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NYBXNQWIDPMYRL-UHFFFAOYSA-N 0 0 141.130 0.229 10 5 ACBERN CC(=O)N[C@H](C)/C=C/C[N+](=O)[O-] 687806597 571883112 /nfs/dbraw/zinc/88/31/12/571883112.db2.gz OOEHISLHVHXNLV-FCJGRKLLSA-N 0 0 172.184 0.344 10 5 ACBERN C[C@H](CO)OC(C)(C)C[N+](=O)[O-] 687806635 571883001 /nfs/dbraw/zinc/88/30/01/571883001.db2.gz YFBSKNFOZOSENU-ZCFIWIBFSA-N 0 0 177.200 0.439 10 5 ACBERN CC(=O)NC/C=C(/C)C[N+](=O)[O-] 687806601 571883055 /nfs/dbraw/zinc/88/30/55/571883055.db2.gz OQDKAYZDERBAMD-UTCJRWHESA-N 0 0 172.184 0.346 10 5 ACBERN C[C@H](CO)OC[C@@H](C)[N+](=O)[O-] 687806626 571883405 /nfs/dbraw/zinc/88/34/05/571883405.db2.gz SVZPTGONUXJYIX-PHDIDXHHSA-N 0 0 163.173 0.049 10 5 ACBERN CC(=O)N[C@@H](C)/C=C/C[N+](=O)[O-] 687806600 571883435 /nfs/dbraw/zinc/88/34/35/571883435.db2.gz OOEHISLHVHXNLV-YUDCMIJISA-N 0 0 172.184 0.344 10 5 ACBERN C[C@H]1OC[C@H](CO)[C@]1(C)[N+](=O)[O-] 687806629 571883463 /nfs/dbraw/zinc/88/34/63/571883463.db2.gz TVCHKEGWQFGFMA-DSYKOEDSSA-N 0 0 175.184 0.049 10 5 ACBERN CCC[C@H](C[N+](=O)[O-])OCCO 687806631 571883546 /nfs/dbraw/zinc/88/35/46/571883546.db2.gz WHGAGSJWIWLLIX-SSDOTTSWSA-N 0 0 177.200 0.441 10 5 ACBERN CC(=O)N[C@@H](C)/C=C\C[N+](=O)[O-] 687806599 571884009 /nfs/dbraw/zinc/88/40/09/571884009.db2.gz OOEHISLHVHXNLV-SYDCGGLASA-N 0 0 172.184 0.344 10 5 ACBERN CC(=O)N[C@H](C)/C=C\C[N+](=O)[O-] 687806598 571884127 /nfs/dbraw/zinc/88/41/27/571884127.db2.gz OOEHISLHVHXNLV-KGJQDRRLSA-N 0 0 172.184 0.344 10 5 ACBERN C[C@@H]1[C@H]([N+](=O)[O-])C(C)(C)O[C@H]1O 687806643 571884168 /nfs/dbraw/zinc/88/41/68/571884168.db2.gz DREABBQECUDCCL-NGJCXOISSA-N 0 0 175.184 0.395 10 5 ACBERN C[C@@H](CO)OC[C@@H](C)[N+](=O)[O-] 687806627 571884268 /nfs/dbraw/zinc/88/42/68/571884268.db2.gz SVZPTGONUXJYIX-RITPCOANSA-N 0 0 163.173 0.049 10 5 ACBERN CNc1cc2ncc([N+](=O)[O-])cn2n1 687806652 571884330 /nfs/dbraw/zinc/88/43/30/571884330.db2.gz HJQOZGDCWLGARH-UHFFFAOYSA-N 0 0 193.166 0.679 10 5 ACBERN C[C@@H](CO[C@H](C)CO)[N+](=O)[O-] 687806625 571884361 /nfs/dbraw/zinc/88/43/61/571884361.db2.gz SVZPTGONUXJYIX-NTSWFWBYSA-N 0 0 163.173 0.049 10 5 ACBERN CCC[C@@H](C[N+](=O)[O-])OCCO 687806632 571884540 /nfs/dbraw/zinc/88/45/40/571884540.db2.gz WHGAGSJWIWLLIX-ZETCQYMHSA-N 0 0 177.200 0.441 10 5 ACBERN C[C@@H](CO)OC(C)(C)C[N+](=O)[O-] 687806634 571884657 /nfs/dbraw/zinc/88/46/57/571884657.db2.gz