.gz OLPFYBLJLWTAAS-UHFFFAOYSA-N 1 1 310.397 3.894 20 5 DHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000749685130 1024770039 /nfs/dbraw/zinc/77/00/39/1024770039.db2.gz AZIPDZWNUYWDRU-RRQGHBQHSA-N 1 1 306.406 3.529 20 5 DHBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792865933 1024808671 /nfs/dbraw/zinc/80/86/71/1024808671.db2.gz DLJVZRQJPTZDOZ-AWEZNQCLSA-N 1 1 307.350 3.514 20 5 DHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879192 1024819715 /nfs/dbraw/zinc/81/97/15/1024819715.db2.gz FRBFCSVDLXBYHH-SMDDNHRTSA-N 1 1 307.350 3.514 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCCC1 ZINC000792875140 1024821243 /nfs/dbraw/zinc/82/12/43/1024821243.db2.gz ZLOCYUDLSBZVLM-UHFFFAOYSA-N 1 1 307.350 3.656 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3nccs3)CCCC2)cc1 ZINC000116374088 1024859722 /nfs/dbraw/zinc/85/97/22/1024859722.db2.gz DHCHBLBYUPJTNI-UHFFFAOYSA-N 1 1 303.387 3.610 20 5 DHBDMO CC1(C)CC[C@@H](C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)O1 ZINC001170424648 1024865777 /nfs/dbraw/zinc/86/57/77/1024865777.db2.gz OGIGWHLLLVIHQZ-WBVHZDCISA-N 1 1 318.417 3.732 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000877139849 1033254684 /nfs/dbraw/zinc/25/46/84/1033254684.db2.gz CVCHTNQWDNDPOR-SFHVURJKSA-N 1 1 318.417 3.603 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC000793351211 1025019853 /nfs/dbraw/zinc/01/98/53/1025019853.db2.gz HERMLTBBZBBJCS-ZDUSSCGKSA-N 1 1 307.350 3.514 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000353449758 1025075887 /nfs/dbraw/zinc/07/58/87/1025075887.db2.gz SIYYQVJYHOTUQF-MRXNPFEDSA-N 1 1 322.405 3.623 20 5 DHBDMO CCC[N@H+](Cc1ccc(F)cc1)Cc1cccnc1[N+](=O)[O-] ZINC000885968852 1025421784 /nfs/dbraw/zinc/42/17/84/1025421784.db2.gz BNKBFOSDCZENSY-UHFFFAOYSA-N 1 1 303.337 3.541 20 5 DHBDMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1cccnc1[N+](=O)[O-] ZINC000885968852 1025421790 /nfs/dbraw/zinc/42/17/90/1025421790.db2.gz BNKBFOSDCZENSY-UHFFFAOYSA-N 1 1 303.337 3.541 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC000885983904 1025426044 /nfs/dbraw/zinc/42/60/44/1025426044.db2.gz STQDCJDQSPNIRZ-INIZCTEOSA-N 1 1 311.385 3.760 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCCCC[C@H]1c1ccco1 ZINC000886014704 1025438470 /nfs/dbraw/zinc/43/84/70/1025438470.db2.gz NXGMRWRQOSNOFH-AWEZNQCLSA-N 1 1 301.346 3.700 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000886014704 1025438473 /nfs/dbraw/zinc/43/84/73/1025438473.db2.gz NXGMRWRQOSNOFH-AWEZNQCLSA-N 1 1 301.346 3.700 20 5 DHBDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886014094 1025439092 /nfs/dbraw/zinc/43/90/92/1025439092.db2.gz BWHGTUSGCIDNSU-ZBFHGGJFSA-N 1 1 311.385 3.676 20 5 DHBDMO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1 ZINC000886106680 1025505079 /nfs/dbraw/zinc/50/50/79/1025505079.db2.gz AKSDXBNHDHHPNO-CYBMUJFWSA-N 1 1 315.373 3.628 20 5 DHBDMO CC(C)C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)C ZINC000073181792 1025772502 /nfs/dbraw/zinc/77/25/02/1025772502.db2.gz GTEGMWBGWIHQQI-UHFFFAOYSA-N 1 1 318.377 3.511 20 5 DHBDMO CO[C@@H]1CCC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000076347834 1025864802 /nfs/dbraw/zinc/86/48/02/1025864802.db2.gz KRUDQKLCGHVLPN-MRXNPFEDSA-N 1 1 323.392 3.557 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC(C)(C)[C@@H]1[C@@H]1CCCO1 ZINC000289640445 1026110101 /nfs/dbraw/zinc/11/01/01/1026110101.db2.gz FOLGJPBOHMPOJX-KCXAZCMYSA-N 1 1 304.390 3.545 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000289652353 1026113211 /nfs/dbraw/zinc/11/32/11/1026113211.db2.gz TWFCIOPFHZVQDF-KBRIMQKVSA-N 1 1 316.401 3.689 20 5 DHBDMO COCC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000356785492 1026168400 /nfs/dbraw/zinc/16/84/00/1026168400.db2.gz NQZPOHZMFCYGBR-WFASDCNBSA-N 1 1 304.346 3.616 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000809352614 1026508637 /nfs/dbraw/zinc/50/86/37/1026508637.db2.gz RDEKKXHFGGSGOX-UHFFFAOYSA-N 1 1 322.315 3.640 20 5 DHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000513497556 1026522826 /nfs/dbraw/zinc/52/28/26/1026522826.db2.gz YNUYTRNKMVVISF-AWEZNQCLSA-N 1 1 314.385 3.666 20 5 DHBDMO Cc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cnc1Cl ZINC000809688715 1026594826 /nfs/dbraw/zinc/59/48/26/1026594826.db2.gz OFRTWMWNBAEBCF-UHFFFAOYSA-N 1 1 319.792 3.626 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000809936296 1026643363 /nfs/dbraw/zinc/64/33/63/1026643363.db2.gz VBARGLDSMDXBDA-LLVKDONJSA-N 1 1 319.188 3.512 20 5 DHBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000809936296 1026643369 /nfs/dbraw/zinc/64/33/69/1026643369.db2.gz VBARGLDSMDXBDA-LLVKDONJSA-N 1 1 319.188 3.512 20 5 DHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@@H]2CCCC[C@H]2F)c1 ZINC000419826081 1026764434 /nfs/dbraw/zinc/76/44/34/1026764434.db2.gz WATQISTZYQIMJH-VXGBXAGGSA-N 1 1 318.295 3.567 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000072599968 1026781405 /nfs/dbraw/zinc/78/14/05/1026781405.db2.gz GNEIPZHGBJTYTN-ZBFHGGJFSA-N 1 1 311.385 3.842 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3ncco3)CC2)ccc1Cl ZINC000931444967 1027125505 /nfs/dbraw/zinc/12/55/05/1027125505.db2.gz NHQIEIYBEUBWCK-UHFFFAOYSA-N 1 1 321.764 3.616 20 5 DHBDMO CCc1cc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)on1 ZINC000562415156 1027424097 /nfs/dbraw/zinc/42/40/97/1027424097.db2.gz WQBFHTVYWHULOU-INIZCTEOSA-N 1 1 315.373 3.657 20 5 DHBDMO CO[C@@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1(C)C ZINC000295976627 1027509369 /nfs/dbraw/zinc/50/93/69/1027509369.db2.gz KTZUACCISLNTRM-CZUORRHYSA-N 1 1 306.406 3.711 20 5 DHBDMO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000575929988 1027530029 /nfs/dbraw/zinc/53/00/29/1027530029.db2.gz YMEFHKYIYGIGSG-SUMWQHHRSA-N 1 1 314.385 3.986 20 5 DHBDMO CS[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000296321233 1027604855 /nfs/dbraw/zinc/60/48/55/1027604855.db2.gz OTLZRUJHYZAQQE-LLVKDONJSA-N 1 1 320.336 3.551 20 5 DHBDMO CS[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000296321233 1027604863 /nfs/dbraw/zinc/60/48/63/1027604863.db2.gz OTLZRUJHYZAQQE-LLVKDONJSA-N 1 1 320.336 3.551 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H](C3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000933089325 1027673984 /nfs/dbraw/zinc/67/39/84/1027673984.db2.gz QTGQHRZYLMDPLD-KRWDZBQOSA-N 1 1 318.417 3.542 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000577096650 1027706829 /nfs/dbraw/zinc/70/68/29/1027706829.db2.gz FDBOSUSZEWCRAA-GJZGRUSLSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000577096650 1027706841 /nfs/dbraw/zinc/70/68/41/1027706841.db2.gz FDBOSUSZEWCRAA-GJZGRUSLSA-N 1 1 307.438 3.674 20 5 DHBDMO Cc1cc([C@H]2CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)[nH]n1 ZINC000364017067 1027795882 /nfs/dbraw/zinc/79/58/82/1027795882.db2.gz ZFTSMRXURVFKBI-ZFWWWQNUSA-N 1 1 314.389 3.567 20 5 DHBDMO Cc1cc([C@H]2CCC[N@@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n[nH]1 ZINC000364017067 1027795895 /nfs/dbraw/zinc/79/58/95/1027795895.db2.gz ZFTSMRXURVFKBI-ZFWWWQNUSA-N 1 1 314.389 3.567 20 5 DHBDMO Cc1cc([C@H]2CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n[nH]1 ZINC000364017067 1027795908 /nfs/dbraw/zinc/79/59/08/1027795908.db2.gz ZFTSMRXURVFKBI-ZFWWWQNUSA-N 1 1 314.389 3.567 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000563656638 1028149863 /nfs/dbraw/zinc/14/98/63/1028149863.db2.gz NTGFRWDHSIVWFG-HIFRSBDPSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000563656638 1028149870 /nfs/dbraw/zinc/14/98/70/1028149870.db2.gz NTGFRWDHSIVWFG-HIFRSBDPSA-N 1 1 307.438 3.674 20 5 DHBDMO OC[C@H]1[C@@H]2C[N@@H+](Cc3c4ccccc4cc4ccccc43)C[C@H]12 ZINC000367840597 1028247236 /nfs/dbraw/zinc/24/72/36/1028247236.db2.gz QUHDGYDJFWQHQC-AERCQKQUSA-N 1 1 303.405 3.663 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000368612167 1028386299 /nfs/dbraw/zinc/38/62/99/1028386299.db2.gz IFNQOFQYZLIGGG-GOEBONIOSA-N 1 1 311.385 3.615 20 5 DHBDMO Cc1cnc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)s1 ZINC000579667324 1028463232 /nfs/dbraw/zinc/46/32/32/1028463232.db2.gz DRALYXKOVJFXMS-AWEZNQCLSA-N 1 1 317.414 3.872 20 5 DHBDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000009902461 1028523322 /nfs/dbraw/zinc/52/33/22/1028523322.db2.gz ZMALESNVUFBESL-SFHVURJKSA-N 1 1 312.369 3.941 20 5 DHBDMO CC[C@@H](CO)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449375561 1028586020 /nfs/dbraw/zinc/58/60/20/1028586020.db2.gz HPSVZYNPAUUUCB-ZDUSSCGKSA-N 1 1 320.414 3.526 20 5 DHBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000449492140 1028687472 /nfs/dbraw/zinc/68/74/72/1028687472.db2.gz IOFVRKLUMTYNRU-RDTXWAMCSA-N 1 1 320.433 3.965 20 5 DHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)(C)C ZINC000566248088 1028691666 /nfs/dbraw/zinc/69/16/66/1028691666.db2.gz LQNWHUTUJRHWQH-UHFFFAOYSA-N 1 1 305.403 3.949 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C/C=C/c3ccncc3)C2)cc1 ZINC000449496270 1028709876 /nfs/dbraw/zinc/70/98/76/1028709876.db2.gz GLONTQKYXYMCKX-ZDBPOJEVSA-N 1 1 323.396 3.883 20 5 DHBDMO CO[C@H]1CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1(C)C ZINC000449499312 1028713846 /nfs/dbraw/zinc/71/38/46/1028713846.db2.gz LSXYFOSUFVJAKU-QXSWTLKVSA-N 1 1 318.417 3.745 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccncc3F)C2)cc1 ZINC000449499154 1028714034 /nfs/dbraw/zinc/71/40/34/1028714034.db2.gz LOVPWAIYFZUSDT-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCOCC1 ZINC000077323259 1028825108 /nfs/dbraw/zinc/82/51/08/1028825108.db2.gz RSIMDXVXYKROFR-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000817280657 1029109030 /nfs/dbraw/zinc/10/90/30/1029109030.db2.gz CDELQCRWHWTIDF-JTQLQIEISA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000817280657 1029109038 /nfs/dbraw/zinc/10/90/38/1029109038.db2.gz CDELQCRWHWTIDF-JTQLQIEISA-N 1 1 320.286 3.898 20 5 DHBDMO C[C@H](Cc1ccsc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000570551390 1029382905 /nfs/dbraw/zinc/38/29/05/1029382905.db2.gz AHNFAOYZCGNEKB-CYBMUJFWSA-N 1 1 304.415 3.762 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CC[C@H]3CCCCO3)C2)cc1 ZINC000451543118 1029906501 /nfs/dbraw/zinc/90/65/01/1029906501.db2.gz AWXCCVSRQMNJQW-FUHWJXTLSA-N 1 1 318.417 3.733 20 5 DHBDMO CCOC1CC(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000451544108 1029906561 /nfs/dbraw/zinc/90/65/61/1029906561.db2.gz DSELMILMJLBGTG-HQVVEAJESA-N 1 1 318.417 3.589 20 5 DHBDMO C[C@H](NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467839110 1029976098 /nfs/dbraw/zinc/97/60/98/1029976098.db2.gz MXKNJYRWWLRGKE-CABCVRRESA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@H]([NH2+]CC(C)(C)N1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000467839110 1029976113 /nfs/dbraw/zinc/97/61/13/1029976113.db2.gz MXKNJYRWWLRGKE-CABCVRRESA-N 1 1 319.449 3.756 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCOCC3(CCCC3)C2)cc1Cl ZINC000783678007 1030020903 /nfs/dbraw/zinc/02/09/03/1030020903.db2.gz AKFWAYBUMUHDTP-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCOCC3(CCCC3)C2)cc1Cl ZINC000783678007 1030020918 /nfs/dbraw/zinc/02/09/18/1030020918.db2.gz AKFWAYBUMUHDTP-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C12CCC2 ZINC000357792868 1030193540 /nfs/dbraw/zinc/19/35/40/1030193540.db2.gz OJPYPDQCIMLTTA-HZPDHXFCSA-N 1 1 322.380 3.513 20 5 DHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C12CCC2 ZINC000357792868 1030193548 /nfs/dbraw/zinc/19/35/48/1030193548.db2.gz OJPYPDQCIMLTTA-HZPDHXFCSA-N 1 1 322.380 3.513 20 5 DHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)C12CCC2 ZINC000357793198 1030193700 /nfs/dbraw/zinc/19/37/00/1030193700.db2.gz GRJAFCZXXGBMFT-IRXDYDNUSA-N 1 1 318.417 3.683 20 5 DHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)C12CCC2 ZINC000357793202 1030193728 /nfs/dbraw/zinc/19/37/28/1030193728.db2.gz GRJAFCZXXGBMFT-SJORKVTESA-N 1 1 318.417 3.683 20 5 DHBDMO C[C@@H](NCc1ccccc1[N+](=O)[O-])c1cccc(C[NH+](C)C)c1 ZINC000925308061 1030341413 /nfs/dbraw/zinc/34/14/13/1030341413.db2.gz AOQLDILMGCXCMG-CQSZACIVSA-N 1 1 313.401 3.507 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H](C)c2ccncc2Cl)cc1[N+](=O)[O-] ZINC000866540187 1030360564 /nfs/dbraw/zinc/36/05/64/1030360564.db2.gz KPIKHHKEZPAMBA-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO CC[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1cccc(OC)n1 ZINC000925693139 1030455322 /nfs/dbraw/zinc/45/53/22/1030455322.db2.gz OOWLJBFNTCKOJI-TZMCWYRMSA-N 1 1 315.373 3.800 20 5 DHBDMO CC(C)([NH2+]Cc1ccnc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000824172928 1030492977 /nfs/dbraw/zinc/49/29/77/1030492977.db2.gz UQKPKYINCDWYLF-UHFFFAOYSA-N 1 1 323.755 3.807 20 5 DHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000291522536 1030532269 /nfs/dbraw/zinc/53/22/69/1030532269.db2.gz JIDTYSHGHRFFDL-DYLHUKMJSA-N 1 1 318.417 3.888 20 5 DHBDMO CCc1ncc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])s1 ZINC000291779546 1030638579 /nfs/dbraw/zinc/63/85/79/1030638579.db2.gz USQLHRAQXWGNFU-UHFFFAOYSA-N 1 1 305.403 3.639 20 5 DHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)C2CC2)cc1OC ZINC000359587584 1031046092 /nfs/dbraw/zinc/04/60/92/1031046092.db2.gz FJMQAILPMXFFAL-LBPRGKRZSA-N 1 1 322.405 3.623 20 5 DHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C2CC2)cc1OC ZINC000359587584 1031046107 /nfs/dbraw/zinc/04/61/07/1031046107.db2.gz FJMQAILPMXFFAL-LBPRGKRZSA-N 1 1 322.405 3.623 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000359632298 1031072369 /nfs/dbraw/zinc/07/23/69/1031072369.db2.gz BBTSUQTVKSPHGV-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO COCCCCc1ccc[nH+]c1NCc1cccc([N+](=O)[O-])c1 ZINC000292618368 1031101019 /nfs/dbraw/zinc/10/10/19/1031101019.db2.gz RRBJUNRCNCMJRZ-UHFFFAOYSA-N 1 1 315.373 3.571 20 5 DHBDMO CC1(C)CC[C@@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)O1 ZINC000360124916 1031285076 /nfs/dbraw/zinc/28/50/76/1031285076.db2.gz VMEDRXNXRUYJCD-INIZCTEOSA-N 1 1 304.390 3.517 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccc(CF)cc1)C2 ZINC000777713423 1031400391 /nfs/dbraw/zinc/40/03/91/1031400391.db2.gz IXXBEKWBAQIBPT-UHFFFAOYSA-N 1 1 300.333 3.623 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccc(CF)cc1)C2 ZINC000777713423 1031400402 /nfs/dbraw/zinc/40/04/02/1031400402.db2.gz IXXBEKWBAQIBPT-UHFFFAOYSA-N 1 1 300.333 3.623 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1F ZINC000872022333 1031405205 /nfs/dbraw/zinc/40/52/05/1031405205.db2.gz XLZHOWKBBYSMKB-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO C[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052963 1031440879 /nfs/dbraw/zinc/44/08/79/1031440879.db2.gz UQBOBXREXPKPET-PIGZYNQJSA-N 1 1 315.348 3.931 20 5 DHBDMO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052960 1031441269 /nfs/dbraw/zinc/44/12/69/1031441269.db2.gz UQBOBXREXPKPET-APPDUMDISA-N 1 1 315.348 3.931 20 5 DHBDMO Cc1c(C[NH2+][C@@H](C)c2cc(O)ccc2F)cccc1[N+](=O)[O-] ZINC000872066429 1031460615 /nfs/dbraw/zinc/46/06/15/1031460615.db2.gz NCTAXLYRVGIOFU-NSHDSACASA-N 1 1 304.321 3.599 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872276902 1031573018 /nfs/dbraw/zinc/57/30/18/1031573018.db2.gz UCFMFSKICSDRQA-MRXNPFEDSA-N 1 1 322.380 3.658 20 5 DHBDMO CCC[C@H](NCC[N@@H+](CC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000360922292 1031625579 /nfs/dbraw/zinc/62/55/79/1031625579.db2.gz NOAZJFWGTNFNOG-KRWDZBQOSA-N 1 1 307.438 3.756 20 5 DHBDMO CCC[C@H]([NH2+]CCN(CC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000360922292 1031625584 /nfs/dbraw/zinc/62/55/84/1031625584.db2.gz NOAZJFWGTNFNOG-KRWDZBQOSA-N 1 1 307.438 3.756 20 5 DHBDMO COc1cc(NCCCC[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000360972735 1031651431 /nfs/dbraw/zinc/65/14/31/1031651431.db2.gz CRQDFVFOQJOKFA-CQSZACIVSA-N 1 1 321.421 3.527 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000873079542 1031705367 /nfs/dbraw/zinc/70/53/67/1031705367.db2.gz HJUQUKXDSRCGJX-UHFFFAOYSA-N 1 1 317.414 3.835 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000361558311 1031987887 /nfs/dbraw/zinc/98/78/87/1031987887.db2.gz GVDPYMSODXKMEH-ZDUSSCGKSA-N 1 1 324.380 3.909 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000361558311 1031987898 /nfs/dbraw/zinc/98/78/98/1031987898.db2.gz GVDPYMSODXKMEH-ZDUSSCGKSA-N 1 1 324.380 3.909 20 5 DHBDMO C[N@@H+](Cc1ccccc1)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777950054 1032011311 /nfs/dbraw/zinc/01/13/11/1032011311.db2.gz FGQDEPABYCBTLA-UHFFFAOYSA-N 1 1 322.368 3.548 20 5 DHBDMO C[N@H+](Cc1ccccc1)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777950054 1032011328 /nfs/dbraw/zinc/01/13/28/1032011328.db2.gz FGQDEPABYCBTLA-UHFFFAOYSA-N 1 1 322.368 3.548 20 5 DHBDMO C[C@H]1CC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1(F)F ZINC001172903264 1033437070 /nfs/dbraw/zinc/43/70/70/1033437070.db2.gz GEQHNGUOLLJWRO-WFASDCNBSA-N 1 1 324.371 3.819 20 5 DHBDMO C[C@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1(F)F ZINC001172903264 1033437076 /nfs/dbraw/zinc/43/70/76/1033437076.db2.gz GEQHNGUOLLJWRO-WFASDCNBSA-N 1 1 324.371 3.819 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCCC[C@@H](F)C1)CC2 ZINC001172907128 1033440503 /nfs/dbraw/zinc/44/05/03/1033440503.db2.gz DIJVDOPQBFAKEO-CVEARBPZSA-N 1 1 306.381 3.666 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@@H](F)CC1)CC2 ZINC001172907093 1033440829 /nfs/dbraw/zinc/44/08/29/1033440829.db2.gz CVZOVIHBJDQWJZ-CVEARBPZSA-N 1 1 306.381 3.666 20 5 DHBDMO C[C@@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172914828 1033464660 /nfs/dbraw/zinc/46/46/60/1033464660.db2.gz JOCQUUTUIOCQJG-CPUCHLNUSA-N 1 1 302.418 3.963 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2C[C@H](C)CC23CC3)c1F ZINC001173191696 1033583448 /nfs/dbraw/zinc/58/34/48/1033583448.db2.gz GKMQIBXHCYOWRE-NEPJUHHUSA-N 1 1 322.380 3.548 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC2(CCCCC2)C1 ZINC001173231386 1033605142 /nfs/dbraw/zinc/60/51/42/1033605142.db2.gz BYJCYMIIEDHRPR-OAHLLOKOSA-N 1 1 318.417 3.561 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](C)C(F)(F)CC1 ZINC001173229517 1033606376 /nfs/dbraw/zinc/60/63/76/1033606376.db2.gz VGRYZWUBFFYMPI-STQMWFEESA-N 1 1 312.360 3.893 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2cc(F)ccc2C1 ZINC001173232636 1033608489 /nfs/dbraw/zinc/60/84/89/1033608489.db2.gz SBBKIPKWXXADAJ-ZDUSSCGKSA-N 1 1 314.360 3.723 20 5 DHBDMO C[C@@H](Nc1c(F)cccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000553184239 1033623438 /nfs/dbraw/zinc/62/34/38/1033623438.db2.gz ADWKBELWAFWDBU-OLZOCXBDSA-N 1 1 321.396 3.799 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C1CCC1)C1CCOCC1 ZINC001173238516 1033648072 /nfs/dbraw/zinc/64/80/72/1033648072.db2.gz UPJOXJXSDYUEHV-CQSZACIVSA-N 1 1 318.417 3.559 20 5 DHBDMO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000880001435 1034176841 /nfs/dbraw/zinc/17/68/41/1034176841.db2.gz UYWBTXNEGMRPNY-GFCCVEGCSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000880001435 1034176849 /nfs/dbraw/zinc/17/68/49/1034176849.db2.gz UYWBTXNEGMRPNY-GFCCVEGCSA-N 1 1 306.259 3.508 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@H]2CCC(C)(C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000794687592 1034364785 /nfs/dbraw/zinc/36/47/85/1034364785.db2.gz VZTHXDQNHYPLFD-AWEZNQCLSA-N 1 1 316.405 3.721 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(Cl)nc1 ZINC000183251688 1034366477 /nfs/dbraw/zinc/36/64/77/1034366477.db2.gz PBABQXKFDAYIJS-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000183251688 1034366490 /nfs/dbraw/zinc/36/64/90/1034366490.db2.gz PBABQXKFDAYIJS-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO CCC[C@H]([NH2+][C@H](CCO)c1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000186537966 1034642138 /nfs/dbraw/zinc/64/21/38/1034642138.db2.gz ZQJWUSSZBKQZPE-JKSUJKDBSA-N 1 1 318.373 3.742 20 5 DHBDMO CCC[C@@H]([NH2+][C@@H](CCO)c1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000186537950 1034642477 /nfs/dbraw/zinc/64/24/77/1034642477.db2.gz ZQJWUSSZBKQZPE-CVEARBPZSA-N 1 1 318.373 3.742 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@@H]4C3)o2)c(Cl)c1 ZINC000600189164 1034790218 /nfs/dbraw/zinc/79/02/18/1034790218.db2.gz CSAPVGQQRFQDCB-PHIMTYICSA-N 1 1 318.760 3.960 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(Cn2c[nH+]c3c2CCCC3)o1 ZINC000600179842 1034792434 /nfs/dbraw/zinc/79/24/34/1034792434.db2.gz ZHOUJNLDSGESSJ-UHFFFAOYSA-N 1 1 323.352 3.978 20 5 DHBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481578599 1034890878 /nfs/dbraw/zinc/89/08/78/1034890878.db2.gz UVMNCBODKINXCG-FZKCQIBNSA-N 1 1 319.449 3.612 20 5 DHBDMO C[C@@H](CN1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481578599 1034890885 /nfs/dbraw/zinc/89/08/85/1034890885.db2.gz UVMNCBODKINXCG-FZKCQIBNSA-N 1 1 319.449 3.612 20 5 DHBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000482685742 1035161613 /nfs/dbraw/zinc/16/16/13/1035161613.db2.gz YVBAHYDIFBWDQA-CYBMUJFWSA-N 1 1 324.384 3.973 20 5 DHBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000482685742 1035161618 /nfs/dbraw/zinc/16/16/18/1035161618.db2.gz YVBAHYDIFBWDQA-CYBMUJFWSA-N 1 1 324.384 3.973 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000483115570 1035228593 /nfs/dbraw/zinc/22/85/93/1035228593.db2.gz YMMNMHAYUIIOIS-ZDUSSCGKSA-N 1 1 318.323 3.863 20 5 DHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000483240989 1035243927 /nfs/dbraw/zinc/24/39/27/1035243927.db2.gz VEOMAXCWZVRABO-GFCCVEGCSA-N 1 1 317.389 3.994 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCSCC[C@H]1C ZINC000483424815 1035268941 /nfs/dbraw/zinc/26/89/41/1035268941.db2.gz GEYUGRNJRNYPMM-QLKUMGTLSA-N 1 1 306.431 3.826 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1C[C@@H](C2CC2)C[C@H]1C1CC1 ZINC001176650342 1035314710 /nfs/dbraw/zinc/31/47/10/1035314710.db2.gz QOAIPLJKCARTKK-GUYCJALGSA-N 1 1 304.365 3.744 20 5 DHBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535560996 1035687964 /nfs/dbraw/zinc/68/79/64/1035687964.db2.gz XDQVQLDQKGKLBN-INIZCTEOSA-N 1 1 315.373 3.870 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494699985 1035777246 /nfs/dbraw/zinc/77/72/46/1035777246.db2.gz AJCNDYSZYSLEOI-DZGCQCFKSA-N 1 1 304.390 3.547 20 5 DHBDMO COc1cc(CNc2cccc3cc[nH+]cc32)ccc1[N+](=O)[O-] ZINC000539802863 1035865920 /nfs/dbraw/zinc/86/59/20/1035865920.db2.gz ZYBASKVCPKMZFG-UHFFFAOYSA-N 1 1 309.325 3.764 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCc2ccccc2CC1 ZINC001194400956 1035920147 /nfs/dbraw/zinc/92/01/47/1035920147.db2.gz NVOLPLWVQVKRNH-UHFFFAOYSA-N 1 1 314.360 3.725 20 5 DHBDMO CS[C@@H]1CCCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000539900454 1035926762 /nfs/dbraw/zinc/92/67/62/1035926762.db2.gz SUOTXMLDHFUHAT-PMGBHYCQSA-N 1 1 306.431 3.826 20 5 DHBDMO CC[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C(C)(C)C ZINC001194656544 1035979186 /nfs/dbraw/zinc/97/91/86/1035979186.db2.gz SVUOIUJWFSWHJY-UHFFFAOYSA-N 1 1 315.211 3.978 20 5 DHBDMO CC[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C(C)(C)C ZINC001194656544 1035979189 /nfs/dbraw/zinc/97/91/89/1035979189.db2.gz SVUOIUJWFSWHJY-UHFFFAOYSA-N 1 1 315.211 3.978 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000494819096 1036048184 /nfs/dbraw/zinc/04/81/84/1036048184.db2.gz AEBVQPZYTGZZNS-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000152936092 1036117654 /nfs/dbraw/zinc/11/76/54/1036117654.db2.gz MOHUERKCJAGWAW-INIZCTEOSA-N 1 1 304.390 3.518 20 5 DHBDMO CCOc1cc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC001195509682 1036259920 /nfs/dbraw/zinc/25/99/20/1036259920.db2.gz ZBLUEXKGGKHDQS-GJZGRUSLSA-N 1 1 304.390 3.758 20 5 DHBDMO CCSc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)ccn1 ZINC000495173602 1036316290 /nfs/dbraw/zinc/31/62/90/1036316290.db2.gz KQSKWEUCWUZZGU-UHFFFAOYSA-N 1 1 321.377 3.531 20 5 DHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)C[C@H]1CCCCO1 ZINC000541773700 1036429354 /nfs/dbraw/zinc/42/93/54/1036429354.db2.gz JIECYZXGXATJST-QGZVFWFLSA-N 1 1 306.406 3.684 20 5 DHBDMO Cc1ccccc1CC1C[NH+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001182990147 1036497325 /nfs/dbraw/zinc/49/73/25/1036497325.db2.gz OSTMDRXJBCULRJ-UHFFFAOYSA-N 1 1 314.360 3.717 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 ZINC000774603422 1036546727 /nfs/dbraw/zinc/54/67/27/1036546727.db2.gz SLYVOXAGFVDFOW-VXGBXAGGSA-N 1 1 315.329 3.915 20 5 DHBDMO C/C=C\C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001196606746 1036570835 /nfs/dbraw/zinc/57/08/35/1036570835.db2.gz WOEHUBWSFRODOM-NQHOJNORSA-N 1 1 304.390 3.782 20 5 DHBDMO CC(C)c1ccc(C[N@@H+]2CC[C@@H](C)C[C@H]2[C@@H](C)O)cc1[N+](=O)[O-] ZINC000443774515 1036580618 /nfs/dbraw/zinc/58/06/18/1036580618.db2.gz AHNMELZSDZIONO-CPUCHLNUSA-N 1 1 320.433 3.700 20 5 DHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000774625271 1036584398 /nfs/dbraw/zinc/58/43/98/1036584398.db2.gz OIEITSTXHLNXRQ-SUMWQHHRSA-N 1 1 314.389 3.536 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC001183371855 1036584918 /nfs/dbraw/zinc/58/49/18/1036584918.db2.gz UVFWYIRPVLUDSM-VFGVELGVSA-N 1 1 318.442 3.683 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCOc1ccccc1F ZINC000487680494 1036707792 /nfs/dbraw/zinc/70/77/92/1036707792.db2.gz UAWZJMNNFVNYOA-CYBMUJFWSA-N 1 1 318.348 3.806 20 5 DHBDMO CC(C)(C)[C@@H]1CSCC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001197295087 1036744109 /nfs/dbraw/zinc/74/41/09/1036744109.db2.gz CYUZQCLEPYKAEY-AWEZNQCLSA-N 1 1 312.410 3.697 20 5 DHBDMO CC(C)(C)[C@@H]1CSCC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001197295087 1036744127 /nfs/dbraw/zinc/74/41/27/1036744127.db2.gz CYUZQCLEPYKAEY-AWEZNQCLSA-N 1 1 312.410 3.697 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2C2CCC2)ccc1[N+](=O)[O-] ZINC000492391734 1036859331 /nfs/dbraw/zinc/85/93/31/1036859331.db2.gz AOWWTTWHZMUTAH-OAHLLOKOSA-N 1 1 304.390 3.758 20 5 DHBDMO CCOc1cc(C[N@H+](C)Cc2ccoc2C)ccc1[N+](=O)[O-] ZINC000492464916 1036881038 /nfs/dbraw/zinc/88/10/38/1036881038.db2.gz VDAMRCRKVQZCQY-UHFFFAOYSA-N 1 1 304.346 3.527 20 5 DHBDMO CCOc1cc(C[N@@H+](C)Cc2ccoc2C)ccc1[N+](=O)[O-] ZINC000492464916 1036881061 /nfs/dbraw/zinc/88/10/61/1036881061.db2.gz VDAMRCRKVQZCQY-UHFFFAOYSA-N 1 1 304.346 3.527 20 5 DHBDMO CCCC[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000488184544 1036894186 /nfs/dbraw/zinc/89/41/86/1036894186.db2.gz ZGHVEYKAAGPRTG-UHFFFAOYSA-N 1 1 319.327 3.757 20 5 DHBDMO Cc1nc(C)c(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000313191807 1036974627 /nfs/dbraw/zinc/97/46/27/1036974627.db2.gz MHWLBEIHQJVSJZ-UHFFFAOYSA-N 1 1 311.794 3.611 20 5 DHBDMO C[N@H+](Cc1cc2ccc(F)cc2[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC000488358732 1036979552 /nfs/dbraw/zinc/97/95/52/1036979552.db2.gz YEBGLNQKOGWYBM-UHFFFAOYSA-N 1 1 313.332 3.847 20 5 DHBDMO C[N@@H+](Cc1cc2ccc(F)cc2[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC000488358732 1036979566 /nfs/dbraw/zinc/97/95/66/1036979566.db2.gz YEBGLNQKOGWYBM-UHFFFAOYSA-N 1 1 313.332 3.847 20 5 DHBDMO CCC(CC)C[N@@H+](CC)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000488509805 1037052509 /nfs/dbraw/zinc/05/25/09/1037052509.db2.gz BBOQXYORJAELMI-CYBMUJFWSA-N 1 1 321.421 3.680 20 5 DHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC=CC23CCCCC3)cc1 ZINC001198801830 1037139165 /nfs/dbraw/zinc/13/91/65/1037139165.db2.gz XPMHQRVIBGXBRE-UHFFFAOYSA-N 1 1 316.401 3.938 20 5 DHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774876769 1037141936 /nfs/dbraw/zinc/14/19/36/1037141936.db2.gz RXOKICIIRSGAHP-AWEZNQCLSA-N 1 1 307.350 3.514 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000153741278 1037218275 /nfs/dbraw/zinc/21/82/75/1037218275.db2.gz OGVIVYYEYMFGSL-LSDHHAIUSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCN(C2CCCC2)C1 ZINC000153741278 1037218290 /nfs/dbraw/zinc/21/82/90/1037218290.db2.gz OGVIVYYEYMFGSL-LSDHHAIUSA-N 1 1 317.433 3.571 20 5 DHBDMO CCC(=O)c1ccc(Nc2ccc3[nH+]ccn3c2)c([N+](=O)[O-])c1 ZINC001187117059 1037566125 /nfs/dbraw/zinc/56/61/25/1037566125.db2.gz UCHREXIHKYGLTE-UHFFFAOYSA-N 1 1 310.313 3.579 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CCCC3)C2)c([N+](=O)[O-])c1 ZINC000775098002 1037591279 /nfs/dbraw/zinc/59/12/79/1037591279.db2.gz NOHUFIPNHYZLKM-UHFFFAOYSA-N 1 1 319.361 3.659 20 5 DHBDMO COc1cc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000490093170 1037613667 /nfs/dbraw/zinc/61/36/67/1037613667.db2.gz XMDHOOOMNOHTDF-SNPRPXQTSA-N 1 1 304.390 3.756 20 5 DHBDMO C[C@H](CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000301147271 1037742142 /nfs/dbraw/zinc/74/21/42/1037742142.db2.gz HHAUZYNRPJDPSU-SECBINFHSA-N 1 1 317.311 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c(F)c1 ZINC000491075833 1037897258 /nfs/dbraw/zinc/89/72/58/1037897258.db2.gz ILNJMYOMGTZHGM-ZDUSSCGKSA-N 1 1 318.323 3.863 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])Cc2ccccc21 ZINC000917040915 1038122682 /nfs/dbraw/zinc/12/26/82/1038122682.db2.gz XTYBVIHDRWSTSD-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])Cc2ccccc21 ZINC000917040915 1038122687 /nfs/dbraw/zinc/12/26/87/1038122687.db2.gz XTYBVIHDRWSTSD-GFCCVEGCSA-N 1 1 300.333 3.853 20 5 DHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccsc1 ZINC000055899638 1038280769 /nfs/dbraw/zinc/28/07/69/1038280769.db2.gz QVQCJAAHPAKILZ-UHFFFAOYSA-N 1 1 306.387 3.557 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1nccn1CC(C)C ZINC000164801937 1038306623 /nfs/dbraw/zinc/30/66/23/1038306623.db2.gz RXCLCBWLZGWNJI-CQSZACIVSA-N 1 1 316.405 3.607 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000588977872 1038414450 /nfs/dbraw/zinc/41/44/50/1038414450.db2.gz BKKNMMPKGNHAAP-OAHLLOKOSA-N 1 1 304.390 3.616 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nccc2ccccc21 ZINC000589184922 1038445741 /nfs/dbraw/zinc/44/57/41/1038445741.db2.gz AHDBEARMGJXHNS-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO Cc1cc(N2CCC(C[N@H+](C)C(C)C)CC2)c(F)cc1[N+](=O)[O-] ZINC000589686029 1038532089 /nfs/dbraw/zinc/53/20/89/1038532089.db2.gz PWCWPNLAUSMCRP-UHFFFAOYSA-N 1 1 323.412 3.599 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC12CCCCC2 ZINC001192291616 1038622783 /nfs/dbraw/zinc/62/27/83/1038622783.db2.gz FKHTYLVEVJVGNK-UHFFFAOYSA-N 1 1 304.390 3.902 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000590601796 1038675270 /nfs/dbraw/zinc/67/52/70/1038675270.db2.gz QMHUTOLJWFFCFN-LSDHHAIUSA-N 1 1 311.385 3.930 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CC(C(F)F)C2)o1 ZINC000590968819 1038732972 /nfs/dbraw/zinc/73/29/72/1038732972.db2.gz UFGRPXJXTFIVHS-UHFFFAOYSA-N 1 1 308.284 3.552 20 5 DHBDMO Cc1c(C[NH2+][C@H]2CCCc3scnc32)cccc1[N+](=O)[O-] ZINC000599045040 1039003007 /nfs/dbraw/zinc/00/30/07/1039003007.db2.gz SYRATQQEMRNZAQ-LBPRGKRZSA-N 1 1 303.387 3.527 20 5 DHBDMO C[C@@H](NC[C@H]1CC[N@@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599065723 1039023754 /nfs/dbraw/zinc/02/37/54/1039023754.db2.gz PWZYYUYQJMSBEL-RDTXWAMCSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@@H](NC[C@H]1CC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599065723 1039023772 /nfs/dbraw/zinc/02/37/72/1039023772.db2.gz PWZYYUYQJMSBEL-RDTXWAMCSA-N 1 1 317.433 3.652 20 5 DHBDMO Cc1c([C@H](C)NC[C@H]2CC[N@@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000599074721 1039030197 /nfs/dbraw/zinc/03/01/97/1039030197.db2.gz VULMAWYWUKUFDO-GOEBONIOSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c([C@H](C)NC[C@H]2CC[N@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000599074721 1039030217 /nfs/dbraw/zinc/03/02/17/1039030217.db2.gz VULMAWYWUKUFDO-GOEBONIOSA-N 1 1 317.433 3.571 20 5 DHBDMO CC(C)=CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130326 1039124106 /nfs/dbraw/zinc/12/41/06/1039124106.db2.gz BWXWVTNLBSGGJV-QAQDUYKDSA-N 1 1 318.417 3.667 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000592140178 1039133683 /nfs/dbraw/zinc/13/36/83/1039133683.db2.gz NNLOFPASFWHBQZ-HOCLYGCPSA-N 1 1 311.385 3.849 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3cccc(F)c3)CCC2)cs1 ZINC000592145766 1039145288 /nfs/dbraw/zinc/14/52/88/1039145288.db2.gz ZQYBDLGQNYPCLW-UHFFFAOYSA-N 1 1 306.362 3.964 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592183148 1039162306 /nfs/dbraw/zinc/16/23/06/1039162306.db2.gz RURKPMQXSBNOEL-UONOGXRCSA-N 1 1 304.390 3.547 20 5 DHBDMO Cc1cccc(OCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000603842066 1039177645 /nfs/dbraw/zinc/17/76/45/1039177645.db2.gz DVUIPTZMDAZGBE-UHFFFAOYSA-N 1 1 314.385 3.722 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000592193764 1039184356 /nfs/dbraw/zinc/18/43/56/1039184356.db2.gz NDLAOFYQAUATIN-KGLIPLIRSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC000592193764 1039184362 /nfs/dbraw/zinc/18/43/62/1039184362.db2.gz NDLAOFYQAUATIN-KGLIPLIRSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000592193765 1039185010 /nfs/dbraw/zinc/18/50/10/1039185010.db2.gz NDLAOFYQAUATIN-UONOGXRCSA-N 1 1 304.390 3.689 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC000592193765 1039185018 /nfs/dbraw/zinc/18/50/18/1039185018.db2.gz NDLAOFYQAUATIN-UONOGXRCSA-N 1 1 304.390 3.689 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC(F)(F)CC2)c(Cl)c1 ZINC000599552026 1039209994 /nfs/dbraw/zinc/20/99/94/1039209994.db2.gz CTKKQXOSBQISRY-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC(F)(F)CC2)c(Cl)c1 ZINC000599552026 1039210005 /nfs/dbraw/zinc/21/00/05/1039210005.db2.gz CTKKQXOSBQISRY-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCc2c(O)cccc2C1 ZINC000599645880 1039245458 /nfs/dbraw/zinc/24/54/58/1039245458.db2.gz HCBWMPJXOGFGMT-CYBMUJFWSA-N 1 1 312.369 3.728 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCc2c(O)cccc2C1 ZINC000599645880 1039245475 /nfs/dbraw/zinc/24/54/75/1039245475.db2.gz HCBWMPJXOGFGMT-CYBMUJFWSA-N 1 1 312.369 3.728 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000604013226 1039282439 /nfs/dbraw/zinc/28/24/39/1039282439.db2.gz TXWXRJSSYAGGLA-KRWDZBQOSA-N 1 1 304.390 3.628 20 5 DHBDMO C[C@H]([NH2+][C@H](CCO)c1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000592404266 1039446888 /nfs/dbraw/zinc/44/68/88/1039446888.db2.gz WMZXGFRHCKWQIB-YVEFUNNKSA-N 1 1 318.348 3.508 20 5 DHBDMO Cc1cccnc1[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])C(C)C ZINC000172349663 1039812357 /nfs/dbraw/zinc/81/23/57/1039812357.db2.gz IPWIEZIWNJBWGR-MRXNPFEDSA-N 1 1 317.364 3.924 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3ccc(O)cc32)c(Cl)c1 ZINC000594978405 1039947828 /nfs/dbraw/zinc/94/78/28/1039947828.db2.gz AWLPUZFFVSUFRJ-INIZCTEOSA-N 1 1 318.760 3.731 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1sc(C)nc1C ZINC000595029364 1040036579 /nfs/dbraw/zinc/03/65/79/1040036579.db2.gz XKOVMTKVQIMBRS-VIFPVBQESA-N 1 1 321.402 3.528 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@H](c3ccccc3C)C[C@H]2C)c1[N+](=O)[O-] ZINC000595323574 1040108229 /nfs/dbraw/zinc/10/82/29/1040108229.db2.gz ZKJKAIRKRVOLBB-TZMCWYRMSA-N 1 1 315.373 3.578 20 5 DHBDMO Cc1noc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)c1[N+](=O)[O-] ZINC000595359602 1040127163 /nfs/dbraw/zinc/12/71/63/1040127163.db2.gz NWQXHLFWUMEBFX-OAHLLOKOSA-N 1 1 321.352 3.907 20 5 DHBDMO CCC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000595367414 1040127943 /nfs/dbraw/zinc/12/79/43/1040127943.db2.gz QMSRWVKFZCUFGJ-OAHLLOKOSA-N 1 1 310.369 3.515 20 5 DHBDMO Cc1noc(C[NH2+][C@H](CC2CCC2)c2ccccc2)c1[N+](=O)[O-] ZINC000595425173 1040135921 /nfs/dbraw/zinc/13/59/21/1040135921.db2.gz YSJLGTWPNHOTNV-OAHLLOKOSA-N 1 1 315.373 3.912 20 5 DHBDMO Cc1noc(C[NH2+][C@H](C)c2cc3ccccc3s2)c1[N+](=O)[O-] ZINC000595427802 1040136101 /nfs/dbraw/zinc/13/61/01/1040136101.db2.gz DLXZTYULOXPHDE-SECBINFHSA-N 1 1 317.370 3.957 20 5 DHBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595469124 1040147641 /nfs/dbraw/zinc/14/76/41/1040147641.db2.gz MUPZTFFMMGGRFX-GZMMTYOYSA-N 1 1 306.259 3.507 20 5 DHBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595469124 1040147648 /nfs/dbraw/zinc/14/76/48/1040147648.db2.gz MUPZTFFMMGGRFX-GZMMTYOYSA-N 1 1 306.259 3.507 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H]2c2ccc(F)cc2)cc1 ZINC000595701812 1040223347 /nfs/dbraw/zinc/22/33/47/1040223347.db2.gz FXONHDHRJKYXQU-QGZVFWFLSA-N 1 1 300.333 3.723 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)c(F)c1 ZINC000595786552 1040251777 /nfs/dbraw/zinc/25/17/77/1040251777.db2.gz BHMJGLKLXITJGW-WMLDXEAASA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)c(F)c1 ZINC000595786555 1040252674 /nfs/dbraw/zinc/25/26/74/1040252674.db2.gz BHMJGLKLXITJGW-YOEHRIQHSA-N 1 1 322.380 3.515 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](CC(C)C)C(C)C ZINC000063495970 1040328066 /nfs/dbraw/zinc/32/80/66/1040328066.db2.gz KEVTWPVUBKOHHB-UHFFFAOYSA-N 1 1 321.421 3.598 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3cccnc3)C2)c(F)c1 ZINC000602853647 1041263193 /nfs/dbraw/zinc/26/31/93/1041263193.db2.gz KBLRSIGUZVPBPN-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000602846144 1041276251 /nfs/dbraw/zinc/27/62/51/1041276251.db2.gz NDBMLJCRTVWMAO-LBPRGKRZSA-N 1 1 322.434 3.633 20 5 DHBDMO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc([N+](=O)[O-])cc1 ZINC000090460418 185297522 /nfs/dbraw/zinc/29/75/22/185297522.db2.gz LMOPXZHAKRWFTD-JTQLQIEISA-N 1 1 303.387 3.780 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](OCC(C)C)C1 ZINC000182845588 335003921 /nfs/dbraw/zinc/00/39/21/335003921.db2.gz VVNHUCHFPWARAM-HOCLYGCPSA-N 1 1 306.406 3.711 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000016419947 182043837 /nfs/dbraw/zinc/04/38/37/182043837.db2.gz SDQVJPMYVIZPBB-GFCCVEGCSA-N 1 1 315.329 3.696 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000016419947 182043839 /nfs/dbraw/zinc/04/38/39/182043839.db2.gz SDQVJPMYVIZPBB-GFCCVEGCSA-N 1 1 315.329 3.696 20 5 DHBDMO Cc1cc(C2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)n[nH]1 ZINC000272954725 130077821 /nfs/dbraw/zinc/07/78/21/130077821.db2.gz MXEALHPOWAOGCV-CYBMUJFWSA-N 1 1 314.389 3.567 20 5 DHBDMO CC[C@H]([NH2+][C@H](C)c1nccn1CC)c1cccc([N+](=O)[O-])c1 ZINC000297689076 132028862 /nfs/dbraw/zinc/02/88/62/132028862.db2.gz LUNWNXFKCRIWAX-DOMZBBRYSA-N 1 1 302.378 3.613 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@H](C)c3ccc(C)c([N+](=O)[O-])c3)cn2c1 ZINC000178725950 333143159 /nfs/dbraw/zinc/14/31/59/333143159.db2.gz WTFICGHIZPKKCZ-CQSZACIVSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1ccc(C[NH2+]C[C@]2(N(C)C)CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000390603556 333305657 /nfs/dbraw/zinc/30/56/57/333305657.db2.gz GGPARFCSNRZUKO-KDOFPFPSSA-N 1 1 319.449 3.503 20 5 DHBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000298754145 334251029 /nfs/dbraw/zinc/25/10/29/334251029.db2.gz NNOASWYVEPPHTJ-LLVKDONJSA-N 1 1 306.387 3.858 20 5 DHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000298754145 334251031 /nfs/dbraw/zinc/25/10/31/334251031.db2.gz NNOASWYVEPPHTJ-LLVKDONJSA-N 1 1 306.387 3.858 20 5 DHBDMO COc1cnccc1[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000188781087 334872101 /nfs/dbraw/zinc/87/21/01/334872101.db2.gz WWMIZVJXLVSGIS-CHWSQXEVSA-N 1 1 315.373 3.719 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC=C(c2ccco2)C1 ZINC000352551630 336224203 /nfs/dbraw/zinc/22/42/03/336224203.db2.gz ZGESLOTVZKFAEV-UHFFFAOYSA-N 1 1 302.305 3.616 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC=C(c2ccco2)C1 ZINC000352551630 336224204 /nfs/dbraw/zinc/22/42/04/336224204.db2.gz ZGESLOTVZKFAEV-UHFFFAOYSA-N 1 1 302.305 3.616 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc2ccccc2c1 ZINC000352570191 336225096 /nfs/dbraw/zinc/22/50/96/336225096.db2.gz DHHXBKXBARBLCU-UHFFFAOYSA-N 1 1 321.380 3.818 20 5 DHBDMO Cc1n[nH]cc1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000352844098 336275956 /nfs/dbraw/zinc/27/59/56/336275956.db2.gz AXLYYQMQMXQRMN-GOSISDBHSA-N 1 1 322.368 3.506 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000301801050 336330979 /nfs/dbraw/zinc/33/09/79/336330979.db2.gz CFNPLKOKINYVMX-UHFFFAOYSA-N 1 1 313.401 3.967 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2sccc2[N+](=O)[O-])C1 ZINC000302020523 336343557 /nfs/dbraw/zinc/34/35/57/336343557.db2.gz NQGUAAWUNZOUFO-ZIAGYGMSSA-N 1 1 323.462 3.747 20 5 DHBDMO Cc1ccc(CNc2ccccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000302042837 336345115 /nfs/dbraw/zinc/34/51/15/336345115.db2.gz IYMRYQIUAWQWBX-UHFFFAOYSA-N 1 1 312.373 3.511 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2cccc(F)c2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000302797411 336369493 /nfs/dbraw/zinc/36/94/93/336369493.db2.gz ANMPALCOCWECLY-HOTGVXAUSA-N 1 1 315.348 3.591 20 5 DHBDMO Cc1[nH+]ccn1CCCCNc1c(C)cc([N+](=O)[O-])cc1Cl ZINC000302802341 336369804 /nfs/dbraw/zinc/36/98/04/336369804.db2.gz CXKOSHNXEZDNRR-UHFFFAOYSA-N 1 1 322.796 3.954 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2ncoc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000360321248 336708068 /nfs/dbraw/zinc/70/80/68/336708068.db2.gz CTAXQHFJAQMGQO-UHFFFAOYSA-N 1 1 323.352 3.848 20 5 DHBDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000378630665 337077112 /nfs/dbraw/zinc/07/71/12/337077112.db2.gz GJHYTOFVJOOWIC-OAHLLOKOSA-N 1 1 306.406 3.719 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000186432212 337256029 /nfs/dbraw/zinc/25/60/29/337256029.db2.gz ICYRHZYMNXKEEZ-IBGZPJMESA-N 1 1 324.380 3.535 20 5 DHBDMO Cc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C)n1 ZINC000187190825 337263678 /nfs/dbraw/zinc/26/36/78/337263678.db2.gz SCGWCYYIHGLPPJ-UHFFFAOYSA-N 1 1 311.385 3.771 20 5 DHBDMO Cc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C)n1 ZINC000187190825 337263679 /nfs/dbraw/zinc/26/36/79/337263679.db2.gz SCGWCYYIHGLPPJ-UHFFFAOYSA-N 1 1 311.385 3.771 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(Cl)cc1 ZINC000036722080 337749295 /nfs/dbraw/zinc/74/92/95/337749295.db2.gz DMBQDDFPZIYGQC-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO Cc1nc(C(C)C)oc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000428968221 338067047 /nfs/dbraw/zinc/06/70/47/338067047.db2.gz OHDAJJJUTIHQHE-UHFFFAOYSA-N 1 1 317.389 3.689 20 5 DHBDMO CC(C)([NH2+]Cc1ccncc1Cl)c1ccccc1[N+](=O)[O-] ZINC000429239545 338074414 /nfs/dbraw/zinc/07/44/14/338074414.db2.gz VBISCLMVFAXRID-UHFFFAOYSA-N 1 1 305.765 3.668 20 5 DHBDMO CSC[C@H]1CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000429293574 338076702 /nfs/dbraw/zinc/07/67/02/338076702.db2.gz LVCWJCSWTFKJGY-NSHDSACASA-N 1 1 314.838 3.823 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000430142245 338098845 /nfs/dbraw/zinc/09/88/45/338098845.db2.gz BLBCKHJKKVRJSH-AWEZNQCLSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000430142245 338098846 /nfs/dbraw/zinc/09/88/46/338098846.db2.gz BLBCKHJKKVRJSH-AWEZNQCLSA-N 1 1 312.369 3.686 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000430192561 338100453 /nfs/dbraw/zinc/10/04/53/338100453.db2.gz CFFBCBJDYCTZSC-SCLBCKFNSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000430192561 338100454 /nfs/dbraw/zinc/10/04/54/338100454.db2.gz CFFBCBJDYCTZSC-SCLBCKFNSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000430193026 338100514 /nfs/dbraw/zinc/10/05/14/338100514.db2.gz CGXRCBYESRUNBZ-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430218559 338101870 /nfs/dbraw/zinc/10/18/70/338101870.db2.gz JDJXSLLVFYFDHS-MRXNPFEDSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430218559 338101871 /nfs/dbraw/zinc/10/18/71/338101871.db2.gz JDJXSLLVFYFDHS-MRXNPFEDSA-N 1 1 315.373 3.582 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCSC2(CCCCC2)C1 ZINC000430760805 338114192 /nfs/dbraw/zinc/11/41/92/338114192.db2.gz SURXWKNOEPVOQE-UHFFFAOYSA-N 1 1 324.421 3.986 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCSC2(CCCCC2)C1 ZINC000430760805 338114193 /nfs/dbraw/zinc/11/41/93/338114193.db2.gz SURXWKNOEPVOQE-UHFFFAOYSA-N 1 1 324.421 3.986 20 5 DHBDMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000433046844 338178276 /nfs/dbraw/zinc/17/82/76/338178276.db2.gz QPHPXSHNTALTBI-ZYHUDNBSSA-N 1 1 314.332 3.817 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCSC(C)(C)CC1 ZINC000434670708 338222929 /nfs/dbraw/zinc/22/29/29/338222929.db2.gz RFNOBUYQJDRFDS-UHFFFAOYSA-N 1 1 324.446 3.711 20 5 DHBDMO Cc1cccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000434837944 338226223 /nfs/dbraw/zinc/22/62/23/338226223.db2.gz WSJNABHUPHFQGX-UHFFFAOYSA-N 1 1 311.341 3.676 20 5 DHBDMO Cc1cccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000434837944 338226224 /nfs/dbraw/zinc/22/62/24/338226224.db2.gz WSJNABHUPHFQGX-UHFFFAOYSA-N 1 1 311.341 3.676 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccnn1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000449202696 338602023 /nfs/dbraw/zinc/60/20/23/338602023.db2.gz JBEWLZDUKQXDST-CYBMUJFWSA-N 1 1 314.389 3.757 20 5 DHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453359673 338831241 /nfs/dbraw/zinc/83/12/41/338831241.db2.gz QEYKLAWEDQELLA-CHWSQXEVSA-N 1 1 302.378 3.531 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@H]3CS4)o2)cc1 ZINC000459746934 339045833 /nfs/dbraw/zinc/04/58/33/339045833.db2.gz GHZDTSKGZFHDGT-ZFWWWQNUSA-N 1 1 316.382 3.545 20 5 DHBDMO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H](C)OC ZINC000462828277 339092642 /nfs/dbraw/zinc/09/26/42/339092642.db2.gz VVHYIFJMHWTQJW-ZDUSSCGKSA-N 1 1 318.373 3.712 20 5 DHBDMO CC[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H](C)OC ZINC000462830061 339093034 /nfs/dbraw/zinc/09/30/34/339093034.db2.gz SRHWANWPCDYYKK-CYBMUJFWSA-N 1 1 318.373 3.712 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCC2CCOCC2)C2CC2)cc1 ZINC000463290169 339113629 /nfs/dbraw/zinc/11/36/29/339113629.db2.gz JQWMCERFBBGOHO-UHFFFAOYSA-N 1 1 318.417 3.766 20 5 DHBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC(C)(C)C ZINC000463376242 339116072 /nfs/dbraw/zinc/11/60/72/339116072.db2.gz OXRXQMVPAUCWIC-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000463493451 339119610 /nfs/dbraw/zinc/11/96/10/339119610.db2.gz LJJWIVSKZOWCLO-DGCLKSJQSA-N 1 1 310.369 3.753 20 5 DHBDMO CO[C@@H]1C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC[C@@H]1C ZINC000467386260 339236055 /nfs/dbraw/zinc/23/60/55/339236055.db2.gz UWHIITPQOGRUDO-SUMWQHHRSA-N 1 1 306.406 3.575 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1CCN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467867205 339248243 /nfs/dbraw/zinc/24/82/43/339248243.db2.gz KXEMBDQYWHGLSG-GOEBONIOSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@@H]1CCCCN1CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467867205 339248244 /nfs/dbraw/zinc/24/82/44/339248244.db2.gz KXEMBDQYWHGLSG-GOEBONIOSA-N 1 1 305.422 3.510 20 5 DHBDMO COC[C@@H]1CCCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000470209064 339314366 /nfs/dbraw/zinc/31/43/66/339314366.db2.gz XDWUXCRIXQEFPE-XBNGYDHASA-N 1 1 318.417 3.747 20 5 DHBDMO CC[C@H]1CCCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500101507 340050324 /nfs/dbraw/zinc/05/03/24/340050324.db2.gz YMVHQTNHWDUPIE-AWEZNQCLSA-N 1 1 319.405 3.578 20 5 DHBDMO CCOCC[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000500785383 340067232 /nfs/dbraw/zinc/06/72/32/340067232.db2.gz PHEQHIJPCVRZRE-UHFFFAOYSA-N 1 1 320.414 3.792 20 5 DHBDMO COc1ccc(-c2ccc(C[N@@H+](C)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000505859275 340179838 /nfs/dbraw/zinc/17/98/38/340179838.db2.gz SRBBIPMSBPOHDK-UHFFFAOYSA-N 1 1 304.346 3.704 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC000506476369 340195361 /nfs/dbraw/zinc/19/53/61/340195361.db2.gz FVOQJJKAJANYKM-KRWDZBQOSA-N 1 1 314.410 3.885 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000506476369 340195362 /nfs/dbraw/zinc/19/53/62/340195362.db2.gz FVOQJJKAJANYKM-KRWDZBQOSA-N 1 1 314.410 3.885 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2c[nH]nc21 ZINC000507176962 340211280 /nfs/dbraw/zinc/21/12/80/340211280.db2.gz ZPPPWFIZOFJRJN-UHFFFAOYSA-N 1 1 324.384 3.882 20 5 DHBDMO C[N@@H+](CCCc1cccc(F)c1)CCc1ccccc1[N+](=O)[O-] ZINC000511138761 340321963 /nfs/dbraw/zinc/32/19/63/340321963.db2.gz GGIKCEBKMYJNMR-UHFFFAOYSA-N 1 1 316.376 3.841 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000511353429 340325610 /nfs/dbraw/zinc/32/56/10/340325610.db2.gz ZDNPYYIHJXWKBP-GJZGRUSLSA-N 1 1 317.433 3.968 20 5 DHBDMO O=C(CCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000516622126 340329323 /nfs/dbraw/zinc/32/93/23/340329323.db2.gz NTHJNCNRONBKLE-UHFFFAOYSA-N 1 1 324.380 3.616 20 5 DHBDMO O=C(CCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000516622126 340329324 /nfs/dbraw/zinc/32/93/24/340329324.db2.gz NTHJNCNRONBKLE-UHFFFAOYSA-N 1 1 324.380 3.616 20 5 DHBDMO CCc1cnc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000130499845 341023996 /nfs/dbraw/zinc/02/39/96/341023996.db2.gz UEZYYBAZQOTBHZ-NSHDSACASA-N 1 1 305.403 3.773 20 5 DHBDMO Cc1c(C[N@H+]2Cc3ccccc3OC[C@H]2C)cccc1[N+](=O)[O-] ZINC000543871106 341062258 /nfs/dbraw/zinc/06/22/58/341062258.db2.gz MVDCSHYIEFYSNP-CYBMUJFWSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1c(C[N@@H+]2Cc3ccccc3OC[C@H]2C)cccc1[N+](=O)[O-] ZINC000543871106 341062259 /nfs/dbraw/zinc/06/22/59/341062259.db2.gz MVDCSHYIEFYSNP-CYBMUJFWSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000544440536 341082223 /nfs/dbraw/zinc/08/22/23/341082223.db2.gz SNSRTRIXSNYNIN-JQFCIGGWSA-N 1 1 320.433 3.693 20 5 DHBDMO COc1ccccc1CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000544607887 341088718 /nfs/dbraw/zinc/08/87/18/341088718.db2.gz LKZVRKHMOZBMEB-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO C[C@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000545235662 341116378 /nfs/dbraw/zinc/11/63/78/341116378.db2.gz JPLRANUORHFKBN-ZUZCIYMTSA-N 1 1 302.305 3.518 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000075612030 341179570 /nfs/dbraw/zinc/17/95/70/341179570.db2.gz FPORMVFKBLRHQJ-CQSZACIVSA-N 1 1 313.401 3.854 20 5 DHBDMO C[C@H]1C[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)S1 ZINC000548296106 341254879 /nfs/dbraw/zinc/25/48/79/341254879.db2.gz VNZPPFYMKPJEOV-UWVGGRQHSA-N 1 1 300.811 3.574 20 5 DHBDMO CSc1ccccc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935414 341281499 /nfs/dbraw/zinc/28/14/99/341281499.db2.gz KSYWSHXZONXOEF-UHFFFAOYSA-N 1 1 316.426 3.991 20 5 DHBDMO CCc1cnc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000130530363 522038658 /nfs/dbraw/zinc/03/86/58/522038658.db2.gz ONHNQDCAGNJDRW-NSHDSACASA-N 1 1 305.403 3.773 20 5 DHBDMO COc1cc(C[N@H+](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000184230057 1013427171 /nfs/dbraw/zinc/42/71/71/1013427171.db2.gz HRNCCYOGBVNZHO-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000184230057 1013427174 /nfs/dbraw/zinc/42/71/74/1013427174.db2.gz HRNCCYOGBVNZHO-GFCCVEGCSA-N 1 1 318.348 3.936 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000475271329 1017111065 /nfs/dbraw/zinc/11/10/65/1017111065.db2.gz CLUHHHASYFDDPY-MFKMUULPSA-N 1 1 302.296 3.676 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000441462427 1013909665 /nfs/dbraw/zinc/90/96/65/1013909665.db2.gz IAWUHPUHBMWIPP-WWGRRREGSA-N 1 1 304.390 3.756 20 5 DHBDMO Cc1ccc([C@@H](C)NCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000319920789 1014277649 /nfs/dbraw/zinc/27/76/49/1014277649.db2.gz BQSAQRMLLZGHBV-JKSUJKDBSA-N 1 1 319.449 3.818 20 5 DHBDMO CC(C)C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000521196581 1014664532 /nfs/dbraw/zinc/66/45/32/1014664532.db2.gz NRAYGCXGTMAPIG-UHFFFAOYSA-N 1 1 306.406 3.874 20 5 DHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581622 1014859384 /nfs/dbraw/zinc/85/93/84/1014859384.db2.gz DBBLQQJYWZTZSH-AWEZNQCLSA-N 1 1 303.362 3.747 20 5 DHBDMO C[N@H+](Cc1cccc(OC(F)F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000064992879 1015083397 /nfs/dbraw/zinc/08/33/97/1015083397.db2.gz YZQMVPRFYYEYGC-UHFFFAOYSA-N 1 1 322.311 3.828 20 5 DHBDMO C[N@@H+](Cc1cccc(OC(F)F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000064992879 1015083406 /nfs/dbraw/zinc/08/34/06/1015083406.db2.gz YZQMVPRFYYEYGC-UHFFFAOYSA-N 1 1 322.311 3.828 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2sccc2C)cc1[N+](=O)[O-] ZINC000051233390 1015344983 /nfs/dbraw/zinc/34/49/83/1015344983.db2.gz JRANZRONDGTVRZ-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO COCCCC1(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])CCC1 ZINC000891622182 1015460468 /nfs/dbraw/zinc/46/04/68/1015460468.db2.gz VVYRGRFEOXBFPD-UHFFFAOYSA-N 1 1 306.406 3.624 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000610701507 1015718140 /nfs/dbraw/zinc/71/81/40/1015718140.db2.gz UACREPMGFHGXRZ-LBPRGKRZSA-N 1 1 322.368 3.632 20 5 DHBDMO CC(C)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000065209209 1015971109 /nfs/dbraw/zinc/97/11/09/1015971109.db2.gz YCWFKJWQTSACPW-UHFFFAOYSA-N 1 1 314.385 3.884 20 5 DHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(Cl)cc1 ZINC000065208687 1015971880 /nfs/dbraw/zinc/97/18/80/1015971880.db2.gz LAIQSXKGUJWUJR-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000072555485 1016556019 /nfs/dbraw/zinc/55/60/19/1016556019.db2.gz SMWPJVPAWCDUHX-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)c1 ZINC000847038653 1032190082 /nfs/dbraw/zinc/19/00/82/1032190082.db2.gz VFCSRUFSUHGEPL-OAHLLOKOSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](OC3CCC3)C2)c1 ZINC000847038653 1032190087 /nfs/dbraw/zinc/19/00/87/1032190087.db2.gz VFCSRUFSUHGEPL-OAHLLOKOSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCOC1CCCCC1)C1CC1 ZINC001168317614 1032233889 /nfs/dbraw/zinc/23/38/89/1032233889.db2.gz SJNUTWRNZIRNKS-UHFFFAOYSA-N 1 1 318.417 3.909 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCOC1CCCCC1)C1CC1 ZINC001168317614 1032233899 /nfs/dbraw/zinc/23/38/99/1032233899.db2.gz SJNUTWRNZIRNKS-UHFFFAOYSA-N 1 1 318.417 3.909 20 5 DHBDMO CCc1cnc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000515127321 1012562667 /nfs/dbraw/zinc/56/26/67/1012562667.db2.gz JSKFKBVRJNYRJN-CQSZACIVSA-N 1 1 315.373 3.525 20 5 DHBDMO CCc1cnc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000515127321 1012562674 /nfs/dbraw/zinc/56/26/74/1012562674.db2.gz JSKFKBVRJNYRJN-CQSZACIVSA-N 1 1 315.373 3.525 20 5 DHBDMO CC[C@@H](C)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425416236 1012619227 /nfs/dbraw/zinc/61/92/27/1012619227.db2.gz KYOOEOGINMLUEB-SECBINFHSA-N 1 1 301.184 3.588 20 5 DHBDMO C[C@@H]1CCC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1 ZINC000748084829 1012688237 /nfs/dbraw/zinc/68/82/37/1012688237.db2.gz VOPQAJBQZCMQFK-LLVKDONJSA-N 1 1 321.402 3.951 20 5 DHBDMO CN(CC1CCCCC1)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001167096345 1012973052 /nfs/dbraw/zinc/97/30/52/1012973052.db2.gz AJDIUMWLOZSNKZ-MDZDMXLPSA-N 1 1 318.421 3.539 20 5 DHBDMO CC[N@@H+](CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000336862664 1013010189 /nfs/dbraw/zinc/01/01/89/1013010189.db2.gz KWPZCWHENSAYCI-UHFFFAOYSA-N 1 1 317.311 3.510 20 5 DHBDMO Cc1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)cc1[N+](=O)[O-] ZINC000475287031 1017118482 /nfs/dbraw/zinc/11/84/82/1017118482.db2.gz MMVJRIWNPFXZTI-ZYHUDNBSSA-N 1 1 302.296 3.676 20 5 DHBDMO CO[C@]1(C)CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000475552648 1017422365 /nfs/dbraw/zinc/42/23/65/1017422365.db2.gz XHQJYDKRYCCSMV-NKAIQICCSA-N 1 1 318.417 3.889 20 5 DHBDMO CC(C)CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000083168274 1017596834 /nfs/dbraw/zinc/59/68/34/1017596834.db2.gz ZPNXEZQNBAVABI-UHFFFAOYSA-N 1 1 303.362 3.747 20 5 DHBDMO Cc1[nH+]ccn1CCCCNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000078336058 1017599629 /nfs/dbraw/zinc/59/96/29/1017599629.db2.gz ZSOLJOKQBHCARX-UHFFFAOYSA-N 1 1 308.769 3.645 20 5 DHBDMO CC(C)C[C@@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444665337 1017619146 /nfs/dbraw/zinc/61/91/46/1017619146.db2.gz UBEAGSRWLFGDBC-ZDUSSCGKSA-N 1 1 316.405 3.872 20 5 DHBDMO Cc1c(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000444692707 1017635166 /nfs/dbraw/zinc/63/51/66/1017635166.db2.gz MSCRSEVTDKQINF-LLVKDONJSA-N 1 1 302.296 3.678 20 5 DHBDMO C[C@@H]1c2c(F)cccc2CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000523448665 1017702053 /nfs/dbraw/zinc/70/20/53/1017702053.db2.gz DOOJJYSLICMPGE-CYBMUJFWSA-N 1 1 314.360 3.896 20 5 DHBDMO COc1cccc([C@H](C)[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088605517 1017781640 /nfs/dbraw/zinc/78/16/40/1017781640.db2.gz PCLWXBOOEWAIND-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc([C@H](C)[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088605517 1017781654 /nfs/dbraw/zinc/78/16/54/1017781654.db2.gz PCLWXBOOEWAIND-ZDUSSCGKSA-N 1 1 312.369 3.723 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1 ZINC000446889171 1018288571 /nfs/dbraw/zinc/28/85/71/1018288571.db2.gz SRTJVVOZWQAUGP-XHSDSOJGSA-N 1 1 317.433 3.745 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H]2CCCC[C@@H]21 ZINC000611802415 1018893116 /nfs/dbraw/zinc/89/31/16/1018893116.db2.gz NUHXKDYYIGJCKE-UXIGCNINSA-N 1 1 315.373 3.747 20 5 DHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccsc2[N+](=O)[O-])C1 ZINC000611370284 1019455641 /nfs/dbraw/zinc/45/56/41/1019455641.db2.gz FOWLEMNOTJNMAG-TZMCWYRMSA-N 1 1 317.414 3.904 20 5 DHBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000611555205 1019518593 /nfs/dbraw/zinc/51/85/93/1019518593.db2.gz RHLRQKLAKOXVGL-PWSUYJOCSA-N 1 1 302.296 3.758 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCc2ccccc2[C@H]1C ZINC000730260559 1019967824 /nfs/dbraw/zinc/96/78/24/1019967824.db2.gz BLMCLQSGPVHYKE-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2ccccc2[C@H]1C ZINC000730260559 1019967831 /nfs/dbraw/zinc/96/78/31/1019967831.db2.gz BLMCLQSGPVHYKE-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC001171763638 1032867520 /nfs/dbraw/zinc/86/75/20/1032867520.db2.gz CUOSNMHXXOUIKD-UHFFFAOYSA-N 1 1 314.385 3.841 20 5 DHBDMO COc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1F ZINC000922537244 1020117954 /nfs/dbraw/zinc/11/79/54/1020117954.db2.gz CPFQQEBTOZGTNJ-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccn2)C2CC2)c(Cl)c1 ZINC000922586113 1020146067 /nfs/dbraw/zinc/14/60/67/1020146067.db2.gz VVJWIZXSOBZXOF-MRXNPFEDSA-N 1 1 317.776 3.884 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H](O)C2CCCCC2)C2CC2)cc1 ZINC000474977607 1020398573 /nfs/dbraw/zinc/39/85/73/1020398573.db2.gz TXSBXSUBEHEIMN-SFHVURJKSA-N 1 1 318.417 3.500 20 5 DHBDMO C[C@H](NCCC[N@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000162381262 1020485976 /nfs/dbraw/zinc/48/59/76/1020485976.db2.gz DQPPMXZAUPIVGS-CABCVRRESA-N 1 1 305.422 3.510 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000303446685 1020489943 /nfs/dbraw/zinc/48/99/43/1020489943.db2.gz JCRBKKMGVUEUJA-CQSZACIVSA-N 1 1 324.446 3.711 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000303498787 1020494159 /nfs/dbraw/zinc/49/41/59/1020494159.db2.gz XXIOMAARIXKLIY-OAHLLOKOSA-N 1 1 324.446 3.711 20 5 DHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000179860383 1020514868 /nfs/dbraw/zinc/51/48/68/1020514868.db2.gz NOOYTENRMUWVRD-LBPRGKRZSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000179860383 1020514876 /nfs/dbraw/zinc/51/48/76/1020514876.db2.gz NOOYTENRMUWVRD-LBPRGKRZSA-N 1 1 318.398 3.544 20 5 DHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000030002426 1020558947 /nfs/dbraw/zinc/55/89/47/1020558947.db2.gz LKJMAFVZPPVONS-ZDUSSCGKSA-N 1 1 300.358 3.796 20 5 DHBDMO CC(C)OC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000735492085 1020744071 /nfs/dbraw/zinc/74/40/71/1020744071.db2.gz FSWODIMYOJRFPA-UHFFFAOYSA-N 1 1 312.797 3.638 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000613180025 1020846846 /nfs/dbraw/zinc/84/68/46/1020846846.db2.gz FERIRVVAYBWUTC-GOEBONIOSA-N 1 1 311.385 3.615 20 5 DHBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccncc1 ZINC000742371927 1021113249 /nfs/dbraw/zinc/11/32/49/1021113249.db2.gz CHNAZACMOHKZNU-HNNXBMFYSA-N 1 1 305.765 3.884 20 5 DHBDMO CC(C)[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275857 1021217476 /nfs/dbraw/zinc/21/74/76/1021217476.db2.gz LRNWVZOWKPZRKU-SFHVURJKSA-N 1 1 314.385 3.539 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1C[C@H](O)c2ccccc21 ZINC000850372248 1021494989 /nfs/dbraw/zinc/49/49/89/1021494989.db2.gz RUFHMZXANMFYBZ-HOCLYGCPSA-N 1 1 318.760 3.516 20 5 DHBDMO C[N@@H+]1CCc2c(NCCC3=CCCCC3)ccc([N+](=O)[O-])c2C1 ZINC001168774213 1021581235 /nfs/dbraw/zinc/58/12/35/1021581235.db2.gz DRTNXNMQPMPFQL-UHFFFAOYSA-N 1 1 315.417 3.885 20 5 DHBDMO C[N@H+]1CCc2c(NCCC3=CCCCC3)ccc([N+](=O)[O-])c2C1 ZINC001168774213 1021581249 /nfs/dbraw/zinc/58/12/49/1021581249.db2.gz DRTNXNMQPMPFQL-UHFFFAOYSA-N 1 1 315.417 3.885 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCOC2(CCCCC2)C1 ZINC000556888144 1021932392 /nfs/dbraw/zinc/93/23/92/1021932392.db2.gz ZFLDWKXTUWJXSE-VURMDHGXSA-N 1 1 316.401 3.643 20 5 DHBDMO CC(C)C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000776580395 1022099067 /nfs/dbraw/zinc/09/90/67/1022099067.db2.gz UZXHFQYZINQAFR-KRWDZBQOSA-N 1 1 306.406 3.529 20 5 DHBDMO CC(C)CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000776580748 1022099431 /nfs/dbraw/zinc/09/94/31/1022099431.db2.gz ZQMYDNOQHMATGO-GOSISDBHSA-N 1 1 320.433 3.919 20 5 DHBDMO CCC(CC)[N@@H+](CC(C)C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588733 1022115853 /nfs/dbraw/zinc/11/58/53/1022115853.db2.gz BJCMOVJJRHLWSM-QGZVFWFLSA-N 1 1 308.422 3.775 20 5 DHBDMO CCC1CCC([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776593475 1022117604 /nfs/dbraw/zinc/11/76/04/1022117604.db2.gz WUBUDNIUMHNDDR-PGEKIEPBSA-N 1 1 306.406 3.529 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)C1 ZINC001169038485 1022222151 /nfs/dbraw/zinc/22/21/51/1022222151.db2.gz ZDQDLMOLRKYMBW-AXAPSJFSSA-N 1 1 310.344 3.547 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H]2CC[C@H](C3CC3)O2)C2CC2)c1 ZINC001167735355 1022229130 /nfs/dbraw/zinc/22/91/30/1022229130.db2.gz ZUEZOMHFZJCUDS-ZWKOTPCHSA-N 1 1 316.401 3.517 20 5 DHBDMO CC(C)([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000179576739 1022469104 /nfs/dbraw/zinc/46/91/04/1022469104.db2.gz HQHFPWLYYMHQBY-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001169780242 1022545503 /nfs/dbraw/zinc/54/55/03/1022545503.db2.gz JYBBOONRGXHKBR-MRXNPFEDSA-N 1 1 310.369 3.515 20 5 DHBDMO Cc1cc(C)cc(C[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC001169985785 1022896818 /nfs/dbraw/zinc/89/68/18/1022896818.db2.gz FPGURCNXNFBRNQ-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO Cc1cc(C)cc(C[N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC001169985785 1022896834 /nfs/dbraw/zinc/89/68/34/1022896834.db2.gz FPGURCNXNFBRNQ-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000876585262 1033098618 /nfs/dbraw/zinc/09/86/18/1033098618.db2.gz GHGWUIQCMITAGX-GOSISDBHSA-N 1 1 311.385 3.944 20 5 DHBDMO Cc1c(F)cc([N+](=O)[O-])cc1NCCC[N@@H+]1CCCC[C@@H]1C ZINC001167754314 1023048473 /nfs/dbraw/zinc/04/84/73/1023048473.db2.gz RUKRTYWTZXMTEQ-LBPRGKRZSA-N 1 1 309.385 3.719 20 5 DHBDMO CC[C@H]1CCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769009410 1023079071 /nfs/dbraw/zinc/07/90/71/1023079071.db2.gz QWZWTVNFSCOQAN-JTQLQIEISA-N 1 1 313.195 3.732 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000770101958 1023275695 /nfs/dbraw/zinc/27/56/95/1023275695.db2.gz ZEYYYEOFPKCCPE-LLVKDONJSA-N 1 1 320.780 3.664 20 5 DHBDMO C[C@@H]1C[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H](C)S1 ZINC000746673195 1023784513 /nfs/dbraw/zinc/78/45/13/1023784513.db2.gz KFVDGGCLTZGFKD-NXEZZACHSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@@H]1c2ccc(Cl)n2CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000787656096 1023808124 /nfs/dbraw/zinc/80/81/24/1023808124.db2.gz XVDHCRKQPYUWDR-GFCCVEGCSA-N 1 1 319.792 3.669 20 5 DHBDMO C[C@@H]1c2ccc(Cl)n2CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000787656096 1023808128 /nfs/dbraw/zinc/80/81/28/1023808128.db2.gz XVDHCRKQPYUWDR-GFCCVEGCSA-N 1 1 319.792 3.669 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788481850 1023891733 /nfs/dbraw/zinc/89/17/33/1023891733.db2.gz JNMRUESFQDZGHO-STQMWFEESA-N 1 1 312.410 3.840 20 5 DHBDMO Cc1cnc(CC[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000270119057 1024353134 /nfs/dbraw/zinc/35/31/34/1024353134.db2.gz NKYOXRWVKBCNBA-LBPRGKRZSA-N 1 1 305.403 3.595 20 5 DHBDMO CCc1noc(C)c1[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000790697323 1024355889 /nfs/dbraw/zinc/35/58/89/1024355889.db2.gz ZFHPYYRJLGOUDB-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)c1 ZINC000883384037 1024417555 /nfs/dbraw/zinc/41/75/55/1024417555.db2.gz KOTRLPWNSLZHHS-IAGOWNOFSA-N 1 1 300.333 3.710 20 5 DHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CC1(C)C ZINC000339134325 1024572859 /nfs/dbraw/zinc/57/28/59/1024572859.db2.gz VGBUFKZRVYFGNG-GFCCVEGCSA-N 1 1 302.296 3.844 20 5 DHBDMO CC[C@H](C)C[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000111254975 1024749715 /nfs/dbraw/zinc/74/97/15/1024749715.db2.gz YBXINSOXICXVEG-ZDUSSCGKSA-N 1 1 317.389 3.770 20 5 DHBDMO Cc1csc(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3)CCCC2)n1 ZINC000112711206 1024783690 /nfs/dbraw/zinc/78/36/90/1024783690.db2.gz GWJACNZTQOEZQX-UHFFFAOYSA-N 1 1 317.414 3.919 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792868904 1024810341 /nfs/dbraw/zinc/81/03/41/1024810341.db2.gz YLZAYXATRFLISS-JMSVASOKSA-N 1 1 319.361 3.656 20 5 DHBDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000792868210 1024810391 /nfs/dbraw/zinc/81/03/91/1024810391.db2.gz SDTICLKYVXYNEK-NWDGAFQWSA-N 1 1 321.377 3.902 20 5 DHBDMO Cc1ccncc1C[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000793339280 1024984661 /nfs/dbraw/zinc/98/46/61/1024984661.db2.gz YTVHYCLSFUSKDC-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO Cc1ccncc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000793339280 1024984672 /nfs/dbraw/zinc/98/46/72/1024984672.db2.gz YTVHYCLSFUSKDC-UHFFFAOYSA-N 1 1 305.765 3.584 20 5 DHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000793340565 1024984766 /nfs/dbraw/zinc/98/47/66/1024984766.db2.gz QRCMBJJVDYNCFT-HNNXBMFYSA-N 1 1 312.797 3.639 20 5 DHBDMO C[C@@]1(C(N)=O)CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000793388748 1025031905 /nfs/dbraw/zinc/03/19/05/1025031905.db2.gz FWCADIKGMUMRHI-OAQYLSRUSA-N 1 1 318.420 3.690 20 5 DHBDMO CCOc1cccc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000353592612 1025147486 /nfs/dbraw/zinc/14/74/86/1025147486.db2.gz SUTSTPYBVARSLC-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCOc1cccc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000353592612 1025147506 /nfs/dbraw/zinc/14/75/06/1025147506.db2.gz SUTSTPYBVARSLC-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCC[N@@H+]1CCC[C@@H]1CN[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353971641 1025307825 /nfs/dbraw/zinc/30/78/25/1025307825.db2.gz LIBJNCNQYJXRPT-SJORKVTESA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[N@H+]1CCC[C@@H]1CN[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000353971641 1025307830 /nfs/dbraw/zinc/30/78/30/1025307830.db2.gz LIBJNCNQYJXRPT-SJORKVTESA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)C[C@@H](C)c1nccs1 ZINC000877316275 1033279818 /nfs/dbraw/zinc/27/98/18/1033279818.db2.gz QZRVRBYSWMLPGN-GFCCVEGCSA-N 1 1 319.430 3.904 20 5 DHBDMO CC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000885965257 1025421484 /nfs/dbraw/zinc/42/14/84/1025421484.db2.gz KJFYEJXPUDPWKM-LBPRGKRZSA-N 1 1 303.337 3.712 20 5 DHBDMO CC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000885965257 1025421494 /nfs/dbraw/zinc/42/14/94/1025421494.db2.gz KJFYEJXPUDPWKM-LBPRGKRZSA-N 1 1 303.337 3.712 20 5 DHBDMO CC(C)[N@H+](Cc1ccc(F)cc1)Cc1cccnc1[N+](=O)[O-] ZINC000885969615 1025423695 /nfs/dbraw/zinc/42/36/95/1025423695.db2.gz YCVKFBYBKFVSMQ-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc(F)cc1)Cc1cccnc1[N+](=O)[O-] ZINC000885969615 1025423703 /nfs/dbraw/zinc/42/37/03/1025423703.db2.gz YCVKFBYBKFVSMQ-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000886013197 1025438943 /nfs/dbraw/zinc/43/89/43/1025438943.db2.gz YFEBEOQCGISPHT-UHFFFAOYSA-N 1 1 315.348 3.541 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000886013197 1025438947 /nfs/dbraw/zinc/43/89/47/1025438947.db2.gz YFEBEOQCGISPHT-UHFFFAOYSA-N 1 1 315.348 3.541 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886021506 1025442580 /nfs/dbraw/zinc/44/25/80/1025442580.db2.gz XWTCUEALKGTQKS-WBMJQRKESA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886021506 1025442583 /nfs/dbraw/zinc/44/25/83/1025442583.db2.gz XWTCUEALKGTQKS-WBMJQRKESA-N 1 1 315.348 3.712 20 5 DHBDMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cccnc2[N+](=O)[O-])o1 ZINC000886028860 1025445577 /nfs/dbraw/zinc/44/55/77/1025445577.db2.gz ZBTFCSCAYNWTNZ-WFASDCNBSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cccnc2[N+](=O)[O-])o1 ZINC000886028860 1025445585 /nfs/dbraw/zinc/44/55/85/1025445585.db2.gz ZBTFCSCAYNWTNZ-WFASDCNBSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1coc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000886093652 1025466049 /nfs/dbraw/zinc/46/60/49/1025466049.db2.gz GAYZHZIXYWRIQO-UHFFFAOYSA-N 1 1 314.263 3.805 20 5 DHBDMO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c(Cl)cc1[N+](=O)[O-] ZINC000747211282 1025466446 /nfs/dbraw/zinc/46/64/46/1025466446.db2.gz DCGCSNDHLRWRGM-RYUDHWBXSA-N 1 1 309.797 3.595 20 5 DHBDMO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886107683 1025507449 /nfs/dbraw/zinc/50/74/49/1025507449.db2.gz XNXXSTGGRPTVLL-CYBMUJFWSA-N 1 1 315.373 3.628 20 5 DHBDMO CSc1ccccc1[C@H](C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886188575 1025554750 /nfs/dbraw/zinc/55/47/50/1025554750.db2.gz VJXVIPPNSWCUAU-NSHDSACASA-N 1 1 303.387 3.563 20 5 DHBDMO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886207446 1025558633 /nfs/dbraw/zinc/55/86/33/1025558633.db2.gz CEZZPZLOHURCTB-INIZCTEOSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886207446 1025558642 /nfs/dbraw/zinc/55/86/42/1025558642.db2.gz CEZZPZLOHURCTB-INIZCTEOSA-N 1 1 315.373 3.582 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[NH2+]C1(c2cccc(Cl)c2)CCC1 ZINC000886265422 1025574457 /nfs/dbraw/zinc/57/44/57/1025574457.db2.gz ILGNSONMZLTIDE-UHFFFAOYSA-N 1 1 317.776 3.812 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000886925082 1025980702 /nfs/dbraw/zinc/98/07/02/1025980702.db2.gz DQQRMMQPESYQAH-OAHLLOKOSA-N 1 1 304.296 3.650 20 5 DHBDMO COc1ccc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)cc1[N+](=O)[O-] ZINC000086235958 1026019299 /nfs/dbraw/zinc/01/92/99/1026019299.db2.gz RAABSWUCUDNKCQ-LBPRGKRZSA-N 1 1 316.357 3.922 20 5 DHBDMO COc1ccc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)cc1[N+](=O)[O-] ZINC000086235958 1026019322 /nfs/dbraw/zinc/01/93/22/1026019322.db2.gz RAABSWUCUDNKCQ-LBPRGKRZSA-N 1 1 316.357 3.922 20 5 DHBDMO C[N@H+](CCCOc1ccc(F)cc1)Cc1csc([N+](=O)[O-])c1 ZINC000047266155 1026095578 /nfs/dbraw/zinc/09/55/78/1026095578.db2.gz UGHAKZXOFIHSGP-UHFFFAOYSA-N 1 1 324.377 3.696 20 5 DHBDMO C[N@@H+](CCCOc1ccc(F)cc1)Cc1csc([N+](=O)[O-])c1 ZINC000047266155 1026095592 /nfs/dbraw/zinc/09/55/92/1026095592.db2.gz UGHAKZXOFIHSGP-UHFFFAOYSA-N 1 1 324.377 3.696 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000289640458 1026110493 /nfs/dbraw/zinc/11/04/93/1026110493.db2.gz FOLGJPBOHMPOJX-WQVCFCJDSA-N 1 1 304.390 3.545 20 5 DHBDMO COCC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000356785490 1026168308 /nfs/dbraw/zinc/16/83/08/1026168308.db2.gz NQZPOHZMFCYGBR-IUODEOHRSA-N 1 1 304.346 3.616 20 5 DHBDMO CCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000513510023 1026527559 /nfs/dbraw/zinc/52/75/59/1026527559.db2.gz XRBOAEVSSLTYNM-NBEHIINDSA-N 1 1 318.417 3.889 20 5 DHBDMO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cs1 ZINC000293746562 1027110231 /nfs/dbraw/zinc/11/02/31/1027110231.db2.gz NVTKPNHDCRSTJM-NXEZZACHSA-N 1 1 320.418 3.608 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)cs1 ZINC000931914512 1027302520 /nfs/dbraw/zinc/30/25/20/1027302520.db2.gz BRNSZXWYXDRVMW-SNVBAGLBSA-N 1 1 324.299 3.523 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)cs1 ZINC000931914512 1027302540 /nfs/dbraw/zinc/30/25/40/1027302540.db2.gz BRNSZXWYXDRVMW-SNVBAGLBSA-N 1 1 324.299 3.523 20 5 DHBDMO CCCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H]1CCC[C@@H](C)C1 ZINC001170684916 1027385959 /nfs/dbraw/zinc/38/59/59/1027385959.db2.gz YYZPPIPXWVWZRT-ZBFHGGJFSA-N 1 1 322.453 3.781 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000574676207 1027416926 /nfs/dbraw/zinc/41/69/26/1027416926.db2.gz VFCMWWZSFHJWGS-HUUCEWRRSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000574676207 1027416931 /nfs/dbraw/zinc/41/69/31/1027416931.db2.gz VFCMWWZSFHJWGS-HUUCEWRRSA-N 1 1 307.438 3.674 20 5 DHBDMO C[C@H](c1ccccc1)[C@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000932276676 1027441548 /nfs/dbraw/zinc/44/15/48/1027441548.db2.gz VLTFUPLVQLFSTL-RHSMWYFYSA-N 1 1 311.385 3.758 20 5 DHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812852389 1027449155 /nfs/dbraw/zinc/44/91/55/1027449155.db2.gz FKFVOROCVMYRJH-LRDDRELGSA-N 1 1 320.414 3.600 20 5 DHBDMO CCC[C@H](NC[C@H]([NH3+])c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423238823 1027459556 /nfs/dbraw/zinc/45/95/56/1027459556.db2.gz JOORDCJSNBRLOM-ROUUACIJSA-N 1 1 313.401 3.726 20 5 DHBDMO CCc1ccccc1[C@@H](N)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000423499264 1027563902 /nfs/dbraw/zinc/56/39/02/1027563902.db2.gz JGIZQHMPOFXOJZ-UGSOOPFHSA-N 1 1 313.401 3.508 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@]2(C)Cc2cccs2)c1[N+](=O)[O-] ZINC000932924089 1027653148 /nfs/dbraw/zinc/65/31/48/1027653148.db2.gz WAWXYYDPOFMHJX-OAHLLOKOSA-N 1 1 321.402 3.550 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C2CCOCC2)C1 ZINC000933079266 1027669959 /nfs/dbraw/zinc/66/99/59/1027669959.db2.gz KXFISTXLJRQKPZ-HOCLYGCPSA-N 1 1 318.417 3.794 20 5 DHBDMO CC(C)c1ccc(C[NH2+]Cc2cccc(F)n2)cc1[N+](=O)[O-] ZINC000747935205 1028013855 /nfs/dbraw/zinc/01/38/55/1028013855.db2.gz JBEKPWSFQNWPMI-UHFFFAOYSA-N 1 1 303.337 3.542 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000601310456 1028073916 /nfs/dbraw/zinc/07/39/16/1028073916.db2.gz OZKALVRIOZRRIN-CYBMUJFWSA-N 1 1 324.384 3.641 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@H]4CCCC[C@H]43)co2)cc1 ZINC000368088382 1028294836 /nfs/dbraw/zinc/29/48/36/1028294836.db2.gz FEDFRZBKUQSHRU-CZUORRHYSA-N 1 1 313.357 3.624 20 5 DHBDMO C[C@H]([NH2+][C@H]1c2ccc(F)cc2O[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000368585161 1028380215 /nfs/dbraw/zinc/38/02/15/1028380215.db2.gz PMTHEHILDJTNRB-PSVSLLHZSA-N 1 1 316.332 3.907 20 5 DHBDMO C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC000369560527 1028504478 /nfs/dbraw/zinc/50/44/78/1028504478.db2.gz HIUHLWRCURRBFA-LRDDRELGSA-N 1 1 317.414 3.761 20 5 DHBDMO COC[C@@]1(C)CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000449391344 1028608918 /nfs/dbraw/zinc/60/89/18/1028608918.db2.gz HYFMTEBRZLJVGZ-KRWDZBQOSA-N 1 1 306.406 3.577 20 5 DHBDMO Cc1csc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000449494677 1028697492 /nfs/dbraw/zinc/69/74/92/1028697492.db2.gz BFDRAVNJNYZMQQ-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO Cc1ncsc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449497300 1028709438 /nfs/dbraw/zinc/70/94/38/1028709438.db2.gz IQFXJQBVWGQPIS-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO CSC1(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000449501564 1028719519 /nfs/dbraw/zinc/71/95/19/1028719519.db2.gz PZJPWVMTBNEDMZ-CQSZACIVSA-N 1 1 306.431 3.670 20 5 DHBDMO Cc1cccnc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449505399 1028730472 /nfs/dbraw/zinc/73/04/72/1028730472.db2.gz XHHDXFWIIIJXII-MRXNPFEDSA-N 1 1 311.385 3.678 20 5 DHBDMO C[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cscn1 ZINC000566501828 1028736813 /nfs/dbraw/zinc/73/68/13/1028736813.db2.gz UKZQXAIRNRQMKX-QMTHXVAHSA-N 1 1 303.387 3.780 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)cc1[N+](=O)[O-] ZINC000449573052 1028817507 /nfs/dbraw/zinc/81/75/07/1028817507.db2.gz PGCULOAEDJOMTR-WFASDCNBSA-N 1 1 314.389 3.710 20 5 DHBDMO CC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1ccncc1 ZINC000568139613 1029013996 /nfs/dbraw/zinc/01/39/96/1029013996.db2.gz JQELOGGYSLWEHU-RVDMUPIBSA-N 1 1 311.385 3.915 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000568691796 1029113297 /nfs/dbraw/zinc/11/32/97/1029113297.db2.gz SYUVQPSMISEETC-INIZCTEOSA-N 1 1 304.390 3.614 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000568691796 1029113304 /nfs/dbraw/zinc/11/33/04/1029113304.db2.gz SYUVQPSMISEETC-INIZCTEOSA-N 1 1 304.390 3.614 20 5 DHBDMO COc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000450227216 1029266074 /nfs/dbraw/zinc/26/60/74/1029266074.db2.gz OSJXHAPDLMIZIE-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000450227216 1029266088 /nfs/dbraw/zinc/26/60/88/1029266088.db2.gz OSJXHAPDLMIZIE-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H]1CCC(F)(F)C1)C1CC1 ZINC000450597482 1029568367 /nfs/dbraw/zinc/56/83/67/1029568367.db2.gz HVBHVTXIOALXEZ-LBPRGKRZSA-N 1 1 310.344 3.995 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000821331860 1029827007 /nfs/dbraw/zinc/82/70/07/1029827007.db2.gz GJVYOSTYFOPGOP-CYBMUJFWSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451963649 1030067855 /nfs/dbraw/zinc/06/78/55/1030067855.db2.gz HTBWHROUPGRXLH-XJKSGUPXSA-N 1 1 306.431 3.875 20 5 DHBDMO COC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000530968304 1030099196 /nfs/dbraw/zinc/09/91/96/1030099196.db2.gz IFRKUSFQSBVQIR-INIZCTEOSA-N 1 1 318.348 3.520 20 5 DHBDMO CCO[C@H]1C[C@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C12CCC2 ZINC000357792862 1030193497 /nfs/dbraw/zinc/19/34/97/1030193497.db2.gz OJPYPDQCIMLTTA-HOTGVXAUSA-N 1 1 322.380 3.513 20 5 DHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C12CCC2 ZINC000357792862 1030193502 /nfs/dbraw/zinc/19/35/02/1030193502.db2.gz OJPYPDQCIMLTTA-HOTGVXAUSA-N 1 1 322.380 3.513 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2Cc3ccc(Cl)cc3C2)cc1 ZINC001171018064 1030289327 /nfs/dbraw/zinc/28/93/27/1030289327.db2.gz KWDUCJNNYUQDJK-UHFFFAOYSA-N 1 1 302.761 3.807 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2Cc3ccc(Cl)cc3C2)cc1 ZINC001171018064 1030289333 /nfs/dbraw/zinc/28/93/33/1030289333.db2.gz KWDUCJNNYUQDJK-UHFFFAOYSA-N 1 1 302.761 3.807 20 5 DHBDMO CSc1ccccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000358070678 1030309603 /nfs/dbraw/zinc/30/96/03/1030309603.db2.gz VYIUFVUPMQQWBU-UHFFFAOYSA-N 1 1 302.399 3.949 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H]2CCCc3scnc32)cc1[N+](=O)[O-] ZINC000866540210 1030360281 /nfs/dbraw/zinc/36/02/81/1030360281.db2.gz LAYCMSKFZVAXNM-GFCCVEGCSA-N 1 1 303.387 3.527 20 5 DHBDMO CC(C)([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1[N+](=O)[O-] ZINC000291756679 1030629626 /nfs/dbraw/zinc/62/96/26/1030629626.db2.gz QVGPTEFWCRBDHO-UHFFFAOYSA-N 1 1 315.329 3.528 20 5 DHBDMO CCC[C@@H]([NH2+]C[C@H](C)N(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000359021268 1030735804 /nfs/dbraw/zinc/73/58/04/1030735804.db2.gz UHGOFXXCZHIOIG-WMLDXEAASA-N 1 1 307.438 3.756 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@]3(CC[C@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000359559003 1031030585 /nfs/dbraw/zinc/03/05/85/1031030585.db2.gz OYNCHYPWQOEQOH-SUMWQHHRSA-N 1 1 304.390 3.616 20 5 DHBDMO CC(C)[C@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1cnn(C)c1 ZINC000927067502 1031065675 /nfs/dbraw/zinc/06/56/75/1031065675.db2.gz RKDQMTDQDIJJKL-BZNIZROVSA-N 1 1 320.368 3.515 20 5 DHBDMO COc1ccnc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000925495177 1031267297 /nfs/dbraw/zinc/26/72/97/1031267297.db2.gz MHAPNYMPRIGEDJ-CHWSQXEVSA-N 1 1 315.373 3.719 20 5 DHBDMO COCc1ccccc1C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872019145 1031400695 /nfs/dbraw/zinc/40/06/95/1031400695.db2.gz TUDSPEKCDVFPAZ-LBPRGKRZSA-N 1 1 318.348 3.731 20 5 DHBDMO C[C@@H](O)c1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872026318 1031409855 /nfs/dbraw/zinc/40/98/55/1031409855.db2.gz COCXFMIZLHTXOA-VXGBXAGGSA-N 1 1 318.348 3.638 20 5 DHBDMO C[C@H](NCCCCC[NH+]1CCCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872072255 1031466589 /nfs/dbraw/zinc/46/65/89/1031466589.db2.gz FQHJQEVXSMQRRE-AWEZNQCLSA-N 1 1 323.412 3.651 20 5 DHBDMO Cc1cc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc(C)n1 ZINC000872079589 1031476791 /nfs/dbraw/zinc/47/67/91/1031476791.db2.gz JHWDVFODVRMTBG-GFCCVEGCSA-N 1 1 303.337 3.597 20 5 DHBDMO CCc1onc(C)c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000929337370 1031498305 /nfs/dbraw/zinc/49/83/05/1031498305.db2.gz DBKLLMUCTVDCIS-UHFFFAOYSA-N 1 1 317.389 3.864 20 5 DHBDMO CCc1onc(C)c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000929337370 1031498311 /nfs/dbraw/zinc/49/83/11/1031498311.db2.gz DBKLLMUCTVDCIS-UHFFFAOYSA-N 1 1 317.389 3.864 20 5 DHBDMO CCc1nocc1C[N@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000293544867 1031512759 /nfs/dbraw/zinc/51/27/59/1031512759.db2.gz YLJCMWRWFLUJFZ-GFCCVEGCSA-N 1 1 303.362 3.647 20 5 DHBDMO CCc1nocc1C[N@@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000293544867 1031512772 /nfs/dbraw/zinc/51/27/72/1031512772.db2.gz YLJCMWRWFLUJFZ-GFCCVEGCSA-N 1 1 303.362 3.647 20 5 DHBDMO COc1ccc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)cc1[N+](=O)[O-] ZINC000360739044 1031544550 /nfs/dbraw/zinc/54/45/50/1031544550.db2.gz QZENUTZMEJRZBH-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO COc1ccc(C[N@H+]2Cc3ccccc3C3(CC3)C2)cc1[N+](=O)[O-] ZINC000360739044 1031544555 /nfs/dbraw/zinc/54/45/55/1031544555.db2.gz QZENUTZMEJRZBH-UHFFFAOYSA-N 1 1 324.380 3.651 20 5 DHBDMO CCCc1nc(C)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000293800818 1031631022 /nfs/dbraw/zinc/63/10/22/1031631022.db2.gz UZBKVRHJPJUWGU-NSHDSACASA-N 1 1 303.362 3.695 20 5 DHBDMO Cc1cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cnc1Cl ZINC000873183296 1031745908 /nfs/dbraw/zinc/74/59/08/1031745908.db2.gz CBLNWRUPDHGDNR-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846109764 1031861489 /nfs/dbraw/zinc/86/14/89/1031861489.db2.gz VNDUYDDLZYKSEL-BYPUDFOVSA-N 1 1 308.328 3.729 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@H]4[C@@H](C3)C4(F)F)o2)cc1 ZINC000846113403 1031862417 /nfs/dbraw/zinc/86/24/17/1031862417.db2.gz XUERNIRIJDAIPR-OKILXGFUSA-N 1 1 320.295 3.552 20 5 DHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777957505 1032044375 /nfs/dbraw/zinc/04/43/75/1032044375.db2.gz RITQDLCOJHQUAV-CJNGLKHVSA-N 1 1 314.389 3.536 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000877502111 1033327916 /nfs/dbraw/zinc/32/79/16/1033327916.db2.gz YOSLHFHTDDYVKW-HNNXBMFYSA-N 1 1 311.385 3.596 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000877603632 1033374537 /nfs/dbraw/zinc/37/45/37/1033374537.db2.gz RKUKFBMKZGJUDQ-MAUKXSAKSA-N 1 1 318.417 3.603 20 5 DHBDMO CSC1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000877663412 1033402467 /nfs/dbraw/zinc/40/24/67/1033402467.db2.gz QNKGPEUHZWGBST-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCCC(F)(F)CC1)CC2 ZINC001172907698 1033441277 /nfs/dbraw/zinc/44/12/77/1033441277.db2.gz HQSYPYZTDKKNEK-HNNXBMFYSA-N 1 1 324.371 3.963 20 5 DHBDMO Cc1csc([C@H]2CC[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)C2)n1 ZINC000877813023 1033463130 /nfs/dbraw/zinc/46/31/30/1033463130.db2.gz IHHJLORVIUKKDR-AWEZNQCLSA-N 1 1 317.414 3.658 20 5 DHBDMO CC(C)[N@@H+](CC1CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172917705 1033464073 /nfs/dbraw/zinc/46/40/73/1033464073.db2.gz WNCUWDFOVUJVDC-QGZVFWFLSA-N 1 1 302.418 3.963 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@@H](C(F)F)C1)CC2 ZINC001172916100 1033464394 /nfs/dbraw/zinc/46/43/94/1033464394.db2.gz QQGCRXDVSDRBPB-HUUCEWRRSA-N 1 1 324.371 3.819 20 5 DHBDMO C[C@@H]1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172914827 1033464856 /nfs/dbraw/zinc/46/48/56/1033464856.db2.gz JOCQUUTUIOCQJG-CKEIUWERSA-N 1 1 302.418 3.963 20 5 DHBDMO CC(C)[C@@H]1CCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922634 1033469876 /nfs/dbraw/zinc/46/98/76/1033469876.db2.gz ZIZJOKBTVUSWIQ-WMZOPIPTSA-N 1 1 302.418 3.963 20 5 DHBDMO C[C@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001172909723 1033483047 /nfs/dbraw/zinc/48/30/47/1033483047.db2.gz VFHYIQSCOHAMFA-WFASDCNBSA-N 1 1 324.371 3.819 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000152554384 1033527237 /nfs/dbraw/zinc/52/72/37/1033527237.db2.gz SZPOJHHVZSJORF-QWHCGFSZSA-N 1 1 315.373 3.800 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCC[C@@H](C)C2)c1F ZINC001173181791 1033581281 /nfs/dbraw/zinc/58/12/81/1033581281.db2.gz PVANRUZOZKPSFH-CHWSQXEVSA-N 1 1 324.396 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H](C)C[C@H]2C)c1F ZINC001173189891 1033583783 /nfs/dbraw/zinc/58/37/83/1033583783.db2.gz OICIJNPSJOJHKY-UPJWGTAASA-N 1 1 324.396 3.794 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@H]2C(C)C)c1F ZINC001173193143 1033587189 /nfs/dbraw/zinc/58/71/89/1033587189.db2.gz QRSPXWGLZCHHAT-JSGCOSHPSA-N 1 1 324.396 3.794 20 5 DHBDMO Cc1cc([C@@H]2CCC[N@@H+]2[C@H](C)Cc2ccc([N+](=O)[O-])cc2)no1 ZINC001173229213 1033605091 /nfs/dbraw/zinc/60/50/91/1033605091.db2.gz RPZJNGSXEIUDDN-PXAZEXFGSA-N 1 1 315.373 3.659 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000878614935 1033771811 /nfs/dbraw/zinc/77/18/11/1033771811.db2.gz SYWPMFJOLKMHMS-QGZVFWFLSA-N 1 1 311.385 3.678 20 5 DHBDMO Cc1c([C@H](C)NCCC[N@H+]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000479885827 1033947753 /nfs/dbraw/zinc/94/77/53/1033947753.db2.gz PGTGYGCEPNOWRC-ZBFHGGJFSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]CC2(N(C)C)CCCCC2)cccc1[N+](=O)[O-] ZINC000480087778 1034057386 /nfs/dbraw/zinc/05/73/86/1034057386.db2.gz YQVVWPYEOMVYJD-OAHLLOKOSA-N 1 1 319.449 3.818 20 5 DHBDMO CC(C)[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1 ZINC000179158032 1034288643 /nfs/dbraw/zinc/28/86/43/1034288643.db2.gz DQOQXZOEWWFFSI-UHFFFAOYSA-N 1 1 301.346 3.623 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H](C)[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000480619834 1034355233 /nfs/dbraw/zinc/35/52/33/1034355233.db2.gz BHYAQNAHDNOUKT-BPUTZDHNSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000480619834 1034355242 /nfs/dbraw/zinc/35/52/42/1034355242.db2.gz BHYAQNAHDNOUKT-BPUTZDHNSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccccc2F)CC1 ZINC000183481577 1034390862 /nfs/dbraw/zinc/39/08/62/1034390862.db2.gz RVLSCPDUAUPKOY-UHFFFAOYSA-N 1 1 300.333 3.821 20 5 DHBDMO Cc1[nH+]ccn1Cc1ccc(Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC001174478250 1034437728 /nfs/dbraw/zinc/43/77/28/1034437728.db2.gz DQYVAEHEUANDHK-UHFFFAOYSA-N 1 1 308.341 3.892 20 5 DHBDMO CCCC[NH+]1CCC([NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000192844519 1034698373 /nfs/dbraw/zinc/69/83/73/1034698373.db2.gz IPKMWQDLYIDDNQ-GOSISDBHSA-N 1 1 319.449 3.900 20 5 DHBDMO CCCCN1CCC([NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000192844519 1034698380 /nfs/dbraw/zinc/69/83/80/1034698380.db2.gz IPKMWQDLYIDDNQ-GOSISDBHSA-N 1 1 319.449 3.900 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@@H](c2ccc(O)cc2)C1 ZINC000600213445 1034809379 /nfs/dbraw/zinc/80/93/79/1034809379.db2.gz FSTCMECIOWSGJD-MAVJXHJTSA-N 1 1 324.380 3.803 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H](c2ccc(O)cc2)C1 ZINC000600213447 1034809558 /nfs/dbraw/zinc/80/95/58/1034809558.db2.gz FSTCMECIOWSGJD-RCFWFJCLSA-N 1 1 324.380 3.803 20 5 DHBDMO Cc1c([C@H](C)NC[C@@H](C)[NH+]2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000481976597 1035039823 /nfs/dbraw/zinc/03/98/23/1035039823.db2.gz ZYVGDHXZXASOHM-ZBFHGGJFSA-N 1 1 319.449 3.674 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCCC[C@@H](C2CCOCC2)C1 ZINC001175688273 1035084527 /nfs/dbraw/zinc/08/45/27/1035084527.db2.gz OJAFLUPMFKTPJQ-MRXNPFEDSA-N 1 1 318.417 3.624 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@H](CF)C2)c1 ZINC001175732999 1035095716 /nfs/dbraw/zinc/09/57/16/1035095716.db2.gz KAPRMJJEYIYAHG-SNVBAGLBSA-N 1 1 320.286 3.795 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H](CF)C2)c1 ZINC001175732999 1035095725 /nfs/dbraw/zinc/09/57/25/1035095725.db2.gz KAPRMJJEYIYAHG-SNVBAGLBSA-N 1 1 320.286 3.795 20 5 DHBDMO C[C@@H](C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)(C)C ZINC001175982324 1035173681 /nfs/dbraw/zinc/17/36/81/1035173681.db2.gz FOHFHENIAMQZDN-NSHDSACASA-N 1 1 304.394 3.585 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1CCN[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000482954619 1035205758 /nfs/dbraw/zinc/20/57/58/1035205758.db2.gz FDRVNKQHJLKRDX-GDBMZVCRSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@@H]1CCCCN1CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000482954619 1035205761 /nfs/dbraw/zinc/20/57/61/1035205761.db2.gz FDRVNKQHJLKRDX-GDBMZVCRSA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+](CC2CC2)C2CCC2)cc1 ZINC000483303335 1035254929 /nfs/dbraw/zinc/25/49/29/1035254929.db2.gz MDOWNCKEVOWQBU-UHFFFAOYSA-N 1 1 304.390 3.628 20 5 DHBDMO CC1(C)C[C@H](c2ccccc2)C[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001176657007 1035316326 /nfs/dbraw/zinc/31/63/26/1035316326.db2.gz MXUQCFQVSJGABW-INIZCTEOSA-N 1 1 311.385 3.758 20 5 DHBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)C1(C)C ZINC001179962936 1035560635 /nfs/dbraw/zinc/56/06/35/1035560635.db2.gz UPDWRBTUXOVUOX-WMZOPIPTSA-N 1 1 320.433 3.847 20 5 DHBDMO CSCCC[N@@H+](C)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001181154677 1035852588 /nfs/dbraw/zinc/85/25/88/1035852588.db2.gz SSAMGHHIEQMOMX-UHFFFAOYSA-N 1 1 322.352 3.799 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cc1 ZINC000152911843 1036026642 /nfs/dbraw/zinc/02/66/42/1036026642.db2.gz WXUAQOKSOHRWMV-KRWDZBQOSA-N 1 1 304.390 3.518 20 5 DHBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000773961618 1036071584 /nfs/dbraw/zinc/07/15/84/1036071584.db2.gz SOHKMDRUDHLXRH-MRXNPFEDSA-N 1 1 310.369 3.515 20 5 DHBDMO CC(C)[N@@H+](C/C=C/c1ccncc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000495079484 1036229016 /nfs/dbraw/zinc/22/90/16/1036229016.db2.gz NWWDXXKYTQIOKP-ONEGZZNKSA-N 1 1 311.385 3.914 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2cccc(F)c2[N+](=O)[O-])C1 ZINC000774520035 1036394259 /nfs/dbraw/zinc/39/42/59/1036394259.db2.gz YGHDFOMULAJOAR-HZSPNIEDSA-N 1 1 321.396 3.576 20 5 DHBDMO CC(C)C[N@@H+](Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C1CC1 ZINC000774635866 1036599272 /nfs/dbraw/zinc/59/92/72/1036599272.db2.gz SEYYFIDQZRYAPB-UHFFFAOYSA-N 1 1 322.796 3.676 20 5 DHBDMO CC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000301060623 1036730827 /nfs/dbraw/zinc/73/08/27/1036730827.db2.gz RBRZMROHHCLXLH-NSHDSACASA-N 1 1 317.311 3.510 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2ccc(F)cc2C)ccc1[N+](=O)[O-] ZINC000487964500 1036883350 /nfs/dbraw/zinc/88/33/50/1036883350.db2.gz UCZHOEWCYGJOHN-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H]1CCC[C@@H]1C ZINC000487967833 1036887346 /nfs/dbraw/zinc/88/73/46/1036887346.db2.gz CAWMKWPJMPMOCK-BBRMVZONSA-N 1 1 306.406 3.540 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000492626169 1036948557 /nfs/dbraw/zinc/94/85/57/1036948557.db2.gz ADUDZTSSWMVBJP-CABCVRRESA-N 1 1 304.390 3.758 20 5 DHBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1F ZINC001185098252 1037025465 /nfs/dbraw/zinc/02/54/65/1037025465.db2.gz KISLLCCZTMOWBI-CQSZACIVSA-N 1 1 309.385 3.800 20 5 DHBDMO CCC(CC)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000774834128 1037037775 /nfs/dbraw/zinc/03/77/75/1037037775.db2.gz BHCAQFIKPDHGSA-UHFFFAOYSA-N 1 1 307.350 3.656 20 5 DHBDMO CC[C@@H](C)C[N@@H+](CC)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000489353376 1037370257 /nfs/dbraw/zinc/37/02/57/1037370257.db2.gz GXLFBDGEEKHZCT-TZMCWYRMSA-N 1 1 321.421 3.598 20 5 DHBDMO C[N@H+](CCc1ccccc1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493499779 1037466279 /nfs/dbraw/zinc/46/62/79/1037466279.db2.gz GQVVUHLCZGFQME-UHFFFAOYSA-N 1 1 304.777 3.923 20 5 DHBDMO C[N@@H+](CCc1ccccc1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493499779 1037466297 /nfs/dbraw/zinc/46/62/97/1037466297.db2.gz GQVVUHLCZGFQME-UHFFFAOYSA-N 1 1 304.777 3.923 20 5 DHBDMO CCn1nc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c2ccccc21 ZINC000326377258 1037534477 /nfs/dbraw/zinc/53/44/77/1037534477.db2.gz LBDUQMQRNGQYKT-UHFFFAOYSA-N 1 1 324.384 3.563 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916152453 1037706134 /nfs/dbraw/zinc/70/61/34/1037706134.db2.gz RRASUSUCVDBURE-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916152453 1037706149 /nfs/dbraw/zinc/70/61/49/1037706149.db2.gz RRASUSUCVDBURE-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO CC[C@H](C)[C@H](C)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000154010930 1037767756 /nfs/dbraw/zinc/76/77/56/1037767756.db2.gz HLPGKZISNNWETR-DCGLDWPTSA-N 1 1 306.406 3.527 20 5 DHBDMO CCC[C@H](NC1CC[NH+](C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000122841160 1037811238 /nfs/dbraw/zinc/81/12/38/1037811238.db2.gz SMYFPTYSXFNEJS-SFHVURJKSA-N 1 1 317.433 3.652 20 5 DHBDMO CC(C)CCOCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000490798911 1037815005 /nfs/dbraw/zinc/81/50/05/1037815005.db2.gz CRDSLRPPSNZUDJ-UHFFFAOYSA-N 1 1 306.406 3.622 20 5 DHBDMO CC(C)(C)[C@H]1CCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609195444 1038072552 /nfs/dbraw/zinc/07/25/52/1038072552.db2.gz VRYGITVMAFQRJG-MRXNPFEDSA-N 1 1 306.406 3.874 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](C)C(C)(C)C ZINC000164537154 1038205994 /nfs/dbraw/zinc/20/59/94/1038205994.db2.gz PDUVHFKJXHGTLO-ZDUSSCGKSA-N 1 1 321.421 3.598 20 5 DHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1sccc1[N+](=O)[O-] ZINC000588858618 1038389688 /nfs/dbraw/zinc/38/96/88/1038389688.db2.gz LZARTDFJACYERA-GFCCVEGCSA-N 1 1 305.403 3.589 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000589200248 1038449132 /nfs/dbraw/zinc/44/91/32/1038449132.db2.gz YAOKVPOMRWAKTB-JKSUJKDBSA-N 1 1 318.417 3.542 20 5 DHBDMO CC(C)C[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001191899509 1038564690 /nfs/dbraw/zinc/56/46/90/1038564690.db2.gz LFLSIMPTJGIVGF-AWEZNQCLSA-N 1 1 321.377 3.904 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H](c3ccccn3)C2)cccc1[N+](=O)[O-] ZINC000590601876 1038676484 /nfs/dbraw/zinc/67/64/84/1038676484.db2.gz SHBPDMILCXDEBY-MRXNPFEDSA-N 1 1 311.385 3.678 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cnc(C2CC2)o1 ZINC000590780119 1038704365 /nfs/dbraw/zinc/70/43/65/1038704365.db2.gz JIAQZBNSGYXFRA-NSHDSACASA-N 1 1 301.346 3.619 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000591582331 1038940035 /nfs/dbraw/zinc/94/00/35/1038940035.db2.gz IMLRPSWNBHWWQC-WBVHZDCISA-N 1 1 317.433 3.700 20 5 DHBDMO C[C@@H](NC[C@@H]1CC[N@@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599065718 1039023152 /nfs/dbraw/zinc/02/31/52/1039023152.db2.gz PWZYYUYQJMSBEL-KDOFPFPSSA-N 1 1 317.433 3.652 20 5 DHBDMO C[C@@H](NC[C@@H]1CC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599065718 1039023170 /nfs/dbraw/zinc/02/31/70/1039023170.db2.gz PWZYYUYQJMSBEL-KDOFPFPSSA-N 1 1 317.433 3.652 20 5 DHBDMO CCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000603838253 1039170805 /nfs/dbraw/zinc/17/08/05/1039170805.db2.gz RFYZBEILJPMMOI-UHFFFAOYSA-N 1 1 314.385 3.886 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)cccc1[N+](=O)[O-] ZINC000604484504 1039480958 /nfs/dbraw/zinc/48/09/58/1039480958.db2.gz YYHSXROKWLIIET-SFHVURJKSA-N 1 1 312.369 3.946 20 5 DHBDMO CC(C)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccco1 ZINC000604492518 1039486143 /nfs/dbraw/zinc/48/61/43/1039486143.db2.gz SDOWSCPWWLDDHO-UHFFFAOYSA-N 1 1 318.373 3.867 20 5 DHBDMO CC[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000061758233 1039545091 /nfs/dbraw/zinc/54/50/91/1039545091.db2.gz SITATWVQLNSONQ-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO CC[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000061758233 1039545106 /nfs/dbraw/zinc/54/51/06/1039545106.db2.gz SITATWVQLNSONQ-UHFFFAOYSA-N 1 1 300.358 3.626 20 5 DHBDMO Cc1cc(NCCC[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000058940590 1039630136 /nfs/dbraw/zinc/63/01/36/1039630136.db2.gz AEXRZVYWARIFNM-UHFFFAOYSA-N 1 1 313.401 3.837 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594026276 1039951082 /nfs/dbraw/zinc/95/10/82/1039951082.db2.gz HYUUKDDALPPGGR-SUMWQHHRSA-N 1 1 304.390 3.689 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccccc1F ZINC000595007629 1040018187 /nfs/dbraw/zinc/01/81/87/1040018187.db2.gz PCMYOPIVHQFGGS-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO Cc1noc(C[N@H+](Cc2ccccc2)CC(C)C)c1[N+](=O)[O-] ZINC000595297457 1040091925 /nfs/dbraw/zinc/09/19/25/1040091925.db2.gz URUSXGGNAIVDQH-UHFFFAOYSA-N 1 1 303.362 3.549 20 5 DHBDMO Cc1noc(C[N@@H+](Cc2ccccc2)CC(C)C)c1[N+](=O)[O-] ZINC000595297457 1040091945 /nfs/dbraw/zinc/09/19/45/1040091945.db2.gz URUSXGGNAIVDQH-UHFFFAOYSA-N 1 1 303.362 3.549 20 5 DHBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)Cc1onc(C)c1[N+](=O)[O-] ZINC000595328612 1040100656 /nfs/dbraw/zinc/10/06/56/1040100656.db2.gz WOZAEHJDJIQOOQ-OAHLLOKOSA-N 1 1 317.389 3.653 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@@H](c3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000595324889 1040108468 /nfs/dbraw/zinc/10/84/68/1040108468.db2.gz CRBJREOPFBZFGH-IUODEOHRSA-N 1 1 315.373 3.517 20 5 DHBDMO CCc1ccc([C@@H]([NH2+]Cc2onc(C)c2[N+](=O)[O-])C(C)C)cc1 ZINC000595351283 1040124823 /nfs/dbraw/zinc/12/48/23/1040124823.db2.gz QBJSVLXLBMFCML-INIZCTEOSA-N 1 1 317.389 3.941 20 5 DHBDMO CC(C)([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(F)c1 ZINC000595416102 1040132317 /nfs/dbraw/zinc/13/23/17/1040132317.db2.gz GLUXHAMIIXYKGN-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](CC2CC2)c2ccccc2)c1[N+](=O)[O-] ZINC000595416015 1040133169 /nfs/dbraw/zinc/13/31/69/1040133169.db2.gz FFLHNAWPNZWWOZ-AWEZNQCLSA-N 1 1 301.346 3.522 20 5 DHBDMO CC(C)Oc1ccnc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000593020930 1040150120 /nfs/dbraw/zinc/15/01/20/1040150120.db2.gz IKHHGVCBMUZAPG-CYBMUJFWSA-N 1 1 315.373 3.628 20 5 DHBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000595497960 1040154449 /nfs/dbraw/zinc/15/44/49/1040154449.db2.gz PLJSPZQLYZHRLQ-UHFFFAOYSA-N 1 1 302.296 3.744 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000595551040 1040171080 /nfs/dbraw/zinc/17/10/80/1040171080.db2.gz KCIIEFRGBILWRL-JTQLQIEISA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000595551040 1040171086 /nfs/dbraw/zinc/17/10/86/1040171086.db2.gz KCIIEFRGBILWRL-JTQLQIEISA-N 1 1 320.286 3.898 20 5 DHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCc2ccccc21 ZINC000491205468 1040184885 /nfs/dbraw/zinc/18/48/85/1040184885.db2.gz OTJZHVXKENBLJQ-KRWDZBQOSA-N 1 1 300.333 3.853 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCc2ccccc21 ZINC000491205468 1040184893 /nfs/dbraw/zinc/18/48/93/1040184893.db2.gz OTJZHVXKENBLJQ-KRWDZBQOSA-N 1 1 300.333 3.853 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2c2c(C)cccc2C)c1[N+](=O)[O-] ZINC000595599782 1040201557 /nfs/dbraw/zinc/20/15/57/1040201557.db2.gz CHIRROPTUMJAMB-CQSZACIVSA-N 1 1 315.373 3.845 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CCF)C1 ZINC000595755966 1040242837 /nfs/dbraw/zinc/24/28/37/1040242837.db2.gz RZCMHGLVTAPENO-CYBMUJFWSA-N 1 1 310.369 3.565 20 5 DHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000174032422 1040501357 /nfs/dbraw/zinc/50/13/57/1040501357.db2.gz IOPHLDBOQBQRMF-LLVKDONJSA-N 1 1 300.399 3.697 20 5 DHBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000608856171 1040638883 /nfs/dbraw/zinc/63/88/83/1040638883.db2.gz ZZJGVXVZFNHWSP-LBPRGKRZSA-N 1 1 309.385 3.656 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCOC2(CCCCC2)C1 ZINC000075832381 1040827391 /nfs/dbraw/zinc/82/73/91/1040827391.db2.gz CKCFFXLZQQSSLH-CQSZACIVSA-N 1 1 304.390 3.691 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCOC2(CCCCC2)C1 ZINC000075832381 1040827394 /nfs/dbraw/zinc/82/73/94/1040827394.db2.gz CKCFFXLZQQSSLH-CQSZACIVSA-N 1 1 304.390 3.691 20 5 DHBDMO CCCC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@H](C)c1ccc(C)o1 ZINC000602448822 1041040151 /nfs/dbraw/zinc/04/01/51/1041040151.db2.gz QOKUPAMAEOOKTH-CYBMUJFWSA-N 1 1 320.393 3.593 20 5 DHBDMO CCCC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@H](C)c1ccc(C)o1 ZINC000602448822 1041040162 /nfs/dbraw/zinc/04/01/62/1041040162.db2.gz QOKUPAMAEOOKTH-CYBMUJFWSA-N 1 1 320.393 3.593 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(CNc3cccc(C4CC4)[nH+]3)nc2c1 ZINC000602677229 1041159619 /nfs/dbraw/zinc/15/96/19/1041159619.db2.gz XDAVVGUJORUXHP-UHFFFAOYSA-N 1 1 310.313 3.621 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2cccnc2)C1 ZINC000602852128 1041258889 /nfs/dbraw/zinc/25/88/89/1041258889.db2.gz CPMDOLVEWLGXOS-HOCLYGCPSA-N 1 1 311.385 3.930 20 5 DHBDMO Cc1cc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)ccn1 ZINC000598619158 1041361506 /nfs/dbraw/zinc/36/15/06/1041361506.db2.gz BZLHQFQKDOBSCH-QGZVFWFLSA-N 1 1 311.385 3.678 20 5 DHBDMO CCC[C@H]([NH2+][C@@H](C)Cc1cc(C)[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000090527793 185300737 /nfs/dbraw/zinc/30/07/37/185300737.db2.gz FMOIEZSJIFVZGK-SJCJKPOMSA-N 1 1 316.405 3.688 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000275811552 130390605 /nfs/dbraw/zinc/39/06/05/130390605.db2.gz IFAOSXJXBAVRLY-MRXNPFEDSA-N 1 1 324.808 3.639 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCOC(C)(C)C1 ZINC000289365414 131378909 /nfs/dbraw/zinc/37/89/09/131378909.db2.gz ATMUBYBWVAHOIL-AWEZNQCLSA-N 1 1 310.369 3.513 20 5 DHBDMO CC[C@@H]([NH2+][C@@H](C)c1nccn1CC)c1cccc([N+](=O)[O-])c1 ZINC000297689096 132028967 /nfs/dbraw/zinc/02/89/67/132028967.db2.gz LUNWNXFKCRIWAX-SWLSCSKDSA-N 1 1 302.378 3.613 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000119768679 132137163 /nfs/dbraw/zinc/13/71/63/132137163.db2.gz YTGSRMJIAWHQMP-OAHLLOKOSA-N 1 1 306.406 3.577 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@](F)(c3ccccc3)C2)cc1 ZINC000563861023 335068309 /nfs/dbraw/zinc/06/83/09/335068309.db2.gz BQVZNQQWVDOXOO-SFHVURJKSA-N 1 1 314.360 3.708 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000556509243 331710606 /nfs/dbraw/zinc/71/06/06/331710606.db2.gz XJMHKOIQFDIAQJ-UHFFFAOYSA-N 1 1 302.296 3.759 20 5 DHBDMO Cc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc(C)c1O ZINC000518440462 332040632 /nfs/dbraw/zinc/04/06/32/332040632.db2.gz USKAPCVRAYQLEK-UHFFFAOYSA-N 1 1 314.385 3.592 20 5 DHBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000409868350 332061928 /nfs/dbraw/zinc/06/19/28/332061928.db2.gz DEEIBHJTYOGUIF-UHFFFAOYSA-N 1 1 319.405 3.578 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1c2ccc(F)cc2O[C@@H]1C ZINC000569405709 332076911 /nfs/dbraw/zinc/07/69/11/332076911.db2.gz QJDCNIRZTJTEHB-PIGZYNQJSA-N 1 1 316.332 3.654 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3CCC[C@@H]3F)cs2)c1 ZINC000559358446 332127630 /nfs/dbraw/zinc/12/76/30/332127630.db2.gz LEDLUYHHASTHLO-UONOGXRCSA-N 1 1 321.377 3.699 20 5 DHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000559431931 332258549 /nfs/dbraw/zinc/25/85/49/332258549.db2.gz MHKLYXURHBLFSG-UONOGXRCSA-N 1 1 304.390 3.614 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H](CC(C)C)[NH+](C)C)cc1[N+](=O)[O-] ZINC000314069988 333085751 /nfs/dbraw/zinc/08/57/51/333085751.db2.gz SSYCSSRLIDMEQJ-HOCLYGCPSA-N 1 1 307.438 3.530 20 5 DHBDMO CC[C@H]([NH2+]CCN(C(C)C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000314391068 333107858 /nfs/dbraw/zinc/10/78/58/333107858.db2.gz SGDFUBMLSKTCCQ-KRWDZBQOSA-N 1 1 307.438 3.754 20 5 DHBDMO COc1cc(NCCC[N@@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000390173532 333240364 /nfs/dbraw/zinc/24/03/64/333240364.db2.gz GGHOHRRCALKWOW-UHFFFAOYSA-N 1 1 321.421 3.670 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2(CF)CCC2)o1 ZINC000563123467 333394531 /nfs/dbraw/zinc/39/45/31/333394531.db2.gz UPOHXKXSKIKQKN-UHFFFAOYSA-N 1 1 304.321 3.837 20 5 DHBDMO C[C@@H](c1cccc(F)c1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000535245735 334381959 /nfs/dbraw/zinc/38/19/59/334381959.db2.gz DYBJWVASEQXLSD-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@@H](c1cccc(F)c1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000535245735 334381961 /nfs/dbraw/zinc/38/19/61/334381961.db2.gz DYBJWVASEQXLSD-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO CC[C@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000340874725 334392196 /nfs/dbraw/zinc/39/21/96/334392196.db2.gz JBMMLUXPDQXECC-AWEZNQCLSA-N 1 1 301.346 3.624 20 5 DHBDMO COc1ccsc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000341560071 334452382 /nfs/dbraw/zinc/45/23/82/334452382.db2.gz ZUERIJHVJQVVNX-UHFFFAOYSA-N 1 1 312.778 3.608 20 5 DHBDMO CC1CCC(O)(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000343920339 335202121 /nfs/dbraw/zinc/20/21/21/335202121.db2.gz ADPJRSYVHYLBEJ-UHFFFAOYSA-N 1 1 318.417 3.500 20 5 DHBDMO CC[C@@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000344096565 335217796 /nfs/dbraw/zinc/21/77/96/335217796.db2.gz HGAJQAZQJMIKKM-HZPDHXFCSA-N 1 1 316.332 3.908 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352540040 336223400 /nfs/dbraw/zinc/22/34/00/336223400.db2.gz GMMBQHHVSVAOKB-KGLIPLIRSA-N 1 1 324.446 3.709 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC=C(c3ccco3)C2)c(F)c1 ZINC000352561844 336224737 /nfs/dbraw/zinc/22/47/37/336224737.db2.gz HYYPVSNSJITHLL-UHFFFAOYSA-N 1 1 302.305 3.616 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC=C(c3ccco3)C2)c(F)c1 ZINC000352561844 336224738 /nfs/dbraw/zinc/22/47/38/336224738.db2.gz HYYPVSNSJITHLL-UHFFFAOYSA-N 1 1 302.305 3.616 20 5 DHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000352609240 336226754 /nfs/dbraw/zinc/22/67/54/336226754.db2.gz SALKKCBUKOQYLW-NSHDSACASA-N 1 1 300.399 3.697 20 5 DHBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2sccc2C1 ZINC000301088904 336289419 /nfs/dbraw/zinc/28/94/19/336289419.db2.gz LUFSOFQKKIGCFO-GFCCVEGCSA-N 1 1 317.414 3.515 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c1 ZINC000301820322 336332207 /nfs/dbraw/zinc/33/22/07/336332207.db2.gz AZOGLEDBFXYNEN-MAUKXSAKSA-N 1 1 311.385 3.761 20 5 DHBDMO O=[N+]([O-])c1ccsc1NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000301923568 336338329 /nfs/dbraw/zinc/33/83/29/336338329.db2.gz FXMYANRFHSPHTG-ZDUSSCGKSA-N 1 1 321.402 3.888 20 5 DHBDMO O=[N+]([O-])c1ccsc1N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000301978221 336341055 /nfs/dbraw/zinc/34/10/55/336341055.db2.gz DYHJPVJOJXWFHZ-AWEZNQCLSA-N 1 1 317.414 3.733 20 5 DHBDMO CC[C@@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000353883861 336445825 /nfs/dbraw/zinc/44/58/25/336445825.db2.gz VPAQOAGCHRWHTQ-HZPDHXFCSA-N 1 1 314.389 3.520 20 5 DHBDMO C[C@H]([NH2+][C@H]1c2ccc(F)cc2O[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000367575454 336825634 /nfs/dbraw/zinc/82/56/34/336825634.db2.gz KUHVYQINEZDXEC-WVQJBOLRSA-N 1 1 316.332 3.907 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ncoc2-c2ccccc2)cc1 ZINC000372783987 336939540 /nfs/dbraw/zinc/93/95/40/336939540.db2.gz BNRULXKXDHMGOZ-UHFFFAOYSA-N 1 1 309.325 3.540 20 5 DHBDMO Cc1ccncc1C1=CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000375004460 337001390 /nfs/dbraw/zinc/00/13/90/337001390.db2.gz KEEBHUUHHJOQRU-UHFFFAOYSA-N 1 1 309.369 3.588 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000375238523 337006417 /nfs/dbraw/zinc/00/64/17/337006417.db2.gz RIKMZOBGOGPGAT-CABCVRRESA-N 1 1 318.417 3.855 20 5 DHBDMO CC[C@H](c1ccccc1)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000375395216 337010362 /nfs/dbraw/zinc/01/03/62/337010362.db2.gz XBRYYSORHFZSSK-NVXWUHKLSA-N 1 1 314.389 3.580 20 5 DHBDMO COC[C@@H]1CCCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000376389886 337032453 /nfs/dbraw/zinc/03/24/53/337032453.db2.gz YKZFMFOGKPUCRN-LSDHHAIUSA-N 1 1 306.406 3.713 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000173404583 337135166 /nfs/dbraw/zinc/13/51/66/337135166.db2.gz RTDNVRRHHGRNHZ-BZNIZROVSA-N 1 1 316.332 3.908 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000182674152 337189337 /nfs/dbraw/zinc/18/93/37/337189337.db2.gz QSVNWUIPYKGSOI-KGLIPLIRSA-N 1 1 314.389 3.567 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000183312777 337192851 /nfs/dbraw/zinc/19/28/51/337192851.db2.gz OZSBHXBXRUKKBF-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2nc3ccccc3n2C2CC2)c1 ZINC000184775940 337201043 /nfs/dbraw/zinc/20/10/43/337201043.db2.gz AICOBRHMSGDXGB-UHFFFAOYSA-N 1 1 322.368 3.569 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)cs1 ZINC000186168118 337254252 /nfs/dbraw/zinc/25/42/52/337254252.db2.gz RKCUVRMLPVZQFZ-UHFFFAOYSA-N 1 1 300.383 3.704 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2Cc3ccccc3C3(CC3)C2)cs1 ZINC000186168118 337254253 /nfs/dbraw/zinc/25/42/53/337254253.db2.gz RKCUVRMLPVZQFZ-UHFFFAOYSA-N 1 1 300.383 3.704 20 5 DHBDMO Cc1nc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)sc1C ZINC000076904367 337574439 /nfs/dbraw/zinc/57/44/39/337574439.db2.gz MNKGNDPWNHUZQH-UHFFFAOYSA-N 1 1 305.403 3.693 20 5 DHBDMO CCc1nocc1C[N@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000516324626 338010826 /nfs/dbraw/zinc/01/08/26/338010826.db2.gz WEQYLFONXSFZQZ-MDWZMJQESA-N 1 1 315.373 3.681 20 5 DHBDMO CCc1nocc1C[N@@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000516324626 338010827 /nfs/dbraw/zinc/01/08/27/338010827.db2.gz WEQYLFONXSFZQZ-MDWZMJQESA-N 1 1 315.373 3.681 20 5 DHBDMO Cc1nc(C(C)C)oc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000428936455 338065443 /nfs/dbraw/zinc/06/54/43/338065443.db2.gz AWOWMJLAWPIEMY-UHFFFAOYSA-N 1 1 317.389 3.689 20 5 DHBDMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000429583813 338085205 /nfs/dbraw/zinc/08/52/05/338085205.db2.gz BWBKOAWUTVGRNN-MLGOLLRUSA-N 1 1 315.373 3.870 20 5 DHBDMO CSC[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000430192892 338100475 /nfs/dbraw/zinc/10/04/75/338100475.db2.gz DRCSSUOYQRFSPH-BMWLXYDHSA-N 1 1 306.431 3.683 20 5 DHBDMO C[C@H]1CC[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000433046842 338178218 /nfs/dbraw/zinc/17/82/18/338178218.db2.gz QPHPXSHNTALTBI-JQWIXIFHSA-N 1 1 314.332 3.817 20 5 DHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])nc2)cc1 ZINC000433414961 338194938 /nfs/dbraw/zinc/19/49/38/338194938.db2.gz PQACXFCVPSMQNY-GFCCVEGCSA-N 1 1 323.356 3.657 20 5 DHBDMO CC(C)CCO[C@@H]1CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000434978173 338228243 /nfs/dbraw/zinc/22/82/43/338228243.db2.gz UOLUVMHIIIDNEH-HUUCEWRRSA-N 1 1 306.406 3.793 20 5 DHBDMO C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000435236468 338234984 /nfs/dbraw/zinc/23/49/84/338234984.db2.gz SNOULLXOYKGRLC-UHFFFAOYSA-N 1 1 322.311 3.828 20 5 DHBDMO C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000435236468 338234985 /nfs/dbraw/zinc/23/49/85/338234985.db2.gz SNOULLXOYKGRLC-UHFFFAOYSA-N 1 1 322.311 3.828 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000439886447 338380142 /nfs/dbraw/zinc/38/01/42/338380142.db2.gz GNEIPZHGBJTYTN-GOEBONIOSA-N 1 1 311.385 3.842 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000439886446 338380166 /nfs/dbraw/zinc/38/01/66/338380166.db2.gz GNEIPZHGBJTYTN-GDBMZVCRSA-N 1 1 311.385 3.842 20 5 DHBDMO CC(C)c1ccc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)cc1[N+](=O)[O-] ZINC000449573049 338639090 /nfs/dbraw/zinc/63/90/90/338639090.db2.gz PGCULOAEDJOMTR-DOMZBBRYSA-N 1 1 314.389 3.710 20 5 DHBDMO C[C@@H](C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000459786115 339048465 /nfs/dbraw/zinc/04/84/65/339048465.db2.gz BBSVJXBEKNQNPX-STQMWFEESA-N 1 1 322.405 3.565 20 5 DHBDMO COc1cc(C[N@@H+](C)C[C@H]2CC=CCC2)c([N+](=O)[O-])cc1F ZINC000464501413 339143708 /nfs/dbraw/zinc/14/37/08/339143708.db2.gz VLYRBAIHLJZPMY-LBPRGKRZSA-N 1 1 308.353 3.531 20 5 DHBDMO COc1cc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000464678513 339148441 /nfs/dbraw/zinc/14/84/41/339148441.db2.gz PMWBRAYMBBPFNP-JMSVASOKSA-N 1 1 322.380 3.896 20 5 DHBDMO CC(C)[C@@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000464770823 339152113 /nfs/dbraw/zinc/15/21/13/339152113.db2.gz JXYPHKUCSMADSG-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000464770823 339152114 /nfs/dbraw/zinc/15/21/14/339152114.db2.gz JXYPHKUCSMADSG-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000464845770 339157235 /nfs/dbraw/zinc/15/72/35/339157235.db2.gz HFMFXSHOPUEXBA-OKILXGFUSA-N 1 1 304.390 3.614 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000471029991 339335025 /nfs/dbraw/zinc/33/50/25/339335025.db2.gz JBYLSIUDVLGBTB-ACJLOTCBSA-N 1 1 312.369 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000471029991 339335026 /nfs/dbraw/zinc/33/50/26/339335026.db2.gz JBYLSIUDVLGBTB-ACJLOTCBSA-N 1 1 312.369 3.796 20 5 DHBDMO C[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000471049526 339335787 /nfs/dbraw/zinc/33/57/87/339335787.db2.gz ZMAYKIHXMHJEGL-KSSFIOAISA-N 1 1 312.369 3.667 20 5 DHBDMO CC[N@@H+](CCc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505783251 340177803 /nfs/dbraw/zinc/17/78/03/340177803.db2.gz LRSMXYLTEWSSJX-UHFFFAOYSA-N 1 1 302.349 3.799 20 5 DHBDMO CCC[N@@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000506771655 340201529 /nfs/dbraw/zinc/20/15/29/340201529.db2.gz HXWRIMRSMLDHGR-UHFFFAOYSA-N 1 1 320.414 3.528 20 5 DHBDMO CCc1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000507154673 340209764 /nfs/dbraw/zinc/20/97/64/340209764.db2.gz KFZSJKMTVCUVIY-UHFFFAOYSA-N 1 1 317.414 3.778 20 5 DHBDMO CCc1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000507154673 340209765 /nfs/dbraw/zinc/20/97/65/340209765.db2.gz KFZSJKMTVCUVIY-UHFFFAOYSA-N 1 1 317.414 3.778 20 5 DHBDMO CC[C@H]1C[C@H](C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCO1 ZINC000507791524 340231544 /nfs/dbraw/zinc/23/15/44/340231544.db2.gz CQCORGJYFZINBD-QAPCUYQASA-N 1 1 318.417 3.764 20 5 DHBDMO CC[C@H]1C[C@@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000507793633 340231751 /nfs/dbraw/zinc/23/17/51/340231751.db2.gz HURPCPBVKZMFJD-YOEHRIQHSA-N 1 1 318.417 3.764 20 5 DHBDMO CC(C)([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1cccs1 ZINC000508965727 340256424 /nfs/dbraw/zinc/25/64/24/340256424.db2.gz HWVOHDZLUKBICQ-UHFFFAOYSA-N 1 1 312.341 3.959 20 5 DHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000302862967 340284602 /nfs/dbraw/zinc/28/46/02/340284602.db2.gz UMKBLERPEQQHOE-KRWDZBQOSA-N 1 1 311.385 3.671 20 5 DHBDMO C[C@H](N[C@@H]1CC[N@@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173453277 340365428 /nfs/dbraw/zinc/36/54/28/340365428.db2.gz UIWWGICLQYDETC-WMLDXEAASA-N 1 1 317.433 3.510 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCN(CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173453277 340365429 /nfs/dbraw/zinc/36/54/29/340365429.db2.gz UIWWGICLQYDETC-WMLDXEAASA-N 1 1 317.433 3.510 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC000513105693 340393419 /nfs/dbraw/zinc/39/34/19/340393419.db2.gz AFOKYLYNCJDRDE-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO Cc1ccc(CNc2[nH+]c3cc(F)ccc3n2C)cc1[N+](=O)[O-] ZINC000184253619 340491417 /nfs/dbraw/zinc/49/14/17/340491417.db2.gz DCXLVNXKGBVKBR-UHFFFAOYSA-N 1 1 314.320 3.541 20 5 DHBDMO Cc1c(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)cccc1[N+](=O)[O-] ZINC000237565785 340672136 /nfs/dbraw/zinc/67/21/36/340672136.db2.gz XVCCQGCXLAQSSC-NHYWBVRUSA-N 1 1 300.358 3.909 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC000543622012 341051479 /nfs/dbraw/zinc/05/14/79/341051479.db2.gz CMMMRFFGYXMZOF-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2cc(F)ccc2C1 ZINC000543622012 341051480 /nfs/dbraw/zinc/05/14/80/341051480.db2.gz CMMMRFFGYXMZOF-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000544608140 341088652 /nfs/dbraw/zinc/08/86/52/341088652.db2.gz LAAMMXFHYDXIBO-MLGOLLRUSA-N 1 1 300.358 3.909 20 5 DHBDMO C[C@@H]([NH2+][C@H]1COc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000545235659 341116402 /nfs/dbraw/zinc/11/64/02/341116402.db2.gz JPLRANUORHFKBN-BMIGLBTASA-N 1 1 302.305 3.518 20 5 DHBDMO CC[N@@H+](CCC1CC1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000546265604 341160295 /nfs/dbraw/zinc/16/02/95/341160295.db2.gz RBYHSMQOCHFKHS-UHFFFAOYSA-N 1 1 314.332 3.818 20 5 DHBDMO C[C@@H]1C[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H](C)S1 ZINC000548296105 341254851 /nfs/dbraw/zinc/25/48/51/341254851.db2.gz VNZPPFYMKPJEOV-NXEZZACHSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000245383898 341290151 /nfs/dbraw/zinc/29/01/51/341290151.db2.gz SGFUPQRHINDYCH-CMPLNLGQSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000245383898 341290152 /nfs/dbraw/zinc/29/01/52/341290152.db2.gz SGFUPQRHINDYCH-CMPLNLGQSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@@H](Cc1ccsc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549810762 341303690 /nfs/dbraw/zinc/30/36/90/341303690.db2.gz WUBXZMNDIZWXJQ-ZDUSSCGKSA-N 1 1 304.415 3.762 20 5 DHBDMO CC[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549865826 341305451 /nfs/dbraw/zinc/30/54/51/341305451.db2.gz GWYAKZRVTKSOSB-JTQLQIEISA-N 1 1 302.296 3.846 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(CC(F)(F)F)CC2)c1 ZINC000551711397 341349831 /nfs/dbraw/zinc/34/98/31/341349831.db2.gz WBDRCSJQHXBFQU-UHFFFAOYSA-N 1 1 302.296 3.759 20 5 DHBDMO C[C@@H](NCCC[N@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000248407887 341376746 /nfs/dbraw/zinc/37/67/46/341376746.db2.gz DQPPMXZAUPIVGS-HUUCEWRRSA-N 1 1 305.422 3.510 20 5 DHBDMO COC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(C)o1 ZINC000156445309 341621514 /nfs/dbraw/zinc/62/15/14/341621514.db2.gz ZJSZFVQMVRCHLT-HIFRSBDPSA-N 1 1 318.373 3.843 20 5 DHBDMO CC(C)c1[nH+]ccn1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000182824988 519879908 /nfs/dbraw/zinc/87/99/08/519879908.db2.gz LSOCYOPPIPUXPU-UHFFFAOYSA-N 1 1 312.329 3.618 20 5 DHBDMO CCCO[C@@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000108392736 520273155 /nfs/dbraw/zinc/27/31/55/520273155.db2.gz WSAXBULWCCNWRB-CYBMUJFWSA-N 1 1 310.369 3.515 20 5 DHBDMO CCC[N@@H+](C)C[C@@H]1CCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182822757 521491770 /nfs/dbraw/zinc/49/17/70/521491770.db2.gz KBKXAQKJQUWKOD-HOTGVXAUSA-N 1 1 319.449 3.628 20 5 DHBDMO COC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(C)o1 ZINC000156444721 522378307 /nfs/dbraw/zinc/37/83/07/522378307.db2.gz PBGKTDJGJQTBNZ-CZUORRHYSA-N 1 1 318.373 3.843 20 5 DHBDMO C[N@@H+](CCCCC(=O)OC(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC000181515376 522726864 /nfs/dbraw/zinc/72/68/64/522726864.db2.gz BXVWGVYPISTYFX-UHFFFAOYSA-N 1 1 322.405 3.539 20 5 DHBDMO CC[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1cccc([N+](=O)[O-])c1 ZINC000338018843 522914878 /nfs/dbraw/zinc/91/48/78/522914878.db2.gz ZQMCDWVYKZSSJV-MEDUHNTESA-N 1 1 303.337 3.931 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccncc1F ZINC000338018966 525564273 /nfs/dbraw/zinc/56/42/73/525564273.db2.gz GBUVXPXQIOKAGC-APPDUMDISA-N 1 1 315.348 3.857 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H]1c1cnn(C)c1 ZINC000245536635 526088812 /nfs/dbraw/zinc/08/88/12/526088812.db2.gz XPAQCXRGYUEYEQ-DYVFJYSZSA-N 1 1 314.389 3.535 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000772953342 1032076072 /nfs/dbraw/zinc/07/60/72/1032076072.db2.gz UKZQXVVYJGJGBF-GFCCVEGCSA-N 1 1 315.329 3.662 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000441462423 1013909447 /nfs/dbraw/zinc/90/94/47/1013909447.db2.gz IAWUHPUHBMWIPP-DVOMOZLQSA-N 1 1 304.390 3.756 20 5 DHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H]1CCOC(C)(C)C1 ZINC000580743291 1014327682 /nfs/dbraw/zinc/32/76/82/1014327682.db2.gz NQNADHZHEJFZGB-HNNXBMFYSA-N 1 1 306.406 3.683 20 5 DHBDMO CC[C@H](C)[C@@H](C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000520592051 1014362065 /nfs/dbraw/zinc/36/20/65/1014362065.db2.gz QQVRYINRDAJNFL-UONOGXRCSA-N 1 1 306.406 3.873 20 5 DHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCc1cccs1 ZINC000561847841 1032097025 /nfs/dbraw/zinc/09/70/25/1032097025.db2.gz YFASHEPCNFAZTA-UHFFFAOYSA-N 1 1 320.414 3.600 20 5 DHBDMO CC(C)(C)[N@H+]1CCCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000522107096 1014893177 /nfs/dbraw/zinc/89/31/77/1014893177.db2.gz GALKOSRVJNIIRU-UHFFFAOYSA-N 1 1 311.813 3.559 20 5 DHBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])c1C ZINC001167465600 1014902923 /nfs/dbraw/zinc/90/29/23/1014902923.db2.gz YMLJZTMQYQTESV-QGZVFWFLSA-N 1 1 311.385 3.944 20 5 DHBDMO Cc1cccc2nc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)cn21 ZINC000178059097 1014989609 /nfs/dbraw/zinc/98/96/09/1014989609.db2.gz FAZLRGHJGKWHKE-AWEZNQCLSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1noc(C)c1[C@H](C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000093633029 1015176240 /nfs/dbraw/zinc/17/62/40/1015176240.db2.gz ZKYHYKAAOVTVKG-QMMMGPOBSA-N 1 1 309.753 3.704 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](c3ccccc3F)C2)cs1 ZINC000337507177 1015299661 /nfs/dbraw/zinc/29/96/61/1015299661.db2.gz BSIGNDRLMSIFNB-LBPRGKRZSA-N 1 1 306.362 3.785 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3ccccc3F)C2)cs1 ZINC000337507177 1015299674 /nfs/dbraw/zinc/29/96/74/1015299674.db2.gz BSIGNDRLMSIFNB-LBPRGKRZSA-N 1 1 306.362 3.785 20 5 DHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000185644477 1015606362 /nfs/dbraw/zinc/60/63/62/1015606362.db2.gz VJKYQOQMLLSHCO-MLGOLLRUSA-N 1 1 315.373 3.870 20 5 DHBDMO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582704 1015634391 /nfs/dbraw/zinc/63/43/91/1015634391.db2.gz OMGVYBPJTZZBPH-GFCCVEGCSA-N 1 1 323.352 3.683 20 5 DHBDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582704 1015634398 /nfs/dbraw/zinc/63/43/98/1015634398.db2.gz OMGVYBPJTZZBPH-GFCCVEGCSA-N 1 1 323.352 3.683 20 5 DHBDMO CCOc1cc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)ccc1[N+](=O)[O-] ZINC000276931223 1015758140 /nfs/dbraw/zinc/75/81/40/1015758140.db2.gz QWQQXWHLGLAAHF-HNNXBMFYSA-N 1 1 315.373 3.659 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)ccc1[N+](=O)[O-] ZINC000276931223 1015758145 /nfs/dbraw/zinc/75/81/45/1015758145.db2.gz QWQQXWHLGLAAHF-HNNXBMFYSA-N 1 1 315.373 3.659 20 5 DHBDMO COc1ccc(C[N@@H+](Cc2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000051403083 1016320707 /nfs/dbraw/zinc/32/07/07/1016320707.db2.gz WDQXQDLPWVFUFV-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO C[C@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000178532449 1016326386 /nfs/dbraw/zinc/32/63/86/1016326386.db2.gz OHRGGJJWTJOJLB-XJKSGUPXSA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000178532449 1016326397 /nfs/dbraw/zinc/32/63/97/1016326397.db2.gz OHRGGJJWTJOJLB-XJKSGUPXSA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CC(C)(C)C ZINC000263818657 1016540161 /nfs/dbraw/zinc/54/01/61/1016540161.db2.gz WUZDPILOXLKGRQ-LLVKDONJSA-N 1 1 318.377 3.684 20 5 DHBDMO COc1cccc(C[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000072555572 1016555765 /nfs/dbraw/zinc/55/57/65/1016555765.db2.gz FFVJMKXGQSOTCD-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1cccc(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000072555572 1016555773 /nfs/dbraw/zinc/55/57/73/1016555773.db2.gz FFVJMKXGQSOTCD-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO CC(C)c1csc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)n1 ZINC000294900128 1032198790 /nfs/dbraw/zinc/19/87/90/1032198790.db2.gz VVJDXDHKEXUSSY-SNVBAGLBSA-N 1 1 320.418 3.608 20 5 DHBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@H]1C(C)(C)C ZINC001171297978 1032283190 /nfs/dbraw/zinc/28/31/90/1032283190.db2.gz QXCNDVIQCLANJW-IKGGRYGDSA-N 1 1 320.433 3.775 20 5 DHBDMO CCOc1cc(C[N@H+]2CCCC3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000348179374 1032490954 /nfs/dbraw/zinc/49/09/54/1032490954.db2.gz JMCDELCPXDFLRJ-UHFFFAOYSA-N 1 1 304.390 3.760 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccc(O)cc1 ZINC000514784946 1012438248 /nfs/dbraw/zinc/43/82/48/1012438248.db2.gz BENMHRUEBQMIJZ-GXDHUFHOSA-N 1 1 312.369 3.836 20 5 DHBDMO Cc1ccc([C@H](C)[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000515479749 1012637810 /nfs/dbraw/zinc/63/78/10/1012637810.db2.gz JVQGSUSWVMOJRB-HNNXBMFYSA-N 1 1 314.385 3.975 20 5 DHBDMO Cc1cc(NCCCC[N@@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000515550351 1012656964 /nfs/dbraw/zinc/65/69/64/1012656964.db2.gz LSCDKYAGBPQIDA-HNNXBMFYSA-N 1 1 305.422 3.970 20 5 DHBDMO C[C@@H](c1ccccc1F)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000515675386 1012692928 /nfs/dbraw/zinc/69/29/28/1012692928.db2.gz ZKRLGRQJUKRVHK-ZDUSSCGKSA-N 1 1 302.349 3.969 20 5 DHBDMO C[N@H+](CCCc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000609144084 1012816893 /nfs/dbraw/zinc/81/68/93/1012816893.db2.gz ZZRRLGONYWILMM-UHFFFAOYSA-N 1 1 302.349 3.799 20 5 DHBDMO C[N@@H+](CCCc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000609144084 1012816914 /nfs/dbraw/zinc/81/69/14/1012816914.db2.gz ZZRRLGONYWILMM-UHFFFAOYSA-N 1 1 302.349 3.799 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3(CF)CCC3)o2)cc1 ZINC000517235323 1012940445 /nfs/dbraw/zinc/94/04/45/1012940445.db2.gz HGNBAXWCRLMFIX-UHFFFAOYSA-N 1 1 304.321 3.837 20 5 DHBDMO CO[C@]1(C)CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000475552650 1017423830 /nfs/dbraw/zinc/42/38/30/1017423830.db2.gz XHQJYDKRYCCSMV-WTQUMQLASA-N 1 1 318.417 3.889 20 5 DHBDMO COc1cc(C[N@@H+](C)Cc2cc(C)cc(C)c2)ccc1[N+](=O)[O-] ZINC000444702390 1017641749 /nfs/dbraw/zinc/64/17/49/1017641749.db2.gz RGJXXAKUQOFVFO-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO Cc1ccc(F)c(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000444745309 1017658012 /nfs/dbraw/zinc/65/80/12/1017658012.db2.gz QLROHNVJJJJHJN-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO Cc1ccc(C)c(C[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000759643693 1017816632 /nfs/dbraw/zinc/81/66/32/1017816632.db2.gz KHVDUNPKPDGGBG-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO Cc1ccc(C)c(C[N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000759643693 1017816656 /nfs/dbraw/zinc/81/66/56/1017816656.db2.gz KHVDUNPKPDGGBG-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000613184936 1017971404 /nfs/dbraw/zinc/97/14/04/1017971404.db2.gz ZBACJVYBLUDEEV-OCCSQVGLSA-N 1 1 317.414 3.589 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H]2CC2(Cl)Cl)C2CC2)cc1 ZINC000764493178 1018293998 /nfs/dbraw/zinc/29/39/98/1018293998.db2.gz PEDQLZJLDXRPSS-LLVKDONJSA-N 1 1 315.200 3.753 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CC2(Cl)Cl)C2CC2)cc1 ZINC000764493178 1018294003 /nfs/dbraw/zinc/29/40/03/1018294003.db2.gz PEDQLZJLDXRPSS-LLVKDONJSA-N 1 1 315.200 3.753 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1csc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000041010475 1018349316 /nfs/dbraw/zinc/34/93/16/1018349316.db2.gz QMDBMKWEWPDDSI-OAHLLOKOSA-N 1 1 305.403 3.991 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCc1ccccc1Cl)C2 ZINC000536009017 1018415967 /nfs/dbraw/zinc/41/59/67/1018415967.db2.gz YYHMEGOZQJXGKR-UHFFFAOYSA-N 1 1 316.788 3.849 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764884345 1018415678 /nfs/dbraw/zinc/41/56/78/1018415678.db2.gz YLYWZQJJVBJQAI-TZMCWYRMSA-N 1 1 316.405 3.721 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1 ZINC000526001122 1018436374 /nfs/dbraw/zinc/43/63/74/1018436374.db2.gz JMFVGISCRCGFIT-HNNXBMFYSA-N 1 1 300.333 3.723 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000526001434 1018436492 /nfs/dbraw/zinc/43/64/92/1018436492.db2.gz WVDIGYUPYUVGJX-CQSZACIVSA-N 1 1 300.333 3.723 20 5 DHBDMO COc1ccc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000583578393 1018569754 /nfs/dbraw/zinc/56/97/54/1018569754.db2.gz OPEJTUOMXSGLGO-ZIAGYGMSSA-N 1 1 304.390 3.614 20 5 DHBDMO C[C@@H]1CC[C@@H](C)[NH+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000706480083 1018719383 /nfs/dbraw/zinc/71/93/83/1018719383.db2.gz YTIPVSFYBDKNSD-NXEZZACHSA-N 1 1 313.195 3.730 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278613692 1018926827 /nfs/dbraw/zinc/92/68/27/1018926827.db2.gz FQAZXPQOBRJMFV-WDEREUQCSA-N 1 1 302.296 3.930 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000278629974 1018956046 /nfs/dbraw/zinc/95/60/46/1018956046.db2.gz FHYFZHYJQKYREP-UHFFFAOYSA-N 1 1 314.263 3.805 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CC(Cc3ccc(F)cc3)C2)c(F)c1 ZINC000611173164 1019408291 /nfs/dbraw/zinc/40/82/91/1019408291.db2.gz ZCXZCHCLVXDCJU-UHFFFAOYSA-N 1 1 318.323 3.548 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cnc(C)s1 ZINC001119066975 1019655177 /nfs/dbraw/zinc/65/51/77/1019655177.db2.gz XVYBUUSEVFUHIM-SECBINFHSA-N 1 1 323.443 3.932 20 5 DHBDMO COc1ccc2c(c1)C[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000067462801 1019745809 /nfs/dbraw/zinc/74/58/09/1019745809.db2.gz JEQCGWRYADPKQS-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc2c(c1)C[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000067462801 1019745826 /nfs/dbraw/zinc/74/58/26/1019745826.db2.gz JEQCGWRYADPKQS-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO Cc1ccc(C[NH2+]C2(c3nccs3)CCCC2)cc1[N+](=O)[O-] ZINC000116374635 1019872953 /nfs/dbraw/zinc/87/29/53/1019872953.db2.gz MTRGKHSQNGVRDS-UHFFFAOYSA-N 1 1 317.414 3.919 20 5 DHBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C ZINC000316791939 1019939130 /nfs/dbraw/zinc/93/91/30/1019939130.db2.gz NWIVUCTWTJBQJP-ONGXEEELSA-N 1 1 317.311 3.508 20 5 DHBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000093445084 1020152099 /nfs/dbraw/zinc/15/20/99/1020152099.db2.gz CJXVVDXTPFSAER-QGZVFWFLSA-N 1 1 311.385 3.944 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000330711153 1020239156 /nfs/dbraw/zinc/23/91/56/1020239156.db2.gz PSEHKBWKZBGJJS-GDBMZVCRSA-N 1 1 318.417 3.713 20 5 DHBDMO CC[C@H](C)[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000179322601 1020252576 /nfs/dbraw/zinc/25/25/76/1020252576.db2.gz DHHFQIOPUBKELL-NSHDSACASA-N 1 1 305.403 3.949 20 5 DHBDMO C[C@H](c1ccncc1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000179676071 1020432853 /nfs/dbraw/zinc/43/28/53/1020432853.db2.gz QANDXBBDVHVCBX-LLVKDONJSA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000179676071 1020432859 /nfs/dbraw/zinc/43/28/59/1020432859.db2.gz QANDXBBDVHVCBX-LLVKDONJSA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@]1(F)CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000537721882 1032906467 /nfs/dbraw/zinc/90/64/67/1032906467.db2.gz RHXRZLCAEUGUAU-INIZCTEOSA-N 1 1 304.321 3.789 20 5 DHBDMO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000537721882 1032906479 /nfs/dbraw/zinc/90/64/79/1032906479.db2.gz RHXRZLCAEUGUAU-INIZCTEOSA-N 1 1 304.321 3.789 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000480658309 1020811724 /nfs/dbraw/zinc/81/17/24/1020811724.db2.gz AWQRZOPEQBDETG-JKSUJKDBSA-N 1 1 319.449 3.818 20 5 DHBDMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000580740461 1020854954 /nfs/dbraw/zinc/85/49/54/1020854954.db2.gz PJKPUUWVJXUHDI-CZUORRHYSA-N 1 1 314.385 3.986 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2c2ccsc2)cc1 ZINC000776273854 1021215182 /nfs/dbraw/zinc/21/51/82/1021215182.db2.gz AZCGGTHKQWXVTC-JKSUJKDBSA-N 1 1 318.398 3.527 20 5 DHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000177162093 1021220831 /nfs/dbraw/zinc/22/08/31/1021220831.db2.gz OHASXPCZORMQLU-INIZCTEOSA-N 1 1 303.362 3.748 20 5 DHBDMO CC(C)C[N@H+]1CCC[C@@H](CN[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000090585614 1021233227 /nfs/dbraw/zinc/23/32/27/1021233227.db2.gz IGDCFXTZXPQTQP-HOTGVXAUSA-N 1 1 319.449 3.613 20 5 DHBDMO Cc1cccc([C@H]2CCCC[N@@H+]2Cn2nccc2[N+](=O)[O-])c1C ZINC000743387175 1021278438 /nfs/dbraw/zinc/27/84/38/1021278438.db2.gz DQBREVZALBNSCA-MRXNPFEDSA-N 1 1 314.389 3.593 20 5 DHBDMO Cc1cccc([C@H]2CCCC[N@H+]2Cn2nccc2[N+](=O)[O-])c1C ZINC000743387175 1021278447 /nfs/dbraw/zinc/27/84/47/1021278447.db2.gz DQBREVZALBNSCA-MRXNPFEDSA-N 1 1 314.389 3.593 20 5 DHBDMO CCC[C@@]1(C)CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000743404568 1021287031 /nfs/dbraw/zinc/28/70/31/1021287031.db2.gz AGWDFIFGOMVMSS-KRWDZBQOSA-N 1 1 316.405 3.804 20 5 DHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000917620706 1021322320 /nfs/dbraw/zinc/32/23/20/1021322320.db2.gz VLZJOGDQRKPGLA-MRXNPFEDSA-N 1 1 314.389 3.557 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)cc1[N+](=O)[O-] ZINC000069752539 1021347718 /nfs/dbraw/zinc/34/77/18/1021347718.db2.gz WDALJSFOSTYZCY-DOMZBBRYSA-N 1 1 300.358 3.909 20 5 DHBDMO Cc1nc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000618565396 1021425941 /nfs/dbraw/zinc/42/59/41/1021425941.db2.gz WGFXBJBIMBMGJW-OAHLLOKOSA-N 1 1 303.387 3.527 20 5 DHBDMO CCC(CC)[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)C1CC1 ZINC000918178804 1021476404 /nfs/dbraw/zinc/47/64/04/1021476404.db2.gz JZJXJIPWLUHPSW-UHFFFAOYSA-N 1 1 302.378 3.555 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2C[C@@H](O)c3ccccc32)c(Cl)c1 ZINC000850371960 1021495431 /nfs/dbraw/zinc/49/54/31/1021495431.db2.gz NRAUXWOTCKTMNV-JKSUJKDBSA-N 1 1 318.760 3.516 20 5 DHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@H+]2C2CCCCC2)s1 ZINC000619549304 1021786673 /nfs/dbraw/zinc/78/66/73/1021786673.db2.gz BPOHYQIRIGDFEU-CYBMUJFWSA-N 1 1 309.435 3.865 20 5 DHBDMO CC[N@H+](Cc1ccc(C)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000746029528 1021831534 /nfs/dbraw/zinc/83/15/34/1021831534.db2.gz RZCINPWDOSUXOM-UHFFFAOYSA-N 1 1 324.384 3.733 20 5 DHBDMO CC(C)C[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)C1CCCC1 ZINC000746056009 1021837924 /nfs/dbraw/zinc/83/79/24/1021837924.db2.gz OQBIELUOJVNDKK-UHFFFAOYSA-N 1 1 316.405 3.803 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000851806409 1022008994 /nfs/dbraw/zinc/00/89/94/1022008994.db2.gz OTVZOKLQOYOSRQ-INIZCTEOSA-N 1 1 300.333 3.551 20 5 DHBDMO Cc1ccc([C@H]2[C@H](C)CCC[N@@H+]2Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000738284079 1022126961 /nfs/dbraw/zinc/12/69/61/1022126961.db2.gz JIKFJIPZXWGXAR-RHSMWYFYSA-N 1 1 314.389 3.530 20 5 DHBDMO Cc1ccc([C@H]2[C@H](C)CCC[N@H+]2Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000738284079 1022126964 /nfs/dbraw/zinc/12/69/64/1022126964.db2.gz JIKFJIPZXWGXAR-RHSMWYFYSA-N 1 1 314.389 3.530 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC([C@@H]2CCCCO2)CC1 ZINC000852593598 1022146124 /nfs/dbraw/zinc/14/61/24/1022146124.db2.gz IKNNEGPXTQKKIE-KRWDZBQOSA-N 1 1 322.380 3.515 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000852598747 1022146865 /nfs/dbraw/zinc/14/68/65/1022146865.db2.gz YNXOJINPNQGFSP-CXAGYDPISA-N 1 1 322.380 3.515 20 5 DHBDMO Cc1c(C[N@H+]2CCCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000609322704 1022202134 /nfs/dbraw/zinc/20/21/34/1022202134.db2.gz JBTPUJNQUZRLTR-UHFFFAOYSA-N 1 1 302.399 3.913 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCCC[C@@H]2c2ccccc2F)C1 ZINC001169030233 1022219497 /nfs/dbraw/zinc/21/94/97/1022219497.db2.gz XAZPJCZDPWPBBP-JKIFEVAISA-N 1 1 306.381 3.798 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H](Cc3ccc(F)cc3)C2)C1 ZINC001169039253 1022221441 /nfs/dbraw/zinc/22/14/41/1022221441.db2.gz OPOQLNQEQRNXCK-JZXOWHBKSA-N 1 1 320.408 3.526 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169048698 1022228675 /nfs/dbraw/zinc/22/86/75/1022228675.db2.gz AQLFKEAVWFOZLV-QMTHXVAHSA-N 1 1 317.216 3.871 20 5 DHBDMO CC[C@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104688356 1022231554 /nfs/dbraw/zinc/23/15/54/1022231554.db2.gz DCCOZHUQXXINHH-LBPRGKRZSA-N 1 1 303.362 3.523 20 5 DHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2cocn2)s1 ZINC000609354175 1022267985 /nfs/dbraw/zinc/26/79/85/1022267985.db2.gz QZMPTQDBUSEPMY-UHFFFAOYSA-N 1 1 315.354 3.601 20 5 DHBDMO C[N@@H+](CCCCC1CCOCC1)Cc1ccccc1[N+](=O)[O-] ZINC000282143266 1022279967 /nfs/dbraw/zinc/27/99/67/1022279967.db2.gz ZTLNLVKTFZPEPD-UHFFFAOYSA-N 1 1 306.406 3.624 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)cc1 ZINC000609800984 1022352147 /nfs/dbraw/zinc/35/21/47/1022352147.db2.gz ZJHDIHBMHQWWKD-QGZVFWFLSA-N 1 1 314.410 3.885 20 5 DHBDMO CCc1ccc(CC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC001169666403 1022493495 /nfs/dbraw/zinc/49/34/95/1022493495.db2.gz LICVHUJQALTOOZ-UHFFFAOYSA-N 1 1 312.413 3.874 20 5 DHBDMO CCn1ccc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000616786061 1022767711 /nfs/dbraw/zinc/76/77/11/1022767711.db2.gz BYOIKSBEDHHOJC-AWEZNQCLSA-N 1 1 301.390 3.918 20 5 DHBDMO CCn1ccc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000616786062 1022768347 /nfs/dbraw/zinc/76/83/47/1022768347.db2.gz BYOIKSBEDHHOJC-CQSZACIVSA-N 1 1 301.390 3.918 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cscn1 ZINC000566501827 1022836075 /nfs/dbraw/zinc/83/60/75/1022836075.db2.gz UKZQXAIRNRQMKX-IINYFYTJSA-N 1 1 303.387 3.780 20 5 DHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCc1ccccc1F ZINC000769029613 1023071364 /nfs/dbraw/zinc/07/13/64/1023071364.db2.gz LYDHWJSDCPBUGK-RMKNXTFCSA-N 1 1 314.360 3.922 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCc2ccccc2F)cc1[N+](=O)[O-] ZINC000769030581 1023072042 /nfs/dbraw/zinc/07/20/42/1023072042.db2.gz VUDBCXIIWLJNTD-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO CCC(C)(C)[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769379909 1023136206 /nfs/dbraw/zinc/13/62/06/1023136206.db2.gz CKPVYAOVZRMMDZ-UHFFFAOYSA-N 1 1 315.211 3.978 20 5 DHBDMO CCC(C)(C)[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769379909 1023136211 /nfs/dbraw/zinc/13/62/11/1023136211.db2.gz CKPVYAOVZRMMDZ-UHFFFAOYSA-N 1 1 315.211 3.978 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cc(O)cc(F)c1 ZINC000925690856 1023168882 /nfs/dbraw/zinc/16/88/82/1023168882.db2.gz HVNCAODMFXNGQD-MNOVXSKESA-N 1 1 304.321 3.851 20 5 DHBDMO C[C@H]1C[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000859412380 1033136807 /nfs/dbraw/zinc/13/68/07/1033136807.db2.gz TZXUMUQSZFRREP-UWVGGRQHSA-N 1 1 318.751 3.971 20 5 DHBDMO CC(C)[C@@H]1C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CCS1 ZINC000746675984 1023784294 /nfs/dbraw/zinc/78/42/94/1023784294.db2.gz WSWXXAAMHYIWIK-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO CC(C)[C@@H]1C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CCS1 ZINC000746675984 1023784299 /nfs/dbraw/zinc/78/42/99/1023784299.db2.gz WSWXXAAMHYIWIK-AWEZNQCLSA-N 1 1 314.838 3.822 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1c(C)noc1C ZINC000787405478 1023793668 /nfs/dbraw/zinc/79/36/68/1023793668.db2.gz CHGCTOQKYDALQR-WQLSENKSSA-N 1 1 315.373 3.735 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1F ZINC000788487021 1023893429 /nfs/dbraw/zinc/89/34/29/1023893429.db2.gz BCFCSAIJRVFGET-LSDHHAIUSA-N 1 1 310.394 3.594 20 5 DHBDMO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cn1 ZINC000266767092 1024044978 /nfs/dbraw/zinc/04/49/78/1024044978.db2.gz IKOFYDZSJXCUGS-QWHCGFSZSA-N 1 1 302.378 3.784 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)C)c[nH]2)cc1[N+](=O)[O-] ZINC000883029457 1024214571 /nfs/dbraw/zinc/21/45/71/1024214571.db2.gz USEWKTXMRDNHRC-GFCCVEGCSA-N 1 1 302.378 3.601 20 5 DHBDMO CC[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000453367958 1024490946 /nfs/dbraw/zinc/49/09/46/1024490946.db2.gz MOZJWUTUGVYFCW-IRXDYDNUSA-N 1 1 304.390 3.548 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-] ZINC000271649554 1024556298 /nfs/dbraw/zinc/55/62/98/1024556298.db2.gz URDZWYPBPBVLOK-TXEJJXNPSA-N 1 1 315.329 3.915 20 5 DHBDMO COc1ccc(F)cc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271693095 1024562704 /nfs/dbraw/zinc/56/27/04/1024562704.db2.gz FOOMSJZHCGBKDK-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCC[NH+]1[C@@H](C)CCC[C@@H]1C ZINC000532231288 1024583367 /nfs/dbraw/zinc/58/33/67/1024583367.db2.gz JVWCBXJMUOBKHJ-JYJNAYRXSA-N 1 1 319.449 3.817 20 5 DHBDMO CC(C)([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000103482541 1024693135 /nfs/dbraw/zinc/69/31/35/1024693135.db2.gz AFLNMELFUMAPHL-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCC[C@](C)(F)C2)c([N+](=O)[O-])c1 ZINC001170336312 1024745918 /nfs/dbraw/zinc/74/59/18/1024745918.db2.gz WGJFXUKGLQQJSZ-DYVFJYSZSA-N 1 1 324.396 3.749 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCC[C@@](C)(F)C2)c([N+](=O)[O-])c1 ZINC001170336310 1024747296 /nfs/dbraw/zinc/74/72/96/1024747296.db2.gz WGJFXUKGLQQJSZ-CXAGYDPISA-N 1 1 324.396 3.749 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CC2CCCC2)c([N+](=O)[O-])c1 ZINC001170352805 1024748829 /nfs/dbraw/zinc/74/88/29/1024748829.db2.gz QRSKCHYHAHDOJI-CYBMUJFWSA-N 1 1 306.406 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H]2C(C)C)c([N+](=O)[O-])c1 ZINC001170354509 1024751139 /nfs/dbraw/zinc/75/11/39/1024751139.db2.gz MLSJOLTUOUYIPX-XJKSGUPXSA-N 1 1 306.406 3.655 20 5 DHBDMO CC(C)[N@@H+](CC1CC1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728896317 1024774580 /nfs/dbraw/zinc/77/45/80/1024774580.db2.gz HNWKBMJTONBMAP-UHFFFAOYSA-N 1 1 314.389 3.536 20 5 DHBDMO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000342685396 1024851916 /nfs/dbraw/zinc/85/19/16/1024851916.db2.gz HPQVPCDXLMLTKL-XHSDSOJGSA-N 1 1 317.433 3.603 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000542053493 1024939506 /nfs/dbraw/zinc/93/95/06/1024939506.db2.gz URIMHSUVFAEPFD-QEJZJMRPSA-N 1 1 304.390 3.614 20 5 DHBDMO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000353544043 1025120878 /nfs/dbraw/zinc/12/08/78/1025120878.db2.gz ABRFHQGFAHXILU-UHFFFAOYSA-N 1 1 323.780 3.878 20 5 DHBDMO Cc1ccc(C[N@H+](Cc2cccnc2[N+](=O)[O-])C(C)C)s1 ZINC000885964466 1025422433 /nfs/dbraw/zinc/42/24/33/1025422433.db2.gz AUYPDMNWMQOQQI-UHFFFAOYSA-N 1 1 305.403 3.770 20 5 DHBDMO Cc1ccc(C[N@@H+](Cc2cccnc2[N+](=O)[O-])C(C)C)s1 ZINC000885964466 1025422438 /nfs/dbraw/zinc/42/24/38/1025422438.db2.gz AUYPDMNWMQOQQI-UHFFFAOYSA-N 1 1 305.403 3.770 20 5 DHBDMO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886236498 1025568614 /nfs/dbraw/zinc/56/86/14/1025568614.db2.gz JIIZNPGEJIMEPC-INIZCTEOSA-N 1 1 315.348 3.774 20 5 DHBDMO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886236498 1025568624 /nfs/dbraw/zinc/56/86/24/1025568624.db2.gz JIIZNPGEJIMEPC-INIZCTEOSA-N 1 1 315.348 3.774 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](C)c1cscn1 ZINC000573626199 1025737246 /nfs/dbraw/zinc/73/72/46/1025737246.db2.gz YOTZRZHSPZKXRZ-BCMYLCSRSA-N 1 1 303.387 3.805 20 5 DHBDMO Cc1c([C@H](C)[NH2+]Cc2cc(C3CC3)no2)cccc1[N+](=O)[O-] ZINC000886682190 1025783228 /nfs/dbraw/zinc/78/32/28/1025783228.db2.gz BJOFRHNPXGVZNN-NSHDSACASA-N 1 1 301.346 3.619 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCOCC3(CCCC3)C2)c(Cl)c1 ZINC000614222897 1025956275 /nfs/dbraw/zinc/95/62/75/1025956275.db2.gz OPVLGIJEFRZKRY-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCOCC3(CCCC3)C2)c(Cl)c1 ZINC000614222897 1025956284 /nfs/dbraw/zinc/95/62/84/1025956284.db2.gz OPVLGIJEFRZKRY-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO CC(C)([NH2+]Cc1cnc(Cl)s1)c1ccccc1[N+](=O)[O-] ZINC000292204739 1026112393 /nfs/dbraw/zinc/11/23/93/1026112393.db2.gz SOSMNYVQMATAGO-UHFFFAOYSA-N 1 1 311.794 3.730 20 5 DHBDMO COc1ccccc1CC[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000513441814 1026508694 /nfs/dbraw/zinc/50/86/94/1026508694.db2.gz BKXXIEVWGQKLDS-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)cs1 ZINC000513465966 1026513753 /nfs/dbraw/zinc/51/37/53/1026513753.db2.gz ABNLFCNEZXZRDZ-ZDUSSCGKSA-N 1 1 306.362 3.785 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)cs1 ZINC000513465966 1026513758 /nfs/dbraw/zinc/51/37/58/1026513758.db2.gz ABNLFCNEZXZRDZ-ZDUSSCGKSA-N 1 1 306.362 3.785 20 5 DHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000810043053 1026666486 /nfs/dbraw/zinc/66/64/86/1026666486.db2.gz FDPWXUBTRCXCAO-AWEZNQCLSA-N 1 1 310.369 3.513 20 5 DHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000810043057 1026666664 /nfs/dbraw/zinc/66/66/64/1026666664.db2.gz FDPWXUBTRCXCAO-CQSZACIVSA-N 1 1 310.369 3.513 20 5 DHBDMO COCc1ccccc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000237175192 1026942961 /nfs/dbraw/zinc/94/29/61/1026942961.db2.gz ZOYROUPLTSPSEW-UHFFFAOYSA-N 1 1 320.776 3.684 20 5 DHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]Cc1cccnc1 ZINC000811471793 1027015829 /nfs/dbraw/zinc/01/58/29/1027015829.db2.gz KMDKCHWXPWDGHA-UHFFFAOYSA-N 1 1 312.156 3.586 20 5 DHBDMO Cc1cc(N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000811812189 1027090790 /nfs/dbraw/zinc/09/07/90/1027090790.db2.gz OFERYRMZHDYSHT-MNOVXSKESA-N 1 1 309.797 3.594 20 5 DHBDMO CC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H](C)OC ZINC000812807593 1027430311 /nfs/dbraw/zinc/43/03/11/1027430311.db2.gz RVWFJNJKOKJONP-SECBINFHSA-N 1 1 321.204 3.758 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@@H]2[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000932274827 1027439517 /nfs/dbraw/zinc/43/95/17/1027439517.db2.gz KQUFMIWVWIPPCU-SWLSCSKDSA-N 1 1 315.373 3.659 20 5 DHBDMO Cc1ccc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000562489000 1027458107 /nfs/dbraw/zinc/45/81/07/1027458107.db2.gz PGJKDFVAOXHDJY-GFCCVEGCSA-N 1 1 302.296 3.678 20 5 DHBDMO CCC[C@H](NC[C@@H]([NH3+])c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423238821 1027459496 /nfs/dbraw/zinc/45/94/96/1027459496.db2.gz JOORDCJSNBRLOM-MSOLQXFVSA-N 1 1 313.401 3.726 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ccncc3)C2)c(F)c1 ZINC000296047860 1027527003 /nfs/dbraw/zinc/52/70/03/1027527003.db2.gz TXDBVNYAIYJALN-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO CCC[C@@H]([NH2+][C@H](CN)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000423533884 1027578670 /nfs/dbraw/zinc/57/86/70/1027578670.db2.gz UNPSDNPEBIVCLN-IAGOWNOFSA-N 1 1 305.422 3.543 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccc(F)cc1F ZINC000576478731 1027620623 /nfs/dbraw/zinc/62/06/23/1027620623.db2.gz ADQRNENGVDAMFZ-OAHLLOKOSA-N 1 1 304.296 3.650 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000778949886 1027633326 /nfs/dbraw/zinc/63/33/26/1027633326.db2.gz DFQFQJNWURGQOX-QWRGUYRKSA-N 1 1 302.296 3.848 20 5 DHBDMO Cc1cc(N[C@@H](C)C[N@H+](C)C(C)C)c2cccc([N+](=O)[O-])c2n1 ZINC000577032142 1027694782 /nfs/dbraw/zinc/69/47/82/1027694782.db2.gz IIZMLKCMNMFRQS-ZDUSSCGKSA-N 1 1 316.405 3.592 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934335924 1027970637 /nfs/dbraw/zinc/97/06/37/1027970637.db2.gz IAHMTCQSNRWURC-OLZOCXBDSA-N 1 1 317.414 3.677 20 5 DHBDMO CO[C@@]1(C)CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601157954 1028006722 /nfs/dbraw/zinc/00/67/22/1028006722.db2.gz JXQUKFFPCKKLIR-KRWDZBQOSA-N 1 1 315.373 3.538 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(F)c1F ZINC000601302083 1028066788 /nfs/dbraw/zinc/06/67/88/1028066788.db2.gz FSCXFOZPHDLAAR-AWEZNQCLSA-N 1 1 304.296 3.650 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC000934836989 1028123545 /nfs/dbraw/zinc/12/35/45/1028123545.db2.gz QHVVXEJQXOOQKY-OAGGEKHMSA-N 1 1 318.417 3.794 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000449735341 1028958692 /nfs/dbraw/zinc/95/86/92/1028958692.db2.gz TWACHGYBKASDFB-MRXNPFEDSA-N 1 1 306.431 3.622 20 5 DHBDMO CC(C)[N@H+](C)C[C@H](C)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000568817463 1029128997 /nfs/dbraw/zinc/12/89/97/1029128997.db2.gz PYIBYSOECFDUMD-SUMWQHHRSA-N 1 1 319.449 3.636 20 5 DHBDMO CC(C)N(C)C[C@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000568817463 1029129001 /nfs/dbraw/zinc/12/90/01/1029129001.db2.gz PYIBYSOECFDUMD-SUMWQHHRSA-N 1 1 319.449 3.636 20 5 DHBDMO CNC(=O)[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000817414088 1029152592 /nfs/dbraw/zinc/15/25/92/1029152592.db2.gz BVSXHJHVJFZIAY-KRWDZBQOSA-N 1 1 318.420 3.561 20 5 DHBDMO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H](C)CO ZINC000569151297 1029184343 /nfs/dbraw/zinc/18/43/43/1029184343.db2.gz LVMBRZLNHKMRFX-LBPRGKRZSA-N 1 1 320.414 3.526 20 5 DHBDMO Cc1cnc([C@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)s1 ZINC000374231263 1029248614 /nfs/dbraw/zinc/24/86/14/1029248614.db2.gz VGHIXKLONUKQBH-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO C[NH+](C)CC[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(C)C ZINC000569941401 1029288243 /nfs/dbraw/zinc/28/82/43/1029288243.db2.gz OLYOXWWGQTXGPW-RDJZCZTQSA-N 1 1 319.449 3.538 20 5 DHBDMO CN(C)CC[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(C)C ZINC000569941401 1029288257 /nfs/dbraw/zinc/28/82/57/1029288257.db2.gz OLYOXWWGQTXGPW-RDJZCZTQSA-N 1 1 319.449 3.538 20 5 DHBDMO Cc1ccc(C[NH2+][C@@H]2c3ccc(F)cc3O[C@@H]2C)cc1[N+](=O)[O-] ZINC000570546981 1029385113 /nfs/dbraw/zinc/38/51/13/1029385113.db2.gz SJGSTOAVFMBQAB-DIFFPNOSSA-N 1 1 316.332 3.654 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H]1CCC(F)(F)C1)C1CC1 ZINC000450597481 1029569041 /nfs/dbraw/zinc/56/90/41/1029569041.db2.gz HVBHVTXIOALXEZ-GFCCVEGCSA-N 1 1 310.344 3.995 20 5 DHBDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000451412481 1029871141 /nfs/dbraw/zinc/87/11/41/1029871141.db2.gz WRDJUKOEVREVJV-YPMHNXCESA-N 1 1 316.323 3.800 20 5 DHBDMO CC1(C)C[C@@H]([NH2+]Cc2ncccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000530524148 1029878025 /nfs/dbraw/zinc/87/80/25/1029878025.db2.gz HZBWFTFEFHCROB-OAHLLOKOSA-N 1 1 315.348 3.641 20 5 DHBDMO CCO[C@@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C[C@@H]1C ZINC000451542040 1029907777 /nfs/dbraw/zinc/90/77/77/1029907777.db2.gz MRHMNXWELSJVMV-GRDNDAEWSA-N 1 1 306.406 3.711 20 5 DHBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)F)C[N@H+]1C1CC1 ZINC000865600424 1029932850 /nfs/dbraw/zinc/93/28/50/1029932850.db2.gz MSSCZHZOJOBLPH-ZJUUUORDSA-N 1 1 311.332 3.570 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1OC ZINC000865824842 1030044706 /nfs/dbraw/zinc/04/47/06/1030044706.db2.gz SRBCLXJGUINPRQ-INIZCTEOSA-N 1 1 318.348 3.983 20 5 DHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)C12CCC2 ZINC000357793192 1030193682 /nfs/dbraw/zinc/19/36/82/1030193682.db2.gz GRJAFCZXXGBMFT-IAGOWNOFSA-N 1 1 318.417 3.683 20 5 DHBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1F ZINC000291771033 1030636051 /nfs/dbraw/zinc/63/60/51/1030636051.db2.gz SVCVLPWOUJEFQO-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCSC[C@H]2C2CC2)ccc1Cl ZINC000824913923 1030664480 /nfs/dbraw/zinc/66/44/80/1030664480.db2.gz JAYUEGKBIXRHDG-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCSC[C@H]2C2CC2)ccc1Cl ZINC000824913923 1030664491 /nfs/dbraw/zinc/66/44/91/1030664491.db2.gz JAYUEGKBIXRHDG-AWEZNQCLSA-N 1 1 312.822 3.576 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCC2(CCCC2)O1 ZINC000558740487 1030761108 /nfs/dbraw/zinc/76/11/08/1030761108.db2.gz LRMSQPNWYIVVJP-KRWDZBQOSA-N 1 1 318.417 3.561 20 5 DHBDMO Cc1cc(C)c([N+](=O)[O-])c(NCCCC[N@@H+]2CCC[C@@H](C)C2)n1 ZINC000359087160 1030770933 /nfs/dbraw/zinc/77/09/33/1030770933.db2.gz WRNCPFBLEKKMQQ-CYBMUJFWSA-N 1 1 320.437 3.531 20 5 DHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)C2CC2)cc1OC ZINC000359587583 1031046026 /nfs/dbraw/zinc/04/60/26/1031046026.db2.gz FJMQAILPMXFFAL-GFCCVEGCSA-N 1 1 322.405 3.623 20 5 DHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C2CC2)cc1OC ZINC000359587583 1031046039 /nfs/dbraw/zinc/04/60/39/1031046039.db2.gz FJMQAILPMXFFAL-GFCCVEGCSA-N 1 1 322.405 3.623 20 5 DHBDMO CC(C)Oc1ccnc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000844333941 1031058608 /nfs/dbraw/zinc/05/86/08/1031058608.db2.gz NHSFVWXJSQRHTK-ZDUSSCGKSA-N 1 1 315.373 3.628 20 5 DHBDMO CC(C)[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1cnn(C)c1 ZINC000927067503 1031064390 /nfs/dbraw/zinc/06/43/90/1031064390.db2.gz RKDQMTDQDIJJKL-MEDUHNTESA-N 1 1 320.368 3.515 20 5 DHBDMO CC(C)[N@@H+](CC[C@@H]1CCCCO1)Cc1ccc([N+](=O)[O-])cc1 ZINC000347392385 1031216956 /nfs/dbraw/zinc/21/69/56/1031216956.db2.gz LCBMRXYNYALYEF-KRWDZBQOSA-N 1 1 306.406 3.764 20 5 DHBDMO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000360018565 1031241680 /nfs/dbraw/zinc/24/16/80/1031241680.db2.gz UTQPKRIXQDBESG-ZJUUUORDSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000360018565 1031241690 /nfs/dbraw/zinc/24/16/90/1031241690.db2.gz UTQPKRIXQDBESG-ZJUUUORDSA-N 1 1 300.811 3.574 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000293163444 1031357590 /nfs/dbraw/zinc/35/75/90/1031357590.db2.gz FUJIBZXRMASYNQ-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000536696464 1031400770 /nfs/dbraw/zinc/40/07/70/1031400770.db2.gz WZGXBKCQQYYHKI-FKQXODTLSA-N 1 1 318.442 3.968 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cc(O)ccc1F ZINC000872026737 1031410776 /nfs/dbraw/zinc/41/07/76/1031410776.db2.gz FGXKZAIANCWDQN-WDEREUQCSA-N 1 1 304.321 3.851 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(C)c(C)c1 ZINC001171156754 1031417651 /nfs/dbraw/zinc/41/76/51/1031417651.db2.gz OKJLKXBNDILFQW-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(C)c(C)c1 ZINC001171156754 1031417656 /nfs/dbraw/zinc/41/76/56/1031417656.db2.gz OKJLKXBNDILFQW-UHFFFAOYSA-N 1 1 314.385 3.852 20 5 DHBDMO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccncc1 ZINC000872038549 1031422137 /nfs/dbraw/zinc/42/21/37/1031422137.db2.gz MLSUTOHBZBJBLH-FZMZJTMJSA-N 1 1 303.337 3.931 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)cc1 ZINC000872260178 1031564246 /nfs/dbraw/zinc/56/42/46/1031564246.db2.gz KLKHDAYUZDWAIS-QGZVFWFLSA-N 1 1 304.390 3.518 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)cc1F ZINC000872280071 1031572701 /nfs/dbraw/zinc/57/27/01/1031572701.db2.gz JJCPCXKGCAZRQN-OAHLLOKOSA-N 1 1 322.380 3.658 20 5 DHBDMO CCCc1nc(C)c(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)o1 ZINC000873126594 1031716467 /nfs/dbraw/zinc/71/64/67/1031716467.db2.gz ALJVVNMDJYRMLF-UHFFFAOYSA-N 1 1 317.389 3.750 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000877607498 1033378869 /nfs/dbraw/zinc/37/88/69/1033378869.db2.gz GQYFLEVIVVXMNZ-AWEZNQCLSA-N 1 1 318.417 3.603 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@@H](CF)C1)CC2 ZINC001172916529 1033464448 /nfs/dbraw/zinc/46/44/48/1033464448.db2.gz TXCOHBFKUBVYKL-XJKSGUPXSA-N 1 1 306.381 3.524 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@H](C(F)F)C1)CC2 ZINC001172916101 1033465128 /nfs/dbraw/zinc/46/51/28/1033465128.db2.gz QQGCRXDVSDRBPB-LSDHHAIUSA-N 1 1 324.371 3.819 20 5 DHBDMO Cc1csc([C@@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000877814850 1033465278 /nfs/dbraw/zinc/46/52/78/1033465278.db2.gz YPBDCWQLVCPNJJ-CQSZACIVSA-N 1 1 317.414 3.658 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@H](C)[C@@H]2C)c1F ZINC001173190929 1033584862 /nfs/dbraw/zinc/58/48/62/1033584862.db2.gz XRAHTWCNTUHFJO-AVGNSLFASA-N 1 1 324.396 3.794 20 5 DHBDMO COc1ccccc1C[N@@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173226005 1033602413 /nfs/dbraw/zinc/60/24/13/1033602413.db2.gz GYLPQSNMOUOKTK-CQSZACIVSA-N 1 1 314.385 3.666 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1F ZINC001173227226 1033606140 /nfs/dbraw/zinc/60/61/40/1033606140.db2.gz OQOCDWGBYDQYMG-CYBMUJFWSA-N 1 1 302.349 3.797 20 5 DHBDMO Cc1csc([C@H]2CC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000880010432 1034183815 /nfs/dbraw/zinc/18/38/15/1034183815.db2.gz UEKLCQWLWFWZRN-OCCSQVGLSA-N 1 1 317.414 3.910 20 5 DHBDMO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000179709631 1034327997 /nfs/dbraw/zinc/32/79/97/1034327997.db2.gz LSOCKSIBQZIGRY-MRXNPFEDSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000179709631 1034328000 /nfs/dbraw/zinc/32/80/00/1034328000.db2.gz LSOCKSIBQZIGRY-MRXNPFEDSA-N 1 1 315.373 3.582 20 5 DHBDMO CC[N@@H+](CC1CCC1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000794682614 1034342055 /nfs/dbraw/zinc/34/20/55/1034342055.db2.gz IMJNZNMQWKLNPN-UHFFFAOYSA-N 1 1 322.796 3.677 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)CN1CCCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000480699961 1034412163 /nfs/dbraw/zinc/41/21/63/1034412163.db2.gz QEMKHQOXWYIYNX-LSDHHAIUSA-N 1 1 305.422 3.510 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cccnc1 ZINC000185350458 1034544209 /nfs/dbraw/zinc/54/42/09/1034544209.db2.gz RUSFSVSJHXEPHW-MRXNPFEDSA-N 1 1 315.373 3.629 20 5 DHBDMO CC1(C)C[C@@H]([NH2+]Cc2cccnc2F)c2cc([N+](=O)[O-])ccc21 ZINC000794827786 1034548498 /nfs/dbraw/zinc/54/84/98/1034548498.db2.gz JLTCDVIPPCVRKY-OAHLLOKOSA-N 1 1 315.348 3.641 20 5 DHBDMO O=[N+]([O-])c1ccc(N2CCC(c3[nH]cc[nH+]3)CC2)c(C(F)F)c1 ZINC000865486456 1034672933 /nfs/dbraw/zinc/67/29/33/1034672933.db2.gz WOYNJWKOHCPGOE-UHFFFAOYSA-N 1 1 322.315 3.640 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCCO[C@H](C(C)C)C1 ZINC000555794054 1034905217 /nfs/dbraw/zinc/90/52/17/1034905217.db2.gz QVVJIILTNXTOCL-PBHICJAKSA-N 1 1 306.406 3.711 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(Cn2cc[nH+]c2C2CC2)c1 ZINC000600611555 1035009492 /nfs/dbraw/zinc/00/94/92/1035009492.db2.gz QIPKJXBOCPLLRT-UHFFFAOYSA-N 1 1 311.263 3.736 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+]CCN2[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000482630803 1035149310 /nfs/dbraw/zinc/14/93/10/1035149310.db2.gz MVVDWHQVVZKENP-JYJNAYRXSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1c([C@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000483195234 1035239277 /nfs/dbraw/zinc/23/92/77/1035239277.db2.gz JMEGLCSUBKEEFX-YOEHRIQHSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1c([C@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000483195234 1035239281 /nfs/dbraw/zinc/23/92/81/1035239281.db2.gz JMEGLCSUBKEEFX-YOEHRIQHSA-N 1 1 321.465 3.920 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@]23CCCOC3)c(Cl)c1 ZINC001177009103 1035342827 /nfs/dbraw/zinc/34/28/27/1035342827.db2.gz XJYYUTGKNMOYNZ-INIZCTEOSA-N 1 1 324.808 3.783 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@]23CCCOC3)c(Cl)c1 ZINC001177009103 1035342830 /nfs/dbraw/zinc/34/28/30/1035342830.db2.gz XJYYUTGKNMOYNZ-INIZCTEOSA-N 1 1 324.808 3.783 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1cn2c(n1)CCCC2 ZINC000924798976 1035419895 /nfs/dbraw/zinc/41/98/95/1035419895.db2.gz QKTGQZNKVMXVGD-CHWSQXEVSA-N 1 1 314.389 3.539 20 5 DHBDMO CC(C)(C[N@@H+]1Cc2ccc([N+](=O)[O-])cc2C1)Oc1ccccc1 ZINC001180071949 1035583651 /nfs/dbraw/zinc/58/36/51/1035583651.db2.gz LJDKYSYULLHRRD-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO CC(C)(C[N@H+]1Cc2ccc([N+](=O)[O-])cc2C1)Oc1ccccc1 ZINC001180071949 1035583660 /nfs/dbraw/zinc/58/36/60/1035583660.db2.gz LJDKYSYULLHRRD-UHFFFAOYSA-N 1 1 312.369 3.768 20 5 DHBDMO CC(C)[C@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535560997 