YFBSKNFOZOSENU-LURJTMIESA-N 0 0 177.200 0.439 10 5 ACBERN Cc1nc([N+](=O)[O-])cn1CCCO 687806650 571885381 /nfs/dbraw/zinc/88/53/81/571885381.db2.gz GAIQLCOHZILHQB-UHFFFAOYSA-N 0 0 185.183 0.482 10 5 ACBERN C[C@@H](CO)OC[C@H](C)[N+](=O)[O-] 687806628 571885546 /nfs/dbraw/zinc/88/55/46/571885546.db2.gz SVZPTGONUXJYIX-WDSKDSINSA-N 0 0 163.173 0.049 10 5 ACBERN CC(=O)NC/C=C(\C)C[N+](=O)[O-] 687806602 571886020 /nfs/dbraw/zinc/88/60/20/571886020.db2.gz OQDKAYZDERBAMD-ZZXKWVIFSA-N 0 0 172.184 0.346 10 5 ACBERN CCc1nc(C)c([N+](=O)[O-])n1CCO 687806651 571886090 /nfs/dbraw/zinc/88/60/90/571886090.db2.gz GZKOGIUVAPCLQR-UHFFFAOYSA-N 0 0 199.210 0.654 10 5 ACBERN CNc1ccc(N)c(N)c1[N+](=O)[O-] 34596743 571886459 /nfs/dbraw/zinc/88/64/59/571886459.db2.gz PFOBDZBJVDSDGQ-UHFFFAOYSA-N 0 0 182.183 0.801 10 5 ACBERN C[C@@](Cl)(CCC(=O)CO)[N+](=O)[O-] 687806688 571889182 /nfs/dbraw/zinc/88/91/82/571889182.db2.gz XBUQDSOOCMDDRW-LURJTMIESA-N 0 0 195.602 0.560 10 5 ACBERN CCC1=C(C)/C(=C/[N+](=O)[O-])NC1=O 687806709 571889448 /nfs/dbraw/zinc/88/94/48/571889448.db2.gz KWZQLRVNGWUKDX-DAXSKMNVSA-N 0 0 182.179 0.961 10 5 ACBERN CCC1=C(C)/C(=C\[N+](=O)[O-])NC1=O 687806710 571889479 /nfs/dbraw/zinc/88/94/79/571889479.db2.gz KWZQLRVNGWUKDX-QPJJXVBHSA-N 0 0 182.179 0.961 10 5 ACBERN CCCC(=O)CC[C@H](O)C[N+](=O)[O-] 687806674 571889606 /nfs/dbraw/zinc/88/96/06/571889606.db2.gz FFXRJOLBDYWQKC-QMMMGPOBSA-N 0 0 189.211 0.773 10 5 ACBERN Nc1c(O)ccc([N+](=O)[O-])c1O 687727092 571890002 /nfs/dbraw/zinc/89/00/02/571890002.db2.gz AAYMZHRTEDUGRW-UHFFFAOYSA-N 0 0 170.124 0.588 10 5 ACBERN COc1cc([N+](=O)[O-])c(C=O)cc1N 687727190 571890301 /nfs/dbraw/zinc/89/03/01/571890301.db2.gz GYYJGGKOHBQQEM-UHFFFAOYSA-N 0 0 196.162 0.998 10 5 ACBERN Cc1cc(C(N)=O)c([N+](=O)[O-])cc1N 687727191 571890569 /nfs/dbraw/zinc/89/05/69/571890569.db2.gz HNYHHACQVUUWOA-UHFFFAOYSA-N 0 0 195.178 0.584 10 5 ACBERN CNc1c([N+](=O)[O-])n[nH]c1[N+](=O)[O-] 687727106 571890692 /nfs/dbraw/zinc/89/06/92/571890692.db2.gz WAFDUIITJAWYDC-UHFFFAOYSA-N 0 0 187.115 0.268 10 5 ACBERN C[C@](Cl)(CCC(=O)CO)[N+](=O)[O-] 687806689 571890800 /nfs/dbraw/zinc/89/08/00/571890800.db2.gz XBUQDSOOCMDDRW-ZCFIWIBFSA-N 0 0 195.602 0.560 10 5 ACBERN CCCC(=O)CC[C@@H](O)C[N+](=O)[O-] 687806673 571890915 /nfs/dbraw/zinc/89/09/15/571890915.db2.gz FFXRJOLBDYWQKC-MRVPVSSYSA-N 0 0 189.211 