1035687497 /nfs/dbraw/zinc/68/74/97/1035687497.db2.gz XDQVQLDQKGKLBN-MRXNPFEDSA-N 1 1 315.373 3.870 20 5 DHBDMO C[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089888653 1035763909 /nfs/dbraw/zinc/76/39/09/1035763909.db2.gz YDCHOYQJCZRFFA-ZDUSSCGKSA-N 1 1 315.373 3.872 20 5 DHBDMO CC[C@@H](C)C[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089897264 1035768246 /nfs/dbraw/zinc/76/82/46/1035768246.db2.gz UTLCKQJMSNCRBJ-GFCCVEGCSA-N 1 1 303.362 3.728 20 5 DHBDMO CO[C@@H]1C[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001194384616 1035916062 /nfs/dbraw/zinc/91/60/62/1035916062.db2.gz LPBBGHZIVPBDHZ-HUUCEWRRSA-N 1 1 324.808 3.638 20 5 DHBDMO CO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001194384616 1035916067 /nfs/dbraw/zinc/91/60/67/1035916067.db2.gz LPBBGHZIVPBDHZ-HUUCEWRRSA-N 1 1 324.808 3.638 20 5 DHBDMO CC[C@@H](c1ccccc1)[N@H+](CC)Cc1onc(C)c1[N+](=O)[O-] ZINC000595296886 1036068639 /nfs/dbraw/zinc/06/86/39/1036068639.db2.gz NMMCLZSELWQOAP-AWEZNQCLSA-N 1 1 303.362 3.864 20 5 DHBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)Cc1onc(C)c1[N+](=O)[O-] ZINC000595296886 1036068658 /nfs/dbraw/zinc/06/86/58/1036068658.db2.gz NMMCLZSELWQOAP-AWEZNQCLSA-N 1 1 303.362 3.864 20 5 DHBDMO C[C@@H](C1CCCCC1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000773974021 1036091373 /nfs/dbraw/zinc/09/13/73/1036091373.db2.gz CSRIPLOCVNWYJH-SUMWQHHRSA-N 1 1 306.406 3.529 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1Cc2ccccc2C1 ZINC000542001954 1036485850 /nfs/dbraw/zinc/48/58/50/1036485850.db2.gz XOWSOIKYKPBSIO-UHFFFAOYSA-N 1 1 316.788 3.847 20 5 DHBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000774618106 1036572520 /nfs/dbraw/zinc/57/25/20/1036572520.db2.gz JNGWLWZYKFPFMQ-DYVFJYSZSA-N 1 1 314.389 3.536 20 5 DHBDMO CC(C)[C@@H]1CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636537 1036602203 /nfs/dbraw/zinc/60/22/03/1036602203.db2.gz VGWWANJSYGJETO-AWEZNQCLSA-N 1 1 322.796 3.676 20 5 DHBDMO Cc1ccccc1OCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000491934267 1036676577 /nfs/dbraw/zinc/67/65/77/1036676577.db2.gz AGBWSJIXDHESDG-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO Cc1ccccc1OCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000491934267 1036676583 /nfs/dbraw/zinc/67/65/83/1036676583.db2.gz AGBWSJIXDHESDG-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](Cc1cccc3ccccc31)CC2 ZINC000495490596 1036682667 /nfs/dbraw/zinc/68/26/67/1036682667.db2.gz JYMULQNZSQFAMT-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](Cc1cccc3ccccc31)CC2 ZINC000495490596 1036682675 /nfs/dbraw/zinc/68/26/75/1036682675.db2.gz JYMULQNZSQFAMT-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO CCOc1cc(C[NH2+][C@H](C)c2nc(C)cs2)ccc1[N+](=O)[O-] ZINC000492873943 1037048049 /nfs/dbraw/zinc/04/80/49/1037048049.db2.gz OIKVNENOVXUZQJ-LLVKDONJSA-N 1 1 321.402 3.609 20 5 DHBDMO CC(C)C[N@H+]1CCC[C@H](CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000090586628 1037123244 /nfs/dbraw/zinc/12/32/44/1037123244.db2.gz MWEQXBYTKOBGDY-JKSUJKDBSA-N 1 1 319.449 3.613 20 5 DHBDMO CCC1(CC)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774888094 1037169751 /nfs/dbraw/zinc/16/97/51/1037169751.db2.gz RYGOFURAHAGDFP-UHFFFAOYSA-N 1 1 307.350 3.515 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000489286721 1037343103 /nfs/dbraw/zinc/34/31/03/1037343103.db2.gz FAQBZCKAILXJNE-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO Cc1cc(NC[C@@H]2[N@@H+](C)CCCC2(C)C)c(F)cc1[N+](=O)[O-] ZINC001186368109 1037374024 /nfs/dbraw/zinc/37/40/24/1037374024.db2.gz MOGTUWJHGGLFSB-HNNXBMFYSA-N 1 1 309.385 3.575 20 5 DHBDMO CC[N@@H+](c1ccc(Nc2ccc([N+](=O)[O-])nc2)cc1)C(C)C ZINC000912733033 1037540154 /nfs/dbraw/zinc/54/01/54/1037540154.db2.gz IZWXPAFQNSCWTR-UHFFFAOYSA-N 1 1 300.362 3.968 20 5 DHBDMO CC[N@H+](c1ccc(Nc2ccc([N+](=O)[O-])nc2)cc1)C(C)C ZINC000912733033 1037540168 /nfs/dbraw/zinc/54/01/68/1037540168.db2.gz IZWXPAFQNSCWTR-UHFFFAOYSA-N 1 1 300.362 3.968 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCc2ccccc2C1 ZINC000490400244 1037706583 /nfs/dbraw/zinc/70/65/83/1037706583.db2.gz LZADOAJVEZRIQK-MRXNPFEDSA-N 1 1 314.360 3.723 20 5 DHBDMO COc1ccccc1CC[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000609194667 1038070201 /nfs/dbraw/zinc/07/02/01/1038070201.db2.gz BNSFZBZSUIEFLF-CQSZACIVSA-N 1 1 314.385 3.839 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](C)C(C)(C)C ZINC000164537031 1038205080 /nfs/dbraw/zinc/20/50/80/1038205080.db2.gz VUZIYMUQISHFSZ-CYBMUJFWSA-N 1 1 321.421 3.598 20 5 DHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001190590204 1038351361 /nfs/dbraw/zinc/35/13/61/1038351361.db2.gz WOWUEVCRUYTVFV-GDBMZVCRSA-N 1 1 306.406 3.874 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cscc1Cl ZINC000589184971 1038444562 /nfs/dbraw/zinc/44/45/62/1038444562.db2.gz GZNUJRSFQXMHKI-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cscc1Cl ZINC000589184971 1038444566 /nfs/dbraw/zinc/44/45/66/1038444566.db2.gz GZNUJRSFQXMHKI-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO Cc1cc(N[C@H]2C[N@@H+](C)Cc3ccccc32)c(F)cc1[N+](=O)[O-] ZINC000589689880 1038533336 /nfs/dbraw/zinc/53/33/36/1038533336.db2.gz VXOJVCCUDIGYRH-INIZCTEOSA-N 1 1 315.348 3.641 20 5 DHBDMO Cc1cc(N[C@H]2C[N@H+](C)Cc3ccccc32)c(F)cc1[N+](=O)[O-] ZINC000589689880 1038533345 /nfs/dbraw/zinc/53/33/45/1038533345.db2.gz VXOJVCCUDIGYRH-INIZCTEOSA-N 1 1 315.348 3.641 20 5 DHBDMO C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590154568 1038594130 /nfs/dbraw/zinc/59/41/30/1038594130.db2.gz OVCVVFKAHNQAGT-SNVBAGLBSA-N 1 1 302.296 3.846 20 5 DHBDMO C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590154568 1038594133 /nfs/dbraw/zinc/59/41/33/1038594133.db2.gz OVCVVFKAHNQAGT-SNVBAGLBSA-N 1 1 302.296 3.846 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@H](C(F)F)C2)c1 ZINC000590169362 1038597878 /nfs/dbraw/zinc/59/78/78/1038597878.db2.gz YCDDFVQQGHUKGW-MRVPVSSYSA-N 1 1 324.249 3.701 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](C(F)F)C2)c1 ZINC000590169362 1038597887 /nfs/dbraw/zinc/59/78/87/1038597887.db2.gz YCDDFVQQGHUKGW-MRVPVSSYSA-N 1 1 324.249 3.701 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H]3CCC[C@H]32)c1 ZINC000590174243 1038606134 /nfs/dbraw/zinc/60/61/34/1038606134.db2.gz BGWUVTHLHUPCPN-IINYFYTJSA-N 1 1 314.307 3.988 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000598680049 1038821769 /nfs/dbraw/zinc/82/17/69/1038821769.db2.gz ROSSOWRVMYMMTK-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC000046037610 1039061418 /nfs/dbraw/zinc/06/14/18/1039061418.db2.gz SMPVURRXGUBKSE-HNNXBMFYSA-N 1 1 318.398 3.872 20 5 DHBDMO CC(C)C[C@H](CNCc1ccc(C(C)C)c([N+](=O)[O-])c1)[NH+](C)C ZINC000603633474 1039095067 /nfs/dbraw/zinc/09/50/67/1039095067.db2.gz NUPUPSYBZYACAO-MRXNPFEDSA-N 1 1 321.465 3.784 20 5 DHBDMO CCC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000170958411 1039131007 /nfs/dbraw/zinc/13/10/07/1039131007.db2.gz XGEUFQNBLRRLPT-OAHLLOKOSA-N 1 1 310.369 3.515 20 5 DHBDMO C[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1Cl ZINC000603838265 1039171622 /nfs/dbraw/zinc/17/16/22/1039171622.db2.gz UTLZLFRRKCPVMS-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1Cl ZINC000603838265 1039171630 /nfs/dbraw/zinc/17/16/30/1039171630.db2.gz UTLZLFRRKCPVMS-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO Cc1c(C[N@@H+](C)CCOc2ccccc2F)cccc1[N+](=O)[O-] ZINC000603845273 1039181715 /nfs/dbraw/zinc/18/17/15/1039181715.db2.gz BULVHFJKEDRRPK-UHFFFAOYSA-N 1 1 318.348 3.553 20 5 DHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC[C@@H]1C ZINC000603854127 1039188805 /nfs/dbraw/zinc/18/88/05/1039188805.db2.gz QZMXGYFISWVGPW-RYUDHWBXSA-N 1 1 311.813 3.923 20 5 DHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc(F)cc1[N+](=O)[O-] ZINC000603859505 1039193635 /nfs/dbraw/zinc/19/36/35/1039193635.db2.gz FLWQNMCBKFHQSI-ZDUSSCGKSA-N 1 1 309.385 3.800 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cccc1[N+](=O)[O-] ZINC000604484503 1039481251 /nfs/dbraw/zinc/48/12/51/1039481251.db2.gz YYHSXROKWLIIET-GOSISDBHSA-N 1 1 312.369 3.946 20 5 DHBDMO COc1c(C)cccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000594520247 1039829570 /nfs/dbraw/zinc/82/95/70/1039829570.db2.gz JGGWMPUEEDECGQ-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC000595005512 1040017994 /nfs/dbraw/zinc/01/79/94/1040017994.db2.gz ZLBPRGRYEKHNBU-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO Cc1noc(C[N@@H+]2CCCC[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595323817 1040109407 /nfs/dbraw/zinc/10/94/07/1040109407.db2.gz AGDRXAHXELUFES-HNNXBMFYSA-N 1 1 315.373 3.927 20 5 DHBDMO Cc1noc(C[N@H+]2CCCC[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595323817 1040109411 /nfs/dbraw/zinc/10/94/11/1040109411.db2.gz AGDRXAHXELUFES-HNNXBMFYSA-N 1 1 315.373 3.927 20 5 DHBDMO Cc1noc(C[NH2+]C2(c3ccc(F)cc3)CCCC2)c1[N+](=O)[O-] ZINC000595365146 1040126643 /nfs/dbraw/zinc/12/66/43/1040126643.db2.gz XTXTXWHWGWUXFQ-UHFFFAOYSA-N 1 1 319.336 3.589 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC000595831542 1040265382 /nfs/dbraw/zinc/26/53/82/1040265382.db2.gz JVCXIFXZPHJNPB-GOEBONIOSA-N 1 1 312.369 3.809 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000595882207 1040268903 /nfs/dbraw/zinc/26/89/03/1040268903.db2.gz ZIPYGVWBUGAABM-AWEZNQCLSA-N 1 1 307.394 3.684 20 5 DHBDMO C[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@@H]1CC1(C)C ZINC000595908743 1040273775 /nfs/dbraw/zinc/27/37/75/1040273775.db2.gz KDSLTQOEYRPTIF-ZDUSSCGKSA-N 1 1 315.373 3.728 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cc(C(C)C)no1 ZINC000169245662 1040369782 /nfs/dbraw/zinc/36/97/82/1040369782.db2.gz WHJOALXYMLBUPH-LBPRGKRZSA-N 1 1 303.362 3.865 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000173841359 1040436947 /nfs/dbraw/zinc/43/69/47/1040436947.db2.gz XCDIZHAATWPWHX-MRXNPFEDSA-N 1 1 322.380 3.658 20 5 DHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])s1)[N@H+]1CCc2ccccc2C1 ZINC000064029432 1040642090 /nfs/dbraw/zinc/64/20/90/1040642090.db2.gz YVLPUZNUNLBNFP-LBPRGKRZSA-N 1 1 317.414 3.515 20 5 DHBDMO CCCC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@@H](C)c1ccc(C)o1 ZINC000602448824 1041041389 /nfs/dbraw/zinc/04/13/89/1041041389.db2.gz QOKUPAMAEOOKTH-ZDUSSCGKSA-N 1 1 320.393 3.593 20 5 DHBDMO CCCC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@@H](C)c1ccc(C)o1 ZINC000602448824 1041041399 /nfs/dbraw/zinc/04/13/99/1041041399.db2.gz QOKUPAMAEOOKTH-ZDUSSCGKSA-N 1 1 320.393 3.593 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761280095 1041274665 /nfs/dbraw/zinc/27/46/65/1041274665.db2.gz LTTZCOYXJQZQJK-GXTWGEPZSA-N 1 1 316.405 3.721 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@H](C)C(C)(C)C)c2cc([N+](=O)[O-])ccc12 ZINC000761279213 1041275397 /nfs/dbraw/zinc/27/53/97/1041275397.db2.gz IHDVEMAVWGVTLA-GFCCVEGCSA-N 1 1 304.394 3.577 20 5 DHBDMO Cc1cc(C2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)n[nH]1 ZINC000272954728 130077709 /nfs/dbraw/zinc/07/77/09/130077709.db2.gz MXEALHPOWAOGCV-ZDUSSCGKSA-N 1 1 314.389 3.567 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CCC(F)(F)CC1 ZINC000286985679 131258739 /nfs/dbraw/zinc/25/87/39/131258739.db2.gz OYXGSMGPJLSYON-UHFFFAOYSA-N 1 1 302.296 3.744 20 5 DHBDMO CCc1cc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc(C)[nH+]1 ZINC000543877287 435648422 /nfs/dbraw/zinc/64/84/22/435648422.db2.gz VFDAJBKAQBJQLW-LLVKDONJSA-N 1 1 300.362 3.737 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cn2c(cccc2C)n1 ZINC000160316728 332783812 /nfs/dbraw/zinc/78/38/12/332783812.db2.gz RXXIUGQBGKOECI-CQSZACIVSA-N 1 1 324.384 3.710 20 5 DHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cn3ccccc3n2)cc1[N+](=O)[O-] ZINC000559918134 332292860 /nfs/dbraw/zinc/29/28/60/332292860.db2.gz RSZINSUYMFYSHX-UONOGXRCSA-N 1 1 324.384 3.963 20 5 DHBDMO CC(C)n1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000569792845 332679813 /nfs/dbraw/zinc/67/98/13/332679813.db2.gz QGJFXKFWLZCQIE-KRWDZBQOSA-N 1 1 314.389 3.539 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(O)c1 ZINC000181517977 333030626 /nfs/dbraw/zinc/03/06/26/333030626.db2.gz AVYVJLBNWTXUFS-SNVBAGLBSA-N 1 1 306.749 3.805 20 5 DHBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])c(OC)c1 ZINC000462806215 333116374 /nfs/dbraw/zinc/11/63/74/333116374.db2.gz GFPHAOJMRULCPS-OAHLLOKOSA-N 1 1 321.421 3.670 20 5 DHBDMO Cc1nc(C)c(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000177998975 333134041 /nfs/dbraw/zinc/13/40/41/333134041.db2.gz VTLLSOYJRBBPBA-UHFFFAOYSA-N 1 1 317.414 3.833 20 5 DHBDMO Cc1nc(C)c(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000177998975 333134042 /nfs/dbraw/zinc/13/40/42/333134042.db2.gz VTLLSOYJRBBPBA-UHFFFAOYSA-N 1 1 317.414 3.833 20 5 DHBDMO Cc1cnc(CC[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000182933512 333181494 /nfs/dbraw/zinc/18/14/94/333181494.db2.gz DEZQIHLSYKEGRZ-CYBMUJFWSA-N 1 1 319.430 3.904 20 5 DHBDMO CC[C@H](C)[N@@H+](C)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000318885361 333220066 /nfs/dbraw/zinc/22/00/66/333220066.db2.gz NMDMEYQUSLKQMG-JTQLQIEISA-N 1 1 319.327 3.756 20 5 DHBDMO CC(C)[N@@H+](C)CCCNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000390079661 333221983 /nfs/dbraw/zinc/22/19/83/333221983.db2.gz RPQFYHHBEQNCCQ-UHFFFAOYSA-N 1 1 319.327 3.756 20 5 DHBDMO CCCCCC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272498642 334035597 /nfs/dbraw/zinc/03/55/97/334035597.db2.gz GHXVOFJLAGURTC-INIZCTEOSA-N 1 1 316.405 3.588 20 5 DHBDMO Cc1cc(CNc2ccccc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000291064166 334176047 /nfs/dbraw/zinc/17/60/47/334176047.db2.gz GDPCDDCEFDPXHL-UHFFFAOYSA-N 1 1 312.373 3.511 20 5 DHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CCC1 ZINC000111299082 334318316 /nfs/dbraw/zinc/31/83/16/334318316.db2.gz BRUUHCHJCKGHNL-UHFFFAOYSA-N 1 1 315.373 3.524 20 5 DHBDMO COc1cnccc1[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000188781050 334872186 /nfs/dbraw/zinc/87/21/86/334872186.db2.gz WWMIZVJXLVSGIS-OLZOCXBDSA-N 1 1 315.373 3.719 20 5 DHBDMO CCCn1cc[nH+]c1CCCN(C)c1ccc([N+](=O)[O-])c(C)c1 ZINC000192234830 336022507 /nfs/dbraw/zinc/02/25/07/336022507.db2.gz RQLZSAHELKRMLK-UHFFFAOYSA-N 1 1 316.405 3.579 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCc2ccc(O)cc2C1 ZINC000332545400 336174172 /nfs/dbraw/zinc/17/41/72/336174172.db2.gz MPOZPYFRZLUJON-CYBMUJFWSA-N 1 1 312.369 3.728 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCc2ccc(O)cc2C1 ZINC000332545400 336174173 /nfs/dbraw/zinc/17/41/73/336174173.db2.gz MPOZPYFRZLUJON-CYBMUJFWSA-N 1 1 312.369 3.728 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352540041 336223378 /nfs/dbraw/zinc/22/33/78/336223378.db2.gz GMMBQHHVSVAOKB-UONOGXRCSA-N 1 1 324.446 3.709 20 5 DHBDMO CC(C)c1nc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000352571216 336225151 /nfs/dbraw/zinc/22/51/51/336225151.db2.gz RWYDWLQXQQOEJD-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO CC(C)c1nc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000352571216 336225152 /nfs/dbraw/zinc/22/51/52/336225152.db2.gz RWYDWLQXQQOEJD-UHFFFAOYSA-N 1 1 319.430 3.849 20 5 DHBDMO C[C@H]1C[C@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000532575220 336256988 /nfs/dbraw/zinc/25/69/88/336256988.db2.gz NGIFWAFTOYBCTD-STQMWFEESA-N 1 1 315.373 3.523 20 5 DHBDMO CCC[C@H](NCCC[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000192925915 336284457 /nfs/dbraw/zinc/28/44/57/336284457.db2.gz JLAVSSWNVFNOPU-KRWDZBQOSA-N 1 1 305.422 3.512 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1cccc(F)c1[N+](=O)[O-] ZINC000301097881 336289918 /nfs/dbraw/zinc/28/99/18/336289918.db2.gz NQTNNWNYYAKNLD-CYBMUJFWSA-N 1 1 309.385 3.800 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c1 ZINC000301820321 336332255 /nfs/dbraw/zinc/33/22/55/336332255.db2.gz AZOGLEDBFXYNEN-CRAIPNDOSA-N 1 1 311.385 3.761 20 5 DHBDMO Cc1ccc(C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)cn1 ZINC000361089692 336738007 /nfs/dbraw/zinc/73/80/07/336738007.db2.gz WXTFGFXSABVCFZ-UHFFFAOYSA-N 1 1 317.414 3.739 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(OCC3CC3)CC2)ccc1Cl ZINC000376783932 337041028 /nfs/dbraw/zinc/04/10/28/337041028.db2.gz BKFCRRIYBOIFIJ-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO COc1cc(C[NH2+][C@@H](C)c2cc(C)oc2C)c([N+](=O)[O-])cc1F ZINC000184407202 337197057 /nfs/dbraw/zinc/19/70/57/337197057.db2.gz GQLQDWSKNZJOFM-JTQLQIEISA-N 1 1 322.336 3.803 20 5 DHBDMO C[C@H]([NH2+]Cc1nccn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000190794265 337290741 /nfs/dbraw/zinc/29/07/41/337290741.db2.gz UCROZDCWSKTUDI-AWEZNQCLSA-N 1 1 322.368 3.631 20 5 DHBDMO COc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000430081365 338095238 /nfs/dbraw/zinc/09/52/38/338095238.db2.gz AVTRVSZYDXCNND-INIZCTEOSA-N 1 1 304.390 3.614 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000430142246 338098905 /nfs/dbraw/zinc/09/89/05/338098905.db2.gz BLBCKHJKKVRJSH-CQSZACIVSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000430142246 338098906 /nfs/dbraw/zinc/09/89/06/338098906.db2.gz BLBCKHJKKVRJSH-CQSZACIVSA-N 1 1 312.369 3.686 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000430195637 338100807 /nfs/dbraw/zinc/10/08/07/338100807.db2.gz OTLASCBJXPDPHU-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000430195637 338100808 /nfs/dbraw/zinc/10/08/08/338100808.db2.gz OTLASCBJXPDPHU-LBPRGKRZSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(F)c(C)c1 ZINC000430243770 338102754 /nfs/dbraw/zinc/10/27/54/338102754.db2.gz VKNZGUFSURQVRJ-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(F)c(C)c1 ZINC000430243770 338102755 /nfs/dbraw/zinc/10/27/55/338102755.db2.gz VKNZGUFSURQVRJ-UHFFFAOYSA-N 1 1 318.348 3.683 20 5 DHBDMO CC1=C[C@H](C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000430883233 338118050 /nfs/dbraw/zinc/11/80/50/338118050.db2.gz PKNGUWDXQRJSQG-JTQLQIEISA-N 1 1 312.316 3.594 20 5 DHBDMO CC1=C[C@H](C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000430883233 338118051 /nfs/dbraw/zinc/11/80/51/338118051.db2.gz PKNGUWDXQRJSQG-JTQLQIEISA-N 1 1 312.316 3.594 20 5 DHBDMO CC[C@@H](C)[N@@H+](C)CCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433173666 338184034 /nfs/dbraw/zinc/18/40/34/338184034.db2.gz HHFGUQJOBHWFIP-CXAGYDPISA-N 1 1 319.449 3.637 20 5 DHBDMO CC[C@@H](C)N(C)CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433173666 338184035 /nfs/dbraw/zinc/18/40/35/338184035.db2.gz HHFGUQJOBHWFIP-CXAGYDPISA-N 1 1 319.449 3.637 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)cc1 ZINC000433193769 338185083 /nfs/dbraw/zinc/18/50/83/338185083.db2.gz LJJAHPQCCHPBSU-UHFFFAOYSA-N 1 1 312.703 3.816 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000434713993 338223803 /nfs/dbraw/zinc/22/38/03/338223803.db2.gz MEJKIZZFGXFEPZ-UHFFFAOYSA-N 1 1 314.838 3.966 20 5 DHBDMO C[C@H](C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000459786112 339048520 /nfs/dbraw/zinc/04/85/20/339048520.db2.gz BBSVJXBEKNQNPX-OLZOCXBDSA-N 1 1 322.405 3.565 20 5 DHBDMO COc1cc(C[N@@H+](C)C2CCCCCC2)c([N+](=O)[O-])cc1F ZINC000463469547 339118940 /nfs/dbraw/zinc/11/89/40/339118940.db2.gz LJODAOPXCASGNP-UHFFFAOYSA-N 1 1 310.369 3.897 20 5 DHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000464499010 339143663 /nfs/dbraw/zinc/14/36/63/339143663.db2.gz LRNNUIQHHPLEFE-LNSITVRQSA-N 1 1 322.380 3.753 20 5 DHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000469994231 339307462 /nfs/dbraw/zinc/30/74/62/339307462.db2.gz YJPJFIPTOWPAIW-GFCCVEGCSA-N 1 1 302.296 3.758 20 5 DHBDMO CO[C@H](C)C[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C(C)C ZINC000470179363 339313110 /nfs/dbraw/zinc/31/31/10/339313110.db2.gz WWGZSBIICQKIMR-AAWPKVBNSA-N 1 1 306.406 3.743 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000470954775 339332544 /nfs/dbraw/zinc/33/25/44/339332544.db2.gz CCAYTKHMDBMQTM-CKYFFXLPSA-N 1 1 302.296 3.929 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000470954776 339332691 /nfs/dbraw/zinc/33/26/91/339332691.db2.gz CCAYTKHMDBMQTM-FOGDFJRCSA-N 1 1 302.296 3.929 20 5 DHBDMO Cc1cn2cc(Nc3ccc4ncccc4c3[N+](=O)[O-])ccc2[nH+]1 ZINC000485210820 339700042 /nfs/dbraw/zinc/70/00/42/339700042.db2.gz ZQXYSKXLOYQEBV-UHFFFAOYSA-N 1 1 319.324 3.843 20 5 DHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(OCC2CC2)CC1 ZINC000493001668 339914528 /nfs/dbraw/zinc/91/45/28/339914528.db2.gz GTUPLHKKMUDZBA-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2cccc(F)c2)C2CC2)cc1 ZINC000506468467 340195154 /nfs/dbraw/zinc/19/51/54/340195154.db2.gz DMMIJKWVCURDSO-UHFFFAOYSA-N 1 1 314.360 3.941 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)cc1 ZINC000506476755 340195496 /nfs/dbraw/zinc/19/54/96/340195496.db2.gz JHJKKYKORKJPJW-KRWDZBQOSA-N 1 1 314.410 3.885 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC[C@H]2c2ccccc2)cc1 ZINC000506476755 340195497 /nfs/dbraw/zinc/19/54/97/340195497.db2.gz JHJKKYKORKJPJW-KRWDZBQOSA-N 1 1 314.410 3.885 20 5 DHBDMO COc1ccsc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507170166 340210818 /nfs/dbraw/zinc/21/08/18/340210818.db2.gz ZVXNXEMCIGHJTE-UHFFFAOYSA-N 1 1 318.398 3.830 20 5 DHBDMO COc1ccsc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507170166 340210819 /nfs/dbraw/zinc/21/08/19/340210819.db2.gz ZVXNXEMCIGHJTE-UHFFFAOYSA-N 1 1 318.398 3.830 20 5 DHBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1CC1 ZINC000507242552 340215172 /nfs/dbraw/zinc/21/51/72/340215172.db2.gz GSWDZCLFEMLRSU-UHFFFAOYSA-N 1 1 300.305 3.571 20 5 DHBDMO CCC(CC)[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCOC ZINC000508520062 340245539 /nfs/dbraw/zinc/24/55/39/340245539.db2.gz XRCOJIDWJYFFHP-NTMALXAHSA-N 1 1 306.406 3.745 20 5 DHBDMO O=[N+]([O-])c1ccccc1N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000302862707 340284696 /nfs/dbraw/zinc/28/46/96/340284696.db2.gz SGWIYRSFEUFQPU-INIZCTEOSA-N 1 1 311.385 3.671 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[NH2+]C2(C(F)F)CCCCC2)cc1 ZINC000510108608 340289149 /nfs/dbraw/zinc/28/91/49/340289149.db2.gz MWFAFMLONVRYEX-UHFFFAOYSA-N 1 1 314.332 3.531 20 5 DHBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000512317501 340356848 /nfs/dbraw/zinc/35/68/48/340356848.db2.gz CDDRTFYTLAQSPP-HNNXBMFYSA-N 1 1 314.360 3.723 20 5 DHBDMO COc1cccc(C2=CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000512683274 340373044 /nfs/dbraw/zinc/37/30/44/340373044.db2.gz PGEVNGZALKDGFW-UHFFFAOYSA-N 1 1 324.380 3.893 20 5 DHBDMO CC(C)n1cc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000541644936 340979201 /nfs/dbraw/zinc/97/92/01/340979201.db2.gz LKLZREOOOURAKE-LLVKDONJSA-N 1 1 322.796 3.876 20 5 DHBDMO Cc1ccc(C[N@H+]2Cc3ccccc3OC[C@@H]2C)cc1[N+](=O)[O-] ZINC000544043590 341067769 /nfs/dbraw/zinc/06/77/69/341067769.db2.gz WWUSRRXNJGMBLF-AWEZNQCLSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1ccc(C[N@@H+]2Cc3ccccc3OC[C@@H]2C)cc1[N+](=O)[O-] ZINC000544043590 341067770 /nfs/dbraw/zinc/06/77/70/341067770.db2.gz WWUSRRXNJGMBLF-AWEZNQCLSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1cccc([C@@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)c1 ZINC000544192377 341074074 /nfs/dbraw/zinc/07/40/74/341074074.db2.gz QDRXOGUDKZLMEA-OAHLLOKOSA-N 1 1 302.399 3.954 20 5 DHBDMO CCc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)s1 ZINC000549808073 341303571 /nfs/dbraw/zinc/30/35/71/341303571.db2.gz IITYFJUVKMDODD-UHFFFAOYSA-N 1 1 304.415 3.893 20 5 DHBDMO C[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1C ZINC000245845844 341315889 /nfs/dbraw/zinc/31/58/89/341315889.db2.gz IJNBQLTZYIPSSE-STQMWFEESA-N 1 1 315.373 3.870 20 5 DHBDMO C[C@@H](NCCC[N@H+]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000248891428 341389570 /nfs/dbraw/zinc/38/95/70/341389570.db2.gz BYCBXEDJYIXQOZ-LSDHHAIUSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@@H](NCCC[N@H+]1CCCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000248891425 341389589 /nfs/dbraw/zinc/38/95/89/341389589.db2.gz BYCBXEDJYIXQOZ-HUUCEWRRSA-N 1 1 305.422 3.510 20 5 DHBDMO Cc1cnc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000192905398 341897076 /nfs/dbraw/zinc/89/70/76/341897076.db2.gz LFVXVTUUGPEWOI-CQSZACIVSA-N 1 1 303.387 3.527 20 5 DHBDMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000337320187 519641350 /nfs/dbraw/zinc/64/13/50/519641350.db2.gz OOMBLBJGODDXAH-UHFFFAOYSA-N 1 1 319.405 3.576 20 5 DHBDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000267054483 520272913 /nfs/dbraw/zinc/27/29/13/520272913.db2.gz RKWVWWLAEPZIKB-OAHLLOKOSA-N 1 1 310.369 3.515 20 5 DHBDMO CC[C@H]([NH2+][C@@H](C)c1ccncc1F)c1cccc([N+](=O)[O-])c1 ZINC000338018844 522699492 /nfs/dbraw/zinc/69/94/92/522699492.db2.gz ZQMCDWVYKZSSJV-ZBEGNZNMSA-N 1 1 303.337 3.931 20 5 DHBDMO CC[C@@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000156479924 522923175 /nfs/dbraw/zinc/92/31/75/522923175.db2.gz JQJYVTYONVMFLK-CVEARBPZSA-N 1 1 318.373 3.925 20 5 DHBDMO Cc1c([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cccc1[N+](=O)[O-] ZINC000126608393 525894689 /nfs/dbraw/zinc/89/46/89/525894689.db2.gz LWIFSGGVGPZRNY-WZYMTQMTSA-N 1 1 317.433 3.569 20 5 DHBDMO Cc1c([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cccc1[N+](=O)[O-] ZINC000126608393 525894697 /nfs/dbraw/zinc/89/46/97/525894697.db2.gz LWIFSGGVGPZRNY-WZYMTQMTSA-N 1 1 317.433 3.569 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000266563105 526117849 /nfs/dbraw/zinc/11/78/49/526117849.db2.gz YMXGZKTYIDCWTF-GHMZBOCLSA-N 1 1 302.296 3.930 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000266563105 526117856 /nfs/dbraw/zinc/11/78/56/526117856.db2.gz YMXGZKTYIDCWTF-GHMZBOCLSA-N 1 1 302.296 3.930 20 5 DHBDMO Cc1csc([C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C2CC2)n1 ZINC000181590267 526438985 /nfs/dbraw/zinc/43/89/85/526438985.db2.gz IOUCNHCGFGTEJV-OAHLLOKOSA-N 1 1 317.414 3.909 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC([C@@H]3CCCO3)CC2)ccc1Cl ZINC000189162514 527329324 /nfs/dbraw/zinc/32/93/24/527329324.db2.gz BPOQGTKSOCSACW-INIZCTEOSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000266947809 527355757 /nfs/dbraw/zinc/35/57/57/527355757.db2.gz SIXYVIRAYBSGMW-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)c1 ZINC000112978300 527387174 /nfs/dbraw/zinc/38/71/74/527387174.db2.gz RHCZDLCMEAPTOO-UHFFFAOYSA-N 1 1 312.369 3.713 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2Cc2ccccc2)cs1 ZINC000054173444 1013251947 /nfs/dbraw/zinc/25/19/47/1013251947.db2.gz LZVTUEWGPBQAND-HNNXBMFYSA-N 1 1 302.399 3.863 20 5 DHBDMO CC[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000247044718 1013322965 /nfs/dbraw/zinc/32/29/65/1013322965.db2.gz LWCNOHFBPNOSBP-INMHGKMJSA-N 1 1 305.422 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2n[nH]c3ccccc32)cc1 ZINC000610271250 1013548155 /nfs/dbraw/zinc/54/81/55/1013548155.db2.gz UEJZHOPKVVLBKY-UHFFFAOYSA-N 1 1 324.384 3.584 20 5 DHBDMO Cn1cc[nH+]c1C[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000610282296 1013716997 /nfs/dbraw/zinc/71/69/97/1013716997.db2.gz GDBSKAPXFFKHOW-MRXNPFEDSA-N 1 1 322.368 3.724 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1COCc2ccccc21 ZINC000894951375 1013754145 /nfs/dbraw/zinc/75/41/45/1013754145.db2.gz ODKHUSYQVUMIBG-OAHLLOKOSA-N 1 1 318.760 3.609 20 5 DHBDMO C[C@H]1c2ccc(F)cc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610003631 1013843026 /nfs/dbraw/zinc/84/30/26/1013843026.db2.gz CUSQWMJAMZLYNL-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO C[C@H]1c2ccc(F)cc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610003631 1013843034 /nfs/dbraw/zinc/84/30/34/1013843034.db2.gz CUSQWMJAMZLYNL-LBPRGKRZSA-N 1 1 300.333 3.853 20 5 DHBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000093337785 1014342676 /nfs/dbraw/zinc/34/26/76/1014342676.db2.gz QLZDNTGQFXZPSQ-HNNXBMFYSA-N 1 1 306.406 3.577 20 5 DHBDMO CC[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000126344309 1014664113 /nfs/dbraw/zinc/66/41/13/1014664113.db2.gz DKHWHORWLSRIJI-UHFFFAOYSA-N 1 1 305.403 3.949 20 5 DHBDMO Cc1c(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000610505390 1014810888 /nfs/dbraw/zinc/81/08/88/1014810888.db2.gz JYCZIXGNKVCENU-QGZVFWFLSA-N 1 1 300.333 3.989 20 5 DHBDMO Cc1c(C[N@H+]2CC[C@@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000610505390 1014810903 /nfs/dbraw/zinc/81/09/03/1014810903.db2.gz JYCZIXGNKVCENU-QGZVFWFLSA-N 1 1 300.333 3.989 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@@H]2c2cccc(F)c2)c1 ZINC000610505322 1014811023 /nfs/dbraw/zinc/81/10/23/1014811023.db2.gz GXLYOFGKXCCKNT-QGZVFWFLSA-N 1 1 316.332 3.560 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H]2c2cccc(F)c2)c1 ZINC000610505322 1014811031 /nfs/dbraw/zinc/81/10/31/1014811031.db2.gz GXLYOFGKXCCKNT-QGZVFWFLSA-N 1 1 316.332 3.560 20 5 DHBDMO C[C@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276269677 1014911092 /nfs/dbraw/zinc/91/10/92/1014911092.db2.gz ZJRVJEKPWRQYTL-GRYCIOLGSA-N 1 1 316.361 3.579 20 5 DHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)c(F)c1 ZINC000522269024 1014993487 /nfs/dbraw/zinc/99/34/87/1014993487.db2.gz RBRIHUDWDSVSEC-UHFFFAOYSA-N 1 1 306.312 3.548 20 5 DHBDMO COc1c(O)ccc(C[N@H+](C)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000891504108 1015335098 /nfs/dbraw/zinc/33/50/98/1015335098.db2.gz ORWAKPARSSEVIZ-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1c(O)ccc(C[N@@H+](C)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000891504108 1015335106 /nfs/dbraw/zinc/33/51/06/1015335106.db2.gz ORWAKPARSSEVIZ-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO CC1(C)[C@@H]2C[N@@H+](Cc3cc(Cl)cc(Cl)c3[N+](=O)[O-])C[C@@H]21 ZINC001167487026 1015413611 /nfs/dbraw/zinc/41/36/11/1015413611.db2.gz DRVXMKCONIOVOE-PHIMTYICSA-N 1 1 315.200 3.989 20 5 DHBDMO CC1(C)[C@@H]2C[N@H+](Cc3cc(Cl)cc(Cl)c3[N+](=O)[O-])C[C@@H]21 ZINC001167487026 1015413612 /nfs/dbraw/zinc/41/36/12/1015413612.db2.gz DRVXMKCONIOVOE-PHIMTYICSA-N 1 1 315.200 3.989 20 5 DHBDMO CC(C)([NH2+]Cc1cccc(F)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000175985498 1015540288 /nfs/dbraw/zinc/54/02/88/1015540288.db2.gz TVVWXSRXPHDOTF-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581623 1015629412 /nfs/dbraw/zinc/62/94/12/1015629412.db2.gz DBBLQQJYWZTZSH-CQSZACIVSA-N 1 1 303.362 3.747 20 5 DHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581134 1015629540 /nfs/dbraw/zinc/62/95/40/1015629540.db2.gz PVCCMVRWQAUVMG-BXUZGUMPSA-N 1 1 303.362 3.747 20 5 DHBDMO C[C@H]1c2ccccc2CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582105 1015631455 /nfs/dbraw/zinc/63/14/55/1015631455.db2.gz SXWBCJWHKNSTST-LBPRGKRZSA-N 1 1 323.352 3.855 20 5 DHBDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582105 1015631462 /nfs/dbraw/zinc/63/14/62/1015631462.db2.gz SXWBCJWHKNSTST-LBPRGKRZSA-N 1 1 323.352 3.855 20 5 DHBDMO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)ccc1[N+](=O)[O-] ZINC000276931228 1015757759 /nfs/dbraw/zinc/75/77/59/1015757759.db2.gz QWQQXWHLGLAAHF-OAHLLOKOSA-N 1 1 315.373 3.659 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)ccc1[N+](=O)[O-] ZINC000276931228 1015757761 /nfs/dbraw/zinc/75/77/61/1015757761.db2.gz QWQQXWHLGLAAHF-OAHLLOKOSA-N 1 1 315.373 3.659 20 5 DHBDMO Cc1nc(C(C)C)oc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000428313477 1015786282 /nfs/dbraw/zinc/78/62/82/1015786282.db2.gz QQLJQQZUKPSOJE-NSHDSACASA-N 1 1 303.362 3.865 20 5 DHBDMO CCOc1cc(C[N@H+](C)[C@H](C)c2ccco2)ccc1[N+](=O)[O-] ZINC000276981020 1015793612 /nfs/dbraw/zinc/79/36/12/1015793612.db2.gz YKKVDMLPZBMFDJ-GFCCVEGCSA-N 1 1 304.346 3.780 20 5 DHBDMO CCOc1cc(C[N@@H+](C)[C@H](C)c2ccco2)ccc1[N+](=O)[O-] ZINC000276981020 1015793616 /nfs/dbraw/zinc/79/36/16/1015793616.db2.gz YKKVDMLPZBMFDJ-GFCCVEGCSA-N 1 1 304.346 3.780 20 5 DHBDMO CCOc1cc(C[N@H+](C)[C@@H](C)c2ccco2)ccc1[N+](=O)[O-] ZINC000276981022 1015794050 /nfs/dbraw/zinc/79/40/50/1015794050.db2.gz YKKVDMLPZBMFDJ-LBPRGKRZSA-N 1 1 304.346 3.780 20 5 DHBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)c2ccco2)ccc1[N+](=O)[O-] ZINC000276981022 1015794053 /nfs/dbraw/zinc/79/40/53/1015794053.db2.gz YKKVDMLPZBMFDJ-LBPRGKRZSA-N 1 1 304.346 3.780 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@H](c3ccncc3)C2)c1 ZINC000846905392 1032128617 /nfs/dbraw/zinc/12/86/17/1032128617.db2.gz IZMPLMPKFWWRFF-ZDUSSCGKSA-N 1 1 317.776 3.633 20 5 DHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000538726636 1016157799 /nfs/dbraw/zinc/15/77/99/1016157799.db2.gz LHRLRIBXBAYTPF-LBPRGKRZSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000178532434 1016326356 /nfs/dbraw/zinc/32/63/56/1016326356.db2.gz OHRGGJJWTJOJLB-CJNGLKHVSA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000178532434 1016326367 /nfs/dbraw/zinc/32/63/67/1016326367.db2.gz OHRGGJJWTJOJLB-CJNGLKHVSA-N 1 1 307.438 3.612 20 5 DHBDMO C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CCCC1 ZINC000159415173 1035048273 /nfs/dbraw/zinc/04/82/73/1035048273.db2.gz IGFIHYHGMQIFSV-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc3c2NCC3)C2CC2)cc1 ZINC000346823193 1016568110 /nfs/dbraw/zinc/56/81/10/1016568110.db2.gz NBEKHMOBXZWDSB-UHFFFAOYSA-N 1 1 323.396 3.727 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000444230377 1016887401 /nfs/dbraw/zinc/88/74/01/1016887401.db2.gz YEZZQRCAMOGLEM-CYBMUJFWSA-N 1 1 322.405 3.710 20 5 DHBDMO O=[N+]([O-])c1cnc(Nc2ccc([NH+]3CCCCCC3)cc2)nc1 ZINC000760520056 1032172074 /nfs/dbraw/zinc/17/20/74/1032172074.db2.gz QRXAZGFDFJSXQQ-UHFFFAOYSA-N 1 1 313.361 3.509 20 5 DHBDMO CCOC(C[N@@H+](CC)[C@H](C)c1cc([N+](=O)[O-])ccc1C)OCC ZINC000846977028 1032176469 /nfs/dbraw/zinc/17/64/69/1032176469.db2.gz YFUCYFJULBIJLG-CQSZACIVSA-N 1 1 324.421 3.685 20 5 DHBDMO Cc1nn(C[N@@H+]2CCC[C@H]2c2ccccc2C)c(C)c1[N+](=O)[O-] ZINC000054566156 1032345278 /nfs/dbraw/zinc/34/52/78/1032345278.db2.gz ZNPVFDSLLHYZNF-INIZCTEOSA-N 1 1 314.389 3.511 20 5 DHBDMO Cc1nn(C[N@H+]2CCC[C@H]2c2ccccc2C)c(C)c1[N+](=O)[O-] ZINC000054566156 1032345291 /nfs/dbraw/zinc/34/52/91/1032345291.db2.gz ZNPVFDSLLHYZNF-INIZCTEOSA-N 1 1 314.389 3.511 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000557589813 1011927044 /nfs/dbraw/zinc/92/70/44/1011927044.db2.gz ZHLJVTIAUDQWAM-SCZZXKLOSA-N 1 1 318.204 3.796 20 5 DHBDMO Cc1ccc(C[N@H+]2CCCC[C@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000537659801 1032619768 /nfs/dbraw/zinc/61/97/68/1032619768.db2.gz MOFRBMHJCCJNMQ-KRWDZBQOSA-N 1 1 313.401 3.969 20 5 DHBDMO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000537659801 1032619774 /nfs/dbraw/zinc/61/97/74/1032619774.db2.gz MOFRBMHJCCJNMQ-KRWDZBQOSA-N 1 1 313.401 3.969 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000515190868 1012573284 /nfs/dbraw/zinc/57/32/84/1012573284.db2.gz PEWMJFIKTBMAHR-HUUCEWRRSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCCN(C)C[C@@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000515190868 1012573295 /nfs/dbraw/zinc/57/32/95/1012573295.db2.gz PEWMJFIKTBMAHR-HUUCEWRRSA-N 1 1 307.438 3.674 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H]3COCC[C@H]32)cc1[N+](=O)[O-] ZINC000537689250 1032642392 /nfs/dbraw/zinc/64/23/92/1032642392.db2.gz JQEHYCODTUAPJO-DOTOQJQBSA-N 1 1 318.417 3.719 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)c1 ZINC000515744491 1012708462 /nfs/dbraw/zinc/70/84/62/1012708462.db2.gz LGROBRUHGODFMW-KRWDZBQOSA-N 1 1 314.360 3.941 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000475271330 1017110941 /nfs/dbraw/zinc/11/09/41/1017110941.db2.gz CLUHHHASYFDDPY-ZWNOBZJWSA-N 1 1 302.296 3.676 20 5 DHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444649904 1017604653 /nfs/dbraw/zinc/60/46/53/1017604653.db2.gz LMPXBTZXZCTSLW-GFCCVEGCSA-N 1 1 302.378 3.626 20 5 DHBDMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444686858 1017616000 /nfs/dbraw/zinc/61/60/00/1017616000.db2.gz UHSZBRBWSILBPI-MLGOLLRUSA-N 1 1 316.405 3.872 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083198425 1017629045 /nfs/dbraw/zinc/62/90/45/1017629045.db2.gz FRWHYOIVWHMZJY-XUJVJEKNSA-N 1 1 315.373 3.889 20 5 DHBDMO Cc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2C)C2CC2)o1 ZINC000051967676 1017789848 /nfs/dbraw/zinc/78/98/48/1017789848.db2.gz XWGAHLIWIMFFRX-UHFFFAOYSA-N 1 1 300.358 3.969 20 5 DHBDMO Cc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C2CC2)o1 ZINC000051967676 1017789868 /nfs/dbraw/zinc/78/98/68/1017789868.db2.gz XWGAHLIWIMFFRX-UHFFFAOYSA-N 1 1 300.358 3.969 20 5 DHBDMO Cc1c([C@H](C)N[C@H]2CC[N@H+](C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000153741953 1018004331 /nfs/dbraw/zinc/00/43/31/1018004331.db2.gz MVCPBLKVTCSHHM-GJZGRUSLSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1c([C@H](C)[NH2+][C@H]2CCN(C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000153741953 1018004341 /nfs/dbraw/zinc/00/43/41/1018004341.db2.gz MVCPBLKVTCSHHM-GJZGRUSLSA-N 1 1 317.433 3.571 20 5 DHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCC2(CCCC2)O1 ZINC000558720547 1018074976 /nfs/dbraw/zinc/07/49/76/1018074976.db2.gz WFTVKDJDQFLEKQ-OAHLLOKOSA-N 1 1 304.390 3.518 20 5 DHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCC2(CCCC2)O1 ZINC000558720547 1018074986 /nfs/dbraw/zinc/07/49/86/1018074986.db2.gz WFTVKDJDQFLEKQ-OAHLLOKOSA-N 1 1 304.390 3.518 20 5 DHBDMO CC(C)N(CC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C(C)C ZINC000447511433 1018406347 /nfs/dbraw/zinc/40/63/47/1018406347.db2.gz UHVXBOBIFMQHCW-SFHVURJKSA-N 1 1 319.449 3.681 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000447827491 1018484650 /nfs/dbraw/zinc/48/46/50/1018484650.db2.gz BOVRKQZFSFMUJK-XJKSGUPXSA-N 1 1 306.406 3.711 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000447827491 1018484654 /nfs/dbraw/zinc/48/46/54/1018484654.db2.gz BOVRKQZFSFMUJK-XJKSGUPXSA-N 1 1 306.406 3.711 20 5 DHBDMO COc1ccc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000583578391 1018570744 /nfs/dbraw/zinc/57/07/44/1018570744.db2.gz OPEJTUOMXSGLGO-KGLIPLIRSA-N 1 1 304.390 3.614 20 5 DHBDMO Cc1ccccc1C1([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000829490430 1018679342 /nfs/dbraw/zinc/67/93/42/1018679342.db2.gz SDLRYUGUPBKKBM-UHFFFAOYSA-N 1 1 300.333 3.821 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccc(F)cc21 ZINC000584125732 1018966066 /nfs/dbraw/zinc/96/60/66/1018966066.db2.gz YVFXODSLLMLNLD-GOSISDBHSA-N 1 1 314.360 3.896 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3cccnc3)CC2)c(F)c1 ZINC000611258749 1019424804 /nfs/dbraw/zinc/42/48/04/1019424804.db2.gz IQAQXWLBHPHCKI-UHFFFAOYSA-N 1 1 315.348 3.509 20 5 DHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccsc2[N+](=O)[O-])C1 ZINC000611370282 1019456962 /nfs/dbraw/zinc/45/69/62/1019456962.db2.gz FOWLEMNOTJNMAG-JSGCOSHPSA-N 1 1 317.414 3.904 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc(O)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000611526572 1019508075 /nfs/dbraw/zinc/50/80/75/1019508075.db2.gz UYXWUJWLXKOROG-UHFFFAOYSA-N 1 1 300.358 3.711 20 5 DHBDMO C[C@@H](C[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000727429299 1019712317 /nfs/dbraw/zinc/71/23/17/1019712317.db2.gz UWUKWTHECSROGY-AWEZNQCLSA-N 1 1 324.384 3.638 20 5 DHBDMO COc1cc(C[N@@H+](C)C2CCC(F)(F)CC2)ccc1[N+](=O)[O-] ZINC000347582495 1019729298 /nfs/dbraw/zinc/72/92/98/1019729298.db2.gz QAYCRQNYOHMJIF-UHFFFAOYSA-N 1 1 314.332 3.613 20 5 DHBDMO C[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000922538687 1020118815 /nfs/dbraw/zinc/11/88/15/1020118815.db2.gz VJXKFDOGPAZRAT-LLVKDONJSA-N 1 1 317.414 3.781 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1ccccc1F ZINC000731670868 1020135015 /nfs/dbraw/zinc/13/50/15/1020135015.db2.gz DNWXPWULRWPSFZ-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO CC[C@@H](C)C[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000732183878 1020209389 /nfs/dbraw/zinc/20/93/89/1020209389.db2.gz ULQGZLZBJFLXHX-SNVBAGLBSA-N 1 1 309.391 3.807 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCc3cccnc32)c(Cl)c1 ZINC000922876552 1020321530 /nfs/dbraw/zinc/32/15/30/1020321530.db2.gz DAOKJCCWRBJICP-OAHLLOKOSA-N 1 1 317.776 3.810 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCCO[C@@H](C(C)C)C1 ZINC000555794055 1020383697 /nfs/dbraw/zinc/38/36/97/1020383697.db2.gz QVVJIILTNXTOCL-RHSMWYFYSA-N 1 1 306.406 3.711 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1ccc3occc3c1)CC2 ZINC000347778868 1020393564 /nfs/dbraw/zinc/39/35/64/1020393564.db2.gz JRSLMRLBSVCHFZ-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1ccc3occc3c1)CC2 ZINC000347778868 1020393572 /nfs/dbraw/zinc/39/35/72/1020393572.db2.gz JRSLMRLBSVCHFZ-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000537721885 1032906088 /nfs/dbraw/zinc/90/60/88/1032906088.db2.gz RHXRZLCAEUGUAU-MRXNPFEDSA-N 1 1 304.321 3.789 20 5 DHBDMO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000537721885 1032906101 /nfs/dbraw/zinc/90/61/01/1032906101.db2.gz RHXRZLCAEUGUAU-MRXNPFEDSA-N 1 1 304.321 3.789 20 5 DHBDMO C[C@H](Cc1cccs1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774969 1020516534 /nfs/dbraw/zinc/51/65/34/1020516534.db2.gz CVKBMNRUJSHSDX-LLVKDONJSA-N 1 1 308.378 3.858 20 5 DHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000738052040 1020860622 /nfs/dbraw/zinc/86/06/22/1020860622.db2.gz BWTUXHQVBYZTPL-BBRMVZONSA-N 1 1 316.405 3.803 20 5 DHBDMO CC(C)[C@@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000738242752 1020868195 /nfs/dbraw/zinc/86/81/95/1020868195.db2.gz ZGCULJOSBMYYKB-CQSZACIVSA-N 1 1 316.405 3.660 20 5 DHBDMO C[C@H](O)[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000581135390 1020874824 /nfs/dbraw/zinc/87/48/24/1020874824.db2.gz GPPQHIRADVOBMJ-NVGCLXPQSA-N 1 1 318.348 3.507 20 5 DHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC4(C3)CCCCC4)c2c1 ZINC000742163668 1021092055 /nfs/dbraw/zinc/09/20/55/1021092055.db2.gz DCHHUZLXFCAUBS-UHFFFAOYSA-N 1 1 314.389 3.558 20 5 DHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776278159 1021228751 /nfs/dbraw/zinc/22/87/51/1021228751.db2.gz RVTFIBQZNPFBSJ-IAOVAPTHSA-N 1 1 306.406 3.529 20 5 DHBDMO Cc1cnc(C(C)(C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000182452280 1021655943 /nfs/dbraw/zinc/65/59/43/1021655943.db2.gz RMISSLJIPAYTHG-NSHDSACASA-N 1 1 305.403 3.946 20 5 DHBDMO Cc1noc(C[N@@H+]2CCCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000851937863 1022046143 /nfs/dbraw/zinc/04/61/43/1022046143.db2.gz CTAHORKXOWDVOV-AWEZNQCLSA-N 1 1 301.346 3.618 20 5 DHBDMO Cc1noc(C[N@H+]2CCCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000851937863 1022046158 /nfs/dbraw/zinc/04/61/58/1022046158.db2.gz CTAHORKXOWDVOV-AWEZNQCLSA-N 1 1 301.346 3.618 20 5 DHBDMO CC1CCC([N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000776580394 1022097449 /nfs/dbraw/zinc/09/74/49/1022097449.db2.gz UVXIXBNZTSCRFH-RWKZGTHUSA-N 1 1 318.417 3.671 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000337493409 1033029858 /nfs/dbraw/zinc/02/98/58/1033029858.db2.gz GSALAIFLUQASPJ-ZDUSSCGKSA-N 1 1 300.333 3.723 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCCC[C@H]2c2ccccc2F)C1 ZINC001169030234 1022219974 /nfs/dbraw/zinc/21/99/74/1022219974.db2.gz XAZPJCZDPWPBBP-KEYYUXOJSA-N 1 1 306.381 3.798 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](c3ccccc3Cl)C2)C1 ZINC001169034558 1022222202 /nfs/dbraw/zinc/22/22/02/1022222202.db2.gz HUURMWDZEYYJFA-MCIONIFRSA-N 1 1 308.809 3.575 20 5 DHBDMO C[N@@H+](Cc1cccc(Cl)c1Cl)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035291 1022222440 /nfs/dbraw/zinc/22/24/40/1022222440.db2.gz KARLPOILWUESCC-ZYHUDNBSSA-N 1 1 317.216 3.871 20 5 DHBDMO CC[C@@H]1CO[C@](C)(CCC(C)C)[N@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169038910 1022222469 /nfs/dbraw/zinc/22/24/69/1022222469.db2.gz LGCIPCDGLCNJGR-QBPKDAKJSA-N 1 1 312.454 3.695 20 5 DHBDMO C[C@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CCc2ccc(Cl)cc21 ZINC001169038870 1022223184 /nfs/dbraw/zinc/22/31/84/1022223184.db2.gz LBVKWXQNSWXWCB-HEHGZKQESA-N 1 1 322.836 3.747 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H]2c2cccc(Cl)c2)C1 ZINC001169041143 1022224971 /nfs/dbraw/zinc/22/49/71/1022224971.db2.gz BCDHREXMOVGFAQ-KCXAZCMYSA-N 1 1 308.809 3.922 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169025301 1022228796 /nfs/dbraw/zinc/22/87/96/1022228796.db2.gz YLPBGMNUDMRFDE-ZYHUDNBSSA-N 1 1 317.216 3.871 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169048699 1022229522 /nfs/dbraw/zinc/22/95/22/1022229522.db2.gz AQLFKEAVWFOZLV-YGRLFVJLSA-N 1 1 317.216 3.871 20 5 DHBDMO Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)c1 ZINC001169046716 1022229742 /nfs/dbraw/zinc/22/97/42/1022229742.db2.gz MGEKNWYCNNRAKY-NJAFHUGGSA-N 1 1 302.418 3.886 20 5 DHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C12CCC2 ZINC000763453599 1022291088 /nfs/dbraw/zinc/29/10/88/1022291088.db2.gz PMQAWMMXZNEKEC-HZPDHXFCSA-N 1 1 322.380 3.513 20 5 DHBDMO C[C@H](CNc1ccc([N+](=O)[O-])s1)[N@@H+](C)Cc1ccccc1 ZINC000609512757 1022296503 /nfs/dbraw/zinc/29/65/03/1022296503.db2.gz IKIRIIKLUWCMBN-GFCCVEGCSA-N 1 1 305.403 3.589 20 5 DHBDMO O=C(c1ccccc1)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000014320028 1022408782 /nfs/dbraw/zinc/40/87/82/1022408782.db2.gz AYPWXDRMMNQVOL-UHFFFAOYSA-N 1 1 324.380 3.690 20 5 DHBDMO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000610133476 1022425433 /nfs/dbraw/zinc/42/54/33/1022425433.db2.gz RVOBAAVCRNJNHL-DJIMGWMZSA-N 1 1 318.417 3.620 20 5 DHBDMO CC(C)(C)[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC001169723754 1022519559 /nfs/dbraw/zinc/51/95/59/1022519559.db2.gz GXRRGUAXVHLYLR-AWEZNQCLSA-N 1 1 306.406 3.732 20 5 DHBDMO O=C(CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000180218809 1022663570 /nfs/dbraw/zinc/66/35/70/1022663570.db2.gz UBBFHUCXKLYSLW-UHFFFAOYSA-N 1 1 324.380 3.832 20 5 DHBDMO C[N@@H+](Cc1cncc2ccccc21)Cc1ccccc1[N+](=O)[O-] ZINC000768337919 1022948131 /nfs/dbraw/zinc/94/81/31/1022948131.db2.gz WUNQKRYFLMVDKG-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO C[N@H+](Cc1cncc2ccccc21)Cc1ccccc1[N+](=O)[O-] ZINC000768337919 1022948142 /nfs/dbraw/zinc/94/81/42/1022948142.db2.gz WUNQKRYFLMVDKG-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO CC[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CCC1 ZINC000769466079 1023158926 /nfs/dbraw/zinc/15/89/26/1023158926.db2.gz HVMCMUJSZDJOAV-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO CC[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CCC1 ZINC000769466079 1023158933 /nfs/dbraw/zinc/15/89/33/1023158933.db2.gz HVMCMUJSZDJOAV-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000770101959 1023275315 /nfs/dbraw/zinc/27/53/15/1023275315.db2.gz ZEYYYEOFPKCCPE-NSHDSACASA-N 1 1 320.780 3.664 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000770311421 1023296069 /nfs/dbraw/zinc/29/60/69/1023296069.db2.gz PCMWWKPTGAAWCL-AOOOYVTPSA-N 1 1 313.195 3.730 20 5 DHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000770311421 1023296075 /nfs/dbraw/zinc/29/60/75/1023296075.db2.gz PCMWWKPTGAAWCL-AOOOYVTPSA-N 1 1 313.195 3.730 20 5 DHBDMO C[C@@H]1C[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H](C)C1(F)F ZINC000859413449 1033136731 /nfs/dbraw/zinc/13/67/31/1033136731.db2.gz IEFRRTFEFWCJSW-NXEZZACHSA-N 1 1 318.751 3.971 20 5 DHBDMO CC(C)[C@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CCS1 ZINC000538728385 1033149698 /nfs/dbraw/zinc/14/96/98/1033149698.db2.gz QPSOXRQIFXOILV-BIENSFFJSA-N 1 1 306.431 3.681 20 5 DHBDMO COc1cccc(C[N@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000746653644 1023766462 /nfs/dbraw/zinc/76/64/62/1023766462.db2.gz MCXGQZNIHDSTOW-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO COc1cccc(C[N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000746653644 1023766469 /nfs/dbraw/zinc/76/64/69/1023766469.db2.gz MCXGQZNIHDSTOW-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccc3cnccc3c1)C2 ZINC000787171633 1023768606 /nfs/dbraw/zinc/76/86/06/1023768606.db2.gz NSVAQSWDSZWCND-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccc3cnccc3c1)C2 ZINC000787171633 1023768609 /nfs/dbraw/zinc/76/86/09/1023768609.db2.gz NSVAQSWDSZWCND-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)C(C)C ZINC000112658123 1023814747 /nfs/dbraw/zinc/81/47/47/1023814747.db2.gz LNKGRBCFTFVUTA-CQSZACIVSA-N 1 1 321.421 3.598 20 5 DHBDMO Cc1[nH+]c(N)ccc1CNc1ccc(C(C)(C)C)cc1[N+](=O)[O-] ZINC001167785932 1023846338 /nfs/dbraw/zinc/84/63/38/1023846338.db2.gz HPMPNNBUOYUQHQ-UHFFFAOYSA-N 1 1 314.389 3.790 20 5 DHBDMO COC[C@@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000452110149 1023979453 /nfs/dbraw/zinc/97/94/53/1023979453.db2.gz YEJKFAHURGCQDG-HUUCEWRRSA-N 1 1 306.406 3.713 20 5 DHBDMO CC(C)[N@H+](Cc1cccs1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269694029 1024304917 /nfs/dbraw/zinc/30/49/17/1024304917.db2.gz VYTVYOXMFSVBAK-MRXNPFEDSA-N 1 1 320.414 3.600 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)cc1 ZINC000269851918 1024321887 /nfs/dbraw/zinc/32/18/87/1024321887.db2.gz PKJBCVQYRQWGJJ-OAHLLOKOSA-N 1 1 304.296 3.650 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(Cl)n1 ZINC000883300968 1024357745 /nfs/dbraw/zinc/35/77/45/1024357745.db2.gz MSHAXLAAWNYCTF-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000270343441 1024379072 /nfs/dbraw/zinc/37/90/72/1024379072.db2.gz UZVJZNRVOQGEMO-JTQLQIEISA-N 1 1 300.280 3.850 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000270343441 1024379085 /nfs/dbraw/zinc/37/90/85/1024379085.db2.gz UZVJZNRVOQGEMO-JTQLQIEISA-N 1 1 300.280 3.850 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2c3ccccc3CC[C@H]2F)cc1 ZINC000883384546 1024419243 /nfs/dbraw/zinc/41/92/43/1024419243.db2.gz UKPJQTDWMYHLBC-SJORKVTESA-N 1 1 300.333 3.710 20 5 DHBDMO CSC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000305922970 1024440744 /nfs/dbraw/zinc/44/07/44/1024440744.db2.gz CLAJFZACZSVVRP-UHFFFAOYSA-N 1 1 300.811 3.576 20 5 DHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000453362512 1024486552 /nfs/dbraw/zinc/48/65/52/1024486552.db2.gz RIIUKOXXNHEMIP-MLGOLLRUSA-N 1 1 314.389 3.539 20 5 DHBDMO CC[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000453367953 1024491840 /nfs/dbraw/zinc/49/18/40/1024491840.db2.gz MOZJWUTUGVYFCW-IAGOWNOFSA-N 1 1 304.390 3.548 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCC(F)(F)F)CC2CC2)cc1F ZINC000283247061 1024616221 /nfs/dbraw/zinc/61/62/21/1024616221.db2.gz VDAOCZSNFHCEKN-UHFFFAOYSA-N 1 1 320.286 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)c(F)c1 ZINC000278944654 1024630811 /nfs/dbraw/zinc/63/08/11/1024630811.db2.gz YGPKYNHYIYOKJE-SECBINFHSA-N 1 1 306.259 3.508 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)c(F)c1 ZINC000278944654 1024630812 /nfs/dbraw/zinc/63/08/12/1024630812.db2.gz YGPKYNHYIYOKJE-SECBINFHSA-N 1 1 306.259 3.508 20 5 DHBDMO CCCO[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000108396910 1024640085 /nfs/dbraw/zinc/64/00/85/1024640085.db2.gz CMHLSUQVZIMHFM-INIZCTEOSA-N 1 1 306.406 3.684 20 5 DHBDMO CCn1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000792182282 1024643459 /nfs/dbraw/zinc/64/34/59/1024643459.db2.gz AEWREFGLIAMPDP-UHFFFAOYSA-N 1 1 307.781 3.702 20 5 DHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000749685128 1024771034 /nfs/dbraw/zinc/77/10/34/1024771034.db2.gz AZIPDZWNUYWDRU-JQFCIGGWSA-N 1 1 306.406 3.529 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792868905 1024811813 /nfs/dbraw/zinc/81/18/13/1024811813.db2.gz YLZAYXATRFLISS-LALPHHSUSA-N 1 1 319.361 3.656 20 5 DHBDMO COc1cccc(C)c1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000877087857 1033237011 /nfs/dbraw/zinc/23/70/11/1033237011.db2.gz USNMLBOPORXABO-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO CC[C@H](NC[C@@H](C(C)C)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000319960209 1024912738 /nfs/dbraw/zinc/91/27/38/1024912738.db2.gz HEIBWRQENOMSPF-ROUUACIJSA-N 1 1 319.449 3.756 20 5 DHBDMO C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1c(F)cncc1F ZINC000353148087 1024965672 /nfs/dbraw/zinc/96/56/72/1024965672.db2.gz ZJMXBPDCHSJCMQ-MALLOTDXSA-N 1 1 319.311 3.632 20 5 DHBDMO CCC[N@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)C1CC1 ZINC000728903110 1024970398 /nfs/dbraw/zinc/97/03/98/1024970398.db2.gz RTJBYLORBUVNRG-UHFFFAOYSA-N 1 1 307.375 3.704 20 5 DHBDMO CCC[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)C1CC1 ZINC000728903110 1024970502 /nfs/dbraw/zinc/97/05/02/1024970502.db2.gz RTJBYLORBUVNRG-UHFFFAOYSA-N 1 1 307.375 3.704 20 5 DHBDMO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000120900319 1025063444 /nfs/dbraw/zinc/06/34/44/1025063444.db2.gz BKJJNQJPSDYZGU-ZDUSSCGKSA-N 1 1 314.389 3.757 20 5 DHBDMO COc1ccc(C[N@H+](C)Cc2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC000353449263 1025070730 /nfs/dbraw/zinc/07/07/30/1025070730.db2.gz QRNKALSCSDJHJZ-UHFFFAOYSA-N 1 1 322.311 3.514 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC000353449263 1025070741 /nfs/dbraw/zinc/07/07/41/1025070741.db2.gz QRNKALSCSDJHJZ-UHFFFAOYSA-N 1 1 322.311 3.514 20 5 DHBDMO CC[C@]1(C)CCC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000353685503 1025198626 /nfs/dbraw/zinc/19/86/26/1025198626.db2.gz IGXIIKWGUDIYKA-QGZVFWFLSA-N 1 1 322.405 3.624 20 5 DHBDMO CC(C)OCCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000354212122 1025382762 /nfs/dbraw/zinc/38/27/62/1025382762.db2.gz ZPIDKMUGLUHXQO-UHFFFAOYSA-N 1 1 324.421 3.629 20 5 DHBDMO CSc1ccccc1[C@@H](C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886190550 1025554175 /nfs/dbraw/zinc/55/41/75/1025554175.db2.gz VJXVIPPNSWCUAU-LLVKDONJSA-N 1 1 303.387 3.563 20 5 DHBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000355211479 1025640092 /nfs/dbraw/zinc/64/00/92/1025640092.db2.gz BYPOBDGBZNZAQD-QGZVFWFLSA-N 1 1 306.406 3.719 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)c1cscn1 ZINC000573626202 1025738940 /nfs/dbraw/zinc/73/89/40/1025738940.db2.gz YOTZRZHSPZKXRZ-HUMZTAOYSA-N 1 1 303.387 3.805 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CCOCC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000355534789 1025757593 /nfs/dbraw/zinc/75/75/93/1025757593.db2.gz UGDDADWUBKQHAG-UHFFFAOYSA-N 1 1 318.417 3.721 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CO[NH+]=C(N)C1CCCC1 ZINC000729674059 1025904299 /nfs/dbraw/zinc/90/42/99/1025904299.db2.gz IDWMSQXZEYBFIN-UHFFFAOYSA-N 1 1 321.377 3.571 20 5 DHBDMO C[C@H]([N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1(C)CC1 ZINC000089909236 1026072999 /nfs/dbraw/zinc/07/29/99/1026072999.db2.gz ZVQRWJVIEAOETA-LBPRGKRZSA-N 1 1 315.373 3.870 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000533067884 1026194148 /nfs/dbraw/zinc/19/41/48/1026194148.db2.gz ANXDCIMKYKOPAZ-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000289853376 1026201932 /nfs/dbraw/zinc/20/19/32/1026201932.db2.gz QKURNTJARZUOOC-UHOFOFEASA-N 1 1 304.390 3.545 20 5 DHBDMO CCC[C@H](NC[C@H]1CC[N@H+](CCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000151119903 1026342562 /nfs/dbraw/zinc/34/25/62/1026342562.db2.gz LWNJFPACPKUDJC-QAPCUYQASA-N 1 1 319.449 3.758 20 5 DHBDMO CCC[C@H](NC[C@H]1CC[N@@H+](CCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000151119903 1026342572 /nfs/dbraw/zinc/34/25/72/1026342572.db2.gz LWNJFPACPKUDJC-QAPCUYQASA-N 1 1 319.449 3.758 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](C4CCCC4)C3)nc2c1 ZINC000420959935 1026892703 /nfs/dbraw/zinc/89/27/03/1026892703.db2.gz FZQNHKZPBSXMGI-CYBMUJFWSA-N 1 1 315.373 3.748 20 5 DHBDMO COCc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000237228248 1027001158 /nfs/dbraw/zinc/00/11/58/1027001158.db2.gz BKCAMKKZOSXCLK-UHFFFAOYSA-N 1 1 320.776 3.684 20 5 DHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccoc1 ZINC000811476085 1027016300 /nfs/dbraw/zinc/01/63/00/1027016300.db2.gz YEXGVSKLBHHMQJ-UHFFFAOYSA-N 1 1 301.129 3.784 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000355754144 1027105293 /nfs/dbraw/zinc/10/52/93/1027105293.db2.gz ZODQNVVMCJWPQQ-WMLDXEAASA-N 1 1 304.390 3.548 20 5 DHBDMO C[N@H+]1CCC[C@@H](CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000228849177 1027127591 /nfs/dbraw/zinc/12/75/91/1027127591.db2.gz UWKHJWJUKFTHCL-VIFPVBQESA-N 1 1 318.204 3.655 20 5 DHBDMO Cc1cc(N[C@H](C)C[N@H+](C)C(C)C)c2cccc([N+](=O)[O-])c2n1 ZINC000562237797 1027321814 /nfs/dbraw/zinc/32/18/14/1027321814.db2.gz IIZMLKCMNMFRQS-CYBMUJFWSA-N 1 1 316.405 3.592 20 5 DHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812851054 1027449893 /nfs/dbraw/zinc/44/98/93/1027449893.db2.gz PSDQVJOMANTLGO-RDTXWAMCSA-N 1 1 314.385 3.539 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000575098367 1027452104 /nfs/dbraw/zinc/45/21/04/1027452104.db2.gz GJZLDRGAMNEGHY-HUUCEWRRSA-N 1 1 307.438 3.674 20 5 DHBDMO CCCN(CC)C[C@@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000575098367 1027452110 /nfs/dbraw/zinc/45/21/10/1027452110.db2.gz GJZLDRGAMNEGHY-HUUCEWRRSA-N 1 1 307.438 3.674 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccccn3)C2)cc1Cl ZINC000798964806 1027666760 /nfs/dbraw/zinc/66/67/60/1027666760.db2.gz MZMWERRLFGKMKX-ZDUSSCGKSA-N 1 1 317.776 3.633 20 5 DHBDMO Cc1cccnc1[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C(C)(C)C ZINC000934285529 1027951689 /nfs/dbraw/zinc/95/16/89/1027951689.db2.gz AHFBOAQWYRPDPI-OAHLLOKOSA-N 1 1 314.389 3.570 20 5 DHBDMO Cc1cc(C)c(COc2c(Cl)cncc2[N+](=O)[O-])c(C)[nH+]1 ZINC000601082778 1027977856 /nfs/dbraw/zinc/97/78/56/1027977856.db2.gz PPMVTEWDRMIQKP-UHFFFAOYSA-N 1 1 307.737 3.542 20 5 DHBDMO CC(C)(F)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000601136517 1027998553 /nfs/dbraw/zinc/99/85/53/1027998553.db2.gz GWAYSVXHWOCHKJ-UHFFFAOYSA-N 1 1 309.366 3.556 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCCC(F)(F)CC3)c2c1 ZINC000601201116 1028020564 /nfs/dbraw/zinc/02/05/64/1028020564.db2.gz LMWSLHLTEWSGTL-UHFFFAOYSA-N 1 1 307.300 3.769 20 5 DHBDMO C[C@H](Nc1cccc2cc[nH+]cc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815613771 1028569936 /nfs/dbraw/zinc/56/99/36/1028569936.db2.gz XDLKGNBQZXPJNK-NSHDSACASA-N 1 1 308.341 3.898 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C/C=C\c3ccncc3)C2)cc1 ZINC000449496268 1028711148 /nfs/dbraw/zinc/71/11/48/1028711148.db2.gz GLONTQKYXYMCKX-PBMKKYJASA-N 1 1 323.396 3.883 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccncc3F)C2)cc1 ZINC000449499226 1028712307 /nfs/dbraw/zinc/71/23/07/1028712307.db2.gz LOVPWAIYFZUSDT-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO CC[C@H](C)[N@@H+](Cc1ccccc1)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000077441890 1028875234 /nfs/dbraw/zinc/87/52/34/1028875234.db2.gz OJLPCRWQSYSLAU-ZDUSSCGKSA-N 1 1 316.405 3.666 20 5 DHBDMO CC[C@H](C)[N@H+](Cc1ccccc1)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000077441890 1028875255 /nfs/dbraw/zinc/87/52/55/1028875255.db2.gz OJLPCRWQSYSLAU-ZDUSSCGKSA-N 1 1 316.405 3.666 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCCc2cccnc21 ZINC000372764471 1028897125 /nfs/dbraw/zinc/89/71/25/1028897125.db2.gz LASUJBVYNLJFFB-QGZVFWFLSA-N 1 1 311.385 3.808 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000568691797 1029112253 /nfs/dbraw/zinc/11/22/53/1029112253.db2.gz SYUVQPSMISEETC-MRXNPFEDSA-N 1 1 304.390 3.614 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000568691797 1029112260 /nfs/dbraw/zinc/11/22/60/1029112260.db2.gz SYUVQPSMISEETC-MRXNPFEDSA-N 1 1 304.390 3.614 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000569238586 1029200097 /nfs/dbraw/zinc/20/00/97/1029200097.db2.gz NORALJIERPLJBB-ZDUSSCGKSA-N 1 1 317.776 3.633 20 5 DHBDMO Cc1cnc([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000374229975 1029247757 /nfs/dbraw/zinc/24/77/57/1029247757.db2.gz NXRRCZOITKKCPE-AWEZNQCLSA-N 1 1 317.414 3.739 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCc2c1cccc2O ZINC000451178513 1029812775 /nfs/dbraw/zinc/81/27/75/1029812775.db2.gz NLPUFZZNZSRSCF-CQSZACIVSA-N 1 1 318.760 3.731 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451336763 1029850543 /nfs/dbraw/zinc/85/05/43/1029850543.db2.gz FZOOQBUYNIAATA-RNJTYBCJSA-N 1 1 318.417 3.671 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451429036 1029868941 /nfs/dbraw/zinc/86/89/41/1029868941.db2.gz YRIDMKWKCPQNSC-NZPGVSJUSA-N 1 1 318.417 3.590 20 5 DHBDMO CCO[C@@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C[C@H]1C ZINC000451542042 1029908029 /nfs/dbraw/zinc/90/80/29/1029908029.db2.gz MRHMNXWELSJVMV-JKIFEVAISA-N 1 1 306.406 3.711 20 5 DHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000530663119 1029949323 /nfs/dbraw/zinc/94/93/23/1029949323.db2.gz KGDWJUVSIHUDJO-CQSZACIVSA-N 1 1 312.369 3.593 20 5 DHBDMO Cc1[nH+]ccn1CCCN(C)c1ccc([N+](=O)[O-])cc1C(F)F ZINC000865629452 1029951947 /nfs/dbraw/zinc/95/19/47/1029951947.db2.gz GVVRVRZNXWZZCF-UHFFFAOYSA-N 1 1 324.331 3.564 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1 ZINC000451835693 1030023298 /nfs/dbraw/zinc/02/32/98/1030023298.db2.gz KGIWWXZBJPJSMJ-QGZVFWFLSA-N 1 1 312.369 3.958 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451963645 1030069165 /nfs/dbraw/zinc/06/91/65/1030069165.db2.gz HTBWHROUPGRXLH-BBRMVZONSA-N 1 1 306.431 3.875 20 5 DHBDMO CSc1ccccc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000358060430 1030304021 /nfs/dbraw/zinc/30/40/21/1030304021.db2.gz GDAGVIDMYMNTJN-UHFFFAOYSA-N 1 1 302.399 3.949 20 5 DHBDMO CSc1ccccc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000358060430 1030304036 /nfs/dbraw/zinc/30/40/36/1030304036.db2.gz GDAGVIDMYMNTJN-UHFFFAOYSA-N 1 1 302.399 3.949 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc2c1OCO2 ZINC000925696278 1030454894 /nfs/dbraw/zinc/45/48/94/1030454894.db2.gz YXYMRHARWZQTCY-RYUDHWBXSA-N 1 1 314.341 3.735 20 5 DHBDMO CCC1([NH3+])CCN([C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000925760348 1030485453 /nfs/dbraw/zinc/48/54/53/1030485453.db2.gz PTEFRXBICGPCCI-MRXNPFEDSA-N 1 1 317.433 3.521 20 5 DHBDMO CO[C@@H](C)C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000558418738 1030568628 /nfs/dbraw/zinc/56/86/28/1030568628.db2.gz ZTZXUEMVKXHNFN-LBPRGKRZSA-N 1 1 320.414 3.790 20 5 DHBDMO Cc1c(C[N@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cccc1[N+](=O)[O-] ZINC000358824926 1030637956 /nfs/dbraw/zinc/63/79/56/1030637956.db2.gz NXZZQYULPRKJTD-FZKQIMNGSA-N 1 1 311.385 3.881 20 5 DHBDMO COCCCCc1ccc[nH+]c1NCc1ccc([N+](=O)[O-])cc1 ZINC000292451873 1031004295 /nfs/dbraw/zinc/00/42/95/1031004295.db2.gz GBUSHWXVPYMQRB-UHFFFAOYSA-N 1 1 315.373 3.571 20 5 DHBDMO CSC[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000292715571 1031140362 /nfs/dbraw/zinc/14/03/62/1031140362.db2.gz DRCSSUOYQRFSPH-GPAKFWEMSA-N 1 1 306.431 3.683 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)c1 ZINC000844437443 1031142935 /nfs/dbraw/zinc/14/29/35/1031142935.db2.gz LGZFZIPXGJXWPR-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@]3(CC3(F)F)C2)c1 ZINC000844437443 1031142940 /nfs/dbraw/zinc/14/29/40/1031142940.db2.gz LGZFZIPXGJXWPR-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO CC1(C)CC[C@@H](C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)O1 ZINC000359899129 1031186541 /nfs/dbraw/zinc/18/65/41/1031186541.db2.gz LJUJZVKIWCSMJS-INIZCTEOSA-N 1 1 304.390 3.517 20 5 DHBDMO CC1(C)CC[C@H](C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)O1 ZINC000359899130 1031186658 /nfs/dbraw/zinc/18/66/58/1031186658.db2.gz LJUJZVKIWCSMJS-MRXNPFEDSA-N 1 1 304.390 3.517 20 5 DHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(C)n1 ZINC000872024525 1031408287 /nfs/dbraw/zinc/40/82/87/1031408287.db2.gz SXCBSLOLBITIOE-LBPRGKRZSA-N 1 1 317.414 3.871 20 5 DHBDMO COc1cc(C)cc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872052886 1031440228 /nfs/dbraw/zinc/44/02/28/1031440228.db2.gz RLBHHRADROQHDK-LBPRGKRZSA-N 1 1 318.348 3.902 20 5 DHBDMO CCc1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000929338280 1031497732 /nfs/dbraw/zinc/49/77/32/1031497732.db2.gz SDYOHIGAYGKMBL-UHFFFAOYSA-N 1 1 303.362 3.556 20 5 DHBDMO CCc1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000929338280 1031497739 /nfs/dbraw/zinc/49/77/39/1031497739.db2.gz SDYOHIGAYGKMBL-UHFFFAOYSA-N 1 1 303.362 3.556 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](OC3CCC3)CC2)cc1 ZINC000872278252 1031572986 /nfs/dbraw/zinc/57/29/86/1031572986.db2.gz KWVWYPRORRVQTL-SFHVURJKSA-N 1 1 318.417 3.561 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(NCCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC000360975621 1031654934 /nfs/dbraw/zinc/65/49/34/1031654934.db2.gz VFOMEUMNMMWDGA-AWEZNQCLSA-N 1 1 321.421 3.527 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H]1C[C@@H]2[C@H](C1)C2(F)F)C1CC1 ZINC000930061289 1031688783 /nfs/dbraw/zinc/68/87/83/1031688783.db2.gz QKKOSOSYGCKULN-SHHSBJBSSA-N 1 1 322.355 3.851 20 5 DHBDMO CCc1noc(CC)c1C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873074742 1031703131 /nfs/dbraw/zinc/70/31/31/1031703131.db2.gz OWJQRNAFSLXEOG-UHFFFAOYSA-N 1 1 317.389 3.614 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCc2cccnc2)C2CC2)cc1 ZINC000930141342 1031712738 /nfs/dbraw/zinc/71/27/38/1031712738.db2.gz YQCAZJNBLXHBLV-UHFFFAOYSA-N 1 1 311.385 3.587 20 5 DHBDMO COCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1CC[C@H](C)C1 ZINC000361641558 1032032085 /nfs/dbraw/zinc/03/20/85/1032032085.db2.gz CKEKVIRUEXFJLQ-XJKSGUPXSA-N 1 1 306.406 3.540 20 5 DHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777957506 1032043812 /nfs/dbraw/zinc/04/38/12/1032043812.db2.gz RITQDLCOJHQUAV-CZUORRHYSA-N 1 1 314.389 3.536 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000877522519 1033334296 /nfs/dbraw/zinc/33/42/96/1033334296.db2.gz BHTHHBQWJJOELY-SFHVURJKSA-N 1 1 311.385 3.944 20 5 DHBDMO Cc1c(C[N@H+]2CC3(CCOCC3)[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000877590566 1033372429 /nfs/dbraw/zinc/37/24/29/1033372429.db2.gz AZHAKWTVWROGNW-KRWDZBQOSA-N 1 1 318.417 3.540 20 5 DHBDMO C[N@@H+](C1CC(F)(F)C1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907664 1033440126 /nfs/dbraw/zinc/44/01/26/1033440126.db2.gz HIZXUWQLXHXLPD-CYBMUJFWSA-N 1 1 310.344 3.572 20 5 DHBDMO CC[C@H]1CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172919319 1033466154 /nfs/dbraw/zinc/46/61/54/1033466154.db2.gz FVNDVBMDCYMMAN-WMLDXEAASA-N 1 1 302.418 3.964 20 5 DHBDMO C[C@H]1CCCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909562 1033482939 /nfs/dbraw/zinc/48/29/39/1033482939.db2.gz SMKHLVPICAIIGW-WMLDXEAASA-N 1 1 302.418 3.964 20 5 DHBDMO CCC[N@@H+](CC1CC1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173187336 1033583842 /nfs/dbraw/zinc/58/38/42/1033583842.db2.gz ZJTZZCSRNVZANB-LBPRGKRZSA-N 1 1 324.396 3.796 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)CC2CCCC2)c1F ZINC001173195934 1033586877 /nfs/dbraw/zinc/58/68/77/1033586877.db2.gz KDHSCSSIUBPEMY-LBPRGKRZSA-N 1 1 324.396 3.796 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173195132 1033587862 /nfs/dbraw/zinc/58/78/62/1033587862.db2.gz CCZFYWMDPYDZFG-QWHCGFSZSA-N 1 1 324.396 3.938 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCCC23CC3)c1F ZINC001173197317 1033590473 /nfs/dbraw/zinc/59/04/73/1033590473.db2.gz SPKFNGAYWWKZQA-GFCCVEGCSA-N 1 1 322.380 3.692 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)C[C@@H]2CC2(C)C)c1F ZINC001173198381 1033590650 /nfs/dbraw/zinc/59/06/50/1033590650.db2.gz ZBTPQLBXHSNWLI-NEPJUHHUSA-N 1 1 324.396 3.651 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1ccccn1 ZINC001173227575 1033606473 /nfs/dbraw/zinc/60/64/73/1033606473.db2.gz QXLYWFYMOKJRTA-RDTXWAMCSA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2cc(F)ccc2C1 ZINC001173232632 1033608062 /nfs/dbraw/zinc/60/80/62/1033608062.db2.gz SBBKIPKWXXADAJ-CYBMUJFWSA-N 1 1 314.360 3.723 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccccc1F ZINC001173232663 1033608337 /nfs/dbraw/zinc/60/83/37/1033608337.db2.gz SEKRMFMHRYHEOM-AWEZNQCLSA-N 1 1 316.376 3.839 20 5 DHBDMO C[N@@H+]1CC=C(CNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000553516874 1033721625 /nfs/dbraw/zinc/72/16/25/1033721625.db2.gz UBTMQRDAQIDMDL-UHFFFAOYSA-N 1 1 316.188 3.575 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H](c2cccnc2)C1 ZINC000878756530 1033817950 /nfs/dbraw/zinc/81/79/50/1033817950.db2.gz OWEBKLNRYJKVQZ-AWEZNQCLSA-N 1 1 315.348 3.509 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC(F)(F)CC2)cc1Cl ZINC000862466311 1033861263 /nfs/dbraw/zinc/86/12/63/1033861263.db2.gz GGACJCIUAJNIRW-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC(F)(F)CC2)cc1Cl ZINC000862466311 1033861279 /nfs/dbraw/zinc/86/12/79/1033861279.db2.gz GGACJCIUAJNIRW-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO Cc1c([C@H](C)NCCC[N@H+]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000479885824 1033947148 /nfs/dbraw/zinc/94/71/48/1033947148.db2.gz PGTGYGCEPNOWRC-HOCLYGCPSA-N 1 1 319.449 3.818 20 5 DHBDMO CCC(=O)c1ccc(Nc2ccc3[nH+]c(C)cn3c2)c([N+](=O)[O-])c1 ZINC000480023534 1034010609 /nfs/dbraw/zinc/01/06/09/1034010609.db2.gz ZJMUGDXNECHYCQ-UHFFFAOYSA-N 1 1 324.340 3.887 20 5 DHBDMO Cc1csc([C@@H]2CC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000880010433 1034183039 /nfs/dbraw/zinc/18/30/39/1034183039.db2.gz UEKLCQWLWFWZRN-TZMCWYRMSA-N 1 1 317.414 3.910 20 5 DHBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]1C ZINC000177879939 1034190773 /nfs/dbraw/zinc/19/07/73/1034190773.db2.gz DOTXXPSPLSLDJE-CHWSQXEVSA-N 1 1 315.373 3.523 20 5 DHBDMO C[C@@H]1[C@@H](C)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000177879951 1034192301 /nfs/dbraw/zinc/19/23/01/1034192301.db2.gz DOTXXPSPLSLDJE-QWHCGFSZSA-N 1 1 315.373 3.523 20 5 DHBDMO Cc1cccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)c1C ZINC000794642055 1034312535 /nfs/dbraw/zinc/31/25/35/1034312535.db2.gz PKSSZNCPFKCHGC-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO Cc1nn(C[N@H+](C)[C@@H]2CCC(C)(C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000794687593 1034365451 /nfs/dbraw/zinc/36/54/51/1034365451.db2.gz VZTHXDQNHYPLFD-CQSZACIVSA-N 1 1 316.405 3.721 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H](C3CCOCC3)C2)cs1 ZINC000880575261 1034368333 /nfs/dbraw/zinc/36/83/33/1034368333.db2.gz WSPSSMINKSZTOI-OAHLLOKOSA-N 1 1 324.446 3.685 20 5 DHBDMO C[C@H](CN1CCCCCC1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000480699958 1034412488 /nfs/dbraw/zinc/41/24/88/1034412488.db2.gz QEMKHQOXWYIYNX-CABCVRRESA-N 1 1 305.422 3.510 20 5 DHBDMO CC1(F)CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC001175026673 1034757601 /nfs/dbraw/zinc/75/76/01/1034757601.db2.gz ZZPOJRTZPQEJQD-UHFFFAOYSA-N 1 1 320.286 3.938 20 5 DHBDMO Cc1csc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000192639952 1034814102 /nfs/dbraw/zinc/81/41/02/1034814102.db2.gz YDAFFAFSCMCHRP-CQSZACIVSA-N 1 1 303.387 3.527 20 5 DHBDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000481768362 1034969391 /nfs/dbraw/zinc/96/93/91/1034969391.db2.gz MNZHOGHAZULYKR-BXUZGUMPSA-N 1 1 316.323 3.800 20 5 DHBDMO Cc1c([C@@H](C)NC[C@@H](C)[NH+]2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000481976588 1035038935 /nfs/dbraw/zinc/03/89/35/1035038935.db2.gz ZYVGDHXZXASOHM-GDBMZVCRSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@@H](C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000481976072 1035040223 /nfs/dbraw/zinc/04/02/23/1035040223.db2.gz XROYFRFTWWSINV-HZPDHXFCSA-N 1 1 319.449 3.674 20 5 DHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159418233 1035051841 /nfs/dbraw/zinc/05/18/41/1035051841.db2.gz FFTZEXLGWALWSG-JTQLQIEISA-N 1 1 315.211 3.834 20 5 DHBDMO CC(C)[C@@H](C)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159418102 1035051911 /nfs/dbraw/zinc/05/19/11/1035051911.db2.gz FFTZEXLGWALWSG-SNVBAGLBSA-N 1 1 315.211 3.834 20 5 DHBDMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000567893182 1035065060 /nfs/dbraw/zinc/06/50/60/1035065060.db2.gz IVWVWAUAJFLOQB-VIFPVBQESA-N 1 1 313.195 3.588 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCCC[C@H](C2CCOCC2)C1 ZINC001175688272 1035084993 /nfs/dbraw/zinc/08/49/93/1035084993.db2.gz OJAFLUPMFKTPJQ-INIZCTEOSA-N 1 1 318.417 3.624 20 5 DHBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@@H]2CC(C)C)c1[N+](=O)[O-] ZINC001180091458 1035576438 /nfs/dbraw/zinc/57/64/38/1035576438.db2.gz BLWLTARTDVJSEJ-CQSZACIVSA-N 1 1 322.405 3.710 20 5 DHBDMO C[C@H]1CCCC[C@H]1OCC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001193743595 1035714563 /nfs/dbraw/zinc/71/45/63/1035714563.db2.gz QTJMDDUZPJXWLK-MAUKXSAKSA-N 1 1 320.433 3.664 20 5 DHBDMO Cc1cc(C)cc(C[N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])c1 ZINC001194093506 1035843588 /nfs/dbraw/zinc/84/35/88/1035843588.db2.gz UTDGQTREAZISEK-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO Cc1cc(C)cc(C[N@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])c1 ZINC001194093506 1035843604 /nfs/dbraw/zinc/84/36/04/1035843604.db2.gz UTDGQTREAZISEK-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO COc1cc(C[N@@H+]2CCc3sccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000485719359 1035900616 /nfs/dbraw/zinc/90/06/16/1035900616.db2.gz VQBRAKWIEFBHLB-LLVKDONJSA-N 1 1 318.398 3.784 20 5 DHBDMO COc1cc(C[N@H+]2CCc3sccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000485719359 1035900627 /nfs/dbraw/zinc/90/06/27/1035900627.db2.gz VQBRAKWIEFBHLB-LLVKDONJSA-N 1 1 318.398 3.784 20 5 DHBDMO C[N@H+](C/C=C\c1cccc(F)c1)CCc1ccccc1[N+](=O)[O-] ZINC001181697938 1035975198 /nfs/dbraw/zinc/97/51/98/1035975198.db2.gz PKUGHBKKISDCDV-ALCCZGGFSA-N 1 1 314.360 3.922 20 5 DHBDMO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC001195010977 1036106213 /nfs/dbraw/zinc/10/62/13/1036106213.db2.gz BJAAIMRSMWQSCU-LBPRGKRZSA-N 1 1 320.339 3.936 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C/C=C\c1ccncc1)C1CC1 ZINC000495066537 1036212071 /nfs/dbraw/zinc/21/20/71/1036212071.db2.gz LYPOCCPJGPEGEE-ARJAWSKDSA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C/C=C\c1ccncc1)C1CC1 ZINC000495066537 1036212094 /nfs/dbraw/zinc/21/20/94/1036212094.db2.gz LYPOCCPJGPEGEE-ARJAWSKDSA-N 1 1 309.369 3.668 20 5 DHBDMO CC(C)[N@@H+](C/C=C\c1ccncc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000495079483 1036229778 /nfs/dbraw/zinc/22/97/78/1036229778.db2.gz NWWDXXKYTQIOKP-ARJAWSKDSA-N 1 1 311.385 3.914 20 5 DHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@@H]1CC=CCC1 ZINC000541320534 1036293072 /nfs/dbraw/zinc/29/30/72/1036293072.db2.gz SXWMFZHHXAUCID-GFCCVEGCSA-N 1 1 301.346 3.524 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(C)s1 ZINC000076342748 1036479929 /nfs/dbraw/zinc/47/99/29/1036479929.db2.gz XVKZIVNTXYOVEP-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(C)s1 ZINC000076342748 1036479939 /nfs/dbraw/zinc/47/99/39/1036479939.db2.gz XVKZIVNTXYOVEP-UHFFFAOYSA-N 1 1 306.387 3.605 20 5 DHBDMO CC[C@H](C[N@@H+](CC)Cn1cc([N+](=O)[O-])c(C)n1)c1ccccc1 ZINC000774701470 1036714427 /nfs/dbraw/zinc/71/44/27/1036714427.db2.gz JDQRCXSVRABTNR-OAHLLOKOSA-N 1 1 316.405 3.573 20 5 DHBDMO CS[C@@H]1CCCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000492209498 1036785270 /nfs/dbraw/zinc/78/52/70/1036785270.db2.gz LOOSPPXOHLRIIE-LLVKDONJSA-N 1 1 314.838 3.966 20 5 DHBDMO CCOc1cc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)ccc1[N+](=O)[O-] ZINC000492372297 1036851113 /nfs/dbraw/zinc/85/11/13/1036851113.db2.gz BHAKTDWDCBXTHT-LBPRGKRZSA-N 1 1 304.390 3.756 20 5 DHBDMO Cc1cc(NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC001185159099 1037049321 /nfs/dbraw/zinc/04/93/21/1037049321.db2.gz SGUZSZFPDHDASF-GFCCVEGCSA-N 1 1 323.412 3.965 20 5 DHBDMO C[N@H+](CCc1cccs1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493000872 1037102630 /nfs/dbraw/zinc/10/26/30/1037102630.db2.gz AZNIUZIBZGGJMB-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO C[N@@H+](CCc1cccs1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493000872 1037102640 /nfs/dbraw/zinc/10/26/40/1037102640.db2.gz AZNIUZIBZGGJMB-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO CC[C@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774905227 1037195440 /nfs/dbraw/zinc/19/54/40/1037195440.db2.gz LPSJDPJUFFGTQN-ZDUSSCGKSA-N 1 1 307.350 3.658 20 5 DHBDMO Cc1ccccc1OCC[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000487675345 1037248211 /nfs/dbraw/zinc/24/82/11/1037248211.db2.gz QHESTRRTPACBPL-HNNXBMFYSA-N 1 1 314.385 3.975 20 5 DHBDMO COc1cc(C[N@@H+](C)C[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000489206264 1037313214 /nfs/dbraw/zinc/31/32/14/1037313214.db2.gz NZOVOZXHRMPTEW-CQSZACIVSA-N 1 1 314.385 3.839 20 5 DHBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNc1ccc([N+](=O)[O-])cc1Cl ZINC001186367490 1037373862 /nfs/dbraw/zinc/37/38/62/1037373862.db2.gz CLWYZVHKLCFVCP-AWEZNQCLSA-N 1 1 311.813 3.781 20 5 DHBDMO Cc1cc(NC[C@H]2[N@@H+](C)CCCC2(C)C)c(F)cc1[N+](=O)[O-] ZINC001186368116 1037375555 /nfs/dbraw/zinc/37/55/55/1037375555.db2.gz MOGTUWJHGGLFSB-OAHLLOKOSA-N 1 1 309.385 3.575 20 5 DHBDMO CCC(CC)[N@H+](CCOC)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493632307 1037498152 /nfs/dbraw/zinc/49/81/52/1037498152.db2.gz FETKDSSZGKKBAJ-UHFFFAOYSA-N 1 1 314.813 3.885 20 5 DHBDMO CCC(CC)[N@@H+](CCOC)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493632307 1037498161 /nfs/dbraw/zinc/49/81/61/1037498161.db2.gz FETKDSSZGKKBAJ-UHFFFAOYSA-N 1 1 314.813 3.885 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccc(F)cc1 ZINC000490354600 1037693411 /nfs/dbraw/zinc/69/34/11/1037693411.db2.gz RKDAGGFPRMBCQO-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c(F)c1 ZINC000490406351 1037711849 /nfs/dbraw/zinc/71/18/49/1037711849.db2.gz YTGBQXDDRJSTJA-HUUCEWRRSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c(F)c1 ZINC000490406351 1037711863 /nfs/dbraw/zinc/71/18/63/1037711863.db2.gz YTGBQXDDRJSTJA-HUUCEWRRSA-N 1 1 310.394 3.594 20 5 DHBDMO C[C@H]1CCC[N@@H+](CCNc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000589107415 1038431926 /nfs/dbraw/zinc/43/19/26/1038431926.db2.gz SNLZPLKPGZXLIU-NSHDSACASA-N 1 1 313.348 3.676 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CC(C4CC4)C3)cs2)c1 ZINC000589736799 1038538403 /nfs/dbraw/zinc/53/84/03/1038538403.db2.gz OUMXRUAMIDCIHX-UHFFFAOYSA-N 1 1 315.398 3.560 20 5 DHBDMO CCC1(CC)[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C[C@@H]1OC ZINC001191744084 1038541877 /nfs/dbraw/zinc/54/18/77/1038541877.db2.gz YJPCMWJIDNJDDP-CVEARBPZSA-N 1 1 306.406 3.620 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H]3CCC[C@H]32)c1 ZINC000590174244 1038605460 /nfs/dbraw/zinc/60/54/60/1038605460.db2.gz BGWUVTHLHUPCPN-QMTHXVAHSA-N 1 1 314.307 3.988 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H]3CCC[C@@H]32)c1 ZINC000590174242 1038606484 /nfs/dbraw/zinc/60/64/84/1038606484.db2.gz BGWUVTHLHUPCPN-HZMBPMFUSA-N 1 1 314.307 3.988 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000590601956 1038675404 /nfs/dbraw/zinc/67/54/04/1038675404.db2.gz UFHIDMTXLRNZMG-GDBMZVCRSA-N 1 1 311.385 3.930 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3ccc(O)cc3)C2)cc1 ZINC000590659576 1038687132 /nfs/dbraw/zinc/68/71/32/1038687132.db2.gz GBYANAXFHAQOIK-INIZCTEOSA-N 1 1 312.369 3.680 20 5 DHBDMO CC[C@H]([NH2+]Cc1c(C)nn(C)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC001192801295 1038700728 /nfs/dbraw/zinc/70/07/28/1038700728.db2.gz GMZRCYLLPHPAPI-AWEZNQCLSA-N 1 1 322.796 3.531 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC(CC(F)(F)F)C1 ZINC000590968721 1038733280 /nfs/dbraw/zinc/73/32/80/1038733280.db2.gz DRARCLCRNZXGDG-WZUFQYTHSA-N 1 1 314.307 3.882 20 5 DHBDMO CC(C)c1ccc(CNC[C@@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000598994378 1038986398 /nfs/dbraw/zinc/98/63/98/1038986398.db2.gz LPZPJJBUMBOWGB-INIZCTEOSA-N 1 1 319.449 3.540 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@H]2CC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599075007 1039028099 /nfs/dbraw/zinc/02/80/99/1039028099.db2.gz ZNASPFKFWVYSRR-RHSMWYFYSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([C@@H](C)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599075007 1039028119 /nfs/dbraw/zinc/02/81/19/1039028119.db2.gz ZNASPFKFWVYSRR-RHSMWYFYSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599073968 1039029619 /nfs/dbraw/zinc/02/96/19/1039029619.db2.gz OTGBNEZDUGHOPW-WMLDXEAASA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599073968 1039029645 /nfs/dbraw/zinc/02/96/45/1039029645.db2.gz OTGBNEZDUGHOPW-WMLDXEAASA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599073966 1039030851 /nfs/dbraw/zinc/03/08/51/1039030851.db2.gz OTGBNEZDUGHOPW-PBHICJAKSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599073966 1039030872 /nfs/dbraw/zinc/03/08/72/1039030872.db2.gz OTGBNEZDUGHOPW-PBHICJAKSA-N 1 1 317.433 3.571 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2cccs2)C2CC2)c1 ZINC000046054386 1039062100 /nfs/dbraw/zinc/06/21/00/1039062100.db2.gz VAQGINFWIVVONW-UHFFFAOYSA-N 1 1 318.398 3.700 20 5 DHBDMO C[C@H](CCO)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000593694247 1039081595 /nfs/dbraw/zinc/08/15/95/1039081595.db2.gz LHGZSEQDIMMEFE-GFCCVEGCSA-N 1 1 320.414 3.526 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593696016 1039085707 /nfs/dbraw/zinc/08/57/07/1039085707.db2.gz ATZGKNJDOWPEGX-BLMSOEDDSA-N 1 1 308.328 3.729 20 5 DHBDMO CCO[C@@H](C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C)C1CC1 ZINC000599270524 1039111355 /nfs/dbraw/zinc/11/13/55/1039111355.db2.gz NHMSZEMTGQVETN-KRWDZBQOSA-N 1 1 306.406 3.620 20 5 DHBDMO Cc1ccccc1C1([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000592139434 1039133435 /nfs/dbraw/zinc/13/34/35/1039133435.db2.gz GXMMKOZIOGGTRA-UHFFFAOYSA-N 1 1 300.333 3.821 20 5 DHBDMO COc1ccccc1C1([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000592373825 1039168611 /nfs/dbraw/zinc/16/86/11/1039168611.db2.gz CWLRAEFZEPAWLG-UHFFFAOYSA-N 1 1 312.369 3.691 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cc2n(n1)CCCC2 ZINC000592386862 1039184906 /nfs/dbraw/zinc/18/49/06/1039184906.db2.gz KXUAUQIEOHLSQT-QWHCGFSZSA-N 1 1 314.389 3.539 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000603850881 1039187025 /nfs/dbraw/zinc/18/70/25/1039187025.db2.gz HIYDPYGJKWRZIY-QGZVFWFLSA-N 1 1 314.360 3.941 20 5 DHBDMO CCOc1cc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000599628237 1039237139 /nfs/dbraw/zinc/23/71/39/1039237139.db2.gz QXYMHUWAANZAEN-NSHDSACASA-N 1 1 314.332 3.613 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC(F)(F)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000599628237 1039237147 /nfs/dbraw/zinc/23/71/47/1039237147.db2.gz QXYMHUWAANZAEN-NSHDSACASA-N 1 1 314.332 3.613 20 5 DHBDMO CC[C@@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1cc(C)ccc1C ZINC000599642949 1039246989 /nfs/dbraw/zinc/24/69/89/1039246989.db2.gz DKNHEWJCEUGNTL-CQSZACIVSA-N 1 1 303.362 3.749 20 5 DHBDMO COc1cc(C[N@@H+]2C[C@@H]3CCCC[C@@]32C)c([N+](=O)[O-])cc1F ZINC000599669794 1039252403 /nfs/dbraw/zinc/25/24/03/1039252403.db2.gz FLUNKGQLJVFEFN-LRDDRELGSA-N 1 1 308.353 3.507 20 5 DHBDMO COc1cc(C[N@H+]2C[C@@H]3CCCC[C@@]32C)c([N+](=O)[O-])cc1F ZINC000599669794 1039252410 /nfs/dbraw/zinc/25/24/10/1039252410.db2.gz FLUNKGQLJVFEFN-LRDDRELGSA-N 1 1 308.353 3.507 20 5 DHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cccc(F)c1 ZINC000058563864 1039277321 /nfs/dbraw/zinc/27/73/21/1039277321.db2.gz ROMYATGGJPSEJS-UHFFFAOYSA-N 1 1 318.348 3.635 20 5 DHBDMO C[C@@H]([NH2+][C@@H](CCO)c1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000592404263 1039449003 /nfs/dbraw/zinc/44/90/03/1039449003.db2.gz WMZXGFRHCKWQIB-PXAZEXFGSA-N 1 1 318.348 3.508 20 5 DHBDMO CCC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC(C)C ZINC000604492910 1039485528 /nfs/dbraw/zinc/48/55/28/1039485528.db2.gz UMYCPJKORYPSRQ-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CC(Cc2ccccc2)C1 ZINC000761061566 1039764658 /nfs/dbraw/zinc/76/46/58/1039764658.db2.gz UTQHQGGIUXRPQJ-UHFFFAOYSA-N 1 1 316.788 3.923 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594026482 1039953516 /nfs/dbraw/zinc/95/35/16/1039953516.db2.gz KJBNVDLABUWWLN-OAHLLOKOSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594026482 1039953530 /nfs/dbraw/zinc/95/35/30/1039953530.db2.gz KJBNVDLABUWWLN-OAHLLOKOSA-N 1 1 324.808 3.782 20 5 DHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000059371390 1039957242 /nfs/dbraw/zinc/95/72/42/1039957242.db2.gz WACIPWGESQXCRD-ZDUSSCGKSA-N 1 1 318.348 3.806 20 5 DHBDMO COc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000594998055 1040011342 /nfs/dbraw/zinc/01/13/42/1040011342.db2.gz FZEKGKUFMZGITO-UHFFFAOYSA-N 1 1 320.776 3.855 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(F)c(F)c1 ZINC000595007560 1040016300 /nfs/dbraw/zinc/01/63/00/1040016300.db2.gz MFBGKBFHHVGKMA-JTQLQIEISA-N 1 1 322.311 3.732 20 5 DHBDMO CC[C@H](N[C@H]1CC[N@@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056863 1040023070 /nfs/dbraw/zinc/02/30/70/1040023070.db2.gz RWNJGGCBOYGVDZ-HOCLYGCPSA-N 1 1 305.422 3.508 20 5 DHBDMO CC[C@H](N[C@H]1CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056863 1040023084 /nfs/dbraw/zinc/02/30/84/1040023084.db2.gz RWNJGGCBOYGVDZ-HOCLYGCPSA-N 1 1 305.422 3.508 20 5 DHBDMO CCC[C@H]([NH2+][C@H](C)c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000595109948 1040070486 /nfs/dbraw/zinc/07/04/86/1040070486.db2.gz XPFLCZSXVMPHTD-DOMZBBRYSA-N 1 1 302.378 3.520 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@H](c3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000595324886 1040108076 /nfs/dbraw/zinc/10/80/76/1040108076.db2.gz CRBJREOPFBZFGH-DOMZBBRYSA-N 1 1 315.373 3.517 20 5 DHBDMO Cc1noc(C[N@@H+](C)[C@@H](c2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000595316871 1040108508 /nfs/dbraw/zinc/10/85/08/1040108508.db2.gz AAHKKVPQMAXEIE-OAHLLOKOSA-N 1 1 303.362 3.720 20 5 DHBDMO Cc1noc(C[N@H+](C)[C@@H](c2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000595316871 1040108518 /nfs/dbraw/zinc/10/85/18/1040108518.db2.gz AAHKKVPQMAXEIE-OAHLLOKOSA-N 1 1 303.362 3.720 20 5 DHBDMO CC[N@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000491204521 1040118904 /nfs/dbraw/zinc/11/89/04/1040118904.db2.gz ADTBNZREEDXMIW-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000491204521 1040118906 /nfs/dbraw/zinc/11/89/06/1040118906.db2.gz ADTBNZREEDXMIW-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO COc1cccc(C2([NH2+]Cc3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC000595417179 1040133615 /nfs/dbraw/zinc/13/36/15/1040133615.db2.gz GGHNHBHMUKUFHE-UHFFFAOYSA-N 1 1 316.332 3.521 20 5 DHBDMO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595400780 1040138881 /nfs/dbraw/zinc/13/88/81/1040138881.db2.gz LMMCMDLITWTYBM-HNNXBMFYSA-N 1 1 303.337 3.712 20 5 DHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595400780 1040138883 /nfs/dbraw/zinc/13/88/83/1040138883.db2.gz LMMCMDLITWTYBM-HNNXBMFYSA-N 1 1 303.337 3.712 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC3CC2(c2ccccc2)C3)cs1 ZINC000595910212 1040274926 /nfs/dbraw/zinc/27/49/26/1040274926.db2.gz HWRUEIITGOBCQF-UHFFFAOYSA-N 1 1 300.383 3.777 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC3CC2(c2ccccc2)C3)cs1 ZINC000595910212 1040274938 /nfs/dbraw/zinc/27/49/38/1040274938.db2.gz HWRUEIITGOBCQF-UHFFFAOYSA-N 1 1 300.383 3.777 20 5 DHBDMO Cc1noc(COc2cc(C)[nH+]c3cc(C)ccc32)c1[N+](=O)[O-] ZINC000596274023 1040353583 /nfs/dbraw/zinc/35/35/83/1040353583.db2.gz NOECOLFAXCLWEJ-UHFFFAOYSA-N 1 1 313.313 3.635 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]Cc2cc(C(C)C)no2)cccc1[N+](=O)[O-] ZINC000169245918 1040371179 /nfs/dbraw/zinc/37/11/79/1040371179.db2.gz KWDLQWMQEIQDIN-GFCCVEGCSA-N 1 1 303.362 3.865 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCCSCC1 ZINC000602590875 1041106134 /nfs/dbraw/zinc/10/61/34/1041106134.db2.gz KAJMLVDAYMBFMI-UHFFFAOYSA-N 1 1 320.336 3.553 20 5 DHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@@H]1C1CC1 ZINC000602679827 1041162397 /nfs/dbraw/zinc/16/23/97/1041162397.db2.gz SEPDBQAASFRNRI-GFCCVEGCSA-N 1 1 300.280 3.598 20 5 DHBDMO Cc1ccccc1C1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000602698715 1041164426 /nfs/dbraw/zinc/16/44/26/1041164426.db2.gz FQKJZELQURHNLK-UHFFFAOYSA-N 1 1 323.352 3.823 20 5 DHBDMO CCCO[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000093316822 193230555 /nfs/dbraw/zinc/23/05/55/193230555.db2.gz VJOCPNJQWAXQGF-JZLODUJNSA-N 1 1 318.417 3.889 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](COc3ccccc3)C2)cs1 ZINC000272603364 130045152 /nfs/dbraw/zinc/04/51/52/130045152.db2.gz RECACQCGCVODCY-ZDUSSCGKSA-N 1 1 318.398 3.557 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](COc3ccccc3)C2)cs1 ZINC000272603364 130045155 /nfs/dbraw/zinc/04/51/55/130045155.db2.gz RECACQCGCVODCY-ZDUSSCGKSA-N 1 1 318.398 3.557 20 5 DHBDMO C[C@]12CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]1C2(Cl)Cl ZINC000284384399 131076442 /nfs/dbraw/zinc/07/64/42/131076442.db2.gz FQTJJHBGUROFQH-OLZOCXBDSA-N 1 1 315.200 3.611 20 5 DHBDMO C[C@]12CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]1C2(Cl)Cl ZINC000284384399 131076443 /nfs/dbraw/zinc/07/64/43/131076443.db2.gz FQTJJHBGUROFQH-OLZOCXBDSA-N 1 1 315.200 3.611 20 5 DHBDMO C[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284917774 131123060 /nfs/dbraw/zinc/12/30/60/131123060.db2.gz CYIAZMPZNVFQKT-LLVKDONJSA-N 1 1 315.348 3.656 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(C2CC2)n1 ZINC000285281685 131154786 /nfs/dbraw/zinc/15/47/86/131154786.db2.gz JMJBDZQDUUKALV-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(C2CC2)n1 ZINC000285281685 131154787 /nfs/dbraw/zinc/15/47/87/131154787.db2.gz JMJBDZQDUUKALV-UHFFFAOYSA-N 1 1 317.414 3.603 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(C(C)(C)C)on1 ZINC000289358994 131377881 /nfs/dbraw/zinc/37/78/81/131377881.db2.gz INHCSPGVKVPQQZ-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(C(C)(C)C)on1 ZINC000289358994 131377883 /nfs/dbraw/zinc/37/78/83/131377883.db2.gz INHCSPGVKVPQQZ-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO COc1ccc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)cc1[N+](=O)[O-] ZINC000299342613 132099487 /nfs/dbraw/zinc/09/94/87/132099487.db2.gz OVQGVJNCYYHQKU-RISCZKNCSA-N 1 1 316.357 3.610 20 5 DHBDMO COc1ccc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)cc1[N+](=O)[O-] ZINC000299342609 132099543 /nfs/dbraw/zinc/09/95/43/132099543.db2.gz OVQGVJNCYYHQKU-FZMZJTMJSA-N 1 1 316.357 3.610 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1c2ccc(F)cc2O[C@@H]1C ZINC000569405707 332076923 /nfs/dbraw/zinc/07/69/23/332076923.db2.gz QJDCNIRZTJTEHB-DIFFPNOSSA-N 1 1 316.332 3.654 20 5 DHBDMO Cn1cc(Cl)cc1C[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000091930624 332115129 /nfs/dbraw/zinc/11/51/29/332115129.db2.gz XYGHCHQWPPLTJU-FNORWQNLSA-N 1 1 319.792 3.732 20 5 DHBDMO Cn1cc(Cl)cc1C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000091930624 332115130 /nfs/dbraw/zinc/11/51/30/332115130.db2.gz XYGHCHQWPPLTJU-FNORWQNLSA-N 1 1 319.792 3.732 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@H]3CCC[C@H]3F)cs2)c1 ZINC000559358821 332128253 /nfs/dbraw/zinc/12/82/53/332128253.db2.gz LEDLUYHHASTHLO-KGLIPLIRSA-N 1 1 321.377 3.699 20 5 DHBDMO CCOC[C@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000093839069 332142976 /nfs/dbraw/zinc/14/29/76/332142976.db2.gz XGDSGKWSIIHFHC-HNNXBMFYSA-N 1 1 306.406 3.577 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000584292313 332220769 /nfs/dbraw/zinc/22/07/69/332220769.db2.gz GFXYTLHLCIRJOF-KQGZCTBQSA-N 1 1 316.401 3.642 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000195347870 335111050 /nfs/dbraw/zinc/11/10/50/335111050.db2.gz PVDFUCDBRLPHHT-JSGCOSHPSA-N 1 1 317.414 3.992 20 5 DHBDMO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(O)c1 ZINC000181517814 333030598 /nfs/dbraw/zinc/03/05/98/333030598.db2.gz AVYVJLBNWTXUFS-JTQLQIEISA-N 1 1 306.749 3.805 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000178511085 333140094 /nfs/dbraw/zinc/14/00/94/333140094.db2.gz OWNMIFPFVKSSNI-INIZCTEOSA-N 1 1 302.378 3.613 20 5 DHBDMO CCC[C@H](NCC[N@@H+](C)[C@@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000318973224 333236085 /nfs/dbraw/zinc/23/60/85/333236085.db2.gz HPVAHOMGTDKASN-YOEHRIQHSA-N 1 1 307.438 3.756 20 5 DHBDMO CCC[C@H]([NH2+]CCN(C)[C@@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000318973224 333236086 /nfs/dbraw/zinc/23/60/86/333236086.db2.gz HPVAHOMGTDKASN-YOEHRIQHSA-N 1 1 307.438 3.756 20 5 DHBDMO CCC[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000414168288 333916808 /nfs/dbraw/zinc/91/68/08/333916808.db2.gz ABDBTURCCCRODU-BLLLJJGKSA-N 1 1 302.378 3.520 20 5 DHBDMO CC(C)c1ccc([C@H](N)C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000414853831 334127649 /nfs/dbraw/zinc/12/76/49/334127649.db2.gz YGLFYXLNCNMQIU-QGZVFWFLSA-N 1 1 313.401 3.508 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2[nH]cnc2c1 ZINC000535078668 334364447 /nfs/dbraw/zinc/36/44/47/334364447.db2.gz BILIUGNCQPEGQO-UHFFFAOYSA-N 1 1 324.384 3.882 20 5 DHBDMO CC[C@@H](NC1CC(C)(C)[NH2+]C(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000193024343 336287206 /nfs/dbraw/zinc/28/72/06/336287206.db2.gz IJVCUMLBGMCEFJ-MRXNPFEDSA-N 1 1 319.449 3.945 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])cc1F ZINC000301104095 336290221 /nfs/dbraw/zinc/29/02/21/336290221.db2.gz PFQQCCULEWGDFN-CYBMUJFWSA-N 1 1 309.385 3.800 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2c(C)cccc2[N+](=O)[O-])c1 ZINC000301226604 336295748 /nfs/dbraw/zinc/29/57/48/336295748.db2.gz GQMYOSPTQZYODY-UHFFFAOYSA-N 1 1 313.401 3.967 20 5 DHBDMO O=[N+]([O-])c1ccsc1N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000302009938 336342928 /nfs/dbraw/zinc/34/29/28/336342928.db2.gz YDOIBEDUWMUJIV-UHFFFAOYSA-N 1 1 323.462 3.749 20 5 DHBDMO Cc1cc(N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000302057970 336346033 /nfs/dbraw/zinc/34/60/33/336346033.db2.gz RMHVQGVPKOCZMR-CABCVRRESA-N 1 1 317.433 3.968 20 5 DHBDMO CC[C@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000353883862 336445841 /nfs/dbraw/zinc/44/58/41/336445841.db2.gz VPAQOAGCHRWHTQ-JKSUJKDBSA-N 1 1 314.389 3.520 20 5 DHBDMO CCc1cnccc1[C@H](C)[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000361121008 336739582 /nfs/dbraw/zinc/73/95/82/336739582.db2.gz TTWAALWZAQHNLG-NSHDSACASA-N 1 1 303.337 3.542 20 5 DHBDMO CC(C)c1[nH+]ccn1[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 ZINC000373086893 336948134 /nfs/dbraw/zinc/94/81/34/336948134.db2.gz GWXLKYAHMLIWKP-INIZCTEOSA-N 1 1 314.389 3.756 20 5 DHBDMO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000376558923 337036659 /nfs/dbraw/zinc/03/66/59/337036659.db2.gz RDGBGHDTSGKXCR-YVEFUNNKSA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000376558923 337036660 /nfs/dbraw/zinc/03/66/60/337036660.db2.gz RDGBGHDTSGKXCR-YVEFUNNKSA-N 1 1 315.348 3.712 20 5 DHBDMO CO[C@H]1CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000378630664 337077015 /nfs/dbraw/zinc/07/70/15/337077015.db2.gz GJHYTOFVJOOWIC-HNNXBMFYSA-N 1 1 306.406 3.719 20 5 DHBDMO CO[C@@H](C)C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000582573954 337107579 /nfs/dbraw/zinc/10/75/79/337107579.db2.gz XDTZATUMWBOXNZ-LBPRGKRZSA-N 1 1 320.414 3.790 20 5 DHBDMO CCC[N@@H+](CC)C[C@H](C)NC/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000582634972 337116547 /nfs/dbraw/zinc/11/65/47/337116547.db2.gz NSCWIVYEDKMSFP-SFKKXYGYSA-N 1 1 319.449 3.708 20 5 DHBDMO CCCN(CC)C[C@H](C)[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000582634972 337116548 /nfs/dbraw/zinc/11/65/48/337116548.db2.gz NSCWIVYEDKMSFP-SFKKXYGYSA-N 1 1 319.449 3.708 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCCOc2cc(F)ccc21 ZINC000182127877 337186731 /nfs/dbraw/zinc/18/67/31/337186731.db2.gz VBVQJUHOOVVVQT-HNNXBMFYSA-N 1 1 316.332 3.737 20 5 DHBDMO COc1cc(C[NH2+][C@H](C)c2cc(C)oc2C)c([N+](=O)[O-])cc1F ZINC000184407183 337197029 /nfs/dbraw/zinc/19/70/29/337197029.db2.gz GQLQDWSKNZJOFM-SNVBAGLBSA-N 1 1 322.336 3.803 20 5 DHBDMO COc1cc(C[N@@H+]([C@H](C)C2CC2)C2CC2)c([N+](=O)[O-])cc1F ZINC000184245602 337197599 /nfs/dbraw/zinc/19/75/99/337197599.db2.gz VWGWTGLRDYINOI-SNVBAGLBSA-N 1 1 308.353 3.505 20 5 DHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000185489328 337205737 /nfs/dbraw/zinc/20/57/37/337205737.db2.gz ZJSLOTYTFGBWER-ZDUSSCGKSA-N 1 1 317.414 3.540 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186705787 337258876 /nfs/dbraw/zinc/25/88/76/337258876.db2.gz JOUOSQBQAJLPGC-IFXJQAMLSA-N 1 1 324.380 3.787 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCc3c(O)cccc32)cs1 ZINC000191654841 337298365 /nfs/dbraw/zinc/29/83/65/337298365.db2.gz CQPXFQDGKAEXHZ-CYBMUJFWSA-N 1 1 304.371 3.529 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCS[C@H](C)CC1 ZINC000426389397 338030075 /nfs/dbraw/zinc/03/00/75/338030075.db2.gz FDFXPWIBAVPHFZ-JWAFFJSPSA-N 1 1 306.431 3.826 20 5 DHBDMO Cc1nc(C(C)C)oc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000428313471 338046855 /nfs/dbraw/zinc/04/68/55/338046855.db2.gz QQLJQQZUKPSOJE-LLVKDONJSA-N 1 1 303.362 3.865 20 5 DHBDMO Cc1c(C[N@@H+]2Cc3ccccc3O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000429194523 338072887 /nfs/dbraw/zinc/07/28/87/338072887.db2.gz ZRVGIPBRMPYILP-ZDUSSCGKSA-N 1 1 312.369 3.686 20 5 DHBDMO Cc1c(C[N@H+]2Cc3ccccc3O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000429194523 338072888 /nfs/dbraw/zinc/07/28/88/338072888.db2.gz ZRVGIPBRMPYILP-ZDUSSCGKSA-N 1 1 312.369 3.686 20 5 DHBDMO COCC(C)(C)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000430144092 338098883 /nfs/dbraw/zinc/09/88/83/338098883.db2.gz YSUUZOWKIXFLET-UHFFFAOYSA-N 1 1 318.373 3.712 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000430208229 338101536 /nfs/dbraw/zinc/10/15/36/338101536.db2.gz AVRMUXDVXGMILJ-CQSZACIVSA-N 1 1 314.385 3.839 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430232222 338102325 /nfs/dbraw/zinc/10/23/25/338102325.db2.gz FWGQEWVMCGWENA-ZFWWWQNUSA-N 1 1 324.446 3.709 20 5 DHBDMO CCN(CC)C[C@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433163671 338183456 /nfs/dbraw/zinc/18/34/56/338183456.db2.gz CBTQTUBXLNLGCO-SUMWQHHRSA-N 1 1 319.449 3.637 20 5 DHBDMO CCN(CC)C[C@@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433163668 338183544 /nfs/dbraw/zinc/18/35/44/338183544.db2.gz CBTQTUBXLNLGCO-CXAGYDPISA-N 1 1 319.449 3.637 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+]2C2CCCCC2)n1 ZINC000435583691 338242864 /nfs/dbraw/zinc/24/28/64/338242864.db2.gz HRGKAHGPFIVCAO-HNNXBMFYSA-N 1 1 318.421 3.507 20 5 DHBDMO C[C@H](c1ccco1)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000440899743 338399584 /nfs/dbraw/zinc/39/95/84/338399584.db2.gz UMLUTYAQSUTYFA-CYBMUJFWSA-N 1 1 316.357 3.792 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000449349599 338616256 /nfs/dbraw/zinc/61/62/56/338616256.db2.gz ROSSOWRVMYMMTK-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO CC[N@H+](Cc1ccccc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000463476897 339119176 /nfs/dbraw/zinc/11/91/76/339119176.db2.gz TUOZFQKOPBLYBK-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CC[N@@H+](Cc1ccccc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000463476897 339119177 /nfs/dbraw/zinc/11/91/77/339119177.db2.gz TUOZFQKOPBLYBK-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO COc1cc(C[N@@H+](CCC(C)C)C2CC2)c([N+](=O)[O-])cc1F ZINC000463479981 339119246 /nfs/dbraw/zinc/11/92/46/339119246.db2.gz DQRYJTMXWOCJAY-UHFFFAOYSA-N 1 1 310.369 3.753 20 5 DHBDMO CCC1(CC)C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)CCS1 ZINC000464584814 339146208 /nfs/dbraw/zinc/14/62/08/339146208.db2.gz AJAYDJWNVFCHFT-UHFFFAOYSA-N 1 1 324.446 3.711 20 5 DHBDMO C[C@H]([NH2+][C@H]1COc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000466995860 339223943 /nfs/dbraw/zinc/22/39/43/339223943.db2.gz GAGOIJXTOGDLQH-BONVTDFDSA-N 1 1 302.305 3.518 20 5 DHBDMO C[C@@H]([NH2+][C@H]1COc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000466995859 339223983 /nfs/dbraw/zinc/22/39/83/339223983.db2.gz GAGOIJXTOGDLQH-BMIGLBTASA-N 1 1 302.305 3.518 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC2(C1)CCOCC2 ZINC000470175279 339312856 /nfs/dbraw/zinc/31/28/56/339312856.db2.gz BSHZQMVYFTVPCJ-PTNGSMBKSA-N 1 1 316.401 3.501 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000473162742 339383433 /nfs/dbraw/zinc/38/34/33/339383433.db2.gz QAALWRSBNJFNHL-KUHUBIRLSA-N 1 1 324.380 3.787 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C1(C(F)F)CC1 ZINC000503928879 340137285 /nfs/dbraw/zinc/13/72/85/340137285.db2.gz UQMYDVBBJQZFOH-AAEUAGOBSA-N 1 1 310.344 3.693 20 5 DHBDMO CCC(CC)[N@H+](CCOC)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509645525 340275442 /nfs/dbraw/zinc/27/54/42/340275442.db2.gz ZAGHXQNABDINLY-UHFFFAOYSA-N 1 1 316.348 3.510 20 5 DHBDMO CCC(CC)[N@@H+](CCOC)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509645525 340275443 /nfs/dbraw/zinc/27/54/43/340275443.db2.gz ZAGHXQNABDINLY-UHFFFAOYSA-N 1 1 316.348 3.510 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccccc1Cl ZINC000511073407 340320160 /nfs/dbraw/zinc/32/01/60/340320160.db2.gz PHGDIEZXPUHTAQ-UHFFFAOYSA-N 1 1 304.777 3.923 20 5 DHBDMO COc1ccc2c(c1)C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000512068221 340347498 /nfs/dbraw/zinc/34/74/98/340347498.db2.gz QBLGWXSJPDYHEW-XQRVVYSFSA-N 1 1 324.380 3.675 20 5 DHBDMO COc1ccc2c(c1)C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000512068221 340347499 /nfs/dbraw/zinc/34/74/99/340347499.db2.gz QBLGWXSJPDYHEW-XQRVVYSFSA-N 1 1 324.380 3.675 20 5 DHBDMO COc1ccc2c(c1)C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000512068218 340347581 /nfs/dbraw/zinc/34/75/81/340347581.db2.gz QBLGWXSJPDYHEW-GQCTYLIASA-N 1 1 324.380 3.675 20 5 DHBDMO COc1ccc2c(c1)C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000512068218 340347582 /nfs/dbraw/zinc/34/75/82/340347582.db2.gz QBLGWXSJPDYHEW-GQCTYLIASA-N 1 1 324.380 3.675 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000544608467 341088614 /nfs/dbraw/zinc/08/86/14/341088614.db2.gz SALIRKFIFQPKSK-UHFFFAOYSA-N 1 1 300.280 3.598 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000544608467 341088615 /nfs/dbraw/zinc/08/86/15/341088615.db2.gz SALIRKFIFQPKSK-UHFFFAOYSA-N 1 1 300.280 3.598 20 5 DHBDMO Cc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000548935863 341281700 /nfs/dbraw/zinc/28/17/00/341281700.db2.gz AEDALWBYKVCJSG-UHFFFAOYSA-N 1 1 304.415 3.948 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549172755 341287965 /nfs/dbraw/zinc/28/79/65/341287965.db2.gz ODQMMTGPWQTGEB-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](CCOC1CCCCCC1)C2 ZINC000550197062 341312259 /nfs/dbraw/zinc/31/22/59/341312259.db2.gz GFGZYAIWZOOGAZ-UHFFFAOYSA-N 1 1 318.417 3.692 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCOC1CCCCCC1)C2 ZINC000550197062 341312260 /nfs/dbraw/zinc/31/22/60/341312260.db2.gz GFGZYAIWZOOGAZ-UHFFFAOYSA-N 1 1 318.417 3.692 20 5 DHBDMO Cc1ccc2nc(C[NH2+]C(C)(C)c3ccc([N+](=O)[O-])cc3)cn2c1 ZINC000551592883 341346873 /nfs/dbraw/zinc/34/68/73/341346873.db2.gz GNYHBWFYDIKFFD-UHFFFAOYSA-N 1 1 324.384 3.576 20 5 DHBDMO C[C@H](O)[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000567358545 341598449 /nfs/dbraw/zinc/59/84/49/341598449.db2.gz VQXBNQYIIHZNEL-PRXAMGSTSA-N 1 1 318.348 3.507 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000246463379 524517644 /nfs/dbraw/zinc/51/76/44/524517644.db2.gz OEWGCUUQDKKFJH-NEPJUHHUSA-N 1 1 317.414 3.949 20 5 DHBDMO Cc1c([C@H](C)[NH2+][C@H](C)c2ccncc2F)cccc1[N+](=O)[O-] ZINC000338006521 525924753 /nfs/dbraw/zinc/92/47/53/525924753.db2.gz DIGQHMDOZLPGCH-NWDGAFQWSA-N 1 1 303.337 3.849 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC([C@H]3CCCO3)CC2)ccc1Cl ZINC000189162534 527328852 /nfs/dbraw/zinc/32/88/52/527328852.db2.gz BPOQGTKSOCSACW-MRXNPFEDSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OC3CCCC3)CC2)c(F)c1 ZINC000267001190 527348359 /nfs/dbraw/zinc/34/83/59/527348359.db2.gz CYENFASOLGHJCA-UHFFFAOYSA-N 1 1 322.380 3.658 20 5 DHBDMO CCOc1ncccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000151196244 1013069058 /nfs/dbraw/zinc/06/90/58/1013069058.db2.gz DMLQAUKCSOLASA-ZDUSSCGKSA-N 1 1 315.373 3.548 20 5 DHBDMO Cc1ccc([C@H](C)[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000059038172 1013484792 /nfs/dbraw/zinc/48/47/92/1013484792.db2.gz DITRWTGUEXLVSX-HNNXBMFYSA-N 1 1 314.385 3.975 20 5 DHBDMO Cc1ccc2c(c1)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)CCO2 ZINC000519674223 1013586866 /nfs/dbraw/zinc/58/68/66/1013586866.db2.gz VBMBKWYFSCFEDZ-UHFFFAOYSA-N 1 1 312.369 3.606 20 5 DHBDMO Cc1ccc2c(c1)C[N@H+](Cc1ccc([N+](=O)[O-])cc1C)CCO2 ZINC000519674223 1013586873 /nfs/dbraw/zinc/58/68/73/1013586873.db2.gz VBMBKWYFSCFEDZ-UHFFFAOYSA-N 1 1 312.369 3.606 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000177199424 1013709914 /nfs/dbraw/zinc/70/99/14/1013709914.db2.gz DKXNPEXPBXIETC-GJZGRUSLSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000177199424 1013709924 /nfs/dbraw/zinc/70/99/24/1013709924.db2.gz DKXNPEXPBXIETC-GJZGRUSLSA-N 1 1 310.394 3.594 20 5 DHBDMO O=[N+]([O-])CC[N@@H+](Cc1ccccc1C(F)(F)F)C1CCCC1 ZINC001307463196 1013882519 /nfs/dbraw/zinc/88/25/19/1013882519.db2.gz KMFQJLBXGYEIBV-UHFFFAOYSA-N 1 1 316.323 3.727 20 5 DHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]3CCC[C@H]32)cc1 ZINC000441444730 1013882639 /nfs/dbraw/zinc/88/26/39/1013882639.db2.gz HLBKOJPJUIIWPR-RHSMWYFYSA-N 1 1 304.390 3.628 20 5 DHBDMO Cc1c(C[NH2+]Cc2cccc(O)c2Cl)cccc1[N+](=O)[O-] ZINC000328462962 1014107912 /nfs/dbraw/zinc/10/79/12/1014107912.db2.gz KMWICFIGVVWIDR-UHFFFAOYSA-N 1 1 306.749 3.552 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cc1 ZINC000441490069 1014259082 /nfs/dbraw/zinc/25/90/82/1014259082.db2.gz VOVNKAVASXRXKV-SFHVURJKSA-N 1 1 318.417 3.561 20 5 DHBDMO CC[C@@H](NCCC[N@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000319889055 1014269975 /nfs/dbraw/zinc/26/99/75/1014269975.db2.gz WUVHQPHXNKJXDT-MAUKXSAKSA-N 1 1 319.449 3.900 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000933077959 1014529495 /nfs/dbraw/zinc/52/94/95/1014529495.db2.gz HAMFMOBUBHTHSZ-QGZVFWFLSA-N 1 1 318.417 3.542 20 5 DHBDMO