0.773 10 5 ACBERN C[C@@H]1CNc2c([N+](=O)[O-])cnn2C1 687727643 571891403 /nfs/dbraw/zinc/89/14/03/571891403.db2.gz PUXKPGIABQBGMV-RXMQYKEDSA-N 0 0 182.183 0.853 10 5 ACBERN NC(=O)N(O)c1cccc([N+](=O)[O-])c1 687727585 571891431 /nfs/dbraw/zinc/89/14/31/571891431.db2.gz NCGAPEMKTHEDTF-UHFFFAOYSA-N 0 0 197.150 0.869 10 5 ACBERN O=CN[C@@H](C[N+](=O)[O-])c1ccccc1 687727572 571892649 /nfs/dbraw/zinc/89/26/49/571892649.db2.gz DCXPPBTUKLJOCT-VIFPVBQESA-N 0 0 194.190 0.750 10 5 ACBERN NC(=O)c1nscc1[N+](=O)[O-] 687727452 571891560 /nfs/dbraw/zinc/89/15/60/571891560.db2.gz HKJMQEZSAQLQNS-UHFFFAOYSA-N 0 0 173.153 0.150 10 5 ACBERN N[C@H]1C([N+](=O)[O-])=CNc2ccncc21 687727159 571891848 /nfs/dbraw/zinc/89/18/48/571891848.db2.gz UYXFXQJEYZXQSK-MRVPVSSYSA-N 0 0 192.178 0.625 10 5 ACBERN Nc1ccc([N+](=O)[O-])c(OCCO)c1 687727556 571891934 /nfs/dbraw/zinc/89/19/34/571891934.db2.gz QSRMYCLZCWBABY-UHFFFAOYSA-N 0 0 198.178 0.548 10 5 ACBERN O=CN[C@H](C[N+](=O)[O-])c1ccccc1 687727571 571891995 /nfs/dbraw/zinc/89/19/95/571891995.db2.gz DCXPPBTUKLJOCT-SECBINFHSA-N 0 0 194.190 0.750 10 5 ACBERN O=[N+]([O-])C1=C2NCCN2C=CC1 687727157 571892032 /nfs/dbraw/zinc/89/20/32/571892032.db2.gz TWURZKVQZYJEPT-UHFFFAOYSA-N 0 0 167.168 0.255 10 5 ACBERN N[C@@H]1C([N+](=O)[O-])=CNc2ccncc21 687727160 571892459 /nfs/dbraw/zinc/89/24/59/571892459.db2.gz UYXFXQJEYZXQSK-QMMMGPOBSA-N 0 0 192.178 0.625 10 5 ACBERN Cc1cc([N+](=O)[O-])c(N)c(C)[n+]1[O-] 687727578 571892475 /nfs/dbraw/zinc/89/24/75/571892475.db2.gz HWOCMDFJLYYUCM-UHFFFAOYSA-N 0 0 183.167 0.427 10 5 ACBERN Nc1cc([N+](=O)[O-])c2nonc2c1 687727443 571892487 /nfs/dbraw/zinc/89/24/87/571892487.db2.gz DNWWVAZUFPQUOS-UHFFFAOYSA-N 0 0 180.123 0.713 10 5 ACBERN C[C@H]1CNc2c([N+](=O)[O-])cnn2C1 687727644 571892793 /nfs/dbraw/zinc/89/27/93/571892793.db2.gz PUXKPGIABQBGMV-YFKPBYRVSA-N 0 0 182.183 0.853 10 5 ACBERN NC(=O)c1cc([N+](=O)[O-])sn1 687727453 571892804 /nfs/dbraw/zinc/89/28/04/571892804.db2.gz JBULPAUBUCUZOO-UHFFFAOYSA-N 0 0 173.153 0.150 10 5 ACBERN Cn1c(C(N)=S)ccc1[N+](=O)[O-] 687727598 571893197 /nfs/dbraw/zinc/89/31/97/571893197.db2.gz UEWBQPSLBCIJLU-UHFFFAOYSA-N 0 0 185.208 0.568 10 5 ACBERN NCOC(=O)c1ccc([N+](=O)[O-])cc1 687727617 571893467 /nfs/dbraw/zinc/89/34/67/571893467.db2.gz BVSZSYMYMRZAJU-UHFFFAOYSA-N 0 0 196.162 0.668 10 5 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