CCC[N@@H+](CCc1ccccn1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000520892688 1014610063 /nfs/dbraw/zinc/61/00/63/1014610063.db2.gz HPINNDASHMPTMN-UHFFFAOYSA-N 1 1 313.401 3.753 20 5 DHBDMO C[C@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000192181594 1014707050 /nfs/dbraw/zinc/70/70/50/1014707050.db2.gz RQFJRJHHOPQMJZ-JTQLQIEISA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000192181594 1014707059 /nfs/dbraw/zinc/70/70/59/1014707059.db2.gz RQFJRJHHOPQMJZ-JTQLQIEISA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@H](c1nc(-c2ccc([N+](=O)[O-])cc2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276240124 1014893227 /nfs/dbraw/zinc/89/32/27/1014893227.db2.gz UMPTYEFOZJGVDI-GRYCIOLGSA-N 1 1 316.361 3.579 20 5 DHBDMO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000093633028 1015177068 /nfs/dbraw/zinc/17/70/68/1015177068.db2.gz ZKYHYKAAOVTVKG-MRVPVSSYSA-N 1 1 309.753 3.704 20 5 DHBDMO C[NH+](C)[C@H](CNc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000025346713 1015226012 /nfs/dbraw/zinc/22/60/12/1015226012.db2.gz ZNKVHQQIHBXWCR-MRXNPFEDSA-N 1 1 319.792 3.963 20 5 DHBDMO C[C@@H](CNc1ccccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000025500376 1015442818 /nfs/dbraw/zinc/44/28/18/1015442818.db2.gz QNTYWUVCLVSLDW-LBPRGKRZSA-N 1 1 317.414 3.515 20 5 DHBDMO C[C@@H]1c2ccccc2CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582104 1015632929 /nfs/dbraw/zinc/63/29/29/1015632929.db2.gz SXWBCJWHKNSTST-GFCCVEGCSA-N 1 1 323.352 3.855 20 5 DHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582104 1015632933 /nfs/dbraw/zinc/63/29/33/1015632933.db2.gz SXWBCJWHKNSTST-GFCCVEGCSA-N 1 1 323.352 3.855 20 5 DHBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582552 1015631692 /nfs/dbraw/zinc/63/16/92/1015631692.db2.gz XCYOPCOEMJNQPM-LBPRGKRZSA-N 1 1 303.362 3.604 20 5 DHBDMO Cc1ccc(C[NH2+][C@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000610707565 1015727169 /nfs/dbraw/zinc/72/71/69/1015727169.db2.gz BPIUBIORXAXHAG-AWEZNQCLSA-N 1 1 318.760 3.780 20 5 DHBDMO CCO[C@H]1CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000610930437 1015946005 /nfs/dbraw/zinc/94/60/05/1015946005.db2.gz CHCOCWDBVVIWGB-HNNXBMFYSA-N 1 1 306.406 3.719 20 5 DHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000065209173 1015970674 /nfs/dbraw/zinc/97/06/74/1015970674.db2.gz SETIMDAUDJNXSZ-ZDUSSCGKSA-N 1 1 318.348 3.806 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2c2cccs2)cc1 ZINC000065208823 1015971571 /nfs/dbraw/zinc/97/15/71/1015971571.db2.gz RERKTOXRAVOAET-OAHLLOKOSA-N 1 1 318.398 3.872 20 5 DHBDMO CCC[C@H](N[C@@H](C)C[N@@H+](C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000320343936 1016104497 /nfs/dbraw/zinc/10/44/97/1016104497.db2.gz JSNSAPAWDDDAPL-YOEHRIQHSA-N 1 1 307.438 3.754 20 5 DHBDMO CCC[C@H]([NH2+][C@@H](C)CN(C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000320343936 1016104502 /nfs/dbraw/zinc/10/45/02/1016104502.db2.gz JSNSAPAWDDDAPL-YOEHRIQHSA-N 1 1 307.438 3.754 20 5 DHBDMO CSC[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000135476492 1016236634 /nfs/dbraw/zinc/23/66/34/1016236634.db2.gz QXUCJECJGQITSH-LBPRGKRZSA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2ccccc2n1 ZINC000089512115 1032144979 /nfs/dbraw/zinc/14/49/79/1032144979.db2.gz WUBWJNIGDHVGRB-CYBMUJFWSA-N 1 1 307.353 3.994 20 5 DHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000089512542 1032147906 /nfs/dbraw/zinc/14/79/06/1032147906.db2.gz ZHQUZFAWRWCGJM-VIFPVBQESA-N 1 1 310.275 3.863 20 5 DHBDMO C[C@H](c1cccs1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000051502047 1016484608 /nfs/dbraw/zinc/48/46/08/1016484608.db2.gz WGYAKAIIZSPTNT-GFCCVEGCSA-N 1 1 306.387 3.728 20 5 DHBDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000349707078 1016583303 /nfs/dbraw/zinc/58/33/03/1016583303.db2.gz MZEVJNLNXCGNIX-OCCSQVGLSA-N 1 1 322.405 3.623 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cncc(F)c1 ZINC000346837355 1016597393 /nfs/dbraw/zinc/59/73/93/1016597393.db2.gz OHQQFILLUWITST-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cncc(F)c1 ZINC000346837355 1016597405 /nfs/dbraw/zinc/59/74/05/1016597405.db2.gz OHQQFILLUWITST-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cnn(CC2CCC2)c1 ZINC000934554211 1017041200 /nfs/dbraw/zinc/04/12/00/1017041200.db2.gz BNMVGTUQDOVFGQ-NSHDSACASA-N 1 1 320.418 3.504 20 5 DHBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC001171297976 1032283602 /nfs/dbraw/zinc/28/36/02/1032283602.db2.gz QXCNDVIQCLANJW-BBWFWOEESA-N 1 1 320.433 3.775 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Cl)o2)cc1Cl ZINC000783585667 1017290415 /nfs/dbraw/zinc/29/04/15/1017290415.db2.gz VMBBGQSSBDFEDA-UHFFFAOYSA-N 1 1 301.129 3.784 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@]1(C)CCCO ZINC000579764988 1012051777 /nfs/dbraw/zinc/05/17/77/1012051777.db2.gz QWXJGHAWAIUZNI-NKAIQICCSA-N 1 1 318.417 3.625 20 5 DHBDMO C[N@@H+](CCC1CC1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000559142995 1012514532 /nfs/dbraw/zinc/51/45/32/1012514532.db2.gz QQLCISNWWIEWCR-UHFFFAOYSA-N 1 1 302.296 3.846 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)c1 ZINC000515744492 1012709287 /nfs/dbraw/zinc/70/92/87/1012709287.db2.gz LGROBRUHGODFMW-QGZVFWFLSA-N 1 1 314.360 3.941 20 5 DHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]2c2ccc[nH]2)cc1 ZINC000079198983 1017165906 /nfs/dbraw/zinc/16/59/06/1017165906.db2.gz DXKPDORYXNNOMX-KRWDZBQOSA-N 1 1 315.373 3.529 20 5 DHBDMO CC(C)[C@H](C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000083168509 1017602090 /nfs/dbraw/zinc/60/20/90/1017602090.db2.gz NWSFLVRAWPZMOD-NSHDSACASA-N 1 1 303.362 3.745 20 5 DHBDMO CC[C@H]1CCCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444649905 1017603599 /nfs/dbraw/zinc/60/35/99/1017603599.db2.gz LMPXBTZXZCTSLW-LBPRGKRZSA-N 1 1 302.378 3.626 20 5 DHBDMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444686847 1017614372 /nfs/dbraw/zinc/61/43/72/1017614372.db2.gz UHSZBRBWSILBPI-BLLLJJGKSA-N 1 1 316.405 3.872 20 5 DHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083198553 1017629888 /nfs/dbraw/zinc/62/98/88/1017629888.db2.gz MQKXUQVBSHCUPK-CQSZACIVSA-N 1 1 303.362 3.747 20 5 DHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCCCC1 ZINC000039536712 1018060088 /nfs/dbraw/zinc/06/00/88/1018060088.db2.gz RZLRVELASAAISV-UHFFFAOYSA-N 1 1 320.389 3.616 20 5 DHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000524895233 1018119835 /nfs/dbraw/zinc/11/98/35/1018119835.db2.gz PSVFTJUBXZOVNL-HOTGVXAUSA-N 1 1 306.406 3.539 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCC(F)(F)CC2)c1 ZINC000702828579 1018241603 /nfs/dbraw/zinc/24/16/03/1018241603.db2.gz WJKFRTFUCNXDRK-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCC(F)(F)CC2)c1 ZINC000702828579 1018241616 /nfs/dbraw/zinc/24/16/16/1018241616.db2.gz WJKFRTFUCNXDRK-UHFFFAOYSA-N 1 1 304.724 3.869 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC000525636757 1018343143 /nfs/dbraw/zinc/34/31/43/1018343143.db2.gz KOFLTBJKNKTZKS-SFHVURJKSA-N 1 1 310.397 3.702 20 5 DHBDMO CC(C)C[C@H](CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[NH+](C)C ZINC000447542956 1018414114 /nfs/dbraw/zinc/41/41/14/1018414114.db2.gz QDDWSJNYCGZHPY-SJLPKXTDSA-N 1 1 319.449 3.538 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccco3)C2)c(Cl)c1 ZINC000611784999 1018659014 /nfs/dbraw/zinc/65/90/14/1018659014.db2.gz SJPJXLFWOFNCCJ-GFCCVEGCSA-N 1 1 306.749 3.831 20 5 DHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CC(C)(C)C ZINC000263818658 1032788671 /nfs/dbraw/zinc/78/86/71/1032788671.db2.gz WUZDPILOXLKGRQ-NSHDSACASA-N 1 1 318.377 3.684 20 5 DHBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000584026538 1018873115 /nfs/dbraw/zinc/87/31/15/1018873115.db2.gz QOZPRQUWGNDIOV-CYBMUJFWSA-N 1 1 316.405 3.675 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1cnc(C)s1 ZINC000601299938 1019199313 /nfs/dbraw/zinc/19/93/13/1019199313.db2.gz RLVRTFBIZYUKDQ-UWVGGRQHSA-N 1 1 321.402 3.780 20 5 DHBDMO C=Cc1ccc(CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)cc1 ZINC001168574485 1019310769 /nfs/dbraw/zinc/31/07/69/1019310769.db2.gz ARNXUEBXXGRPRA-UHFFFAOYSA-N 1 1 323.396 3.838 20 5 DHBDMO C=Cc1ccc(CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)cc1 ZINC001168574485 1019310781 /nfs/dbraw/zinc/31/07/81/1019310781.db2.gz ARNXUEBXXGRPRA-UHFFFAOYSA-N 1 1 323.396 3.838 20 5 DHBDMO C[C@@H]1C[C@H](Nc2sccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000611413471 1019476523 /nfs/dbraw/zinc/47/65/23/1019476523.db2.gz WHVYFBGQGJMMNY-OCCSQVGLSA-N 1 1 317.414 3.731 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000316898511 1019945139 /nfs/dbraw/zinc/94/51/39/1019945139.db2.gz ZBNBRYCPECSUDZ-UNEWFSDZSA-N 1 1 305.422 3.508 20 5 DHBDMO CCC[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000316898511 1019945146 /nfs/dbraw/zinc/94/51/46/1019945146.db2.gz ZBNBRYCPECSUDZ-UNEWFSDZSA-N 1 1 305.422 3.508 20 5 DHBDMO CC(C)[C@@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000264185210 1032869926 /nfs/dbraw/zinc/86/99/26/1032869926.db2.gz LAKAAVYXIVIEPF-CYBMUJFWSA-N 1 1 317.389 3.769 20 5 DHBDMO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000092332257 1020083138 /nfs/dbraw/zinc/08/31/38/1020083138.db2.gz LIAYWHGGBFXGIX-MRVPVSSYSA-N 1 1 309.753 3.704 20 5 DHBDMO CCC[N@@H+](CC)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000264226456 1032877411 /nfs/dbraw/zinc/87/74/11/1032877411.db2.gz XAZAIMKWWORCHJ-UHFFFAOYSA-N 1 1 303.362 3.524 20 5 DHBDMO C[C@H](C1CC1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555299249 1020196746 /nfs/dbraw/zinc/19/67/46/1020196746.db2.gz AVUNHVJJLZXKQQ-SECBINFHSA-N 1 1 302.296 3.844 20 5 DHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000155332649 1020217916 /nfs/dbraw/zinc/21/79/16/1020217916.db2.gz YEAIIMABDRTQFY-OAHLLOKOSA-N 1 1 312.369 3.593 20 5 DHBDMO C[N@H+](Cc1c[nH]nc1-c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315351 1020250833 /nfs/dbraw/zinc/25/08/33/1020250833.db2.gz DKZPXOOZWIRPFD-UHFFFAOYSA-N 1 1 322.368 3.617 20 5 DHBDMO C[N@@H+](Cc1c[nH]nc1-c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315351 1020250843 /nfs/dbraw/zinc/25/08/43/1020250843.db2.gz DKZPXOOZWIRPFD-UHFFFAOYSA-N 1 1 322.368 3.617 20 5 DHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000732571787 1020254791 /nfs/dbraw/zinc/25/47/91/1020254791.db2.gz YXAVZQPJXUSABR-CQSZACIVSA-N 1 1 312.410 3.842 20 5 DHBDMO C[N@H+]1CCC[C@H](CNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000553387657 1020286047 /nfs/dbraw/zinc/28/60/47/1020286047.db2.gz HGVWPWQBYYKFEF-SECBINFHSA-N 1 1 318.204 3.655 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCc3c4ccccc4[nH]c3C2)cc1 ZINC000126615558 1020399271 /nfs/dbraw/zinc/39/92/71/1020399271.db2.gz AVDGMWCKZIYIEX-UHFFFAOYSA-N 1 1 321.380 3.677 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3c4ccccc4[nH]c3C2)cc1 ZINC000126615558 1020399277 /nfs/dbraw/zinc/39/92/77/1020399277.db2.gz AVDGMWCKZIYIEX-UHFFFAOYSA-N 1 1 321.380 3.677 20 5 DHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000179860366 1020514367 /nfs/dbraw/zinc/51/43/67/1020514367.db2.gz NOOYTENRMUWVRD-GFCCVEGCSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000179860366 1020514373 /nfs/dbraw/zinc/51/43/73/1020514373.db2.gz NOOYTENRMUWVRD-GFCCVEGCSA-N 1 1 318.398 3.544 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCc2sccc2C1 ZINC000612577495 1020628639 /nfs/dbraw/zinc/62/86/39/1020628639.db2.gz ZXSPYKLQOHKLQY-UHFFFAOYSA-N 1 1 302.399 3.913 20 5 DHBDMO CC[C@H](C)[N@@H+](CC)Cc1cc([N+](=O)[O-])ccc1Br ZINC001171917544 1032918953 /nfs/dbraw/zinc/91/89/53/1032918953.db2.gz ZIMFDBLSFOZJEY-JTQLQIEISA-N 1 1 315.211 3.978 20 5 DHBDMO CC[N@@H+](CCc1ccccn1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000734834850 1020668030 /nfs/dbraw/zinc/66/80/30/1020668030.db2.gz ANTFZXSKZCCKQM-UHFFFAOYSA-N 1 1 319.792 3.708 20 5 DHBDMO Cc1c([C@H](C)[NH2+]Cc2nn(C)c3ccccc23)cccc1[N+](=O)[O-] ZINC000612829290 1020722745 /nfs/dbraw/zinc/72/27/45/1020722745.db2.gz PORBCRNVDXHUIM-ZDUSSCGKSA-N 1 1 324.384 3.641 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000613184934 1020844878 /nfs/dbraw/zinc/84/48/78/1020844878.db2.gz ZBACJVYBLUDEEV-GXTWGEPZSA-N 1 1 317.414 3.589 20 5 DHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000738052950 1020860606 /nfs/dbraw/zinc/86/06/06/1020860606.db2.gz FZALQAWPUPFYBG-BBRMVZONSA-N 1 1 316.405 3.803 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccc3occc3c1)C2 ZINC000581515628 1020894309 /nfs/dbraw/zinc/89/43/09/1020894309.db2.gz ZONAGJMBKQHNEK-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccc3occc3c1)C2 ZINC000581515628 1020894315 /nfs/dbraw/zinc/89/43/15/1020894315.db2.gz ZONAGJMBKQHNEK-UHFFFAOYSA-N 1 1 308.337 3.899 20 5 DHBDMO CCC[C@H]([NH2+][C@H](C)c1ccn(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000414168296 1020957317 /nfs/dbraw/zinc/95/73/17/1020957317.db2.gz ABDBTURCCCRODU-WBMJQRKESA-N 1 1 302.378 3.520 20 5 DHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccns2)cc1[N+](=O)[O-] ZINC000858578673 1032955510 /nfs/dbraw/zinc/95/55/10/1032955510.db2.gz XETNQKAEJUCXGC-GHMZBOCLSA-N 1 1 321.402 3.862 20 5 DHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]12 ZINC000776277476 1021209004 /nfs/dbraw/zinc/20/90/04/1021209004.db2.gz PYLGHFCCYMCCEU-QCSYZSNVSA-N 1 1 318.417 3.529 20 5 DHBDMO COC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000537984375 1032962004 /nfs/dbraw/zinc/96/20/04/1032962004.db2.gz SITNTKUSQKBYFY-PXAZEXFGSA-N 1 1 318.348 3.772 20 5 DHBDMO CC[N@H+](Cc1ccccc1C)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917437502 1021261012 /nfs/dbraw/zinc/26/10/12/1021261012.db2.gz WRXCYENQTKMQNM-UHFFFAOYSA-N 1 1 324.384 3.733 20 5 DHBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000743380242 1021288082 /nfs/dbraw/zinc/28/80/82/1021288082.db2.gz XLGOCNYUECXYQB-BBRMVZONSA-N 1 1 316.405 3.803 20 5 DHBDMO Cc1c(C[N@H+]2CC[C@@H](Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000170688586 1021352378 /nfs/dbraw/zinc/35/23/78/1021352378.db2.gz PLXVXXHZGURJEP-QGZVFWFLSA-N 1 1 311.385 3.590 20 5 DHBDMO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000877813151 1033463442 /nfs/dbraw/zinc/46/34/42/1033463442.db2.gz XBLJOVDMHMSHKY-LBPRGKRZSA-N 1 1 306.259 3.508 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCc2c1cc(F)cc2F ZINC000154601625 1021417116 /nfs/dbraw/zinc/41/71/16/1021417116.db2.gz YAOBGHXUFZDXAS-HNNXBMFYSA-N 1 1 304.296 3.650 20 5 DHBDMO C[C@H](CN1CCCCCC1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000480697433 1021462726 /nfs/dbraw/zinc/46/27/26/1021462726.db2.gz KURZHENCZGHMQX-CABCVRRESA-N 1 1 305.422 3.510 20 5 DHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])s2)[C@@H]1c1ccccc1 ZINC000618679587 1021483855 /nfs/dbraw/zinc/48/38/55/1021483855.db2.gz VOFOSCJTMOMLFG-WFASDCNBSA-N 1 1 303.387 3.514 20 5 DHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000744442065 1021546674 /nfs/dbraw/zinc/54/66/74/1021546674.db2.gz WBZHVTXCGMOFEK-WDEREUQCSA-N 1 1 321.402 3.950 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCSc3ccccc32)cs1 ZINC000037563065 1021840744 /nfs/dbraw/zinc/84/07/44/1021840744.db2.gz VRZPPAZDMSRDLV-GFCCVEGCSA-N 1 1 306.412 3.983 20 5 DHBDMO CC[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000556997052 1022003685 /nfs/dbraw/zinc/00/36/85/1022003685.db2.gz IRONBUAIXWQIQQ-LLVKDONJSA-N 1 1 302.296 3.988 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)cc1F ZINC000852084141 1022069514 /nfs/dbraw/zinc/06/95/14/1022069514.db2.gz QEPGTZLQJKCLBA-CQSZACIVSA-N 1 1 315.348 3.509 20 5 DHBDMO COc1ccc(C[N@@H+]2CCCc3sccc3C2)cc1[N+](=O)[O-] ZINC000609322806 1022201312 /nfs/dbraw/zinc/20/13/12/1022201312.db2.gz MCZBVDCYJHXYLL-UHFFFAOYSA-N 1 1 318.398 3.613 20 5 DHBDMO COc1ccc(C[N@H+]2CCCc3sccc3C2)cc1[N+](=O)[O-] ZINC000609322806 1022201319 /nfs/dbraw/zinc/20/13/19/1022201319.db2.gz MCZBVDCYJHXYLL-UHFFFAOYSA-N 1 1 318.398 3.613 20 5 DHBDMO CC[N@@H+](Cc1c(F)cccc1Cl)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169041642 1022225035 /nfs/dbraw/zinc/22/50/35/1022225035.db2.gz BTTZIWQKHYEUGD-NWDGAFQWSA-N 1 1 314.788 3.746 20 5 DHBDMO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169025295 1022228804 /nfs/dbraw/zinc/22/88/04/1022228804.db2.gz YLPBGMNUDMRFDE-JQWIXIFHSA-N 1 1 317.216 3.871 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169048696 1022229043 /nfs/dbraw/zinc/22/90/43/1022229043.db2.gz AQLFKEAVWFOZLV-HZMBPMFUSA-N 1 1 317.216 3.871 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2c(F)cccc2F)C1 ZINC001169046328 1022229607 /nfs/dbraw/zinc/22/96/07/1022229607.db2.gz KNNAMVYTQGFPSI-TYNCELHUSA-N 1 1 310.344 3.547 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H]2c2ccccc2Cl)C1 ZINC001169025501 1022229639 /nfs/dbraw/zinc/22/96/39/1022229639.db2.gz JQUTUPUUFOVXSQ-WWGRRREGSA-N 1 1 308.809 3.922 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H](CCc3ccccc3)C2)C1 ZINC001169057612 1022233604 /nfs/dbraw/zinc/23/36/04/1022233604.db2.gz WFVGQKAHEGNMBP-GUDVDZBRSA-N 1 1 316.445 3.777 20 5 DHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H](CCc3ccccc3)C2)C1 ZINC001169057615 1022235600 /nfs/dbraw/zinc/23/56/00/1022235600.db2.gz WFVGQKAHEGNMBP-QRVBRYPASA-N 1 1 316.445 3.777 20 5 DHBDMO Cc1nn(C[N@@H+]2CCC[C@H]2c2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000853522625 1022286249 /nfs/dbraw/zinc/28/62/49/1022286249.db2.gz NUJRZZUMMVMMPI-HNNXBMFYSA-N 1 1 314.389 3.511 20 5 DHBDMO Cc1nn(C[N@H+]2CCC[C@H]2c2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000853522625 1022286263 /nfs/dbraw/zinc/28/62/63/1022286263.db2.gz NUJRZZUMMVMMPI-HNNXBMFYSA-N 1 1 314.389 3.511 20 5 DHBDMO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000610133479 1022424236 /nfs/dbraw/zinc/42/42/36/1022424236.db2.gz RVOBAAVCRNJNHL-USXIJHARSA-N 1 1 318.417 3.620 20 5 DHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC001169723755 1022520133 /nfs/dbraw/zinc/52/01/33/1022520133.db2.gz GXRRGUAXVHLYLR-CQSZACIVSA-N 1 1 306.406 3.732 20 5 DHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cn2)cc1 ZINC000080914807 1022535475 /nfs/dbraw/zinc/53/54/75/1022535475.db2.gz MYRODCKCMYPQCO-LBPRGKRZSA-N 1 1 323.356 3.657 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccnc(F)c1 ZINC000859090928 1033064806 /nfs/dbraw/zinc/06/48/06/1033064806.db2.gz ZOUDRWJJAQXOMZ-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccnc(F)c1 ZINC000859090928 1033064818 /nfs/dbraw/zinc/06/48/18/1033064818.db2.gz ZOUDRWJJAQXOMZ-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO C[C@H](NCc1cccc(C[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000173307063 1022690054 /nfs/dbraw/zinc/69/00/54/1022690054.db2.gz LIFODLQCWVIYRX-AWEZNQCLSA-N 1 1 313.401 3.507 20 5 DHBDMO C[C@@H](NCc1cccc(C[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000173307078 1022691455 /nfs/dbraw/zinc/69/14/55/1022691455.db2.gz LIFODLQCWVIYRX-CQSZACIVSA-N 1 1 313.401 3.507 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1nccs1)CCCC2 ZINC000417346248 1022695890 /nfs/dbraw/zinc/69/58/90/1022695890.db2.gz VOZQIYSOQLHOJL-AWEZNQCLSA-N 1 1 303.387 3.609 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1noc3ccccc13)CCC2 ZINC000566475897 1022722101 /nfs/dbraw/zinc/72/21/01/1022722101.db2.gz QSXSHNPHJPOSLE-INIZCTEOSA-N 1 1 323.352 3.903 20 5 DHBDMO Cc1csc([C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000742376903 1022824059 /nfs/dbraw/zinc/82/40/59/1022824059.db2.gz DGHPHMXJQSDKPS-HNNXBMFYSA-N 1 1 317.414 3.909 20 5 DHBDMO CC[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C(C)C ZINC000768237438 1022933471 /nfs/dbraw/zinc/93/34/71/1022933471.db2.gz RQBYEVDTMZZJHI-UHFFFAOYSA-N 1 1 301.184 3.588 20 5 DHBDMO CC[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C(C)C ZINC000768237438 1022933478 /nfs/dbraw/zinc/93/34/78/1022933478.db2.gz RQBYEVDTMZZJHI-UHFFFAOYSA-N 1 1 301.184 3.588 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2cccs2)C2CC2)c1 ZINC000768544902 1022992665 /nfs/dbraw/zinc/99/26/65/1022992665.db2.gz TZJQUZBDGWEFNF-UHFFFAOYSA-N 1 1 302.399 3.863 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@]3(CCCOC3)C2)ccc1Cl ZINC000768548927 1022994670 /nfs/dbraw/zinc/99/46/70/1022994670.db2.gz LEKISLPVMWBQHR-MRXNPFEDSA-N 1 1 324.808 3.641 20 5 DHBDMO Cc1c(NCCC[N@@H+]2CCCC[C@@H]2C)cc(F)cc1[N+](=O)[O-] ZINC001167750782 1023022316 /nfs/dbraw/zinc/02/23/16/1023022316.db2.gz CDZGNRSJLIUSPR-LBPRGKRZSA-N 1 1 309.385 3.719 20 5 DHBDMO CC[C@@H](C)C[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768772549 1023024064 /nfs/dbraw/zinc/02/40/64/1023024064.db2.gz ZRURZPLFBSMLKS-SNVBAGLBSA-N 1 1 315.211 3.835 20 5 DHBDMO CC[C@@H](C)C[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768772549 1023024070 /nfs/dbraw/zinc/02/40/70/1023024070.db2.gz ZRURZPLFBSMLKS-SNVBAGLBSA-N 1 1 315.211 3.835 20 5 DHBDMO C[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])CC(C)(C)C ZINC000768936273 1023060024 /nfs/dbraw/zinc/06/00/24/1023060024.db2.gz BAJSTOZFSUEVPD-UHFFFAOYSA-N 1 1 315.211 3.835 20 5 DHBDMO C[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])CC(C)(C)C ZINC000768936273 1023060031 /nfs/dbraw/zinc/06/00/31/1023060031.db2.gz BAJSTOZFSUEVPD-UHFFFAOYSA-N 1 1 315.211 3.835 20 5 DHBDMO CC1(C)CCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769244153 1023107971 /nfs/dbraw/zinc/10/79/71/1023107971.db2.gz MCEKLWFAUOJVGB-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO CC1(C)CCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769244153 1023107968 /nfs/dbraw/zinc/10/79/68/1023107968.db2.gz MCEKLWFAUOJVGB-UHFFFAOYSA-N 1 1 313.195 3.732 20 5 DHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000769446252 1023154217 /nfs/dbraw/zinc/15/42/17/1023154217.db2.gz LHRLRIBXBAYTPF-GFCCVEGCSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@@H]1C[C@H](C)[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769471260 1023160660 /nfs/dbraw/zinc/16/06/60/1023160660.db2.gz RNMAZLFRYQOEAJ-ZJUUUORDSA-N 1 1 313.195 3.588 20 5 DHBDMO CNC(=O)[C@H](C)C[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000769569803 1023182151 /nfs/dbraw/zinc/18/21/51/1023182151.db2.gz VYJMIIAJEDCPQC-OAHLLOKOSA-N 1 1 320.436 3.807 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000538722833 1033146173 /nfs/dbraw/zinc/14/61/73/1033146173.db2.gz UBFFJJVNUYELNL-TWVNLXSWSA-N 1 1 308.381 3.925 20 5 DHBDMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538717423 1033142707 /nfs/dbraw/zinc/14/27/07/1033142707.db2.gz ZZFRFIUYSDIFIR-NWDGAFQWSA-N 1 1 317.414 3.949 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000538722831 1033147095 /nfs/dbraw/zinc/14/70/95/1033147095.db2.gz UBFFJJVNUYELNL-OEPRFQHASA-N 1 1 308.381 3.925 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)cc1F ZINC000788487020 1023894018 /nfs/dbraw/zinc/89/40/18/1023894018.db2.gz BCFCSAIJRVFGET-HUUCEWRRSA-N 1 1 310.394 3.594 20 5 DHBDMO Cc1[nH+]c(N)ccc1CNc1cc2ccccc2c([N+](=O)[O-])c1 ZINC001167788095 1023923560 /nfs/dbraw/zinc/92/35/60/1023923560.db2.gz NTPMQXKKPVFMLP-UHFFFAOYSA-N 1 1 308.341 3.646 20 5 DHBDMO Cc1c([C@@H](C)[NH2+]C2CCN(C3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000268975039 1024206105 /nfs/dbraw/zinc/20/61/05/1024206105.db2.gz GOBSOEZQJGPABY-CQSZACIVSA-N 1 1 317.433 3.571 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C ZINC000531714653 1024280181 /nfs/dbraw/zinc/28/01/81/1024280181.db2.gz ZVLHAFHTVLNTFV-RHSMWYFYSA-N 1 1 321.465 3.920 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C ZINC000531714653 1024280188 /nfs/dbraw/zinc/28/01/88/1024280188.db2.gz ZVLHAFHTVLNTFV-RHSMWYFYSA-N 1 1 321.465 3.920 20 5 DHBDMO CCCC1CCC([N@@H+](C)Cn2nc(C)c([N+](=O)[O-])c2C)CC1 ZINC000790476949 1024307862 /nfs/dbraw/zinc/30/78/62/1024307862.db2.gz GZVWBYCIYYDVJX-UHFFFAOYSA-N 1 1 308.426 3.656 20 5 DHBDMO Cc1c([C@H](C)[NH2+]Cc2cnc(C3CC3)o2)cccc1[N+](=O)[O-] ZINC000453347919 1024474974 /nfs/dbraw/zinc/47/49/74/1024474974.db2.gz IVYIJTDFHIHQET-NSHDSACASA-N 1 1 301.346 3.619 20 5 DHBDMO CCC[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000453353452 1024478084 /nfs/dbraw/zinc/47/80/84/1024478084.db2.gz HXTGUJQWPTWRLS-QZTJIDSGSA-N 1 1 318.417 3.939 20 5 DHBDMO CC[C@H]([NH2+]Cc1cnc(C2CC2)o1)c1cccc([N+](=O)[O-])c1 ZINC000453355714 1024478685 /nfs/dbraw/zinc/47/86/85/1024478685.db2.gz MRCNSWJRGPCSQM-HNNXBMFYSA-N 1 1 301.346 3.701 20 5 DHBDMO CCCc1ncc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000453382228 1024483244 /nfs/dbraw/zinc/48/32/44/1024483244.db2.gz LTTLZVZBJCBTCH-GFCCVEGCSA-N 1 1 303.362 3.695 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)[N@@H+]1CCCC[C@H]1C ZINC000532192719 1024572077 /nfs/dbraw/zinc/57/20/77/1024572077.db2.gz DWFDZRPKVVNCGZ-PMPSAXMXSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000532192719 1024572081 /nfs/dbraw/zinc/57/20/81/1024572081.db2.gz DWFDZRPKVVNCGZ-PMPSAXMXSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000106877011 1024607391 /nfs/dbraw/zinc/60/73/91/1024607391.db2.gz XEYTXZHDBZJUKC-NSHDSACASA-N 1 1 305.403 3.861 20 5 DHBDMO CO[C@H]1C[C@@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C12CCC2 ZINC001170324902 1024744376 /nfs/dbraw/zinc/74/43/76/1024744376.db2.gz UTKKSOJIROFNEG-CABCVRRESA-N 1 1 324.808 3.638 20 5 DHBDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C12CCC2 ZINC001170324902 1024744385 /nfs/dbraw/zinc/74/43/85/1024744385.db2.gz UTKKSOJIROFNEG-CABCVRRESA-N 1 1 324.808 3.638 20 5 DHBDMO CO[C@@H]1C[C@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C12CCC2 ZINC001170324905 1024744885 /nfs/dbraw/zinc/74/48/85/1024744885.db2.gz UTKKSOJIROFNEG-LSDHHAIUSA-N 1 1 324.808 3.638 20 5 DHBDMO CO[C@@H]1C[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C12CCC2 ZINC001170324905 1024744898 /nfs/dbraw/zinc/74/48/98/1024744898.db2.gz UTKKSOJIROFNEG-LSDHHAIUSA-N 1 1 324.808 3.638 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@](C)(F)CC2)c([N+](=O)[O-])c1 ZINC001170330051 1024747022 /nfs/dbraw/zinc/74/70/22/1024747022.db2.gz XGVXQWNYIJANST-SUMWQHHRSA-N 1 1 324.396 3.749 20 5 DHBDMO COc1ccc(C[C@H](C)[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001170329758 1024747477 /nfs/dbraw/zinc/74/74/77/1024747477.db2.gz TWEPMFWFLWKKCW-CWRNSKLLSA-N 1 1 318.417 3.656 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170352787 1024748928 /nfs/dbraw/zinc/74/89/28/1024748928.db2.gz QGXPRGNHOOCBNH-DZGCQCFKSA-N 1 1 306.406 3.799 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170341248 1024757515 /nfs/dbraw/zinc/75/75/15/1024757515.db2.gz HMXRWBNEBKFGBN-UONOGXRCSA-N 1 1 306.406 3.799 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C2CC2)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000792861344 1024809189 /nfs/dbraw/zinc/80/91/89/1024809189.db2.gz BTXVOIBBBUKMFM-UHFFFAOYSA-N 1 1 319.361 3.800 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(O)cc1)CC1CC1 ZINC000354121972 1025362172 /nfs/dbraw/zinc/36/21/72/1025362172.db2.gz HBMRAQFQDFWUJN-UHFFFAOYSA-N 1 1 312.369 3.713 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)C[C@H](C)c1nccs1 ZINC000877316276 1033280490 /nfs/dbraw/zinc/28/04/90/1033280490.db2.gz QZRVRBYSWMLPGN-LBPRGKRZSA-N 1 1 319.430 3.904 20 5 DHBDMO CC(C)[N@H+](Cc1cccc(F)c1)Cc1cccnc1[N+](=O)[O-] ZINC000885965931 1025422519 /nfs/dbraw/zinc/42/25/19/1025422519.db2.gz YRNZMZNYJWPFCT-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO CC(C)[N@@H+](Cc1cccc(F)c1)Cc1cccnc1[N+](=O)[O-] ZINC000885965931 1025422526 /nfs/dbraw/zinc/42/25/26/1025422526.db2.gz YRNZMZNYJWPFCT-UHFFFAOYSA-N 1 1 303.337 3.540 20 5 DHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000886242930 1025570136 /nfs/dbraw/zinc/57/01/36/1025570136.db2.gz JFHBCQPONVHVNI-IAGOWNOFSA-N 1 1 311.385 3.758 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc4occc4c3)nc2c1 ZINC000348375910 1025587709 /nfs/dbraw/zinc/58/77/09/1025587709.db2.gz IQTGWGPNJUVAMJ-UHFFFAOYSA-N 1 1 322.324 3.507 20 5 DHBDMO C[C@H](NCCC[N@@H+](C)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000322117200 1025732202 /nfs/dbraw/zinc/73/22/02/1025732202.db2.gz QJDLFTWXUBZWOS-HNNXBMFYSA-N 1 1 319.449 3.900 20 5 DHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1N(C)C ZINC000089512274 1026051405 /nfs/dbraw/zinc/05/14/05/1026051405.db2.gz HNLFFWNDSXGUME-LBPRGKRZSA-N 1 1 317.364 3.651 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)[C@H]1C ZINC000419367600 1026274356 /nfs/dbraw/zinc/27/43/56/1026274356.db2.gz DHIBKNAFUPOZDT-AGIUHOORSA-N 1 1 315.373 3.726 20 5 DHBDMO C[N@@H+](Cc1ccc(O)cc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809753835 1026616258 /nfs/dbraw/zinc/61/62/58/1026616258.db2.gz SFRHSBNTUTYPTP-UHFFFAOYSA-N 1 1 306.749 3.586 20 5 DHBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000810015861 1026664417 /nfs/dbraw/zinc/66/44/17/1026664417.db2.gz RMFVADBMPAJYPQ-NSHDSACASA-N 1 1 319.188 3.512 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000810015861 1026664420 /nfs/dbraw/zinc/66/44/20/1026664420.db2.gz RMFVADBMPAJYPQ-NSHDSACASA-N 1 1 319.188 3.512 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)c1cccs1 ZINC000016434732 1027005848 /nfs/dbraw/zinc/00/58/48/1027005848.db2.gz XMTUHEPLXGKGBS-LLVKDONJSA-N 1 1 306.387 3.858 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)c1cccs1 ZINC000016434732 1027005854 /nfs/dbraw/zinc/00/58/54/1027005854.db2.gz XMTUHEPLXGKGBS-LLVKDONJSA-N 1 1 306.387 3.858 20 5 DHBDMO Cc1cc(N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000811812180 1027091202 /nfs/dbraw/zinc/09/12/02/1027091202.db2.gz OFERYRMZHDYSHT-GHMZBOCLSA-N 1 1 309.797 3.594 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000355754141 1027105792 /nfs/dbraw/zinc/10/57/92/1027105792.db2.gz ZODQNVVMCJWPQQ-PBHICJAKSA-N 1 1 304.390 3.548 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC=C(c2ccccn2)C1 ZINC000571962471 1027160760 /nfs/dbraw/zinc/16/07/60/1027160760.db2.gz MMYFBYLQJFSPFD-AWEZNQCLSA-N 1 1 309.369 3.840 20 5 DHBDMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000572425976 1027199631 /nfs/dbraw/zinc/19/96/31/1027199631.db2.gz MLPOQRIDNMTGCM-GFCCVEGCSA-N 1 1 316.405 3.872 20 5 DHBDMO CCCc1nc(C)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000293761507 1027264968 /nfs/dbraw/zinc/26/49/68/1027264968.db2.gz SBQBMYSQEZHHTN-LLVKDONJSA-N 1 1 303.362 3.695 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](Cc3nccs3)C2)cs1 ZINC000932200808 1027409706 /nfs/dbraw/zinc/40/97/06/1027409706.db2.gz ZFOXUEFTGSOMTF-LLVKDONJSA-N 1 1 323.443 3.568 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](Cc3nccs3)C2)cs1 ZINC000932200808 1027409712 /nfs/dbraw/zinc/40/97/12/1027409712.db2.gz ZFOXUEFTGSOMTF-LLVKDONJSA-N 1 1 323.443 3.568 20 5 DHBDMO CO[C@H]1CC[C@@H]1[N@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000934111842 1027903469 /nfs/dbraw/zinc/90/34/69/1027903469.db2.gz PRSGUAADJJJCRC-RYUDHWBXSA-N 1 1 319.188 3.511 20 5 DHBDMO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000934111842 1027903479 /nfs/dbraw/zinc/90/34/79/1027903479.db2.gz PRSGUAADJJJCRC-RYUDHWBXSA-N 1 1 319.188 3.511 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H]4CC[C@@H](C3)S4)c2c1 ZINC000601201649 1028024743 /nfs/dbraw/zinc/02/47/43/1028024743.db2.gz PPESRGHQGZSPAL-OLZOCXBDSA-N 1 1 315.398 3.617 20 5 DHBDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)n1 ZINC000367293298 1028160176 /nfs/dbraw/zinc/16/01/76/1028160176.db2.gz YSURSJVJTDZGAJ-KRWDZBQOSA-N 1 1 315.348 3.774 20 5 DHBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)n1 ZINC000367293298 1028160178 /nfs/dbraw/zinc/16/01/78/1028160178.db2.gz YSURSJVJTDZGAJ-KRWDZBQOSA-N 1 1 315.348 3.774 20 5 DHBDMO Cc1cnccc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000578953670 1028286383 /nfs/dbraw/zinc/28/63/83/1028286383.db2.gz OINYDNXQNFDNEX-KRWDZBQOSA-N 1 1 311.385 3.678 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@H]3C3CC3)cs2)c1 ZINC000449424528 1028631871 /nfs/dbraw/zinc/63/18/71/1028631871.db2.gz FDZQOFALZMTSED-HNNXBMFYSA-N 1 1 315.398 3.703 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H]3C3CC3)cs2)c1 ZINC000449424528 1028631879 /nfs/dbraw/zinc/63/18/79/1028631879.db2.gz FDZQOFALZMTSED-HNNXBMFYSA-N 1 1 315.398 3.703 20 5 DHBDMO CS[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449447381 1028651395 /nfs/dbraw/zinc/65/13/95/1028651395.db2.gz YKIOHUKDPWXFPJ-OAHLLOKOSA-N 1 1 318.398 3.792 20 5 DHBDMO CC(C)C[C@@H](CO)[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000566002542 1028666158 /nfs/dbraw/zinc/66/61/58/1028666158.db2.gz QNGHAHARPLBBHP-HNNXBMFYSA-N 1 1 308.422 3.557 20 5 DHBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000449492137 1028687446 /nfs/dbraw/zinc/68/74/46/1028687446.db2.gz IOFVRKLUMTYNRU-KBXCAEBGSA-N 1 1 320.433 3.965 20 5 DHBDMO C[C@@H]1C[C@H](C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449498901 1028713705 /nfs/dbraw/zinc/71/37/05/1028713705.db2.gz LKGWUYYGIUIHBI-BFYDXBDKSA-N 1 1 318.417 3.589 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000371681875 1028744088 /nfs/dbraw/zinc/74/40/88/1028744088.db2.gz UJDNRNUTTQJMRC-NJELEJDNSA-N 1 1 323.396 3.568 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000568468266 1029076588 /nfs/dbraw/zinc/07/65/88/1029076588.db2.gz LTFLNZRXWAOHOW-GDBMZVCRSA-N 1 1 311.385 3.849 20 5 DHBDMO Cc1cnc([C@@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)s1 ZINC000374231265 1029246623 /nfs/dbraw/zinc/24/66/23/1029246623.db2.gz VGHIXKLONUKQBH-CQSZACIVSA-N 1 1 317.414 3.739 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@H]1CC[N@H+](C(C)C)C1 ZINC000570783237 1029418296 /nfs/dbraw/zinc/41/82/96/1029418296.db2.gz AOYPBFCNWKHPJX-GFCCVEGCSA-N 1 1 311.813 3.699 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000821331861 1029826608 /nfs/dbraw/zinc/82/66/08/1029826608.db2.gz GJVYOSTYFOPGOP-ZDUSSCGKSA-N 1 1 315.348 3.509 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451429045 1029869184 /nfs/dbraw/zinc/86/91/84/1029869184.db2.gz YRIDMKWKCPQNSC-PLYYQAHHSA-N 1 1 318.417 3.590 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCC3CCOCC3)C2)cc1 ZINC000451554104 1029917092 /nfs/dbraw/zinc/91/70/92/1029917092.db2.gz ZGCNJWITCWHLDU-QGZVFWFLSA-N 1 1 318.417 3.591 20 5 DHBDMO Cc1ccc(C[NH2+]Cc2nc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC000865787884 1030025309 /nfs/dbraw/zinc/02/53/09/1030025309.db2.gz UOVMJBBZPVRGHR-UHFFFAOYSA-N 1 1 317.414 3.528 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCCc3ncccc32)c1 ZINC000866305070 1030214264 /nfs/dbraw/zinc/21/42/64/1030214264.db2.gz NCHTVTUIJVQMCX-INIZCTEOSA-N 1 1 317.776 3.810 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000866581964 1030386990 /nfs/dbraw/zinc/38/69/90/1030386990.db2.gz FSVRMSWERXEPSO-MELADBBJSA-N 1 1 306.431 3.649 20 5 DHBDMO CCCC[N@@H+](C)CC1CCN(c2c(C)cccc2[N+](=O)[O-])CC1 ZINC000533546919 1030420747 /nfs/dbraw/zinc/42/07/47/1030420747.db2.gz VWLLGGRUGFEUGG-UHFFFAOYSA-N 1 1 319.449 3.852 20 5 DHBDMO COc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1F ZINC000824462447 1030566385 /nfs/dbraw/zinc/56/63/85/1030566385.db2.gz CPFQQEBTOZGTNJ-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO CCc1nc(C)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000291809259 1030652010 /nfs/dbraw/zinc/65/20/10/1030652010.db2.gz CPCQQUGUFMRBCF-LLVKDONJSA-N 1 1 303.362 3.613 20 5 DHBDMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000122994909 1030937179 /nfs/dbraw/zinc/93/71/79/1030937179.db2.gz UKGPIGJPVXSLGL-VIFPVBQESA-N 1 1 313.195 3.588 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844434523 1031139218 /nfs/dbraw/zinc/13/92/18/1031139218.db2.gz ADMFSCKEVWJIRG-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844434523 1031139220 /nfs/dbraw/zinc/13/92/20/1031139220.db2.gz ADMFSCKEVWJIRG-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO CSC[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000292715573 1031141190 /nfs/dbraw/zinc/14/11/90/1031141190.db2.gz DRCSSUOYQRFSPH-LHRNQBEKSA-N 1 1 306.431 3.683 20 5 DHBDMO C[C@H]1SCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)[C@H]1C ZINC000360018564 1031242828 /nfs/dbraw/zinc/24/28/28/1031242828.db2.gz UTQPKRIXQDBESG-VHSXEESVSA-N 1 1 300.811 3.574 20 5 DHBDMO C[C@H]1SCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)[C@H]1C ZINC000360018564 1031242840 /nfs/dbraw/zinc/24/28/40/1031242840.db2.gz UTQPKRIXQDBESG-VHSXEESVSA-N 1 1 300.811 3.574 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2C2CCOCC2)c(Cl)c1 ZINC000360209698 1031327045 /nfs/dbraw/zinc/32/70/45/1031327045.db2.gz RGVOYMQHAXWPOK-INIZCTEOSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](OC3CCC3)CC2)cs1 ZINC000872260036 1031565773 /nfs/dbraw/zinc/56/57/73/1031565773.db2.gz GZOJIRJZHMGEEH-AWEZNQCLSA-N 1 1 310.419 3.580 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)cs1 ZINC000872260036 1031565777 /nfs/dbraw/zinc/56/57/77/1031565777.db2.gz GZOJIRJZHMGEEH-AWEZNQCLSA-N 1 1 310.419 3.580 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)cc1F ZINC000872280070 1031571214 /nfs/dbraw/zinc/57/12/14/1031571214.db2.gz JJCPCXKGCAZRQN-HNNXBMFYSA-N 1 1 322.380 3.658 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCCc1cccnc1)C1CC1 ZINC000930061904 1031688702 /nfs/dbraw/zinc/68/87/02/1031688702.db2.gz VIUVAEGTYADCGH-UHFFFAOYSA-N 1 1 311.385 3.587 20 5 DHBDMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792880195 1031719379 /nfs/dbraw/zinc/71/93/79/1031719379.db2.gz BEUYCAUUZKOQKH-GFCCVEGCSA-N 1 1 321.377 3.904 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000361576728 1031995366 /nfs/dbraw/zinc/99/53/66/1031995366.db2.gz JNNZVTZHTWDJMS-ZDUSSCGKSA-N 1 1 324.380 3.909 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000361576728 1031995378 /nfs/dbraw/zinc/99/53/78/1031995378.db2.gz JNNZVTZHTWDJMS-ZDUSSCGKSA-N 1 1 324.380 3.909 20 5 DHBDMO CC(C)C[N@@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1CC1 ZINC000777951832 1032026012 /nfs/dbraw/zinc/02/60/12/1032026012.db2.gz KNTVWKJEYKDJGV-UHFFFAOYSA-N 1 1 314.389 3.536 20 5 DHBDMO CC(C)[C@@H]1CCC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777954041 1032029811 /nfs/dbraw/zinc/02/98/11/1032029811.db2.gz PNKCJFXFDLDDMP-KRWDZBQOSA-N 1 1 314.389 3.536 20 5 DHBDMO CCCC[N@@H+](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000561702638 1032041544 /nfs/dbraw/zinc/04/15/44/1032041544.db2.gz HYEKKYWOHNIUGJ-ZDUSSCGKSA-N 1 1 316.405 3.675 20 5 DHBDMO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000877813151 1033463434 /nfs/dbraw/zinc/46/34/34/1033463434.db2.gz XBLJOVDMHMSHKY-LBPRGKRZSA-N 1 1 306.259 3.508 20 5 DHBDMO C[C@@H]1CCCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909559 1033483322 /nfs/dbraw/zinc/48/33/22/1033483322.db2.gz SMKHLVPICAIIGW-RHSMWYFYSA-N 1 1 302.418 3.964 20 5 DHBDMO CC[N@@H+](CCOc1ccccc1C)Cc1ccccc1[N+](=O)[O-] ZINC000552875238 1033540005 /nfs/dbraw/zinc/54/00/05/1033540005.db2.gz JFDQJTFDSIAYET-UHFFFAOYSA-N 1 1 314.385 3.804 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC[C@H]2C)c1F ZINC001173187079 1033583054 /nfs/dbraw/zinc/58/30/54/1033583054.db2.gz WMFSSOCOHGGEHH-NEPJUHHUSA-N 1 1 310.369 3.548 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)CC(C)(C)C)c1F ZINC001173190109 1033583181 /nfs/dbraw/zinc/58/31/81/1033583181.db2.gz QKKUNZBMKWDGBK-LLVKDONJSA-N 1 1 312.385 3.651 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173191328 1033583917 /nfs/dbraw/zinc/58/39/17/1033583917.db2.gz CCZFYWMDPYDZFG-STQMWFEESA-N 1 1 324.396 3.938 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2sccc2C1 ZINC001173221192 1033600857 /nfs/dbraw/zinc/60/08/57/1033600857.db2.gz GEPGCMHZCJGDMA-GFCCVEGCSA-N 1 1 302.399 3.646 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1cccnc1 ZINC001173226617 1033605332 /nfs/dbraw/zinc/60/53/32/1033605332.db2.gz MWOPDRQJOKNQIQ-KBXCAEBGSA-N 1 1 311.385 3.758 20 5 DHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc(F)cc1 ZINC001173229405 1033605610 /nfs/dbraw/zinc/60/56/10/1033605610.db2.gz UGOMYSWZWQSFPQ-ZDUSSCGKSA-N 1 1 302.349 3.797 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000878755601 1033818380 /nfs/dbraw/zinc/81/83/80/1033818380.db2.gz VWBGVCDDHIDXNC-KRWDZBQOSA-N 1 1 311.385 3.678 20 5 DHBDMO CC[C@@H](C)C[N@@H+](CC)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000177860961 1034189061 /nfs/dbraw/zinc/18/90/61/1034189061.db2.gz FEOVSKLSEAFZDW-GFCCVEGCSA-N 1 1 318.377 3.513 20 5 DHBDMO CCc1onc(C)c1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000927143467 1034201298 /nfs/dbraw/zinc/20/12/98/1034201298.db2.gz ZQDKKCZPRLNTHO-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880318358 1034295645 /nfs/dbraw/zinc/29/56/45/1034295645.db2.gz YCVSEPOFYWYQKR-RYUDHWBXSA-N 1 1 303.387 3.602 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C(C)(C)c1cccc(F)c1 ZINC000179564247 1034314449 /nfs/dbraw/zinc/31/44/49/1034314449.db2.gz QTQZEXQKJKAYMK-UHFFFAOYSA-N 1 1 318.348 3.767 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000600187938 1034789514 /nfs/dbraw/zinc/78/95/14/1034789514.db2.gz BAXQMQLYGJSAHO-FIRJTHROSA-N 1 1 318.442 3.968 20 5 DHBDMO CC1(C)CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000159434694 1035052419 /nfs/dbraw/zinc/05/24/19/1035052419.db2.gz GXZPYWNEGJJLRV-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO CC1(C)CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000159434694 1035052425 /nfs/dbraw/zinc/05/24/25/1035052425.db2.gz GXZPYWNEGJJLRV-UHFFFAOYSA-N 1 1 313.195 3.589 20 5 DHBDMO Cc1c([C@H](C)NCC[NH+]2[C@H](C)CCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000482627044 1035149704 /nfs/dbraw/zinc/14/97/04/1035149704.db2.gz GRGBGVUPQOVPRP-FMKPAKJESA-N 1 1 319.449 3.817 20 5 DHBDMO CC[C@H](C)C[N@@H+](CC)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000482893025 1035192919 /nfs/dbraw/zinc/19/29/19/1035192919.db2.gz RBZBHAAHWSTVIY-ZDUSSCGKSA-N 1 1 321.421 3.600 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1CCN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000482954622 1035205929 /nfs/dbraw/zinc/20/59/29/1035205929.db2.gz FDRVNKQHJLKRDX-HOCLYGCPSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@H]1CCCCN1CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000482954622 1035205934 /nfs/dbraw/zinc/20/59/34/1035205934.db2.gz FDRVNKQHJLKRDX-HOCLYGCPSA-N 1 1 305.422 3.510 20 5 DHBDMO C[N@@H+](CCc1cccs1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000111323434 1035211721 /nfs/dbraw/zinc/21/17/21/1035211721.db2.gz QEDMNAXILFSMNZ-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO COCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CC[C@H](C)C1 ZINC000483422674 1035268726 /nfs/dbraw/zinc/26/87/26/1035268726.db2.gz YBFHSKZARULJME-NKHHLTQSSA-N 1 1 318.417 3.745 20 5 DHBDMO CC[C@@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000161098764 1035297310 /nfs/dbraw/zinc/29/73/10/1035297310.db2.gz LWCNOHFBPNOSBP-YQQAZPJKSA-N 1 1 305.422 3.508 20 5 DHBDMO CC[C@@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000161098526 1035297489 /nfs/dbraw/zinc/29/74/89/1035297489.db2.gz LWCNOHFBPNOSBP-HLLBOEOZSA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1cccnc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC001176896742 1035337639 /nfs/dbraw/zinc/33/76/39/1035337639.db2.gz IENBMSLFFXHRSP-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC[N@H+]1C ZINC000484640042 1035378650 /nfs/dbraw/zinc/37/86/50/1035378650.db2.gz PSFBRWVDQKPAAU-OCCSQVGLSA-N 1 1 321.421 3.667 20 5 DHBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)C1(C)C ZINC001179962935 1035561690 /nfs/dbraw/zinc/56/16/90/1035561690.db2.gz UPDWRBTUXOVUOX-SJLPKXTDSA-N 1 1 320.433 3.847 20 5 DHBDMO Cc1ccc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000122264846 1035770685 /nfs/dbraw/zinc/77/06/85/1035770685.db2.gz MSGZEPFUXGMDSM-UHFFFAOYSA-N 1 1 324.380 3.898 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494704452 1035771011 /nfs/dbraw/zinc/77/10/11/1035771011.db2.gz SEGYXWUZEQTRMZ-YOEHRIQHSA-N 1 1 318.417 3.855 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H]1C[C@@H]1c1ccccc1)C2 ZINC000539829626 1035885639 /nfs/dbraw/zinc/88/56/39/1035885639.db2.gz PUWYCCHLTAAPSH-SJLPKXTDSA-N 1 1 308.381 3.757 20 5 DHBDMO CC[N@@H+](CCc1ccccc1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485734793 1035921285 /nfs/dbraw/zinc/92/12/85/1035921285.db2.gz DREHZSQKCVSUCX-UHFFFAOYSA-N 1 1 314.385 3.668 20 5 DHBDMO C[C@]1(F)CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000539924827 1035936012 /nfs/dbraw/zinc/93/60/12/1035936012.db2.gz RJFWGEWMPLCECJ-INIZCTEOSA-N 1 1 304.321 3.789 20 5 DHBDMO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000539924827 1035936022 /nfs/dbraw/zinc/93/60/22/1035936022.db2.gz RJFWGEWMPLCECJ-INIZCTEOSA-N 1 1 304.321 3.789 20 5 DHBDMO COC(C)(C)C[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000539926649 1035936462 /nfs/dbraw/zinc/93/64/62/1035936462.db2.gz AQJHTQUUOAFDPU-UHFFFAOYSA-N 1 1 318.373 3.712 20 5 DHBDMO CC[C@@H]1C[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C[C@@H](CC)O1 ZINC001195298598 1036211807 /nfs/dbraw/zinc/21/18/07/1036211807.db2.gz FDEUJKBCDVNRCT-NUEKZKHPSA-N 1 1 306.406 3.854 20 5 DHBDMO Cc1noc(C[N@H+]2CC[C@@H]([C@H]3CCCC3(C)C)C2)c1[N+](=O)[O-] ZINC000595558957 1036234210 /nfs/dbraw/zinc/23/42/10/1036234210.db2.gz RMDKHNONOLJFMC-CHWSQXEVSA-N 1 1 307.394 3.539 20 5 DHBDMO CCc1noc(C)c1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000271801465 1036540093 /nfs/dbraw/zinc/54/00/93/1036540093.db2.gz PHINSRWRZCKTBU-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cscc1C ZINC000487173922 1036556215 /nfs/dbraw/zinc/55/62/15/1036556215.db2.gz WCQVFFRZUBRJBV-UHFFFAOYSA-N 1 1 306.387 3.653 20 5 DHBDMO CC(C)c1ccc(C[N@@H+]2CC[C@@H](C)C[C@@H]2[C@@H](C)O)cc1[N+](=O)[O-] ZINC000443774512 1036579072 /nfs/dbraw/zinc/57/90/72/1036579072.db2.gz AHNMELZSDZIONO-CKEIUWERSA-N 1 1 320.433 3.700 20 5 DHBDMO CC(C)[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774639745 1036605219 /nfs/dbraw/zinc/60/52/19/1036605219.db2.gz XYWXLUFFPIVTMP-LLVKDONJSA-N 1 1 322.796 3.533 20 5 DHBDMO CCOc1cc(C[NH2+][C@@H](CC)c2nccs2)ccc1[N+](=O)[O-] ZINC000491612398 1036615257 /nfs/dbraw/zinc/61/52/57/1036615257.db2.gz IWKNONYWCRAZEO-LBPRGKRZSA-N 1 1 321.402 3.691 20 5 DHBDMO C[C@H]([N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C1(C)CC1 ZINC000774638215 1036616407 /nfs/dbraw/zinc/61/64/07/1036616407.db2.gz QNIFRRIZSGKERI-JTQLQIEISA-N 1 1 322.796 3.676 20 5 DHBDMO CC(C)[N@@H+](CC1CC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000915207825 1036703807 /nfs/dbraw/zinc/70/38/07/1036703807.db2.gz GOTIHSAETUSSKK-UHFFFAOYSA-N 1 1 321.402 3.950 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](C3CCC3)CC2)cc1 ZINC001197202082 1036705731 /nfs/dbraw/zinc/70/57/31/1036705731.db2.gz LORFEQRAMPSWAC-YJBOKZPZSA-N 1 1 318.417 3.530 20 5 DHBDMO CC(C)(C)[C@@H]1CSCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC001197298246 1036728442 /nfs/dbraw/zinc/72/84/42/1036728442.db2.gz VPONWYWJEPLJQX-AWEZNQCLSA-N 1 1 312.410 3.697 20 5 DHBDMO CC(C)(C)[C@@H]1CSCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC001197298246 1036728462 /nfs/dbraw/zinc/72/84/62/1036728462.db2.gz VPONWYWJEPLJQX-AWEZNQCLSA-N 1 1 312.410 3.697 20 5 DHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cccc(CO)c1 ZINC000271957677 1036759775 /nfs/dbraw/zinc/75/97/75/1036759775.db2.gz LBEJJHLVPJWSQD-NSHDSACASA-N 1 1 320.776 3.591 20 5 DHBDMO CCC1(CC)CCC[N@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC001197515117 1036787547 /nfs/dbraw/zinc/78/75/47/1036787547.db2.gz YRJXCWHRQOFHFZ-UHFFFAOYSA-N 1 1 322.405 3.637 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@]12CCC[C@H]1OCC2 ZINC001184374124 1036826660 /nfs/dbraw/zinc/82/66/60/1036826660.db2.gz JSAHJKJAGDDGSB-HZPDHXFCSA-N 1 1 324.808 3.639 20 5 DHBDMO CCOc1cc(C[N@@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000492357061 1036844888 /nfs/dbraw/zinc/84/48/88/1036844888.db2.gz MBNGCTCIHLMLCP-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO CCOc1cc(C[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000492357061 1036844909 /nfs/dbraw/zinc/84/49/09/1036844909.db2.gz MBNGCTCIHLMLCP-UHFFFAOYSA-N 1 1 312.369 3.552 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1C[C@H]2C[C@@]2(c2ccccc2)C1 ZINC001197719766 1036855503 /nfs/dbraw/zinc/85/55/03/1036855503.db2.gz LXDKBSSFOWBKSG-QAPCUYQASA-N 1 1 312.344 3.507 20 5 DHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CCC[C@H]1C ZINC000487967898 1036887518 /nfs/dbraw/zinc/88/75/18/1036887518.db2.gz CAWMKWPJMPMOCK-CZUORRHYSA-N 1 1 306.406 3.540 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCOCC3(CCCC3)C2)ccc1Cl ZINC000775848038 1037019735 /nfs/dbraw/zinc/01/97/35/1037019735.db2.gz HCOPRQLDCQWLQQ-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCOCC3(CCCC3)C2)ccc1Cl ZINC000775848038 1037019748 /nfs/dbraw/zinc/01/97/48/1037019748.db2.gz HCOPRQLDCQWLQQ-UHFFFAOYSA-N 1 1 324.808 3.641 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000489179482 1037299142 /nfs/dbraw/zinc/29/91/42/1037299142.db2.gz ZIACYALUIWGJMC-MRXNPFEDSA-N 1 1 312.369 3.593 20 5 DHBDMO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nc2ccccc2n1C ZINC000193901292 1037306538 /nfs/dbraw/zinc/30/65/38/1037306538.db2.gz LGHLUBAKFWPDGB-STQMWFEESA-N 1 1 324.384 3.893 20 5 DHBDMO CCn1c2ccccc2nc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000326170648 1037401352 /nfs/dbraw/zinc/40/13/52/1037401352.db2.gz GYSUEEUBISFQES-UHFFFAOYSA-N 1 1 324.384 3.563 20 5 DHBDMO CCC[C@@H](NC1CC[NH+](C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000122841394 1037810775 /nfs/dbraw/zinc/81/07/75/1037810775.db2.gz SMYFPTYSXFNEJS-GOSISDBHSA-N 1 1 317.433 3.652 20 5 DHBDMO CCOc1cc(OCc2c(C)cc(C)[nH+]c2C)ccc1[N+](=O)[O-] ZINC001189288714 1038110088 /nfs/dbraw/zinc/11/00/88/1038110088.db2.gz HYOLUQOQZAKWRC-UHFFFAOYSA-N 1 1 316.357 3.893 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc3c[nH]nc32)C2CC2)cc1 ZINC000154258633 1038121031 /nfs/dbraw/zinc/12/10/31/1038121031.db2.gz KAFHMFQEIHNHQY-UHFFFAOYSA-N 1 1 322.368 3.636 20 5 DHBDMO CC[N@H+]1CCCC[C@@H]1CNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000589113898 1038434083 /nfs/dbraw/zinc/43/40/83/1038434083.db2.gz SNEBBEIPGLYSME-GFCCVEGCSA-N 1 1 313.348 3.819 20 5 DHBDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589187851 1038445145 /nfs/dbraw/zinc/44/51/45/1038445145.db2.gz ZYIXGJCOQUATNG-GPXGYGPYSA-N 1 1 318.417 3.624 20 5 DHBDMO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001191330133 1038491592 /nfs/dbraw/zinc/49/15/92/1038491592.db2.gz NHBAHBLHXQPNDT-LBPRGKRZSA-N 1 1 300.333 3.681 20 5 DHBDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001191330133 1038491597 /nfs/dbraw/zinc/49/15/97/1038491597.db2.gz NHBAHBLHXQPNDT-LBPRGKRZSA-N 1 1 300.333 3.681 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H]1C[C@H]1c1ccccc1)CCO2 ZINC000589521543 1038500066 /nfs/dbraw/zinc/50/00/66/1038500066.db2.gz FKXZXJHDGVBWRJ-QAPCUYQASA-N 1 1 324.380 3.593 20 5 DHBDMO COc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000572829765 1038504904 /nfs/dbraw/zinc/50/49/04/1038504904.db2.gz QMCTYMHHVAFQDY-UHFFFAOYSA-N 1 1 314.385 3.586 20 5 DHBDMO Cc1cc(CNc2ccc([N+](=O)[O-])s2)cc(N2CCCC2)[nH+]1 ZINC000589604347 1038517090 /nfs/dbraw/zinc/51/70/90/1038517090.db2.gz DVNLNXPIWJYHPZ-UHFFFAOYSA-N 1 1 318.402 3.572 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(O)c1Cl ZINC000590366528 1038632325 /nfs/dbraw/zinc/63/23/25/1038632325.db2.gz FHESURWMWJICKS-UHFFFAOYSA-N 1 1 320.776 3.628 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(O)c1Cl ZINC000590366528 1038632330 /nfs/dbraw/zinc/63/23/30/1038632330.db2.gz FHESURWMWJICKS-UHFFFAOYSA-N 1 1 320.776 3.628 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000598679542 1038821043 /nfs/dbraw/zinc/82/10/43/1038821043.db2.gz JCMARDANZCMLPJ-GFCCVEGCSA-N 1 1 318.348 3.902 20 5 DHBDMO Cc1nn(C[N@H+](C)C2CCC(C)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000761288023 1038868924 /nfs/dbraw/zinc/86/89/24/1038868924.db2.gz ICKRTGSKNYOIHY-UHFFFAOYSA-N 1 1 316.405 3.721 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2ccccc2C)CC1 ZINC000592138164 1039129533 /nfs/dbraw/zinc/12/95/33/1039129533.db2.gz VBUIJFORLXBHJC-UHFFFAOYSA-N 1 1 312.369 3.691 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000592140177 1039134381 /nfs/dbraw/zinc/13/43/81/1039134381.db2.gz NNLOFPASFWHBQZ-GOEBONIOSA-N 1 1 311.385 3.849 20 5 DHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCc1ccccc1 ZINC000603852141 1039186391 /nfs/dbraw/zinc/18/63/91/1039186391.db2.gz AWDVVLLKIVSJEE-UHFFFAOYSA-N 1 1 314.385 3.538 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cccc(C)c1 ZINC000603859882 1039194732 /nfs/dbraw/zinc/19/47/32/1039194732.db2.gz HEAZJYDMUNDGCK-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc(C)c1 ZINC000603859882 1039194737 /nfs/dbraw/zinc/19/47/37/1039194737.db2.gz HEAZJYDMUNDGCK-UHFFFAOYSA-N 1 1 300.358 3.544 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](c2cccc(C)c2)C(C)C)c1[N+](=O)[O-] ZINC000599630567 1039238902 /nfs/dbraw/zinc/23/89/02/1039238902.db2.gz SDABOVSOOWAWPN-OAHLLOKOSA-N 1 1 303.362 3.687 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2ccccc2)C2CC2)c1 ZINC000058563281 1039276517 /nfs/dbraw/zinc/27/65/17/1039276517.db2.gz LBZOPZOWUMFECX-UHFFFAOYSA-N 1 1 312.369 3.638 20 5 DHBDMO Cc1ccc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)cc1[N+](=O)[O-] ZINC000574143912 1039418255 /nfs/dbraw/zinc/41/82/55/1039418255.db2.gz DNGVZJDFHRTHGB-QGZVFWFLSA-N 1 1 318.417 3.827 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000593075208 1039445817 /nfs/dbraw/zinc/44/58/17/1039445817.db2.gz BCHFZEXFGFTGPA-UHFFFAOYSA-N 1 1 316.735 3.869 20 5 DHBDMO C[C@H](CNc1ccsc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000604432647 1039475463 /nfs/dbraw/zinc/47/54/63/1039475463.db2.gz JCXFFELDHRJCPT-GFCCVEGCSA-N 1 1 317.414 3.515 20 5 DHBDMO C[N@H+](CCOc1ccc(Cl)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000061779090 1039547386 /nfs/dbraw/zinc/54/73/86/1039547386.db2.gz OZLSBDCIHHHAFI-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO C[N@@H+](CCOc1ccc(Cl)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000061779090 1039547404 /nfs/dbraw/zinc/54/74/04/1039547404.db2.gz OZLSBDCIHHHAFI-UHFFFAOYSA-N 1 1 320.776 3.759 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](OC3CCC3)C2)c(Cl)c1 ZINC000594026365 1039951261 /nfs/dbraw/zinc/95/12/61/1039951261.db2.gz JYQUNKAOEWLZOW-HNNXBMFYSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](OC3CCC3)C2)c(Cl)c1 ZINC000594026365 1039951267 /nfs/dbraw/zinc/95/12/67/1039951267.db2.gz JYQUNKAOEWLZOW-HNNXBMFYSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594026481 1039953996 /nfs/dbraw/zinc/95/39/96/1039953996.db2.gz KJBNVDLABUWWLN-HNNXBMFYSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594026481 1039954008 /nfs/dbraw/zinc/95/40/08/1039954008.db2.gz KJBNVDLABUWWLN-HNNXBMFYSA-N 1 1 324.808 3.782 20 5 DHBDMO CC(C)[C@@H](O)[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000594991544 1040007660 /nfs/dbraw/zinc/00/76/60/1040007660.db2.gz JCGJSALVHWTXSN-HZPDHXFCSA-N 1 1 320.414 3.504 20 5 DHBDMO CCOc1ccc(C[N@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000595291966 1040090570 /nfs/dbraw/zinc/09/05/70/1040090570.db2.gz NOSBYNLBYYFOJS-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000595291966 1040090589 /nfs/dbraw/zinc/09/05/89/1040090589.db2.gz NOSBYNLBYYFOJS-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CC[C@@H](C)[N@H+](Cc1onc(C)c1[N+](=O)[O-])Cc1ccccc1 ZINC000595286499 1040095491 /nfs/dbraw/zinc/09/54/91/1040095491.db2.gz JMTRJIJAUAFSFZ-GFCCVEGCSA-N 1 1 303.362 3.692 20 5 DHBDMO CC[C@@H](C)[N@@H+](Cc1onc(C)c1[N+](=O)[O-])Cc1ccccc1 ZINC000595286499 1040095505 /nfs/dbraw/zinc/09/55/05/1040095505.db2.gz JMTRJIJAUAFSFZ-GFCCVEGCSA-N 1 1 303.362 3.692 20 5 DHBDMO CC[C@H](Cc1ccccc1)[N@@H+](CC)Cc1onc(C)c1[N+](=O)[O-] ZINC000595345181 1040104440 /nfs/dbraw/zinc/10/44/40/1040104440.db2.gz PVSNSAXXIFCIIQ-OAHLLOKOSA-N 1 1 317.389 3.734 20 5 DHBDMO Cc1noc(C[N@@H+]2CCc3ccccc3[C@H]2C(C)C)c1[N+](=O)[O-] ZINC000595345057 1040104548 /nfs/dbraw/zinc/10/45/48/1040104548.db2.gz LGJZFYMEELMWJG-MRXNPFEDSA-N 1 1 315.373 3.647 20 5 DHBDMO Cc1noc(C[N@H+]2CCc3ccccc3[C@H]2C(C)C)c1[N+](=O)[O-] ZINC000595345057 1040104554 /nfs/dbraw/zinc/10/45/54/1040104554.db2.gz LGJZFYMEELMWJG-MRXNPFEDSA-N 1 1 315.373 3.647 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@H](c3ccccc3C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000595323569 1040107242 /nfs/dbraw/zinc/10/72/42/1040107242.db2.gz ZKJKAIRKRVOLBB-GXTWGEPZSA-N 1 1 315.373 3.578 20 5 DHBDMO Cc1noc(C[N@@H+]2CCCC[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595323818 1040107548 /nfs/dbraw/zinc/10/75/48/1040107548.db2.gz AGDRXAHXELUFES-OAHLLOKOSA-N 1 1 315.373 3.927 20 5 DHBDMO Cc1noc(C[N@H+]2CCCC[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595323818 1040107557 /nfs/dbraw/zinc/10/75/57/1040107557.db2.gz AGDRXAHXELUFES-OAHLLOKOSA-N 1 1 315.373 3.927 20 5 DHBDMO Cc1noc(C[N@H+]2CCCC3(C2)CCCCCC3)c1[N+](=O)[O-] ZINC000595324677 1040107991 /nfs/dbraw/zinc/10/79/91/1040107991.db2.gz FQWRNZRPOMJAOA-UHFFFAOYSA-N 1 1 307.394 3.828 20 5 DHBDMO Cc1cccnc1[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])C(C)C ZINC000595373206 1040127994 /nfs/dbraw/zinc/12/79/94/1040127994.db2.gz YLGGVXZXJINWSJ-INIZCTEOSA-N 1 1 317.364 3.924 20 5 DHBDMO Cc1noc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000595432532 1040136768 /nfs/dbraw/zinc/13/67/68/1040136768.db2.gz WMCHXWVUXWZGRN-FEAKQIBJSA-N 1 1 313.357 3.569 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000595432532 1040136775 /nfs/dbraw/zinc/13/67/75/1040136775.db2.gz WMCHXWVUXWZGRN-FEAKQIBJSA-N 1 1 313.357 3.569 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595453236 1040143984 /nfs/dbraw/zinc/14/39/84/1040143984.db2.gz DWYJZGHFVQPFEL-LBPRGKRZSA-N 1 1 320.286 3.897 20 5 DHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595453236 1040143998 /nfs/dbraw/zinc/14/39/98/1040143998.db2.gz DWYJZGHFVQPFEL-LBPRGKRZSA-N 1 1 320.286 3.897 20 5 DHBDMO Cc1noc(C[N@@H+]2C[C@@H](c3ccc(C)cc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000595479630 1040149136 /nfs/dbraw/zinc/14/91/36/1040149136.db2.gz GAVFXZPOIFXNLC-WFASDCNBSA-N 1 1 315.373 3.578 20 5 DHBDMO Cc1noc(C[N@@H+]2CC(C)(C)C[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595554055 1040173040 /nfs/dbraw/zinc/17/30/40/1040173040.db2.gz QWRIOHMOSWXBFX-CQSZACIVSA-N 1 1 315.373 3.864 20 5 DHBDMO Cc1noc(C[N@H+]2CC(C)(C)C[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595554055 1040173048 /nfs/dbraw/zinc/17/30/48/1040173048.db2.gz QWRIOHMOSWXBFX-CQSZACIVSA-N 1 1 315.373 3.864 20 5 DHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(c2ccco2)CC1 ZINC000595615984 1040208081 /nfs/dbraw/zinc/20/80/81/1040208081.db2.gz OZHOSUSKDBOWEW-UHFFFAOYSA-N 1 1 304.321 3.707 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@H](CCF)C2)ccc1[N+](=O)[O-] ZINC000595755506 1040244190 /nfs/dbraw/zinc/24/41/90/1040244190.db2.gz NBZDOLPQUZSMEP-CYBMUJFWSA-N 1 1 310.369 3.565 20 5 DHBDMO C[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000596145102 1040315572 /nfs/dbraw/zinc/31/55/72/1040315572.db2.gz GMIBBVQYXOIXSF-ONGXEEELSA-N 1 1 317.311 3.508 20 5 DHBDMO Cc1ncc(-c2ccc(C[N@@H+]3CCC[C@H]3C)cc2)cc1[N+](=O)[O-] ZINC000596631664 1040528881 /nfs/dbraw/zinc/52/88/81/1040528881.db2.gz XBTYSANMDWKNQZ-CYBMUJFWSA-N 1 1 311.385 3.950 20 5 DHBDMO CCCn1nccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000596980043 1040615243 /nfs/dbraw/zinc/61/52/43/1040615243.db2.gz SWCQZDBOWIMBKV-UHFFFAOYSA-N 1 1 316.405 3.612 20 5 DHBDMO CCCn1nccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000596980043 1040615246 /nfs/dbraw/zinc/61/52/46/1040615246.db2.gz SWCQZDBOWIMBKV-UHFFFAOYSA-N 1 1 316.405 3.612 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)cc1[N+](=O)[O-] ZINC000597224009 1040703262 /nfs/dbraw/zinc/70/32/62/1040703262.db2.gz ARRNSUAXFAXBFG-AEFFLSMTSA-N 1 1 318.417 3.684 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cs1 ZINC000075831507 1040827350 /nfs/dbraw/zinc/82/73/50/1040827350.db2.gz RQIOJKPXYJMVFL-AWEZNQCLSA-N 1 1 310.419 3.580 20 5 DHBDMO C[C@@H](NCC(C)(C)[NH+]1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000152686639 1040923417 /nfs/dbraw/zinc/92/34/17/1040923417.db2.gz ITXGUONEPPCDGJ-CQSZACIVSA-N 1 1 305.422 3.510 20 5 DHBDMO C[C@H](NCC(C)(C)[NH+]1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000152686575 1040923513 /nfs/dbraw/zinc/92/35/13/1040923513.db2.gz ITXGUONEPPCDGJ-AWEZNQCLSA-N 1 1 305.422 3.510 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000491230650 1040970504 /nfs/dbraw/zinc/97/05/04/1040970504.db2.gz YLYPFSOFYIWUFO-CYBMUJFWSA-N 1 1 318.323 3.863 20 5 DHBDMO CCc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000602513284 1041081216 /nfs/dbraw/zinc/08/12/16/1041081216.db2.gz BMLCYXAGRHSCJR-UHFFFAOYSA-N 1 1 317.370 3.650 20 5 DHBDMO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1nc3cc([N+](=O)[O-])ccc3o1)CC2 ZINC000602540362 1041083494 /nfs/dbraw/zinc/08/34/94/1041083494.db2.gz MOEKWAUOMAEIDJ-HNNXBMFYSA-N 1 1 323.352 3.822 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC4(CCC4)[C@@H]3C3CC3)nc2c1 ZINC000602667240 1041150364 /nfs/dbraw/zinc/15/03/64/1041150364.db2.gz OXOVEASWAFRPQR-INIZCTEOSA-N 1 1 313.357 3.501 20 5 DHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC4(CCC4)[C@@H]3C3CC3)nc2c1 ZINC000602667240 1041150368 /nfs/dbraw/zinc/15/03/68/1041150368.db2.gz OXOVEASWAFRPQR-INIZCTEOSA-N 1 1 313.357 3.501 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@H](c3cccnc3)C2)cccc1[N+](=O)[O-] ZINC000602851627 1041260054 /nfs/dbraw/zinc/26/00/54/1041260054.db2.gz BAPSMPQYJZDLAD-QGZVFWFLSA-N 1 1 311.385 3.678 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2cccnc2)C1 ZINC000602852127 1041262098 /nfs/dbraw/zinc/26/20/98/1041262098.db2.gz CPMDOLVEWLGXOS-GOEBONIOSA-N 1 1 311.385 3.930 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cc3cnccc3o2)C2CC2)c1 ZINC000593565158 1041329095 /nfs/dbraw/zinc/32/90/95/1041329095.db2.gz BITFZZWZDWPFNC-UHFFFAOYSA-N 1 1 323.352 3.901 20 5 DHBDMO COc1ccccc1C[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000016419950 182043790 /nfs/dbraw/zinc/04/37/90/182043790.db2.gz VXFNCNBELNZOOE-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO COc1ccccc1C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000016419950 182043792 /nfs/dbraw/zinc/04/37/92/182043792.db2.gz VXFNCNBELNZOOE-CYBMUJFWSA-N 1 1 300.358 3.796 20 5 DHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1CCC1 ZINC000353809786 335095228 /nfs/dbraw/zinc/09/52/28/335095228.db2.gz CIDYNNNSJIQYAQ-UHFFFAOYSA-N 1 1 300.305 3.571 20 5 DHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cn3ccccc3n2)cc1[N+](=O)[O-] ZINC000559918135 332292685 /nfs/dbraw/zinc/29/26/85/332292685.db2.gz RSZINSUYMFYSHX-ZIAGYGMSSA-N 1 1 324.384 3.963 20 5 DHBDMO CC[C@H](NC[C@H](CC(C)C)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000314060734 333084977 /nfs/dbraw/zinc/08/49/77/333084977.db2.gz AIGKPSLLIJXROF-IRXDYDNUSA-N 1 1 307.438 3.612 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCc1nccs1 ZINC000182929971 333181544 /nfs/dbraw/zinc/18/15/44/333181544.db2.gz AXVIFQHKYUZQHB-GFCCVEGCSA-N 1 1 305.403 3.595 20 5 DHBDMO Cc1cc(F)ccc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000488113931 333362627 /nfs/dbraw/zinc/36/26/27/333362627.db2.gz UUXSYSLCIUDOLJ-UHFFFAOYSA-N 1 1 302.349 3.983 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000526063205 333390273 /nfs/dbraw/zinc/39/02/73/333390273.db2.gz QDAXVEIQMDNKKN-IONAJQSGSA-N 1 1 306.431 3.824 20 5 DHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000571018716 333479719 /nfs/dbraw/zinc/47/97/19/333479719.db2.gz XLNDOROPRPLACI-QWHCGFSZSA-N 1 1 302.378 3.531 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)CCSC ZINC000353832215 335155272 /nfs/dbraw/zinc/15/52/72/335155272.db2.gz XBAODHWOSMDTMX-GFCCVEGCSA-N 1 1 312.435 3.567 20 5 DHBDMO CCCCCC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272498647 334035587 /nfs/dbraw/zinc/03/55/87/334035587.db2.gz GHXVOFJLAGURTC-MRXNPFEDSA-N 1 1 316.405 3.588 20 5 DHBDMO CC(C)([NH2+]Cc1cccc(F)c1F)c1ccccc1[N+](=O)[O-] ZINC000291748435 334181508 /nfs/dbraw/zinc/18/15/08/334181508.db2.gz PVSOLUSVIGFGAV-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO C[C@@H]1CCCC[C@@H]1OCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000534509757 334279438 /nfs/dbraw/zinc/27/94/38/334279438.db2.gz NLOSPLIWFGEJLX-KDOFPFPSSA-N 1 1 318.417 3.548 20 5 DHBDMO C[C@@H]1CCCC[C@@H]1OCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000534509757 334279439 /nfs/dbraw/zinc/27/94/39/334279439.db2.gz NLOSPLIWFGEJLX-KDOFPFPSSA-N 1 1 318.417 3.548 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccccc2Br)c1 ZINC000048819766 334301290 /nfs/dbraw/zinc/30/12/90/334301290.db2.gz OJOSVRHZCDNIJC-UHFFFAOYSA-N 1 1 321.174 3.647 20 5 DHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534841854 334339480 /nfs/dbraw/zinc/33/94/80/334339480.db2.gz GAINNTTUHMWVAK-SWLSCSKDSA-N 1 1 315.373 3.870 20 5 DHBDMO CC(C)[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)CC1CC1 ZINC000535072702 334364483 /nfs/dbraw/zinc/36/44/83/334364483.db2.gz XPFGYAFQXURUEP-UHFFFAOYSA-N 1 1 314.332 3.817 20 5 DHBDMO CCc1nc(C)c(C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)o1 ZINC000291983111 334908046 /nfs/dbraw/zinc/90/80/46/334908046.db2.gz VQLDEOIZDQVWKA-CQSZACIVSA-N 1 1 303.362 3.695 20 5 DHBDMO CCc1cnc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000344089414 335217035 /nfs/dbraw/zinc/21/70/35/335217035.db2.gz IZRJIIPRZVBMRD-UHFFFAOYSA-N 1 1 305.403 3.639 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)N[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000344133037 335220259 /nfs/dbraw/zinc/22/02/59/335220259.db2.gz YADMWVFXOLYFSB-PBHICJAKSA-N 1 1 307.438 3.756 20 5 DHBDMO CCCCN(C)C[C@@H](C)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000344133037 335220261 /nfs/dbraw/zinc/22/02/61/335220261.db2.gz YADMWVFXOLYFSB-PBHICJAKSA-N 1 1 307.438 3.756 20 5 DHBDMO CCCC[N@@H+](C)C[C@@H](C)N[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000344133038 335220445 /nfs/dbraw/zinc/22/04/45/335220445.db2.gz YADMWVFXOLYFSB-RHSMWYFYSA-N 1 1 307.438 3.756 20 5 DHBDMO CCCCN(C)C[C@@H](C)[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000344133038 335220446 /nfs/dbraw/zinc/22/04/46/335220446.db2.gz YADMWVFXOLYFSB-RHSMWYFYSA-N 1 1 307.438 3.756 20 5 DHBDMO C[C@@H](C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000346244790 335393998 /nfs/dbraw/zinc/39/39/98/335393998.db2.gz CLGXYRZNAVMVEP-VGVVRCBHSA-N 1 1 317.414 3.800 20 5 DHBDMO COCC[C@H]1CCCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000332338740 336169199 /nfs/dbraw/zinc/16/91/99/336169199.db2.gz QMVVWIOVHSQNFN-HUUCEWRRSA-N 1 1 306.406 3.794 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nccs1 ZINC000192839810 336265417 /nfs/dbraw/zinc/26/54/17/336265417.db2.gz ZEJFJKRHCITEIE-IINYFYTJSA-N 1 1 303.387 3.780 20 5 DHBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@@H]1CCCCO1 ZINC000532714505 336268031 /nfs/dbraw/zinc/26/80/31/336268031.db2.gz OYNKIFQZMULRSI-INIZCTEOSA-N 1 1 306.406 3.684 20 5 DHBDMO CCC[C@@H]([NH2+]C1CCN(C(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000192950589 336285843 /nfs/dbraw/zinc/28/58/43/336285843.db2.gz KOKKACHJHREXPW-GOSISDBHSA-N 1 1 319.449 3.898 20 5 DHBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000301102861 336290168 /nfs/dbraw/zinc/29/01/68/336290168.db2.gz OQCPOJDYKMLYFM-LBPRGKRZSA-N 1 1 311.813 3.781 20 5 DHBDMO CC[N@@H+](C)Cc1cccc(CNc2sccc2[N+](=O)[O-])c1 ZINC000301930137 336338515 /nfs/dbraw/zinc/33/85/15/336338515.db2.gz KHLJLFFODAEWQX-UHFFFAOYSA-N 1 1 305.403 3.720 20 5 DHBDMO C[C@@H](CNc1sccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000301984232 336341384 /nfs/dbraw/zinc/34/13/84/336341384.db2.gz CBYLXDIDPVCQIK-LBPRGKRZSA-N 1 1 305.403 3.589 20 5 DHBDMO C[C@H](Nc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302049791 336345599 /nfs/dbraw/zinc/34/55/99/336345599.db2.gz NFFKEHMOOAXYHN-KBPBESRZSA-N 1 1 303.406 3.660 20 5 DHBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000359632297 336681085 /nfs/dbraw/zinc/68/10/85/336681085.db2.gz BBTSUQTVKSPHGV-JTQLQIEISA-N 1 1 321.764 3.503 20 5 DHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000376624245 337038416 /nfs/dbraw/zinc/03/84/16/337038416.db2.gz XQPOOMILBHQRMK-CQSZACIVSA-N 1 1 322.368 3.631 20 5 DHBDMO CCc1cc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)on1 ZINC000582655668 337121373 /nfs/dbraw/zinc/12/13/73/337121373.db2.gz XQBWKZJFBGDBPI-KRWDZBQOSA-N 1 1 315.373 3.703 20 5 DHBDMO Cc1c(C[NH2+][C@@H](C)c2ccncc2Cl)cccc1[N+](=O)[O-] ZINC000421835651 337652158 /nfs/dbraw/zinc/65/21/58/337652158.db2.gz FKOQZSVLRFEKGV-NSHDSACASA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@@H](c1ccco1)[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000086233154 338013692 /nfs/dbraw/zinc/01/36/92/338013692.db2.gz SEQQIQNXOPASKU-ZDUSSCGKSA-N 1 1 316.357 3.792 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000426456834 338032675 /nfs/dbraw/zinc/03/26/75/338032675.db2.gz FISJWOTWGLFNIG-CZUORRHYSA-N 1 1 304.390 3.756 20 5 DHBDMO C[C@]12CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000428716015 338059324 /nfs/dbraw/zinc/05/93/24/338059324.db2.gz ZMOVPAGTRLQILZ-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@]12CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000428716015 338059325 /nfs/dbraw/zinc/05/93/25/338059325.db2.gz ZMOVPAGTRLQILZ-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@]12CC[N@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000428728576 338059731 /nfs/dbraw/zinc/05/97/31/338059731.db2.gz LFAKIUZKLDEIIQ-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@]12CC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000428728576 338059732 /nfs/dbraw/zinc/05/97/32/338059732.db2.gz LFAKIUZKLDEIIQ-OLZOCXBDSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429116013 338071005 /nfs/dbraw/zinc/07/10/05/338071005.db2.gz PTZNSPFJBHNFPP-KGLIPLIRSA-N 1 1 312.369 3.939 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429116013 338071006 /nfs/dbraw/zinc/07/10/06/338071006.db2.gz PTZNSPFJBHNFPP-KGLIPLIRSA-N 1 1 312.369 3.939 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000430226569 338102130 /nfs/dbraw/zinc/10/21/30/338102130.db2.gz OXUIXRRVRNAKDL-HNNXBMFYSA-N 1 1 312.369 3.593 20 5 DHBDMO C[N@@H+](CCSc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000432915080 338172780 /nfs/dbraw/zinc/17/27/80/338172780.db2.gz FVJMEEQOURMEKA-UHFFFAOYSA-N 1 1 302.399 3.819 20 5 DHBDMO C[N@@H+](CCSCc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000433019266 338176609 /nfs/dbraw/zinc/17/66/09/338176609.db2.gz JAKKFVKCYLGYRF-UHFFFAOYSA-N 1 1 316.426 3.960 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCN(C)c2ccccc2C1 ZINC000436102913 338258363 /nfs/dbraw/zinc/25/83/63/338258363.db2.gz RTUWQRBWXMNOKS-AWEZNQCLSA-N 1 1 311.385 3.608 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)cc1 ZINC000449220727 338603602 /nfs/dbraw/zinc/60/36/02/338603602.db2.gz RBLIHMCREZFVQT-CYBMUJFWSA-N 1 1 322.286 3.789 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c(F)c1 ZINC000194620054 338647830 /nfs/dbraw/zinc/64/78/30/338647830.db2.gz VIDPYNSRWSPYBA-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1ncccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000453369011 338832966 /nfs/dbraw/zinc/83/29/66/338832966.db2.gz PPSSCOCYNMIXDC-OAHLLOKOSA-N 1 1 315.373 3.629 20 5 DHBDMO Cc1ccc(C[NH2+][C@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000459644335 339040078 /nfs/dbraw/zinc/04/00/78/339040078.db2.gz DXHDLVGFFWLJMD-LLVKDONJSA-N 1 1 317.414 3.699 20 5 DHBDMO Cc1cn2cc(Nc3cc(C)c([N+](=O)[O-])cc3F)ccc2[nH+]1 ZINC000461942982 339069338 /nfs/dbraw/zinc/06/93/38/339069338.db2.gz FGZHGVONYQYNMN-UHFFFAOYSA-N 1 1 300.293 3.742 20 5 DHBDMO COc1ccc([N+](=O)[O-])c(NCCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000462788164 339088578 /nfs/dbraw/zinc/08/85/78/339088578.db2.gz GGCKCPMIUOZHKW-CQSZACIVSA-N 1 1 321.421 3.670 20 5 DHBDMO COc1cc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000463470909 339118998 /nfs/dbraw/zinc/11/89/98/339118998.db2.gz UEMSHJCDWYVCBR-WFASDCNBSA-N 1 1 322.380 3.897 20 5 DHBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])C1CCCCC1 ZINC000463495421 339119562 /nfs/dbraw/zinc/11/95/62/339119562.db2.gz ZLDVTMLQDIDBGO-UHFFFAOYSA-N 1 1 310.369 3.897 20 5 DHBDMO COc1cc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000464482906 339143119 /nfs/dbraw/zinc/14/31/19/339143119.db2.gz BIJGWMBBNSXDRA-GFCCVEGCSA-N 1 1 310.369 3.611 20 5 DHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464772982 339152422 /nfs/dbraw/zinc/15/24/22/339152422.db2.gz KBLWHFQBFBNGSD-HOTGVXAUSA-N 1 1 308.447 3.743 20 5 DHBDMO CO[C@H]1C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC[C@H]1C ZINC000467386258 339236019 /nfs/dbraw/zinc/23/60/19/339236019.db2.gz UWHIITPQOGRUDO-DYVFJYSZSA-N 1 1 306.406 3.575 20 5 DHBDMO CC[C@@H]1CCCC[N@H+]1CCN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467867203 339248213 /nfs/dbraw/zinc/24/82/13/339248213.db2.gz KXEMBDQYWHGLSG-GDBMZVCRSA-N 1 1 305.422 3.510 20 5 DHBDMO CC[C@@H]1CCCCN1CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467867203 339248214 /nfs/dbraw/zinc/24/82/14/339248214.db2.gz KXEMBDQYWHGLSG-GDBMZVCRSA-N 1 1 305.422 3.510 20 5 DHBDMO COCC[C@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000468690462 339268780 /nfs/dbraw/zinc/26/87/80/339268780.db2.gz PPGFWDRXUWURRX-OAHLLOKOSA-N 1 1 306.406 3.542 20 5 DHBDMO CC(C)C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000468948232 339275565 /nfs/dbraw/zinc/27/55/65/339275565.db2.gz LHOBGNLBOOJTKH-ZDUSSCGKSA-N 1 1 317.389 3.994 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCc1nccs1 ZINC000470175706 339312874 /nfs/dbraw/zinc/31/28/74/339312874.db2.gz RRCADOXNYDLJDG-RAXLEYEMSA-N 1 1 317.414 3.629 20 5 DHBDMO COC1CCC([N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000470173776 339312894 /nfs/dbraw/zinc/31/28/94/339312894.db2.gz FJORQVTZZKDCFX-SDNWHVSQSA-N 1 1 318.417 3.888 20 5 DHBDMO CCOC[C@H]1CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000470174961 339312907 /nfs/dbraw/zinc/31/29/07/339312907.db2.gz OIAINSPEFDPKPC-MJSCBBHESA-N 1 1 318.417 3.747 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000470949218 339332336 /nfs/dbraw/zinc/33/23/36/339332336.db2.gz WBPZSNDJOSTFHS-NRUUGDAUSA-N 1 1 302.296 3.929 20 5 DHBDMO C[N@@H+](CCCCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000471803296 339354609 /nfs/dbraw/zinc/35/46/09/339354609.db2.gz GRCNTDUDAHVXFT-UHFFFAOYSA-N 1 1 320.414 3.528 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000502058092 340094327 /nfs/dbraw/zinc/09/43/27/340094327.db2.gz YLLLGBLZATVZLG-MNOVXSKESA-N 1 1 317.414 3.952 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]C1(C(F)F)CC1 ZINC000503928882 340137275 /nfs/dbraw/zinc/13/72/75/340137275.db2.gz UQMYDVBBJQZFOH-YPMHNXCESA-N 1 1 310.344 3.693 20 5 DHBDMO CC(C)[N@@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000506772004 340201386 /nfs/dbraw/zinc/20/13/86/340201386.db2.gz MGWSORFODNAGKU-UHFFFAOYSA-N 1 1 320.414 3.526 20 5 DHBDMO CCc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000507154988 340209901 /nfs/dbraw/zinc/20/99/01/340209901.db2.gz MLBVSVAUTDECRQ-UHFFFAOYSA-N 1 1 300.358 3.915 20 5 DHBDMO CCc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000507154988 340209902 /nfs/dbraw/zinc/20/99/02/340209902.db2.gz MLBVSVAUTDECRQ-UHFFFAOYSA-N 1 1 300.358 3.915 20 5 DHBDMO CC[C@@H]1C[C@@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCO1 ZINC000507790119 340231584 /nfs/dbraw/zinc/23/15/84/340231584.db2.gz ABTPLEYQSFSZMS-MAUKXSAKSA-N 1 1 318.417 3.764 20 5 DHBDMO Cc1c(C[N@@H+]2CCc3cc(F)ccc3C2)cccc1[N+](=O)[O-] ZINC000509453889 340270077 /nfs/dbraw/zinc/27/00/77/340270077.db2.gz QNEFKJLDGDOHTL-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1c(C[N@H+]2CCc3cc(F)ccc3C2)cccc1[N+](=O)[O-] ZINC000509453889 340270078 /nfs/dbraw/zinc/27/00/78/340270078.db2.gz QNEFKJLDGDOHTL-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@]3(CC=CCC3)C2)cc1 ZINC000512164864 340350457 /nfs/dbraw/zinc/35/04/57/340350457.db2.gz NTPCGGDOYUIATD-SFHVURJKSA-N 1 1 316.401 3.796 20 5 DHBDMO CCOCC[N@@H+](CC)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000512250967 340354253 /nfs/dbraw/zinc/35/42/53/340354253.db2.gz FIIDRXZKYPKOKC-UHFFFAOYSA-N 1 1 318.373 3.713 20 5 DHBDMO COCCC[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000512284953 340355420 /nfs/dbraw/zinc/35/54/20/340355420.db2.gz DVJUQRZIIDPLKJ-UHFFFAOYSA-N 1 1 320.414 3.792 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1ccccc1O ZINC000543251264 341038395 /nfs/dbraw/zinc/03/83/95/341038395.db2.gz YWZVWEWRJPBTDN-ZDUSSCGKSA-N 1 1 300.358 3.536 20 5 DHBDMO CCC[C@@H](NC[C@@H](C)[N@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000130989328 341055733 /nfs/dbraw/zinc/05/57/33/341055733.db2.gz FQQSYOPEULHBMI-CXAGYDPISA-N 1 1 305.422 3.508 20 5 DHBDMO CCC[C@@H](NC[C@@H](C)[N@@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000130989328 341055734 /nfs/dbraw/zinc/05/57/34/341055734.db2.gz FQQSYOPEULHBMI-CXAGYDPISA-N 1 1 305.422 3.508 20 5 DHBDMO CC[N@@H+](Cc1cccs1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000076458573 341207801 /nfs/dbraw/zinc/20/78/01/341207801.db2.gz UQEPZEAYCLWRNX-UHFFFAOYSA-N 1 1 306.387 3.687 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000548508514 341265028 /nfs/dbraw/zinc/26/50/28/341265028.db2.gz JIPODKRWNVFSGX-XHBSWPGZSA-N 1 1 314.389 3.624 20 5 DHBDMO COc1cccc([C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549172129 341287947 /nfs/dbraw/zinc/28/79/47/341287947.db2.gz RJBPRYONHXADCN-AWEZNQCLSA-N 1 1 314.385 3.839 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000245383755 341290179 /nfs/dbraw/zinc/29/01/79/341290179.db2.gz RHNORRUFCPBXTA-RHSMWYFYSA-N 1 1 311.385 3.842 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000245516659 341298776 /nfs/dbraw/zinc/29/87/76/341298776.db2.gz FZQDLUUTFKHVGV-DAYGRLMNSA-N 1 1 318.417 3.591 20 5 DHBDMO CCC[N@@H+](C)C[C@@H]1CCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245520976 341299754 /nfs/dbraw/zinc/29/97/54/341299754.db2.gz KBKXAQKJQUWKOD-CVEARBPZSA-N 1 1 319.449 3.628 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000550063119 341309302 /nfs/dbraw/zinc/30/93/02/341309302.db2.gz GGPUTEGRWGOJLK-MAUKXSAKSA-N 1 1 320.433 3.695 20 5 DHBDMO CCOc1cc(C[N@H+]2CC[C@@H](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000550409484 341316461 /nfs/dbraw/zinc/31/64/61/341316461.db2.gz JRMXUJLFNBCFLC-HNNXBMFYSA-N 1 1 304.390 3.616 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000245930589 341318684 /nfs/dbraw/zinc/31/86/84/341318684.db2.gz PEJYWBCYMGZTIS-CHWSQXEVSA-N 1 1 315.373 3.728 20 5 DHBDMO Cc1cnc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000192905412 341897156 /nfs/dbraw/zinc/89/71/56/341897156.db2.gz LFVXVTUUGPEWOI-AWEZNQCLSA-N 1 1 303.387 3.527 20 5 DHBDMO CCCC[N@@H+](CC)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000131855330 520482022 /nfs/dbraw/zinc/48/20/22/520482022.db2.gz VAEIUGYKBCSUEF-LBPRGKRZSA-N 1 1 318.377 3.828 20 5 DHBDMO COC1(CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000339046026 522587375 /nfs/dbraw/zinc/58/73/75/522587375.db2.gz ZGAVSHFTYIEPSO-UHFFFAOYSA-N 1 1 304.390 3.518 20 5 DHBDMO CC[C@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000156479801 522710640 /nfs/dbraw/zinc/71/06/40/522710640.db2.gz JQJYVTYONVMFLK-HOTGVXAUSA-N 1 1 318.373 3.925 20 5 DHBDMO C[C@H]1CCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000124289603 524122355 /nfs/dbraw/zinc/12/23/55/524122355.db2.gz CMTQVPUHGJHWAY-NSHDSACASA-N 1 1 303.387 3.703 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H]1c1cnn(C)c1 ZINC000182745005 526089989 /nfs/dbraw/zinc/08/99/89/526089989.db2.gz XPAQCXRGYUEYEQ-CXAGYDPISA-N 1 1 314.389 3.535 20 5 DHBDMO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000180806757 526118772 /nfs/dbraw/zinc/11/87/72/526118772.db2.gz GPSVFMKLSYMLCV-NSHDSACASA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000180806757 526118785 /nfs/dbraw/zinc/11/87/85/526118785.db2.gz GPSVFMKLSYMLCV-NSHDSACASA-N 1 1 305.765 3.836 20 5 DHBDMO C[C@@H]1CCC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000725263952 563570337 /nfs/dbraw/zinc/57/03/37/563570337.db2.gz WVUJFLWYTFOYAJ-SNVBAGLBSA-N 1 1 313.195 3.589 20 5 DHBDMO C[C@@H]1CCC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000725263952 563570339 /nfs/dbraw/zinc/57/03/39/563570339.db2.gz WVUJFLWYTFOYAJ-SNVBAGLBSA-N 1 1 313.195 3.589 20 5 DHBDMO C[C@H]1CCCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000725263790 563570401 /nfs/dbraw/zinc/57/04/01/563570401.db2.gz IQQMASWPRWGUCG-JTQLQIEISA-N 1 1 313.195 3.732 20 5 DHBDMO C[C@H]1CCCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000725263790 563570403 /nfs/dbraw/zinc/57/04/03/563570403.db2.gz IQQMASWPRWGUCG-JTQLQIEISA-N 1 1 313.195 3.732 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)c(Cl)c1 ZINC000517736055 1013054121 /nfs/dbraw/zinc/05/41/21/1013054121.db2.gz FPRJVBYVXZNZBD-CJNGLKHVSA-N 1 1 324.808 3.639 20 5 DHBDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000109780987 1013749374 /nfs/dbraw/zinc/74/93/74/1013749374.db2.gz OGNVQVUITJQIIJ-ZDUSSCGKSA-N 1 1 300.358 3.536 20 5 DHBDMO C[N@H+]1Cc2ccccc2[C@@H](Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000536023074 1013889269 /nfs/dbraw/zinc/88/92/69/1013889269.db2.gz LNSXWSCMIBEYHZ-INIZCTEOSA-N 1 1 317.776 3.847 20 5 DHBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000536023074 1013889274 /nfs/dbraw/zinc/88/92/74/1013889274.db2.gz LNSXWSCMIBEYHZ-INIZCTEOSA-N 1 1 317.776 3.847 20 5 DHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]3CCC[C@@H]32)cc1 ZINC000441444734 1013884049 /nfs/dbraw/zinc/88/40/49/1013884049.db2.gz HLBKOJPJUIIWPR-YOEHRIQHSA-N 1 1 304.390 3.628 20 5 DHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000441464278 1014167661 /nfs/dbraw/zinc/16/76/61/1014167661.db2.gz AIVCFAACSYKGRX-CPUCHLNUSA-N 1 1 304.390 3.627 20 5 DHBDMO CC(C)[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC001167424526 1014256456 /nfs/dbraw/zinc/25/64/56/1014256456.db2.gz KZNILSSWQWIYDI-HNNXBMFYSA-N 1 1 306.406 3.732 20 5 DHBDMO C[C@@H](O)[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000581135392 1014585812 /nfs/dbraw/zinc/58/58/12/1014585812.db2.gz GPPQHIRADVOBMJ-XWCIJXRUSA-N 1 1 318.348 3.507 20 5 DHBDMO C[C@@H](c1nc(-c2ccc([N+](=O)[O-])cc2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276240137 1014893423 /nfs/dbraw/zinc/89/34/23/1014893423.db2.gz UMPTYEFOZJGVDI-TUAOUCFPSA-N 1 1 316.361 3.579 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])s2)C[N@H+]1Cc1ccccc1 ZINC000610709513 1014896848 /nfs/dbraw/zinc/89/68/48/1014896848.db2.gz VDWRHFMMYWTTLC-TZMCWYRMSA-N 1 1 317.414 3.731 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000610701506 1014897255 /nfs/dbraw/zinc/89/72/55/1014897255.db2.gz UACREPMGFHGXRZ-GFCCVEGCSA-N 1 1 322.368 3.632 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895583627 1015212024 /nfs/dbraw/zinc/21/20/24/1015212024.db2.gz MISGIMWXPGNWIP-LYKUJDHUSA-N 1 1 315.398 3.554 20 5 DHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)cc1[N+](=O)[O-] ZINC000895846879 1015331540 /nfs/dbraw/zinc/33/15/40/1015331540.db2.gz RJLMQVJIJLEKQO-YJBOKZPZSA-N 1 1 318.417 3.719 20 5 DHBDMO Cc1cc(F)ncc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000891621824 1015460789 /nfs/dbraw/zinc/46/07/89/1015460789.db2.gz CRTWWFAVVZTIPF-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO Cc1cc(F)ncc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000891621824 1015460793 /nfs/dbraw/zinc/46/07/93/1015460793.db2.gz CRTWWFAVVZTIPF-UHFFFAOYSA-N 1 1 315.348 3.602 20 5 DHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(C)c(F)c1 ZINC000101590145 1015506459 /nfs/dbraw/zinc/50/64/59/1015506459.db2.gz SNEJIFAWTXCAKB-UHFFFAOYSA-N 1 1 318.348 3.731 20 5 DHBDMO CC(C)c1ccc(C[N@@H+]2CC[C@@H](C)C[C@@H]2[C@H](C)O)cc1[N+](=O)[O-] ZINC000443774517 1015601266 /nfs/dbraw/zinc/60/12/66/1015601266.db2.gz AHNMELZSDZIONO-JKIFEVAISA-N 1 1 320.433 3.700 20 5 DHBDMO CC(C)Oc1ncccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000320311968 1015655574 /nfs/dbraw/zinc/65/55/74/1015655574.db2.gz CSYLNZMXNJQWMK-ZDUSSCGKSA-N 1 1 315.373 3.628 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000610847503 1015884212 /nfs/dbraw/zinc/88/42/12/1015884212.db2.gz YFLXSZFVTHREHL-GFCCVEGCSA-N 1 1 322.368 3.632 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000610847504 1015884586 /nfs/dbraw/zinc/88/45/86/1015884586.db2.gz YFLXSZFVTHREHL-LBPRGKRZSA-N 1 1 322.368 3.632 20 5 DHBDMO C[C@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000178532421 1016325662 /nfs/dbraw/zinc/32/56/62/1016325662.db2.gz OHRGGJJWTJOJLB-BBRMVZONSA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000178532421 1016325671 /nfs/dbraw/zinc/32/56/71/1016325671.db2.gz OHRGGJJWTJOJLB-BBRMVZONSA-N 1 1 307.438 3.612 20 5 DHBDMO C[C@H](Nc1sccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000611583557 1016507417 /nfs/dbraw/zinc/50/74/17/1016507417.db2.gz NYBOUXLFJQEEIB-RYUDHWBXSA-N 1 1 309.435 3.721 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCOc1ccccc1 ZINC000072555593 1016556263 /nfs/dbraw/zinc/55/62/63/1016556263.db2.gz AFGSOGQXSDONKJ-AWEZNQCLSA-N 1 1 300.358 3.667 20 5 DHBDMO C[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCC1(F)F ZINC000601166243 1016732117 /nfs/dbraw/zinc/73/21/17/1016732117.db2.gz MLBQMJLPTMQAHN-JTQLQIEISA-N 1 1 307.300 3.625 20 5 DHBDMO CCCN(Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000347110661 1016737166 /nfs/dbraw/zinc/73/71/66/1016737166.db2.gz NPXGNXIZHLCOFL-UHFFFAOYSA-N 1 1 319.449 3.682 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c1 ZINC000523007779 1017032206 /nfs/dbraw/zinc/03/22/06/1017032206.db2.gz XGEJTYGTGSHBIC-INIZCTEOSA-N 1 1 314.360 3.799 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000847038813 1032189838 /nfs/dbraw/zinc/18/98/38/1032189838.db2.gz WMJTUNIRSZGXES-OAHLLOKOSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000847038813 1032189853 /nfs/dbraw/zinc/18/98/53/1032189853.db2.gz WMJTUNIRSZGXES-OAHLLOKOSA-N 1 1 324.808 3.782 20 5 DHBDMO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000073007513 1017087095 /nfs/dbraw/zinc/08/70/95/1017087095.db2.gz NWUQBLLADVFKKP-MRVPVSSYSA-N 1 1 309.753 3.704 20 5 DHBDMO CCc1ccc([C@H]([NH2+][C@H]2CC23CC3)c2ccc([N+](=O)[O-])cc2)o1 ZINC000424318795 1011977387 /nfs/dbraw/zinc/97/73/87/1011977387.db2.gz HSVGJSZKNAHKOT-DLBZAZTESA-N 1 1 312.369 3.982 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000515184688 1012571256 /nfs/dbraw/zinc/57/12/56/1012571256.db2.gz IJPCXCGUVFJWTL-ZBFHGGJFSA-N 1 1 318.417 3.713 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCOC2(CCCCC2)C1 ZINC000075832747 1017366624 /nfs/dbraw/zinc/36/66/24/1017366624.db2.gz VPAXEUYLYKBEDE-CQSZACIVSA-N 1 1 304.390 3.691 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCOC2(CCCCC2)C1 ZINC000075832747 1017366636 /nfs/dbraw/zinc/36/66/36/1017366636.db2.gz VPAXEUYLYKBEDE-CQSZACIVSA-N 1 1 304.390 3.691 20 5 DHBDMO CC[C@@H]([NH2+]CCc1ccc2cn[nH]c2c1)c1cccc([N+](=O)[O-])c1 ZINC000342830558 1017521823 /nfs/dbraw/zinc/52/18/23/1017521823.db2.gz WZAQZLJBLZGIIW-QGZVFWFLSA-N 1 1 324.384 3.755 20 5 DHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444611578 1017588418 /nfs/dbraw/zinc/58/84/18/1017588418.db2.gz QSBQUCHOQDZMJQ-CYBMUJFWSA-N 1 1 316.405 3.872 20 5 DHBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444652760 1017606558 /nfs/dbraw/zinc/60/65/58/1017606558.db2.gz KCDVPQGGMZGSOM-WBMJQRKESA-N 1 1 316.405 3.872 20 5 DHBDMO COc1ccc(C[N@H+]2CCC[C@@H](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000523707818 1017764362 /nfs/dbraw/zinc/76/43/62/1017764362.db2.gz VCXLUSUNAWDMDI-OAHLLOKOSA-N 1 1 306.406 3.862 20 5 DHBDMO COc1ccc(C[N@H+](Cc2ccc(C)o2)C2CC2)cc1[N+](=O)[O-] ZINC000051967679 1017789092 /nfs/dbraw/zinc/78/90/92/1017789092.db2.gz PYOWAFXIFQSDFV-UHFFFAOYSA-N 1 1 316.357 3.669 20 5 DHBDMO COc1ccc(C[N@@H+](Cc2ccc(C)o2)C2CC2)cc1[N+](=O)[O-] ZINC000051967679 1017789099 /nfs/dbraw/zinc/78/90/99/1017789099.db2.gz PYOWAFXIFQSDFV-UHFFFAOYSA-N 1 1 316.357 3.669 20 5 DHBDMO COc1cc(C[N@H+]2CCCC3(CCCC3)C2)c([N+](=O)[O-])cc1F ZINC000445865041 1017997892 /nfs/dbraw/zinc/99/78/92/1017997892.db2.gz CIOHFUNBCCGVSM-UHFFFAOYSA-N 1 1 322.380 3.899 20 5 DHBDMO C[C@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000278080683 1018046901 /nfs/dbraw/zinc/04/69/01/1018046901.db2.gz GHRVOFGQJDSGDD-KXUCPTDWSA-N 1 1 322.390 3.640 20 5 DHBDMO C[C@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000278080683 1018046924 /nfs/dbraw/zinc/04/69/24/1018046924.db2.gz GHRVOFGQJDSGDD-KXUCPTDWSA-N 1 1 322.390 3.640 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccc(F)c1)C1CC1 ZINC000052161463 1018158360 /nfs/dbraw/zinc/15/83/60/1018158360.db2.gz XZUDYJROCSGOQE-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000052161463 1018158371 /nfs/dbraw/zinc/15/83/71/1018158371.db2.gz XZUDYJROCSGOQE-UHFFFAOYSA-N 1 1 300.333 3.899 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000245528565 1018209148 /nfs/dbraw/zinc/20/91/48/1018209148.db2.gz QSVNWUIPYKGSOI-UONOGXRCSA-N 1 1 314.389 3.567 20 5 DHBDMO CCC1(CC)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000446713606 1018210181 /nfs/dbraw/zinc/21/01/81/1018210181.db2.gz YFPZPXDTNWLDHM-UHFFFAOYSA-N 1 1 303.362 3.748 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1C[C@H](C)S[C@@H](C)C1 ZINC000525273815 1018222132 /nfs/dbraw/zinc/22/21/32/1018222132.db2.gz VXBQNQJADRPDRG-STQMWFEESA-N 1 1 324.446 3.708 20 5 DHBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000447068315 1018321770 /nfs/dbraw/zinc/32/17/70/1018321770.db2.gz OIRNWJRHMBVTTN-MRXNPFEDSA-N 1 1 310.369 3.515 20 5 DHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC3(C2)CCCCC3)c1 ZINC000525636494 1018340965 /nfs/dbraw/zinc/34/09/65/1018340965.db2.gz ADHRHUONLUBIPX-UHFFFAOYSA-N 1 1 304.390 3.630 20 5 DHBDMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000447384462 1018384163 /nfs/dbraw/zinc/38/41/63/1018384163.db2.gz MLPOQRIDNMTGCM-LBPRGKRZSA-N 1 1 316.405 3.872 20 5 DHBDMO COc1cc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)ccn1 ZINC000340499678 1018796964 /nfs/dbraw/zinc/79/69/64/1018796964.db2.gz DKVNACMAAGSBKH-JTQLQIEISA-N 1 1 321.764 3.503 20 5 DHBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H]2CCCC[C@H]21 ZINC000611802414 1018896949 /nfs/dbraw/zinc/89/69/49/1018896949.db2.gz NUHXKDYYIGJCKE-OSAQELSMSA-N 1 1 315.373 3.747 20 5 DHBDMO Cc1ccc(C[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C2CC2)o1 ZINC000611254257 1019422120 /nfs/dbraw/zinc/42/21/20/1019422120.db2.gz GOMYZNRIRNFZQF-UHFFFAOYSA-N 1 1 300.358 3.969 20 5 DHBDMO Cc1ccc(C[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C2CC2)o1 ZINC000611254257 1019422125 /nfs/dbraw/zinc/42/21/25/1019422125.db2.gz GOMYZNRIRNFZQF-UHFFFAOYSA-N 1 1 300.358 3.969 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000611350965 1019451466 /nfs/dbraw/zinc/45/14/66/1019451466.db2.gz VVZPWLPCPJVZGV-OWCLPIDISA-N 1 1 318.417 3.794 20 5 DHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2sccc2[N+](=O)[O-])C1 ZINC000611411629 1019476214 /nfs/dbraw/zinc/47/62/14/1019476214.db2.gz GKXMLSGOKYZQPM-JSGCOSHPSA-N 1 1 317.414 3.904 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccnc(Cl)c1 ZINC000765766437 1019572243 /nfs/dbraw/zinc/57/22/43/1019572243.db2.gz HLTFSYHXPZKVIP-SNVBAGLBSA-N 1 1 321.764 3.503 20 5 DHBDMO COc1cc([C@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])ccn1 ZINC000347568295 1019687844 /nfs/dbraw/zinc/68/78/44/1019687844.db2.gz YLMPOMRMHQJBEC-JTQLQIEISA-N 1 1 321.764 3.503 20 5 DHBDMO CCC[C@@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000264175441 1032866554 /nfs/dbraw/zinc/86/65/54/1032866554.db2.gz ISOBVKMLQWXVEI-CYBMUJFWSA-N 1 1 317.389 3.913 20 5 DHBDMO Cc1c(C[N@@H+](C)CCc2ccccc2F)cccc1[N+](=O)[O-] ZINC000731669736 1020133724 /nfs/dbraw/zinc/13/37/24/1020133724.db2.gz MEVMVJBULIINRG-UHFFFAOYSA-N 1 1 302.349 3.717 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)CC2CCOCC2)cc1[N+](=O)[O-] ZINC000093314748 1020146989 /nfs/dbraw/zinc/14/69/89/1020146989.db2.gz IPOSJVKJEJHMDA-UHFFFAOYSA-N 1 1 306.406 3.577 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccn2)C2CC2)c(Cl)c1 ZINC000922586111 1020147811 /nfs/dbraw/zinc/14/78/11/1020147811.db2.gz VVJWIZXSOBZXOF-INIZCTEOSA-N 1 1 317.776 3.884 20 5 DHBDMO CCC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350030 1020166110 /nfs/dbraw/zinc/16/61/10/1020166110.db2.gz WMSRRZBIPYVNSQ-KBXCAEBGSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350030 1020166124 /nfs/dbraw/zinc/16/61/24/1020166124.db2.gz WMSRRZBIPYVNSQ-KBXCAEBGSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350030 1020166134 /nfs/dbraw/zinc/16/61/34/1020166134.db2.gz WMSRRZBIPYVNSQ-KBXCAEBGSA-N 1 1 317.433 3.510 20 5 DHBDMO CCC[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000124350030 1020166143 /nfs/dbraw/zinc/16/61/43/1020166143.db2.gz WMSRRZBIPYVNSQ-KBXCAEBGSA-N 1 1 317.433 3.510 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000330711156 1020239667 /nfs/dbraw/zinc/23/96/67/1020239667.db2.gz PSEHKBWKZBGJJS-ZBFHGGJFSA-N 1 1 318.417 3.713 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1 ZINC000280901533 1020314831 /nfs/dbraw/zinc/31/48/31/1020314831.db2.gz DVBPFGCGUVSWCQ-KSZLIROESA-N 1 1 318.417 3.500 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1 ZINC000280901540 1020315212 /nfs/dbraw/zinc/31/52/12/1020315212.db2.gz DVBPFGCGUVSWCQ-KZNAEPCWSA-N 1 1 318.417 3.500 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000281047497 1020322384 /nfs/dbraw/zinc/32/23/84/1020322384.db2.gz QPMUBEDPWJTLDT-KBAYOESNSA-N 1 1 318.417 3.500 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000281047494 1020322814 /nfs/dbraw/zinc/32/28/14/1020322814.db2.gz QPMUBEDPWJTLDT-JQHSSLGASA-N 1 1 318.417 3.500 20 5 DHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1CCCC1 ZINC000179799555 1020447767 /nfs/dbraw/zinc/44/77/67/1020447767.db2.gz OMXYFQVOPUQYNN-UHFFFAOYSA-N 1 1 300.305 3.571 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H]1C[C@H]1c1cccc(F)c1 ZINC000411689471 1020581043 /nfs/dbraw/zinc/58/10/43/1020581043.db2.gz FWEIDHAMKXOTDT-ZWKOTPCHSA-N 1 1 314.360 3.764 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1nn(C)c2ccccc12 ZINC000612829291 1020722274 /nfs/dbraw/zinc/72/22/74/1020722274.db2.gz RNTUPKNYGCKGTK-CYBMUJFWSA-N 1 1 324.384 3.641 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@@H](c3ccco3)C2)c1 ZINC000735493846 1020743301 /nfs/dbraw/zinc/74/33/01/1020743301.db2.gz RNQUILNTESNGAC-LLVKDONJSA-N 1 1 306.749 3.831 20 5 DHBDMO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000580740459 1020854998 /nfs/dbraw/zinc/85/49/98/1020854998.db2.gz PJKPUUWVJXUHDI-BBRMVZONSA-N 1 1 314.385 3.986 20 5 DHBDMO CCC(CC)[N@@H+](CC)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000581274371 1020878778 /nfs/dbraw/zinc/87/87/78/1020878778.db2.gz GUEVNZXDCZIKHA-UHFFFAOYSA-N 1 1 318.377 3.655 20 5 DHBDMO CCC(CC)C[N@@H+](CC)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917454514 1021267794 /nfs/dbraw/zinc/26/77/94/1021267794.db2.gz QLUCSKCCPXGIFU-UHFFFAOYSA-N 1 1 304.394 3.660 20 5 DHBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCC(C)(C)CC1 ZINC000154436659 1021289607 /nfs/dbraw/zinc/28/96/07/1021289607.db2.gz MQRBWKSPLMGTAS-MRXNPFEDSA-N 1 1 306.406 3.529 20 5 DHBDMO COC[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000181664127 1021308938 /nfs/dbraw/zinc/30/89/38/1021308938.db2.gz NKRKYCMNEDZGJD-OAHLLOKOSA-N 1 1 320.776 3.726 20 5 DHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](C3CC3)C3CCCCC3)nc2c1 ZINC000618275011 1021341298 /nfs/dbraw/zinc/34/12/98/1021341298.db2.gz LMISSINVRJQXHY-UHFFFAOYSA-N 1 1 314.389 3.768 20 5 DHBDMO CC(C)c1cc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)on1 ZINC000618568493 1021427089 /nfs/dbraw/zinc/42/70/89/1021427089.db2.gz XGGWUNJVJWKKLE-MRXNPFEDSA-N 1 1 315.373 3.873 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1C[C@@H](O)c2ccccc21 ZINC000850372246 1021495666 /nfs/dbraw/zinc/49/56/66/1021495666.db2.gz RUFHMZXANMFYBZ-GDBMZVCRSA-N 1 1 318.760 3.516 20 5 DHBDMO CSC[C@H]1CCC[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154728895 1021522221 /nfs/dbraw/zinc/52/22/21/1021522221.db2.gz AVSCHGWBJOARES-LLVKDONJSA-N 1 1 300.811 3.576 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H]2CCCC[N@H+]2C(C)C)cc1[N+](=O)[O-] ZINC000556124190 1021537199 /nfs/dbraw/zinc/53/71/99/1021537199.db2.gz YKEQQYMVVFWZIQ-DOTOQJQBSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H]2CCCC[N@@H+]2C(C)C)cc1[N+](=O)[O-] ZINC000556124190 1021537207 /nfs/dbraw/zinc/53/72/07/1021537207.db2.gz YKEQQYMVVFWZIQ-DOTOQJQBSA-N 1 1 319.449 3.817 20 5 DHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(F)F ZINC000556225501 1021615532 /nfs/dbraw/zinc/61/55/32/1021615532.db2.gz VNQMALKBADHEKN-SNVBAGLBSA-N 1 1 304.362 3.710 20 5 DHBDMO C[C@@H]1C[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H](C)S1 ZINC000070383164 1021658708 /nfs/dbraw/zinc/65/87/08/1021658708.db2.gz INXDYHGTNLWNBF-NXEZZACHSA-N 1 1 300.811 3.574 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC000517397330 1021697208 /nfs/dbraw/zinc/69/72/08/1021697208.db2.gz WZNADKOQBKKYIA-QGZVFWFLSA-N 1 1 300.333 3.666 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC000517397330 1021697213 /nfs/dbraw/zinc/69/72/13/1021697213.db2.gz WZNADKOQBKKYIA-QGZVFWFLSA-N 1 1 300.333 3.666 20 5 DHBDMO COc1cccc2c1CC[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000182673663 1021764771 /nfs/dbraw/zinc/76/47/71/1021764771.db2.gz CWRVTQCQYLSTPN-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1cccc2c1CC[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000182673663 1021764786 /nfs/dbraw/zinc/76/47/86/1021764786.db2.gz CWRVTQCQYLSTPN-CYBMUJFWSA-N 1 1 312.369 3.723 20 5 DHBDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037562818 1021839893 /nfs/dbraw/zinc/83/98/93/1021839893.db2.gz OCZCSQVZWUTYGZ-LLVKDONJSA-N 1 1 306.387 3.824 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@H](c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000851749458 1021989707 /nfs/dbraw/zinc/98/97/07/1021989707.db2.gz ZFMSYSHKYXQXNF-HNNXBMFYSA-N 1 1 315.373 3.661 20 5 DHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776584002 1022096236 /nfs/dbraw/zinc/09/62/36/1022096236.db2.gz ISTZGCKVMKWIDK-NVXWUHKLSA-N 1 1 320.433 3.776 20 5 DHBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CCCCCCC1 ZINC000776581370 1022097211 /nfs/dbraw/zinc/09/72/11/1022097211.db2.gz IEKMQPQOBYHCPX-KRWDZBQOSA-N 1 1 306.406 3.673 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccco3)CC2)cc1F ZINC000852321206 1022104765 /nfs/dbraw/zinc/10/47/65/1022104765.db2.gz KCEUMOGAXIFDBY-UHFFFAOYSA-N 1 1 304.321 3.707 20 5 DHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586615 1022110368 /nfs/dbraw/zinc/11/03/68/1022110368.db2.gz OMHZFPPPJFRZLW-RRQGHBQHSA-N 1 1 306.406 3.529 20 5 DHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586608 1022111114 /nfs/dbraw/zinc/11/11/14/1022111114.db2.gz OMHZFPPPJFRZLW-IAOVAPTHSA-N 1 1 306.406 3.529 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@@H](c2nccs2)C1 ZINC000195340122 1022120826 /nfs/dbraw/zinc/12/08/26/1022120826.db2.gz KZOZAZUJTRTPHW-LLVKDONJSA-N 1 1 321.377 3.570 20 5 DHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000195340122 1022120833 /nfs/dbraw/zinc/12/08/33/1022120833.db2.gz KZOZAZUJTRTPHW-LLVKDONJSA-N 1 1 321.377 3.570 20 5 DHBDMO CO[C@@H](C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)C1CCCC1 ZINC001168849170 1022161055 /nfs/dbraw/zinc/16/10/55/1022161055.db2.gz WHDANYYHAHIFJP-SFHVURJKSA-N 1 1 318.417 3.764 20 5 DHBDMO CC(C)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000104666548 1022223425 /nfs/dbraw/zinc/22/34/25/1022223425.db2.gz HUUKXLLKBAQDPO-UHFFFAOYSA-N 1 1 315.373 3.665 20 5 DHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169048697 1022229761 /nfs/dbraw/zinc/22/97/61/1022229761.db2.gz AQLFKEAVWFOZLV-IINYFYTJSA-N 1 1 317.216 3.871 20 5 DHBDMO CC[C@H]([NH2+]Cc1ccc(Cl)cn1)c1cccc([N+](=O)[O-])c1 ZINC000182112897 1022264005 /nfs/dbraw/zinc/26/40/05/1022264005.db2.gz COJSCZHQTCCVLC-HNNXBMFYSA-N 1 1 305.765 3.884 20 5 DHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccncc1 ZINC000183743045 1022320322 /nfs/dbraw/zinc/32/03/22/1022320322.db2.gz MIXZZANXXODVLX-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccncc1 ZINC000183743045 1022320335 /nfs/dbraw/zinc/32/03/35/1022320335.db2.gz MIXZZANXXODVLX-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO COCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000609705197 1022336230 /nfs/dbraw/zinc/33/62/30/1022336230.db2.gz DWBANCZDINUZRS-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000609800544 1022352702 /nfs/dbraw/zinc/35/27/02/1022352702.db2.gz MTIHKGXUQDOXCR-KRWDZBQOSA-N 1 1 314.410 3.885 20 5 DHBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCC[C@@H](C)C1 ZINC000195666909 1022401554 /nfs/dbraw/zinc/40/15/54/1022401554.db2.gz WASVFEWCECDWBE-VXGBXAGGSA-N 1 1 311.813 3.781 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3c(Cl)cccc3C2)cc1 ZINC000610079928 1022416730 /nfs/dbraw/zinc/41/67/30/1022416730.db2.gz CGGUQQFCQMFAAA-UHFFFAOYSA-N 1 1 316.788 3.849 20 5 DHBDMO COCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000615836075 1022567965 /nfs/dbraw/zinc/56/79/65/1022567965.db2.gz OEJJBUWLNIRYJO-NTCAYCPXSA-N 1 1 318.417 3.889 20 5 DHBDMO CCCC[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768142097 1022891797 /nfs/dbraw/zinc/89/17/97/1022891797.db2.gz GFKNTVFULCOSDK-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO CCCC[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000768142097 1022891821 /nfs/dbraw/zinc/89/18/21/1022891821.db2.gz GFKNTVFULCOSDK-UHFFFAOYSA-N 1 1 301.184 3.589 20 5 DHBDMO CC[N@@H+](CCc1ccccn1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768543026 1022985955 /nfs/dbraw/zinc/98/59/55/1022985955.db2.gz VHXSDBOJFNBVEM-UHFFFAOYSA-N 1 1 319.792 3.708 20 5 DHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1cc([N+](=O)[O-])cc2cc[nH]c21 ZINC001167752339 1023031652 /nfs/dbraw/zinc/03/16/52/1023031652.db2.gz FHPVNUBPKOHBFV-CYBMUJFWSA-N 1 1 316.405 3.753 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1nccc3ccccc31)C2 ZINC000769425571 1023147004 /nfs/dbraw/zinc/14/70/04/1023147004.db2.gz IIIXNQDXXSQBFD-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1nccc3ccccc31)C2 ZINC000769425571 1023147014 /nfs/dbraw/zinc/14/70/14/1023147014.db2.gz IIIXNQDXXSQBFD-UHFFFAOYSA-N 1 1 319.364 3.701 20 5 DHBDMO COC[C@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)CCO1 ZINC000769459538 1023159922 /nfs/dbraw/zinc/15/99/22/1023159922.db2.gz GDNODLXLUGMVIY-GOSISDBHSA-N 1 1 321.420 3.840 20 5 DHBDMO C[C@H]1C[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)S1 ZINC000746673197 1023784145 /nfs/dbraw/zinc/78/41/45/1023784145.db2.gz KFVDGGCLTZGFKD-UWVGGRQHSA-N 1 1 300.811 3.574 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000859542938 1033163491 /nfs/dbraw/zinc/16/34/91/1033163491.db2.gz RFMJQBWTXBIZDR-OLZOCXBDSA-N 1 1 312.822 3.718 20 5 DHBDMO CC1(C)C[C@@H]([NH2+]Cc2cccc(F)n2)c2cc([N+](=O)[O-])ccc21 ZINC000788594177 1023910711 /nfs/dbraw/zinc/91/07/11/1023910711.db2.gz ZXQZTAMJLREWBB-OAHLLOKOSA-N 1 1 315.348 3.641 20 5 DHBDMO COC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000193687704 1023969190 /nfs/dbraw/zinc/96/91/90/1023969190.db2.gz UEYAALNIDBAHGU-HNNXBMFYSA-N 1 1 320.776 3.726 20 5 DHBDMO CCC[C@@H]([NH2+]Cc1cn2ccccc2n1)c1cccc([N+](=O)[O-])c1 ZINC000268717900 1024146509 /nfs/dbraw/zinc/14/65/09/1024146509.db2.gz JHAJKGRRAJNUCH-QGZVFWFLSA-N 1 1 324.384 3.874 20 5 DHBDMO CCc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)o1 ZINC000268840946 1024175264 /nfs/dbraw/zinc/17/52/64/1024175264.db2.gz QUTYHJZDCUEHLC-LLVKDONJSA-N 1 1 304.346 3.610 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2c3ccccc3CC[C@@H]2F)cc1 ZINC000883384545 1024419959 /nfs/dbraw/zinc/41/99/59/1024419959.db2.gz UKPJQTDWMYHLBC-IRXDYDNUSA-N 1 1 300.333 3.710 20 5 DHBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000453352211 1024476072 /nfs/dbraw/zinc/47/60/72/1024476072.db2.gz INXUUFMFFFKYGS-PBHICJAKSA-N 1 1 320.458 3.745 20 5 DHBDMO CCC[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000453353453 1024479085 /nfs/dbraw/zinc/47/90/85/1024479085.db2.gz HXTGUJQWPTWRLS-ROUUACIJSA-N 1 1 318.417 3.939 20 5 DHBDMO CCCc1ncc(C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)o1 ZINC000453367113 1024491059 /nfs/dbraw/zinc/49/10/59/1024491059.db2.gz HBSGGMCXZOBBLH-HNNXBMFYSA-N 1 1 303.362 3.776 20 5 DHBDMO COc1cc2c(cc1F)CC[C@H]2[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000337883670 1033216630 /nfs/dbraw/zinc/21/66/30/1033216630.db2.gz ZZLKFFJZXNEMSB-CYBMUJFWSA-N 1 1 322.361 3.581 20 5 DHBDMO COc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000106465747 1024536387 /nfs/dbraw/zinc/53/63/87/1024536387.db2.gz QEMUNTWZVASJKD-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCC[N@H+]1CCCC[C@H]1C ZINC000532188090 1024570687 /nfs/dbraw/zinc/57/06/87/1024570687.db2.gz AKRCRWMPHOMCKJ-HZPDHXFCSA-N 1 1 319.449 3.818 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C(C)C)N1CCCC1 ZINC000532202439 1024574383 /nfs/dbraw/zinc/57/43/83/1024574383.db2.gz CMSKSQKAPKTJAA-CRAIPNDOSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](CC(C)C)[NH+](C)C ZINC000532202580 1024575082 /nfs/dbraw/zinc/57/50/82/1024575082.db2.gz XHFZFRTXRXKGFH-GOEBONIOSA-N 1 1 307.438 3.530 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C(C)C)N1CCCC1 ZINC000532202441 1024575695 /nfs/dbraw/zinc/57/56/95/1024575695.db2.gz CMSKSQKAPKTJAA-QAPCUYQASA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000317742246 1024626226 /nfs/dbraw/zinc/62/62/26/1024626226.db2.gz QJKQYGKKVRMGNU-WDEREUQCSA-N 1 1 303.362 3.920 20 5 DHBDMO CCc1ccccc1CC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC001170194401 1024696302 /nfs/dbraw/zinc/69/63/02/1024696302.db2.gz MTWAGSUEBUONGS-UHFFFAOYSA-N 1 1 312.413 3.874 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000109781474 1024696337 /nfs/dbraw/zinc/69/63/37/1024696337.db2.gz KUTFWIIEQCIWTA-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000109781474 1024696344 /nfs/dbraw/zinc/69/63/44/1024696344.db2.gz KUTFWIIEQCIWTA-GFCCVEGCSA-N 1 1 316.357 3.502 20 5 DHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170328305 1024743757 /nfs/dbraw/zinc/74/37/57/1024743757.db2.gz JBTHJSTVNGXQSQ-UONOGXRCSA-N 1 1 306.406 3.656 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC[C@@](C)(F)C2)c([N+](=O)[O-])c1 ZINC001170336315 1024745249 /nfs/dbraw/zinc/74/52/49/1024745249.db2.gz WGJFXUKGLQQJSZ-SUMWQHHRSA-N 1 1 324.396 3.749 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@](C)(F)CC2)c([N+](=O)[O-])c1 ZINC001170330050 1024745295 /nfs/dbraw/zinc/74/52/95/1024745295.db2.gz XGVXQWNYIJANST-GUYCJALGSA-N 1 1 324.396 3.749 20 5 DHBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cccc([N+](=O)[O-])c1)CCC2 ZINC000111310756 1024752861 /nfs/dbraw/zinc/75/28/61/1024752861.db2.gz GZNWEQZSGXLGFD-HNNXBMFYSA-N 1 1 317.414 3.869 20 5 DHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H](C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170345738 1024756369 /nfs/dbraw/zinc/75/63/69/1024756369.db2.gz LIUYOTNIDBNINF-IHRRRGAJSA-N 1 1 306.406 3.655 20 5 DHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000269694182 1025009088 /nfs/dbraw/zinc/00/90/88/1025009088.db2.gz WGJREWZSSFLUMJ-HOTGVXAUSA-N 1 1 318.398 3.527 20 5 DHBDMO COc1ccc(C[N@@H+]2Cc3ccccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000353649301 1025173364 /nfs/dbraw/zinc/17/33/64/1025173364.db2.gz RWHYEXCOSKOVCN-CYBMUJFWSA-N 1 1 312.369 3.550 20 5 DHBDMO COc1ccc(C[N@H+]2Cc3ccccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000353649301 1025173374 /nfs/dbraw/zinc/17/33/74/1025173374.db2.gz RWHYEXCOSKOVCN-CYBMUJFWSA-N 1 1 312.369 3.550 20 5 DHBDMO CC[N@@H+](CCCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000353647578 1025174794 /nfs/dbraw/zinc/17/47/94/1025174794.db2.gz LPGACPLSBWNRPN-UHFFFAOYSA-N 1 1 320.414 3.528 20 5 DHBDMO Cc1[nH+]ccn1CCCCNc1cc(Cl)ccc1[N+](=O)[O-] ZINC000804502342 1025320483 /nfs/dbraw/zinc/32/04/83/1025320483.db2.gz QBHMBYSKETWRFP-UHFFFAOYSA-N 1 1 308.769 3.645 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000885983905 1025427039 /nfs/dbraw/zinc/42/70/39/1025427039.db2.gz STQDCJDQSPNIRZ-MRXNPFEDSA-N 1 1 311.385 3.760 20 5 DHBDMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886014093 1025438829 /nfs/dbraw/zinc/43/88/29/1025438829.db2.gz BWHGTUSGCIDNSU-HOCLYGCPSA-N 1 1 311.385 3.676 20 5 DHBDMO CC(C)C[C@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000137072216 1025497555 /nfs/dbraw/zinc/49/75/55/1025497555.db2.gz ZMTLXCWCJZKRIS-WBVHZDCISA-N 1 1 306.406 3.529 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000886120796 1025517307 /nfs/dbraw/zinc/51/73/07/1025517307.db2.gz NXVZWORDIFWZLQ-DVQDXYAYSA-N 1 1 309.369 3.668 20 5 DHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000886120796 1025517312 /nfs/dbraw/zinc/51/73/12/1025517312.db2.gz NXVZWORDIFWZLQ-DVQDXYAYSA-N 1 1 309.369 3.668 20 5 DHBDMO C[C@H](CSc1ccccc1)[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886266955 1025573278 /nfs/dbraw/zinc/57/32/78/1025573278.db2.gz BZRRWJRZRYZOJE-CYBMUJFWSA-N 1 1 317.414 3.602 20 5 DHBDMO C[C@H](CSc1ccccc1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886266955 1025573290 /nfs/dbraw/zinc/57/32/90/1025573290.db2.gz BZRRWJRZRYZOJE-CYBMUJFWSA-N 1 1 317.414 3.602 20 5 DHBDMO CC(C)([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000886350129 1025600931 /nfs/dbraw/zinc/60/09/31/1025600931.db2.gz KGLJWYHSJFNXIU-UHFFFAOYSA-N 1 1 306.312 3.898 20 5 DHBDMO C[N@@H+](CCSc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000432924714 1025741026 /nfs/dbraw/zinc/74/10/26/1025741026.db2.gz NHOOKGWONZWWLF-UHFFFAOYSA-N 1 1 302.399 3.819 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000084137384 1025993718 /nfs/dbraw/zinc/99/37/18/1025993718.db2.gz HYBORWJJPWKRGD-UHFFFAOYSA-N 1 1 302.296 3.759 20 5 DHBDMO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000052039831 1026108600 /nfs/dbraw/zinc/10/86/00/1026108600.db2.gz RCAWDCNPZFRFBP-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000052039831 1026108608 /nfs/dbraw/zinc/10/86/08/1026108608.db2.gz RCAWDCNPZFRFBP-UHFFFAOYSA-N 1 1 318.348 3.765 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC(C)(C)[C@@H]1[C@@H]1CCCO1 ZINC000289853372 1026201289 /nfs/dbraw/zinc/20/12/89/1026201289.db2.gz QKURNTJARZUOOC-KCXAZCMYSA-N 1 1 304.390 3.545 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000576399653 1026280023 /nfs/dbraw/zinc/28/00/23/1026280023.db2.gz YGCUWEUHRYQGPP-QWSHFYNQSA-N 1 1 323.396 3.883 20 5 DHBDMO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000237178703 1026941613 /nfs/dbraw/zinc/94/16/13/1026941613.db2.gz KDUWNUGIKQBKHW-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(F)c(F)cc1F ZINC000561967216 1027149438 /nfs/dbraw/zinc/14/94/38/1027149438.db2.gz BHONZCRPFMHVJT-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(F)c(F)cc1F ZINC000561967216 1027149443 /nfs/dbraw/zinc/14/94/43/1027149443.db2.gz BHONZCRPFMHVJT-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000362384841 1027175059 /nfs/dbraw/zinc/17/50/59/1027175059.db2.gz MLUJRNNCQLBQDM-ZIAGYGMSSA-N 1 1 324.446 3.580 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc(C(C)(C)C)co1 ZINC000894274146 1027294869 /nfs/dbraw/zinc/29/48/69/1027294869.db2.gz ZIZTXQNJKMVMFN-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc(C(C)(C)C)co1 ZINC000894274146 1027294885 /nfs/dbraw/zinc/29/48/85/1027294885.db2.gz ZIZTXQNJKMVMFN-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO C[C@H](C[C@H]1CCCCC[NH2+]1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423142609 1027433689 /nfs/dbraw/zinc/43/36/89/1027433689.db2.gz AUDFXRAEUMRQFX-IJEWVQPXSA-N 1 1 305.422 3.556 20 5 DHBDMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000575929985 1027529721 /nfs/dbraw/zinc/52/97/21/1027529721.db2.gz YMEFHKYIYGIGSG-CXAGYDPISA-N 1 1 314.385 3.986 20 5 DHBDMO CC[C@@H](CSC)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000576606589 1027637515 /nfs/dbraw/zinc/63/75/15/1027637515.db2.gz NGXYUUXLIZQWHF-LBPRGKRZSA-N 1 1 302.827 3.822 20 5 DHBDMO COc1ccc(C[N@@H+](C2CC2)C2CCCCC2)cc1[N+](=O)[O-] ZINC000047903708 1027731115 /nfs/dbraw/zinc/73/11/15/1027731115.db2.gz JSGASPSTAZLQLO-UHFFFAOYSA-N 1 1 304.390 3.901 20 5 DHBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(C)cc1 ZINC000577259359 1027737302 /nfs/dbraw/zinc/73/73/02/1027737302.db2.gz SAEXATUHSAYSFU-UHFFFAOYSA-N 1 1 324.384 3.802 20 5 DHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(C)cc1 ZINC000577259359 1027737319 /nfs/dbraw/zinc/73/73/19/1027737319.db2.gz SAEXATUHSAYSFU-UHFFFAOYSA-N 1 1 324.384 3.802 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H](OCC3CC3)C2)c1 ZINC000778173325 1027738956 /nfs/dbraw/zinc/73/89/56/1027738956.db2.gz SQPOUOCCDLOFGZ-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](OCC3CC3)C2)c1 ZINC000778173325 1027738973 /nfs/dbraw/zinc/73/89/73/1027738973.db2.gz SQPOUOCCDLOFGZ-HNNXBMFYSA-N 1 1 324.808 3.639 20 5 DHBDMO CC(C)c1ccc(C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)cc1[N+](=O)[O-] ZINC000448361129 1027755626 /nfs/dbraw/zinc/75/56/26/1027755626.db2.gz VWWGJIGLTGOWPT-ZBFHGGJFSA-N 1 1 320.433 3.844 20 5 DHBDMO CO[C@H]1CC[C@H]1[N@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000934111839 1027905119 /nfs/dbraw/zinc/90/51/19/1027905119.db2.gz PRSGUAADJJJCRC-NEPJUHHUSA-N 1 1 319.188 3.511 20 5 DHBDMO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000934111839 1027905130 /nfs/dbraw/zinc/90/51/30/1027905130.db2.gz PRSGUAADJJJCRC-NEPJUHHUSA-N 1 1 319.188 3.511 20 5 DHBDMO CCC[N@@H+](CC(N)=O)Cc1c2ccccc2cc2ccccc21 ZINC000814177481 1027916570 /nfs/dbraw/zinc/91/65/70/1027916570.db2.gz DGDHUUIUPYYUEA-UHFFFAOYSA-N 1 1 306.409 3.690 20 5 DHBDMO C[C@@]12CC[N@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C[C@@H]1C2(F)F ZINC000814170303 1027926289 /nfs/dbraw/zinc/92/62/89/1027926289.db2.gz UVTRGVRYILFFGB-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@@]12CC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C[C@@H]1C2(F)F ZINC000814170303 1027926295 /nfs/dbraw/zinc/92/62/95/1027926295.db2.gz UVTRGVRYILFFGB-QWHCGFSZSA-N 1 1 316.735 3.725 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000934836991 1028124625 /nfs/dbraw/zinc/12/46/25/1028124625.db2.gz QHVVXEJQXOOQKY-OWCLPIDISA-N 1 1 318.417 3.794 20 5 DHBDMO COC1(CC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)CCC1 ZINC000815063889 1028346854 /nfs/dbraw/zinc/34/68/54/1028346854.db2.gz SVAKHEHMRGQSKS-UHFFFAOYSA-N 1 1 312.797 3.639 20 5 DHBDMO Cc1ccc2nc(C[NH2+][C@H](C)Cc3ccccc3[N+](=O)[O-])[nH]c2c1 ZINC000449168826 1028412313 /nfs/dbraw/zinc/41/23/13/1028412313.db2.gz BQDWLATWRRRUBQ-CYBMUJFWSA-N 1 1 324.384 3.500 20 5 DHBDMO C[C@H]([NH2+]Cc1ccnn1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000449202697 1028438437 /nfs/dbraw/zinc/43/84/37/1028438437.db2.gz JBEWLZDUKQXDST-ZDUSSCGKSA-N 1 1 314.389 3.757 20 5 DHBDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000449462330 1028682566 /nfs/dbraw/zinc/68/25/66/1028682566.db2.gz SJRMCMZTDZXNSP-ZYHUDNBSSA-N 1 1 302.296 3.758 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C/C=C/c3ccncc3)C2)cc1 ZINC000449496267 1028708402 /nfs/dbraw/zinc/70/84/02/1028708402.db2.gz GLONTQKYXYMCKX-FVIAUOKHSA-N 1 1 323.396 3.883 20 5 DHBDMO Cc1ccncc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449504326 1028724304 /nfs/dbraw/zinc/72/43/04/1028724304.db2.gz VTUCZVUTPOXRFV-MRXNPFEDSA-N 1 1 311.385 3.678 20 5 DHBDMO Cc1ncccc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449506714 1028727330 /nfs/dbraw/zinc/72/73/30/1028727330.db2.gz ZLKWTBXZXMZWDS-KRWDZBQOSA-N 1 1 311.385 3.678 20 5 DHBDMO Cc1cnccc1CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000567467651 1028899849 /nfs/dbraw/zinc/89/98/49/1028899849.db2.gz GJQFVICEUVVNPX-UHFFFAOYSA-N 1 1 313.401 3.751 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000449681480 1028907514 /nfs/dbraw/zinc/90/75/14/1028907514.db2.gz LXXQWNBIWMHBAH-KAPURRDVSA-N 1 1 316.401 3.501 20 5 DHBDMO CC(C)c1ccc(C[NH2+]Cc2cnc(C3CC3)o2)cc1[N+](=O)[O-] ZINC000449702056 1028922577 /nfs/dbraw/zinc/92/25/77/1028922577.db2.gz YBCOAIZEZCIKIM-UHFFFAOYSA-N 1 1 315.373 3.873 20 5 DHBDMO CC[C@H]([NH2+][C@@H](C)c1cn(C(C)C)nn1)c1cccc([N+](=O)[O-])c1 ZINC000925227799 1029408053 /nfs/dbraw/zinc/40/80/53/1029408053.db2.gz BHSWYWIHOBTLLI-WFASDCNBSA-N 1 1 317.393 3.569 20 5 DHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@@H]1CC[N@H+](C(C)C)C1 ZINC000570783240 1029418307 /nfs/dbraw/zinc/41/83/07/1029418307.db2.gz AOYPBFCNWKHPJX-LBPRGKRZSA-N 1 1 311.813 3.699 20 5 DHBDMO CC(=O)c1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000450501979 1029517773 /nfs/dbraw/zinc/51/77/73/1029517773.db2.gz RFTBSXVIYZRPTF-UHFFFAOYSA-N 1 1 324.380 3.962 20 5 DHBDMO CC(=O)c1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000450501979 1029517783 /nfs/dbraw/zinc/51/77/83/1029517783.db2.gz RFTBSXVIYZRPTF-UHFFFAOYSA-N 1 1 324.380 3.962 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451332987 1029849622 /nfs/dbraw/zinc/84/96/22/1029849622.db2.gz ADZADYBRGRVGJP-NOVWEMISSA-N 1 1 318.417 3.671 20 5 DHBDMO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000451412478 1029870534 /nfs/dbraw/zinc/87/05/34/1029870534.db2.gz WRDJUKOEVREVJV-AAEUAGOBSA-N 1 1 316.323 3.800 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CC[C@@H]3CCCCO3)C2)cc1 ZINC000451543116 1029907143 /nfs/dbraw/zinc/90/71/43/1029907143.db2.gz AWXCCVSRQMNJQW-AEFFLSMTSA-N 1 1 318.417 3.733 20 5 DHBDMO C[C@H](NC[C@H](C)[N@@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000467839486 1029976203 /nfs/dbraw/zinc/97/62/03/1029976203.db2.gz MXOKHFPCAXTRHV-KKUMJFAQSA-N 1 1 305.422 3.508 20 5 DHBDMO C[C@H](NC[C@H](C)[N@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000467839486 1029976220 /nfs/dbraw/zinc/97/62/20/1029976220.db2.gz MXOKHFPCAXTRHV-KKUMJFAQSA-N 1 1 305.422 3.508 20 5 DHBDMO Cc1c(C[N@H+]2CCC[C@@]3(CCSC3)C2)cccc1[N+](=O)[O-] ZINC000451965983 1030071507 /nfs/dbraw/zinc/07/15/07/1030071507.db2.gz NURPOLVXXQCXLV-MRXNPFEDSA-N 1 1 306.431 3.622 20 5 DHBDMO C[C@H]([NH2+][C@@H]1CCc2c1nccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC000924797653 1030191285 /nfs/dbraw/zinc/19/12/85/1030191285.db2.gz HQQKDNZWPNEFRB-ZUZCIYMTSA-N 1 1 317.776 3.981 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000866581968 1030388317 /nfs/dbraw/zinc/38/83/17/1030388317.db2.gz FSVRMSWERXEPSO-MJBXVCDLSA-N 1 1 306.431 3.649 20 5 DHBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC(C)(C)C ZINC000291199273 1030391687 /nfs/dbraw/zinc/39/16/87/1030391687.db2.gz JPNZWUHQEQHKFX-UHFFFAOYSA-N 1 1 318.377 3.513 20 5 DHBDMO Cc1c(C[NH2+][C@H](C)c2ccc(Cl)cn2)cccc1[N+](=O)[O-] ZINC000358330764 1030442151 /nfs/dbraw/zinc/44/21/51/1030442151.db2.gz YOBRWKQWOACZFO-LLVKDONJSA-N 1 1 305.765 3.802 20 5 DHBDMO C[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000824462972 1030567582 /nfs/dbraw/zinc/56/75/82/1030567582.db2.gz VJXKFDOGPAZRAT-NSHDSACASA-N 1 1 317.414 3.781 20 5 DHBDMO Cc1c(C[N@H+]2C[C@H](C)C[C@H]2c2cccnc2)cccc1[N+](=O)[O-] ZINC000358824924 1030639551 /nfs/dbraw/zinc/63/95/51/1030639551.db2.gz NXZZQYULPRKJTD-ACJLOTCBSA-N 1 1 311.385 3.881 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCSC[C@@H]2C2CC2)cc1Cl ZINC000824913820 1030663121 /nfs/dbraw/zinc/66/31/21/1030663121.db2.gz GLSBLFWWHBNPMS-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC[C@@H]2C2CC2)cc1Cl ZINC000824913820 1030663132 /nfs/dbraw/zinc/66/31/32/1030663132.db2.gz GLSBLFWWHBNPMS-CQSZACIVSA-N 1 1 312.822 3.576 20 5 DHBDMO Cc1cc(C)c([N+](=O)[O-])c(NCCCC[N@@H+]2CCC[C@H](C)C2)n1 ZINC000359087161 1030769346 /nfs/dbraw/zinc/76/93/46/1030769346.db2.gz WRNCPFBLEKKMQQ-ZDUSSCGKSA-N 1 1 320.437 3.531 20 5 DHBDMO COc1ccc(C[N@H+]2CC[C@@]3(CC[C@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000359292247 1030891654 /nfs/dbraw/zinc/89/16/54/1030891654.db2.gz DPBFHBJDNSHZFQ-SUMWQHHRSA-N 1 1 304.390 3.616 20 5 DHBDMO CC(C)([NH2+]Cc1ccnc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000292262704 1030910332 /nfs/dbraw/zinc/91/03/32/1030910332.db2.gz YSLDLNCEDJIAJC-UHFFFAOYSA-N 1 1 305.765 3.668 20 5 DHBDMO C[C@@H]([NH2+][C@H]1CCc2c1nccc2Cl)c1ccc([N+](=O)[O-])cc1 ZINC000926891745 1030972961 /nfs/dbraw/zinc/97/29/61/1030972961.db2.gz JSXGONBTNDOOLI-BMIGLBTASA-N 1 1 317.776 3.981 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1cn2c(n1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000926894277 1030973828 /nfs/dbraw/zinc/97/38/28/1030973828.db2.gz XDBQNCAXPDEFJF-OLZOCXBDSA-N 1 1 314.389 3.539 20 5 DHBDMO CCc1onc(C)c1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000927138806 1031114613 /nfs/dbraw/zinc/11/46/13/1031114613.db2.gz HDFCHRFKIZYSIB-NSHDSACASA-N 1 1 303.362 3.613 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)ccc1Cl ZINC000844439426 1031142918 /nfs/dbraw/zinc/14/29/18/1031142918.db2.gz WYMBBQWRSAABLX-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)ccc1Cl ZINC000844439426 1031142924 /nfs/dbraw/zinc/14/29/24/1031142924.db2.gz WYMBBQWRSAABLX-ZDUSSCGKSA-N 1 1 316.735 3.869 20 5 DHBDMO CCCc1[nH+]ccn1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000292785688 1031174489 /nfs/dbraw/zinc/17/44/89/1031174489.db2.gz YWUYPMUTZWYAOR-UHFFFAOYSA-N 1 1 313.279 3.811 20 5 DHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000536696462 1031399433 /nfs/dbraw/zinc/39/94/33/1031399433.db2.gz WZGXBKCQQYYHKI-BJESKFFQSA-N 1 1 318.442 3.968 20 5 DHBDMO CC(C)[N@H+]1CCC[C@H](CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872035587 1031419068 /nfs/dbraw/zinc/41/90/68/1031419068.db2.gz XIENAQMDRLSAAG-ZIAGYGMSSA-N 1 1 323.412 3.505 20 5 DHBDMO Cc1ccc(C[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1C ZINC001171157193 1031435075 /nfs/dbraw/zinc/43/50/75/1031435075.db2.gz SLGQZKHMZCPOIH-UHFFFAOYSA-N 1 1 314.385 3.722 20 5 DHBDMO COc1ccc(F)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000293421850 1031466698 /nfs/dbraw/zinc/46/66/98/1031466698.db2.gz AMGVTBGLINGXPA-LLVKDONJSA-N 1 1 304.321 3.593 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)c1 ZINC000360663226 1031512720 /nfs/dbraw/zinc/51/27/20/1031512720.db2.gz JINVAMBSXNKMAP-LJQANCHMSA-N 1 1 324.380 3.616 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1 ZINC000872260330 1031563304 /nfs/dbraw/zinc/56/33/04/1031563304.db2.gz MIXXLXARLOVYKY-QGZVFWFLSA-N 1 1 304.390 3.518 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872278116 1031570264 /nfs/dbraw/zinc/57/02/64/1031570264.db2.gz GYIRMDNQMFRHMN-AWEZNQCLSA-N 1 1 322.380 3.658 20 5 DHBDMO COc1ccccc1-c1ccc([C@@H](C)[N@H+](C)CC[N+](=O)[O-])cc1 ZINC000929710306 1031585258 /nfs/dbraw/zinc/58/52/58/1031585258.db2.gz NQLYLDFBLFROSL-CQSZACIVSA-N 1 1 314.385 3.632 20 5 DHBDMO COc1ccccc1-c1ccc([C@@H](C)[N@@H+](C)CC[N+](=O)[O-])cc1 ZINC000929710306 1031585263 /nfs/dbraw/zinc/58/52/63/1031585263.db2.gz NQLYLDFBLFROSL-CQSZACIVSA-N 1 1 314.385 3.632 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCCSCC2)c1 ZINC000293910274 1031690389 /nfs/dbraw/zinc/69/03/89/1031690389.db2.gz WWJXQOIZSFZKRZ-UHFFFAOYSA-N 1 1 320.336 3.553 20 5 DHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCCSCC2)c1 ZINC000293910274 1031690394 /nfs/dbraw/zinc/69/03/94/1031690394.db2.gz WWJXQOIZSFZKRZ-UHFFFAOYSA-N 1 1 320.336 3.553 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1CNc1ccc2c(c1)C[N@@H+](C)C2 ZINC000873082838 1031706519 /nfs/dbraw/zinc/70/65/19/1031706519.db2.gz QEIQZFACOKJPQZ-UHFFFAOYSA-N 1 1 311.385 3.769 20 5 DHBDMO COCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H]1CC[C@@H](C)C1 ZINC000361641555 1032031577 /nfs/dbraw/zinc/03/15/77/1032031577.db2.gz CKEKVIRUEXFJLQ-CJNGLKHVSA-N 1 1 306.406 3.540 20 5 DHBDMO CC[N@@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)[C@@H](C)C(C)C ZINC000777955021 1032037215 /nfs/dbraw/zinc/03/72/15/1032037215.db2.gz SFYTXNMVSASTFF-AWEZNQCLSA-N 1 1 316.405 3.782 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC(CC(F)(F)F)C1 ZINC000877581017 1033365536 /nfs/dbraw/zinc/36/55/36/1033365536.db2.gz WAMOAXWVCVVQGY-UHFFFAOYSA-N 1 1 302.296 3.596 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000877615127 1033383198 /nfs/dbraw/zinc/38/31/98/1033383198.db2.gz QVEWFABLLYTMSO-OAHLLOKOSA-N 1 1 310.344 3.833 20 5 DHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCc3ccccc3C1)CC2 ZINC001172908753 1033439730 /nfs/dbraw/zinc/43/97/30/1033439730.db2.gz NPOPQVATORYWSA-LJQANCHMSA-N 1 1 322.408 3.901 20 5 DHBDMO C[N@@H+](CC1CC(F)(F)C1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172917624 1033464341 /nfs/dbraw/zinc/46/43/41/1033464341.db2.gz WDMUUWQCPIJRPC-HNNXBMFYSA-N 1 1 324.371 3.819 20 5 DHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000152554206 1033529607 /nfs/dbraw/zinc/52/96/07/1033529607.db2.gz SZPOJHHVZSJORF-STQMWFEESA-N 1 1 315.373 3.800 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001173232466 1033608905 /nfs/dbraw/zinc/60/89/05/1033608905.db2.gz GXJHIMXWLGPXRX-GFCCVEGCSA-N 1 1 319.792 3.706 20 5 DHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccc(F)cc1 ZINC001173233720 1033609005 /nfs/dbraw/zinc/60/90/05/1033609005.db2.gz MNZVOQPHXHGOOE-CQSZACIVSA-N 1 1 316.376 3.839 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000880316702 1034292927 /nfs/dbraw/zinc/29/29/27/1034292927.db2.gz GBOOQVVJZREQMY-LLVKDONJSA-N 1 1 323.805 3.694 20 5 DHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880316702 1034292938 /nfs/dbraw/zinc/29/29/38/1034292938.db2.gz GBOOQVVJZREQMY-LLVKDONJSA-N 1 1 323.805 3.694 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2C[C@@H]3CC[C@H]2c2ccccc23)cc1 ZINC000880535450 1034350923 /nfs/dbraw/zinc/35/09/23/1034350923.db2.gz CPZVCYHZKFPPBF-JVPBZIDWSA-N 1 1 324.380 3.563 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H](C)[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000480618829 1034352536 /nfs/dbraw/zinc/35/25/36/1034352536.db2.gz WSTULPYHHKXJJA-JYJNAYRXSA-N 1 1 319.449 3.817 20 5 DHBDMO Cc1ccc([C@H](C)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000480618829 1034352549 /nfs/dbraw/zinc/35/25/49/1034352549.db2.gz WSTULPYHHKXJJA-JYJNAYRXSA-N 1 1 319.449 3.817 20 5 DHBDMO C[C@@H](CN1CCCCCC1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000480697434 1034409682 /nfs/dbraw/zinc/40/96/82/1034409682.db2.gz KURZHENCZGHMQX-GJZGRUSLSA-N 1 1 305.422 3.510 20 5 DHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H]1CC1(C)C ZINC001174908273 1034673921 /nfs/dbraw/zinc/67/39/21/1034673921.db2.gz YAXMDFLYEVTMFH-CQSZACIVSA-N 1 1 306.406 3.860 20 5 DHBDMO CC[C@H](N[C@H](C)C[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000192846524 1034698018 /nfs/dbraw/zinc/69/80/18/1034698018.db2.gz NGKQJCIICVKLCV-PBHICJAKSA-N 1 1 305.422 3.510 20 5 DHBDMO CC(C)[N@H+](Cc1cnc(C2CC2)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000600113172 1034747039 /nfs/dbraw/zinc/74/70/39/1034747039.db2.gz UYLOUUPJCZAHSS-UHFFFAOYSA-N 1 1 315.373 3.871 20 5 DHBDMO CC(C)[N@@H+](Cc1cnc(C2CC2)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000600113172 1034747052 /nfs/dbraw/zinc/74/70/52/1034747052.db2.gz UYLOUUPJCZAHSS-UHFFFAOYSA-N 1 1 315.373 3.871 20 5 DHBDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000481768366 1034969420 /nfs/dbraw/zinc/96/94/20/1034969420.db2.gz MNZHOGHAZULYKR-RISCZKNCSA-N 1 1 316.323 3.800 20 5 DHBDMO CC(C)[N@@H+](CCc1nccs1)Cc1ccccc1[N+](=O)[O-] ZINC000159757466 1035087177 /nfs/dbraw/zinc/08/71/77/1035087177.db2.gz BKOMHUYKZINLJR-UHFFFAOYSA-N 1 1 305.403 3.504 20 5 DHBDMO CC[C@H]1CCCC[N@H+]1CCN[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000482941705 1035203257 /nfs/dbraw/zinc/20/32/57/1035203257.db2.gz AKGVETSGRMDNTD-CVEARBPZSA-N 1 1 319.449 3.818 20 5 DHBDMO CC[C@H]1CCCCN1CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000482941705 1035203259 /nfs/dbraw/zinc/20/32/59/1035203259.db2.gz AKGVETSGRMDNTD-CVEARBPZSA-N 1 1 319.449 3.818 20 5 DHBDMO O=[N+]([O-])c1ccc(Nc2ccc3c(c2)[nH+]c2n3CCCCC2)cn1 ZINC000484004404 1035312823 /nfs/dbraw/zinc/31/28/23/1035312823.db2.gz IWXBUYGAMGRPRJ-UHFFFAOYSA-N 1 1 323.356 3.810 20 5 DHBDMO Cc1ccc([N+](=O)[O-])c(C)c1CN(C)CC[C@@H]1CCCC[N@H+]1C ZINC001180098010 1035598436 /nfs/dbraw/zinc/59/84/36/1035598436.db2.gz JAGFLMJGWKYIBQ-INIZCTEOSA-N 1 1 319.449 3.518 20 5 DHBDMO CNc1ccc(C)cc1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001180267322 1035634659 /nfs/dbraw/zinc/63/46/59/1035634659.db2.gz TXQXBHLXYWCAIL-UHFFFAOYSA-N 1 1 311.385 3.503 20 5 DHBDMO CNc1ccc(C)cc1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001180267322 1035634665 /nfs/dbraw/zinc/63/46/65/1035634665.db2.gz TXQXBHLXYWCAIL-UHFFFAOYSA-N 1 1 311.385 3.503 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494704449 1035772216 /nfs/dbraw/zinc/77/22/16/1035772216.db2.gz SEGYXWUZEQTRMZ-PBHICJAKSA-N 1 1 318.417 3.855 20 5 DHBDMO Cc1ccc(C[N@H+](C)Cc2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC000539825263 1035867670 /nfs/dbraw/zinc/86/76/70/1035867670.db2.gz MTLGLDWINYKWMH-UHFFFAOYSA-N 1 1 313.401 3.601 20 5 DHBDMO CC(C)c1ccc(C[N@@H+](C)CCOCC2CC2)cc1[N+](=O)[O-] ZINC000539861681 1035908426 /nfs/dbraw/zinc/90/84/26/1035908426.db2.gz YESUTQOPJWBWBY-UHFFFAOYSA-N 1 1 306.406 3.577 20 5 DHBDMO CO[C@H]1C[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001194384615 1035916733 /nfs/dbraw/zinc/91/67/33/1035916733.db2.gz LPBBGHZIVPBDHZ-GJZGRUSLSA-N 1 1 324.808 3.638 20 5 DHBDMO CO[C@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001194384615 1035916744 /nfs/dbraw/zinc/91/67/44/1035916744.db2.gz LPBBGHZIVPBDHZ-GJZGRUSLSA-N 1 1 324.808 3.638 20 5 DHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(F)c(F)c1F ZINC001181697145 1035974008 /nfs/dbraw/zinc/97/40/08/1035974008.db2.gz GDAUYOWTKAUMPE-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(F)c(F)c1F ZINC001181697145 1035974031 /nfs/dbraw/zinc/97/40/31/1035974031.db2.gz GDAUYOWTKAUMPE-UHFFFAOYSA-N 1 1 324.302 3.687 20 5 DHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c1 ZINC000152917908 1036030314 /nfs/dbraw/zinc/03/03/14/1036030314.db2.gz OEEGBMNQAFUKJF-QGZVFWFLSA-N 1 1 304.390 3.518 20 5 DHBDMO Cc1ccc(F)cc1C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000540916524 1036193603 /nfs/dbraw/zinc/19/36/03/1036193603.db2.gz COWPEFZYTIPXCA-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO Cc1ccc(F)cc1C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000540916524 1036193612 /nfs/dbraw/zinc/19/36/12/1036193612.db2.gz COWPEFZYTIPXCA-UHFFFAOYSA-N 1 1 300.333 3.601 20 5 DHBDMO CC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC000541073123 1036232256 /nfs/dbraw/zinc/23/22/56/1036232256.db2.gz NRWNAVDEYGHPHN-GFCCVEGCSA-N 1 1 300.811 3.576 20 5 DHBDMO CC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC000541073123 1036232268 /nfs/dbraw/zinc/23/22/68/1036232268.db2.gz NRWNAVDEYGHPHN-GFCCVEGCSA-N 1 1 300.811 3.576 20 5 DHBDMO C[C@@H]1C[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)S1 ZINC000541998434 1036485572 /nfs/dbraw/zinc/48/55/72/1036485572.db2.gz QPCCJDCJPLBJOG-NXEZZACHSA-N 1 1 300.811 3.574 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000609144487 1036502542 /nfs/dbraw/zinc/50/25/42/1036502542.db2.gz YNAQRLBZMOCMLB-MRXNPFEDSA-N 1 1 316.332 3.777 20 5 DHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000609144487 1036502558 /nfs/dbraw/zinc/50/25/58/1036502558.db2.gz YNAQRLBZMOCMLB-MRXNPFEDSA-N 1 1 316.332 3.777 20 5 DHBDMO C[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000596144519 1036545412 /nfs/dbraw/zinc/54/54/12/1036545412.db2.gz GMIBBVQYXOIXSF-KOLCDFICSA-N 1 1 317.311 3.508 20 5 DHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000774618108 1036571571 /nfs/dbraw/zinc/57/15/71/1036571571.db2.gz JNGWLWZYKFPFMQ-GUYCJALGSA-N 1 1 314.389 3.536 20 5 DHBDMO C[C@@H]([NH2+]Cc1cnc(Cl)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC001197513756 1036786048 /nfs/dbraw/zinc/78/60/48/1036786048.db2.gz BZBQGNSTCRIHJC-SECBINFHSA-N 1 1 309.728 3.633 20 5 DHBDMO CCOc1cc(C[N@H+]2CCCC[C@@H](SC)C2)ccc1[N+](=O)[O-] ZINC000492556455 1036917770 /nfs/dbraw/zinc/91/77/70/1036917770.db2.gz FZBPVPQNXHIZND-CQSZACIVSA-N 1 1 324.446 3.711 20 5 DHBDMO CCOc1cc(C[N@@H+](C)CCc2cccs2)ccc1[N+](=O)[O-] ZINC000492629341 1036946904 /nfs/dbraw/zinc/94/69/04/1036946904.db2.gz JUBOOCSQWGQMJW-UHFFFAOYSA-N 1 1 320.414 3.730 20 5 DHBDMO CCOc1cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000492626171 1036947691 /nfs/dbraw/zinc/94/76/91/1036947691.db2.gz ADUDZTSSWMVBJP-HUUCEWRRSA-N 1 1 304.390 3.758 20 5 DHBDMO CCOc1cc(C[N@@H+]2CCc3ccsc3C2)ccc1[N+](=O)[O-] ZINC000492719093 1036980808 /nfs/dbraw/zinc/98/08/08/1036980808.db2.gz DAALFLPZMGESNN-UHFFFAOYSA-N 1 1 318.398 3.613 20 5 DHBDMO CCOc1cc(C[N@H+]2CCc3ccsc3C2)ccc1[N+](=O)[O-] ZINC000492719093 1036980821 /nfs/dbraw/zinc/98/08/21/1036980821.db2.gz DAALFLPZMGESNN-UHFFFAOYSA-N 1 1 318.398 3.613 20 5 DHBDMO Cc1cc([NH+](C)C)cc(C)c1NCc1csc([N+](=O)[O-])c1 ZINC000152381101 1037088012 /nfs/dbraw/zinc/08/80/12/1037088012.db2.gz FVACTVCDMSFWNF-UHFFFAOYSA-N 1 1 305.403 3.951 20 5 DHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@H](C(C)(C)C)CC1 ZINC001198800930 1037138845 /nfs/dbraw/zinc/13/88/45/1037138845.db2.gz NNWMITOICIVDKM-BBRMVZONSA-N 1 1 306.406 3.793 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCC[C@]12CCCOC2 ZINC001198820871 1037142370 /nfs/dbraw/zinc/14/23/70/1037142370.db2.gz MSERIPONNVCGJN-MRXNPFEDSA-N 1 1 324.808 3.783 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCC[C@]12CCCOC2 ZINC001198820871 1037142378 /nfs/dbraw/zinc/14/23/78/1037142378.db2.gz MSERIPONNVCGJN-MRXNPFEDSA-N 1 1 324.808 3.783 20 5 DHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774906717 1037200043 /nfs/dbraw/zinc/20/00/43/1037200043.db2.gz YEAXUJGGECHDKG-RYUDHWBXSA-N 1 1 307.350 3.514 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1C)c1cccc([N+](=O)[O-])c1 ZINC000193901311 1037306318 /nfs/dbraw/zinc/30/63/18/1037306318.db2.gz LGHLUBAKFWPDGB-OLZOCXBDSA-N 1 1 324.384 3.893 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1nc2ccccc2n1C ZINC000193901339 1037306996 /nfs/dbraw/zinc/30/69/96/1037306996.db2.gz LGHLUBAKFWPDGB-CHWSQXEVSA-N 1 1 324.384 3.893 20 5 DHBDMO CC[C@H](C)C[N@@H+](CC)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000489353374 1037368811 /nfs/dbraw/zinc/36/88/11/1037368811.db2.gz GXLFBDGEEKHZCT-JSGCOSHPSA-N 1 1 321.421 3.598 20 5 DHBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000489742740 1037528518 /nfs/dbraw/zinc/52/85/18/1037528518.db2.gz OBQXQFDUJFTQOL-UHFFFAOYSA-N 1 1 320.776 3.889 20 5 DHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCc2ccccc2C1 ZINC000490400243 1037707391 /nfs/dbraw/zinc/70/73/91/1037707391.db2.gz LZADOAJVEZRIQK-INIZCTEOSA-N 1 1 314.360 3.723 20 5 DHBDMO C[C@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000491181841 1037924881 /nfs/dbraw/zinc/92/48/81/1037924881.db2.gz GUBKOXJQZFMANP-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2c2cccc(C)c2)c(C)c1[N+](=O)[O-] ZINC000055034066 1038024354 /nfs/dbraw/zinc/02/43/54/1038024354.db2.gz UNLFJDRMDNBOLN-MRXNPFEDSA-N 1 1 314.389 3.511 20 5 DHBDMO Cc1nn(C[N@H+]2CCC[C@@H]2c2cccc(C)c2)c(C)c1[N+](=O)[O-] ZINC000055034066 1038024376 /nfs/dbraw/zinc/02/43/76/1038024376.db2.gz UNLFJDRMDNBOLN-MRXNPFEDSA-N 1 1 314.389 3.511 20 5 DHBDMO C[N@@H+](Cc1cccc2ccccc21)Cc1cccnc1[N+](=O)[O-] ZINC001190375567 1038308126 /nfs/dbraw/zinc/30/81/26/1038308126.db2.gz QRIGTJGLWYAATK-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO C[N@H+](Cc1cccc2ccccc21)Cc1cccnc1[N+](=O)[O-] ZINC001190375567 1038308136 /nfs/dbraw/zinc/30/81/36/1038308136.db2.gz QRIGTJGLWYAATK-UHFFFAOYSA-N 1 1 307.353 3.775 20 5 DHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC(C)(C)CO1 ZINC001190529403 1038337868 /nfs/dbraw/zinc/33/78/68/1038337868.db2.gz SIMBGNOFZYJTCM-INIZCTEOSA-N 1 1 306.406 3.620 20 5 DHBDMO Cc1ccnc([C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000572131883 1038339377 /nfs/dbraw/zinc/33/93/77/1038339377.db2.gz QYUAECRCHXIQQY-INIZCTEOSA-N 1 1 311.385 3.596 20 5 DHBDMO CC(C)C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC001190571762 1038346334 /nfs/dbraw/zinc/34/63/34/1038346334.db2.gz PLELDZLLELSIOL-UHFFFAOYSA-N 1 1 306.406 3.874 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000589200242 1038449163 /nfs/dbraw/zinc/44/91/63/1038449163.db2.gz YAOKVPOMRWAKTB-CVEARBPZSA-N 1 1 318.417 3.542 20 5 DHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000589199931 1038449200 /nfs/dbraw/zinc/44/92/00/1038449200.db2.gz NPLXEGQBYGPFOE-DOTOQJQBSA-N 1 1 318.417 3.542 20 5 DHBDMO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccccc2)O1 ZINC000249738986 1038466392 /nfs/dbraw/zinc/46/63/92/1038466392.db2.gz HCFOFRWMFZMIPN-KSSFIOAISA-N 1 1 312.369 3.557 20 5 DHBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccccc2)O1 ZINC000249738986 1038466396 /nfs/dbraw/zinc/46/63/96/1038466396.db2.gz HCFOFRWMFZMIPN-KSSFIOAISA-N 1 1 312.369 3.557 20 5 DHBDMO C[C@@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H]1C ZINC001191486908 1038509201 /nfs/dbraw/zinc/50/92/01/1038509201.db2.gz VSMNLAFFFNOAPH-NXEZZACHSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H]1C ZINC001191486908 1038509207 /nfs/dbraw/zinc/50/92/07/1038509207.db2.gz VSMNLAFFFNOAPH-NXEZZACHSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC001191486909 1038509858 /nfs/dbraw/zinc/50/98/58/1038509858.db2.gz VSMNLAFFFNOAPH-UWVGGRQHSA-N 1 1 313.195 3.588 20 5 DHBDMO C[C@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC001191486909 1038509860 /nfs/dbraw/zinc/50/98/60/1038509860.db2.gz VSMNLAFFFNOAPH-UWVGGRQHSA-N 1 1 313.195 3.588 20 5 DHBDMO Cc1cc(CNc2ccsc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000589604463 1038516724 /nfs/dbraw/zinc/51/67/24/1038516724.db2.gz XKJXJCVZZXNBJR-UHFFFAOYSA-N 1 1 318.402 3.572 20 5 DHBDMO CCC1(CC)[C@@H](OC)C[C@@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001191744086 1038540711 /nfs/dbraw/zinc/54/07/11/1038540711.db2.gz YJPCMWJIDNJDDP-HOTGVXAUSA-N 1 1 306.406 3.620 20 5 DHBDMO CC(C)CC[C@@H]1CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001192159176 1038594694 /nfs/dbraw/zinc/59/46/94/1038594694.db2.gz OSHKFFNUGOASOZ-HNNXBMFYSA-N 1 1 306.406 3.874 20 5 DHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3ccc(O)cc3)C2)cc1 ZINC000590659577 1038686862 /nfs/dbraw/zinc/68/68/62/1038686862.db2.gz GBYANAXFHAQOIK-MRXNPFEDSA-N 1 1 312.369 3.680 20 5 DHBDMO Cc1nc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000591347999 1038835892 /nfs/dbraw/zinc/83/58/92/1038835892.db2.gz QILLKWWFEVINAS-MRXNPFEDSA-N 1 1 317.414 3.917 20 5 DHBDMO Cc1cnc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000591348058 1038837588 /nfs/dbraw/zinc/83/75/88/1038837588.db2.gz ZUCCHWGJQLSLGJ-HNNXBMFYSA-N 1 1 317.414 3.917 20 5 DHBDMO CCn1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C(C)C)cn1 ZINC000593676442 1039043718 /nfs/dbraw/zinc/04/37/18/1039043718.db2.gz IUKKVGMEIFFXCQ-UHFFFAOYSA-N 1 1 316.405 3.530 20 5 DHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCC[C@H]3CCOC3)C2)cc1 ZINC000592126851 1039124368 /nfs/dbraw/zinc/12/43/68/1039124368.db2.gz RIOCGXHEODBTLX-RDJZCZTQSA-N 1 1 318.417 3.591 20 5 DHBDMO C[C@H](c1ccccc1F)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000603894838 1039216196 /nfs/dbraw/zinc/21/61/96/1039216196.db2.gz ZBBLPTYLNVQKOQ-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO COc1ccc(C[N@H+]2CCC[C@H]2C2CCCC2)cc1[N+](=O)[O-] ZINC000604013187 1039281275 /nfs/dbraw/zinc/28/12/75/1039281275.db2.gz NZWYUKUFYKOZMU-HNNXBMFYSA-N 1 1 304.390 3.758 20 5 DHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC34CCCC4)co2)cc1 ZINC000593037824 1039366189 /nfs/dbraw/zinc/36/61/89/1039366189.db2.gz CLEUNLFZVKNEPI-UHFFFAOYSA-N 1 1 313.357 3.768 20 5 DHBDMO COc1ccccc1C1([NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000594506881 1039806346 /nfs/dbraw/zinc/80/63/46/1039806346.db2.gz GRQGELMDFFILMX-MRXNPFEDSA-N 1 1 324.380 3.870 20 5 DHBDMO Cc1cccnc1[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])C(C)C ZINC000172349665 1039811536 /nfs/dbraw/zinc/81/15/36/1039811536.db2.gz IPWIEZIWNJBWGR-INIZCTEOSA-N 1 1 317.364 3.924 20 5 DHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2cccc(OC3CC3)c2F)c1 ZINC000594918691 1039926690 /nfs/dbraw/zinc/92/66/90/1039926690.db2.gz RMJJZFSFAYKYGG-UHFFFAOYSA-N 1 1 316.332 3.565 20 5 DHBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccccc1F ZINC000594018113 1039946238 /nfs/dbraw/zinc/94/62/38/1039946238.db2.gz SBCHEXPUUBPMKU-MRXNPFEDSA-N 1 1 318.348 3.983 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)c(Cl)c1 ZINC000594026366 1039951373 /nfs/dbraw/zinc/95/13/73/1039951373.db2.gz JYQUNKAOEWLZOW-OAHLLOKOSA-N 1 1 324.808 3.782 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](OC3CCC3)C2)c(Cl)c1 ZINC000594026366 1039951391 /nfs/dbraw/zinc/95/13/91/1039951391.db2.gz JYQUNKAOEWLZOW-OAHLLOKOSA-N 1 1 324.808 3.782 20 5 DHBDMO CCC[C@H]([NH2+][C@@H](C)c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000595109953 1040069593 /nfs/dbraw/zinc/06/95/93/1040069593.db2.gz XPFLCZSXVMPHTD-WFASDCNBSA-N 1 1 302.378 3.520 20 5 DHBDMO CCC1CCC([N@@H+](Cc2onc(C)c2[N+](=O)[O-])C2CC2)CC1 ZINC000595295540 1040092955 /nfs/dbraw/zinc/09/29/55/1040092955.db2.gz GWTNSEWBOCOYMM-UHFFFAOYSA-N 1 1 307.394 3.824 20 5 DHBDMO CC(C)(C)OC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595346486 1040105931 /nfs/dbraw/zinc/10/59/31/1040105931.db2.gz WUDQKTQFRBNCKL-UHFFFAOYSA-N 1 1 310.369 3.513 20 5 DHBDMO Cc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000595350341 1040111050 /nfs/dbraw/zinc/11/10/50/1040111050.db2.gz AEKIIYYGIYYLMB-CQSZACIVSA-N 1 1 307.325 3.517 20 5 DHBDMO COc1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1F ZINC000595410822 1040131688 /nfs/dbraw/zinc/13/16/88/1040131688.db2.gz WNVAQBICHONTTJ-SNVBAGLBSA-N 1 1 322.311 3.732 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595439149 1040138911 /nfs/dbraw/zinc/13/89/11/1040138911.db2.gz WTFQKYDAPJPDEY-WBMJQRKESA-N 1 1 315.348 3.712 20 5 DHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595439149 1040138917 /nfs/dbraw/zinc/13/89/17/1040138917.db2.gz WTFQKYDAPJPDEY-WBMJQRKESA-N 1 1 315.348 3.712 20 5 DHBDMO CC[C@@H](CC(F)F)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000595485041 1040140631 /nfs/dbraw/zinc/14/06/31/1040140631.db2.gz QFPXXEHYBNWBFF-LBPRGKRZSA-N 1 1 300.349 3.751 20 5 DHBDMO Cc1noc(C[N@H+]2CCC[C@@H](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000595882208 1040271430 /nfs/dbraw/zinc/27/14/30/1040271430.db2.gz ZIPYGVWBUGAABM-CQSZACIVSA-N 1 1 307.394 3.684 20 5 DHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC2CC1(c1ccccc1)C2 ZINC000595909982 1040272110 /nfs/dbraw/zinc/27/21/10/1040272110.db2.gz FRJCPDGWHZYAPJ-UHFFFAOYSA-N 1 1 324.380 3.595 20 5 DHBDMO Cc1c([C@H](C)[NH2+]Cc2cc(C(C)C)no2)cccc1[N+](=O)[O-] ZINC000169246007 1040369707 /nfs/dbraw/zinc/36/97/07/1040369707.db2.gz KWDLQWMQEIQDIN-LBPRGKRZSA-N 1 1 303.362 3.865 20 5 DHBDMO CCOc1cc(NC[C@H]2CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000596306544 1040375894 /nfs/dbraw/zinc/37/58/94/1040375894.db2.gz FKSWKAKGNJNNEJ-CYBMUJFWSA-N 1 1 321.421 3.526 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC1=CCSC1 ZINC000597246517 1040710440 /nfs/dbraw/zinc/71/04/40/1040710440.db2.gz VSNMXUZLRFOVJL-MDWZMJQESA-N 1 1 304.415 3.603 20 5 DHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3ccc(Cl)cc3C2)cc1 ZINC000534179129 1040738239 /nfs/dbraw/zinc/73/82/39/1040738239.db2.gz PVFIKVVDDWMQQF-UHFFFAOYSA-N 1 1 316.788 3.849 20 5 DHBDMO CCn1nc(C)c(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000602924553 1041315986 /nfs/dbraw/zinc/31/59/86/1041315986.db2.gz FHZGIUFQPOLLOY-ZDUSSCGKSA-N 1 1 316.405 3.621 20 5 DHBDMO CCn1nc(C)c(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000602924553 1041316003 /nfs/dbraw/zinc/31/60/03/1041316003.db2.gz FHZGIUFQPOLLOY-ZDUSSCGKSA-N 1 1 316.405 3.621 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cc3cnccc3o2)C2CC2)cc1 ZINC000593567564 1041343175 /nfs/dbraw/zinc/34/31/75/1041343175.db2.gz SIUUOLYMBDMIIZ-UHFFFAOYSA-N 1 1 323.352 3.901 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cncc(Cl)c2)C2CC2)cc1 ZINC000598600102 1041359795 /nfs/dbraw/zinc/35/97/95/1041359795.db2.gz MYDNVXSBSLYYON-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cncc(Cl)c2)C2CC2)cc1 ZINC000598600102 1041359805 /nfs/dbraw/zinc/35/98/05/1041359805.db2.gz MYDNVXSBSLYYON-UHFFFAOYSA-N 1 1 317.776 3.808 20 5 DHBDMO C[C@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104661655 194022894 /nfs/dbraw/zinc/02/28/94/194022894.db2.gz JVMLLIDPRWKMDF-ZDUSSCGKSA-N 1 1 315.373 3.667 20 5 DHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)C[C@H](C)c1nccs1 ZINC000273109160 130091024 /nfs/dbraw/zinc/09/10/24/130091024.db2.gz XBXPNBSADARDOF-NWDGAFQWSA-N 1 1 305.403 3.848 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC=C(c2cccnc2)C1 ZINC000289270986 131369996 /nfs/dbraw/zinc/36/99/96/131369996.db2.gz FCLGLZJVALHXAN-AWEZNQCLSA-N 1 1 309.369 3.840 20 5 DHBDMO COc1ccc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)cc1[N+](=O)[O-] ZINC000299342605 132099609 /nfs/dbraw/zinc/09/96/09/132099609.db2.gz OVQGVJNCYYHQKU-BXUZGUMPSA-N 1 1 316.357 3.610 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cccc(C(F)(F)F)c2)cs1 ZINC000037562437 331579781 /nfs/dbraw/zinc/57/97/81/331579781.db2.gz XPXVRVQMBNAQDR-UHFFFAOYSA-N 1 1 316.304 3.965 20 5 DHBDMO C[C@@H](C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000183989423 333190774 /nfs/dbraw/zinc/19/07/74/333190774.db2.gz BDWOMHGPKLWEFU-RYUDHWBXSA-N 1 1 305.403 3.848 20 5 DHBDMO CCC[C@H](NCC[N@@H+](C)[C@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000318973221 333236054 /nfs/dbraw/zinc/23/60/54/333236054.db2.gz HPVAHOMGTDKASN-PBHICJAKSA-N 1 1 307.438 3.756 20 5 DHBDMO CCC[C@H]([NH2+]CCN(C)[C@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000318973221 333236056 /nfs/dbraw/zinc/23/60/56/333236056.db2.gz HPVAHOMGTDKASN-PBHICJAKSA-N 1 1 307.438 3.756 20 5 DHBDMO Cc1ccc(C[NH2+]C[C@@]2(N(C)C)CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000390603555 333305760 /nfs/dbraw/zinc/30/57/60/333305760.db2.gz GGPARFCSNRZUKO-KBXCAEBGSA-N 1 1 319.449 3.503 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCSc1ccccc1)C2 ZINC000534512106 334278086 /nfs/dbraw/zinc/27/80/86/334278086.db2.gz NIHPFONIYBADEB-UHFFFAOYSA-N 1 1 314.410 3.745 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)[N@@H+]1CCC[C@@H](C)C1 ZINC000531937945 334295802 /nfs/dbraw/zinc/29/58/02/334295802.db2.gz ZFLMOJVPHOXSIH-KBMXLJTQSA-N 1 1 319.449 3.674 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000531937945 334295803 /nfs/dbraw/zinc/29/58/03/334295803.db2.gz ZFLMOJVPHOXSIH-KBMXLJTQSA-N 1 1 319.449 3.674 20 5 DHBDMO COc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000049963140 334359491 /nfs/dbraw/zinc/35/94/91/334359491.db2.gz NGWQPQKYTZXUQT-UHFFFAOYSA-N 1 1 306.749 3.547 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(F)c(F)c2)c(Cl)c1 ZINC000049963734 334359884 /nfs/dbraw/zinc/35/98/84/334359884.db2.gz PAHCQBICWGUMMS-UHFFFAOYSA-N 1 1 312.703 3.816 20 5 DHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2cccnc2)C2CC2)c(Cl)c1 ZINC000344325441 335245593 /nfs/dbraw/zinc/24/55/93/335245593.db2.gz MBQDLTHWLZXBFK-INIZCTEOSA-N 1 1 317.776 3.884 20 5 DHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCCC1 ZINC000332195707 336162387 /nfs/dbraw/zinc/16/23/87/336162387.db2.gz RLIUZXGYMITEKB-UHFFFAOYSA-N 1 1 302.378 3.626 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352426755 336217910 /nfs/dbraw/zinc/21/79/10/336217910.db2.gz XUDCUIJUVGKGOA-AWEZNQCLSA-N 1 1 324.446 3.711 20 5 DHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000352609487 336226835 /nfs/dbraw/zinc/22/68/35/336226835.db2.gz UGVJMSDOWOHXDO-GXTWGEPZSA-N 1 1 312.410 3.840 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000532584509 336256487 /nfs/dbraw/zinc/25/64/87/336256487.db2.gz YNXGYVHIORBQMZ-OAHLLOKOSA-N 1 1 317.433 3.606 20 5 DHBDMO Cc1[nH+]c2cc(Nc3ccc([N+](=O)[O-])cc3F)ccc2n1C ZINC000301413461 336305102 /nfs/dbraw/zinc/30/51/02/336305102.db2.gz AZMFTBLWVQDKIH-UHFFFAOYSA-N 1 1 300.293 3.673 20 5 DHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC000301842160 336333634 /nfs/dbraw/zinc/33/36/34/336333634.db2.gz QBKOTKDIDHLHIL-IAGOWNOFSA-N 1 1 315.348 3.591 20 5 DHBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302031746 336344293 /nfs/dbraw/zinc/34/42/93/336344293.db2.gz CHYFRVVLBXZGMS-KBPBESRZSA-N 1 1 303.406 3.660 20 5 DHBDMO C[C@H](Nc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302052746 336345713 /nfs/dbraw/zinc/34/57/13/336345713.db2.gz OYLSVPROBGKCFC-QWHCGFSZSA-N 1 1 321.396 3.799 20 5 DHBDMO CSCc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000353095988 336402497 /nfs/dbraw/zinc/40/24/97/336402497.db2.gz YLCFEXOKELIFPY-UHFFFAOYSA-N 1 1 320.389 3.887 20 5 DHBDMO CC[C@H]([NH2+][C@H](c1nccn1C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000353883860 336445935 /nfs/dbraw/zinc/44/59/35/336445935.db2.gz VPAQOAGCHRWHTQ-HOTGVXAUSA-N 1 1 314.389 3.520 20 5 DHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000174349415 337140947 /nfs/dbraw/zinc/14/09/47/337140947.db2.gz JKLRWVBRFQKMLR-VXGBXAGGSA-N 1 1 300.449 3.762 20 5 DHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccncc1 ZINC000183739792 337193254 /nfs/dbraw/zinc/19/32/54/337193254.db2.gz JIBOZTACGXYRCY-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccncc1 ZINC000183739792 337193255 /nfs/dbraw/zinc/19/32/55/337193255.db2.gz JIBOZTACGXYRCY-UHFFFAOYSA-N 1 1 323.352 3.882 20 5 DHBDMO CCC[C@@H](NCC1([NH+](C)C)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000321703271 337284553 /nfs/dbraw/zinc/28/45/53/337284553.db2.gz NZHPHQAXLWOJQN-QGZVFWFLSA-N 1 1 319.449 3.900 20 5 DHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(C(C)(C)C)on1 ZINC000583781530 337332636 /nfs/dbraw/zinc/33/26/36/337332636.db2.gz OBFIUYLNWFALTQ-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(C(C)(C)C)on1 ZINC000583781530 337332637 /nfs/dbraw/zinc/33/26/37/337332637.db2.gz OBFIUYLNWFALTQ-UHFFFAOYSA-N 1 1 317.389 3.555 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429116011 338071069 /nfs/dbraw/zinc/07/10/69/338071069.db2.gz PTZNSPFJBHNFPP-KBPBESRZSA-N 1 1 312.369 3.939 20 5 DHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429116011 338071070 /nfs/dbraw/zinc/07/10/70/338071070.db2.gz PTZNSPFJBHNFPP-KBPBESRZSA-N 1 1 312.369 3.939 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000430093858 338096064 /nfs/dbraw/zinc/09/60/64/338096064.db2.gz HKXKUCQKYQXLEY-KIIBNJGVSA-N 1 1 322.355 3.975 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1cccs1)C1CC1 ZINC000430192382 338100315 /nfs/dbraw/zinc/10/03/15/338100315.db2.gz AGSOGLMZTXCSEK-UHFFFAOYSA-N 1 1 318.398 3.830 20 5 DHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1cccs1)C1CC1 ZINC000430192382 338100316 /nfs/dbraw/zinc/10/03/16/338100316.db2.gz AGSOGLMZTXCSEK-UHFFFAOYSA-N 1 1 318.398 3.830 20 5 DHBDMO CC[C@H]1CC[N@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000430196980 338100975 /nfs/dbraw/zinc/10/09/75/338100975.db2.gz SZCVDTZOYZEABT-LBPRGKRZSA-N 1 1 316.357 3.848 20 5 DHBDMO CCS[C@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430235662 338102560 /nfs/dbraw/zinc/10/25/60/338102560.db2.gz FGXGBPKUYGUUCU-HNNXBMFYSA-N 1 1 324.446 3.711 20 5 DHBDMO Cc1csc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433168938 338183915 /nfs/dbraw/zinc/18/39/15/338183915.db2.gz OXOMDVHELBFTOI-AWEZNQCLSA-N 1 1 317.414 3.872 20 5 DHBDMO CC(C)[N@@H+](C)CCCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433172021 338184017 /nfs/dbraw/zinc/18/40/17/338184017.db2.gz BTTMPAMYACJFKH-QGZVFWFLSA-N 1 1 319.449 3.637 20 5 DHBDMO O=[N+]([O-])c1cc(C[NH2+]CCF)ccc1Oc1ccc(F)cc1 ZINC000437247329 338304744 /nfs/dbraw/zinc/30/47/44/338304744.db2.gz PEYHLMKRQDISOP-UHFFFAOYSA-N 1 1 308.284 3.585 20 5 DHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000437581734 338314519 /nfs/dbraw/zinc/31/45/19/338314519.db2.gz WZKZFASREAMHKO-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000459638222 339039795 /nfs/dbraw/zinc/03/97/95/339039795.db2.gz TUNOVXUCXFUWHW-MNOVXSKESA-N 1 1 317.414 3.952 20 5 DHBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CC(C)(C)C1 ZINC000459748925 339046064 /nfs/dbraw/zinc/04/60/64/339046064.db2.gz XRXSZBFLQHZFTO-UHFFFAOYSA-N 1 1 315.373 3.870 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@H]3CS4)o2)c1 ZINC000459767227 339047339 /nfs/dbraw/zinc/04/73/39/339047339.db2.gz PERQCMFHADNMPX-ZFWWWQNUSA-N 1 1 316.382 3.545 20 5 DHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459785318 339048502 /nfs/dbraw/zinc/04/85/02/339048502.db2.gz ARKWXSHHWSNXTI-QWHCGFSZSA-N 1 1 322.405 3.565 20 5 DHBDMO Cc1cc(N[C@H]2CC[N@@H+](CC3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000462933916 339098332 /nfs/dbraw/zinc/09/83/32/339098332.db2.gz YCEIEUOJMIBNMK-INIZCTEOSA-N 1 1 303.406 3.580 20 5 DHBDMO C[N@@H+](CCc1cccs1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464762222 339151502 /nfs/dbraw/zinc/15/15/02/339151502.db2.gz UFLKDTBWELRPEJ-UHFFFAOYSA-N 1 1 310.806 3.984 20 5 DHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464772981 339152302 /nfs/dbraw/zinc/15/23/02/339152302.db2.gz KBLWHFQBFBNGSD-CVEARBPZSA-N 1 1 308.447 3.743 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCn2cccc2[C@H]1C ZINC000470169027 339312577 /nfs/dbraw/zinc/31/25/77/339312577.db2.gz AQVIKXUCLOLXJH-QKXCFHHRSA-N 1 1 311.385 3.876 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCn2cccc2[C@H]1C ZINC000470169027 339312578 /nfs/dbraw/zinc/31/25/78/339312578.db2.gz AQVIKXUCLOLXJH-QKXCFHHRSA-N 1 1 311.385 3.876 20 5 DHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCc1nccs1 ZINC000470175705 339312813 /nfs/dbraw/zinc/31/28/13/339312813.db2.gz RRCADOXNYDLJDG-JLHYYAGUSA-N 1 1 317.414 3.629 20 5 DHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCc1ccncc1 ZINC000470204148 339314123 /nfs/dbraw/zinc/31/41/23/339314123.db2.gz UDYRKUAPPSVMNP-QINSGFPZSA-N 1 1 311.385 3.568 20 5 DHBDMO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1nc2c(s1)CCC2 ZINC000502058091 340094378 /nfs/dbraw/zinc/09/43/78/340094378.db2.gz YLLLGBLZATVZLG-GHMZBOCLSA-N 1 1 317.414 3.952 20 5 DHBDMO COc1cc(C[N@@H+](C)C2CCCCCC2)c([N+](=O)[O-])cc1OC ZINC000506146556 340186835 /nfs/dbraw/zinc/18/68/35/340186835.db2.gz DPTYCWUWUPMLQP-UHFFFAOYSA-N 1 1 322.405 3.767 20 5 DHBDMO CC[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000506354518 340193012 /nfs/dbraw/zinc/19/30/12/340193012.db2.gz BSMWWIZVVCGEFK-UHFFFAOYSA-N 1 1 304.321 3.978 20 5 DHBDMO C[N@@H+](CCCOc1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511058898 340319563 /nfs/dbraw/zinc/31/95/63/340319563.db2.gz IUCMPDDMMBEADP-UHFFFAOYSA-N 1 1 314.385 3.538 20 5 DHBDMO C[C@H](c1ccccc1F)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511059421 340319710 /nfs/dbraw/zinc/31/97/10/340319710.db2.gz LQLPGXYVRVOTNX-CYBMUJFWSA-N 1 1 302.349 3.969 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](COC(F)F)C1 ZINC000512844222 340380585 /nfs/dbraw/zinc/38/05/85/340380585.db2.gz MCBXRHZWJBREKE-NEPJUHHUSA-N 1 1 314.332 3.525 20 5 DHBDMO Cn1c2ccccc2nc1C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000185634688 340503776 /nfs/dbraw/zinc/50/37/76/340503776.db2.gz JHBQOAIVABLXSX-UHFFFAOYSA-N 1 1 324.384 3.506 20 5 DHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cc(F)ccc1F ZINC000521898990 340538877 /nfs/dbraw/zinc/53/88/77/340538877.db2.gz FQHWTGBRENPULK-OAHLLOKOSA-N 1 1 304.296 3.650 20 5 DHBDMO CC1(C)CCC(C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC1 ZINC000542549344 341013020 /nfs/dbraw/zinc/01/30/20/341013020.db2.gz HITAGFFLZXSBMQ-UHFFFAOYSA-N 1 1 303.406 3.564 20 5 DHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCCSCC3)o2)c1 ZINC000543621087 341051445 /nfs/dbraw/zinc/05/14/45/341051445.db2.gz FAUMVGXXAIADAG-UHFFFAOYSA-N 1 1 318.398 3.794 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000544610624 341088826 /nfs/dbraw/zinc/08/88/26/341088826.db2.gz SHKYKEIPCLGLCU-UHFFFAOYSA-N 1 1 324.302 3.953 20 5 DHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000544610624 341088827 /nfs/dbraw/zinc/08/88/27/341088827.db2.gz SHKYKEIPCLGLCU-UHFFFAOYSA-N 1 1 324.302 3.953 20 5 DHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCOC1 ZINC000132042412 341115472 /nfs/dbraw/zinc/11/54/72/341115472.db2.gz HUSSTTLGHIQWPS-AWEZNQCLSA-N 1 1 318.398 3.544 20 5 DHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000548508509 341264979 /nfs/dbraw/zinc/26/49/79/341264979.db2.gz JIPODKRWNVFSGX-BFQNTYOBSA-N 1 1 314.389 3.624 20 5 DHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCCC1 ZINC000549343347 341291581 /nfs/dbraw/zinc/29/15/81/341291581.db2.gz GXXACEXAVSCKIX-UHFFFAOYSA-N 1 1 302.296 3.988 20 5 DHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000550444416 341317148 /nfs/dbraw/zinc/31/71/48/341317148.db2.gz UXPNMWXZVDLCQN-JSGCOSHPSA-N 1 1 322.380 3.753 20 5 DHBDMO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)CO2 ZINC000539058200 518190075 /nfs/dbraw/zinc/19/00/75/518190075.db2.gz HUJRHISOGLLIDT-GUYCJALGSA-N 1 1 312.369 3.996 20 5 DHBDMO COC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)o1 ZINC000156492469 522760234 /nfs/dbraw/zinc/76/02/34/522760234.db2.gz DHSWUCMOXSAIFP-WFASDCNBSA-N 1 1 304.346 3.535 20 5 DHBDMO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)o1 ZINC000130908901 523021614 /nfs/dbraw/zinc/02/16/14/523021614.db2.gz HGLPGXZIGXQDHG-MRXNPFEDSA-N 1 1 316.357 3.671 20 5 DHBDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)o1 ZINC000130908901 523021624 /nfs/dbraw/zinc/02/16/24/523021624.db2.gz HGLPGXZIGXQDHG-MRXNPFEDSA-N 1 1 316.357 3.671 20 5 DHBDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000237183526 524332612 /nfs/dbraw/zinc/33/26/12/524332612.db2.gz KDUWNUGIKQBKHW-NSHDSACASA-N 1 1 304.321 3.593 20 5 DHBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000158093671 524813372 /nfs/dbraw/zinc/81/33/72/524813372.db2.gz PTSXUWRIXWMNAE-ZDUSSCGKSA-N 1 1 318.398 3.654 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC2(CCC[N@H+]2C)CC1 ZINC000368617515 526087790 /nfs/dbraw/zinc/08/77/90/526087790.db2.gz ZNWJBYBWFIGEIR-OAHLLOKOSA-N 1 1 317.433 3.524 20 5 DHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1ccncc1F ZINC000338016704 526089851 /nfs/dbraw/zinc/08/98/51/526089851.db2.gz VFHKNDCWOSBNKO-NEPJUHHUSA-N 1 1 303.337 3.849 20 5 DHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC([C@@H]3CCCO3)CC2)c1 ZINC000189165798 527354926 /nfs/dbraw/zinc/35/49/26/527354926.db2.gz SKMUGYUJJUSAQC-INIZCTEOSA-N 1 1 324.808 3.639 20 5 DHBDMO Cc1ncsc1C[N@@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182772769 527499596 /nfs/dbraw/zinc/49/95/96/527499596.db2.gz RKHRIDAOWHYDKR-GFCCVEGCSA-N 1 1 305.403 3.861 20 5 DHBDMO Cc1ncsc1C[N@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182772769 527499604 /nfs/dbraw/zinc/49/96/04/527499604.db2.gz RKHRIDAOWHYDKR-GFCCVEGCSA-N 1 1 305.403 3.861 20 5 DHBDMO CCOC1CC2(C1)CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC000285359272 535397806 /nfs/dbraw/zinc/39/78/06/535397806.db2.gz BFTQWMPOEKRCFQ-UHFFFAOYSA-N 1 1 324.808 3.639 20 5 DHBDMO